data_nef_c25612_2n2u save_entry_information _nef_nmr_meta_data.sf_category nef_nmr_meta_data _nef_nmr_meta_data.sf_framecode entry_information _nef_nmr_meta_data.format_name nmr_exchange_format _nef_nmr_meta_data.format_version 1.1 loop_ _nef_related_entries.database_name _nef_related_entries.database_accession_code PDB 2N2U stop_ save_ save_assembly _nef_molecular_system.sf_category nef_molecular_system _nef_molecular_system.sf_framecode assembly loop_ _nef_sequence.index _nef_sequence.chain_code _nef_sequence.sequence_code _nef_sequence.residue_name _nef_sequence.linking _nef_sequence.residue_variant _nef_sequence.cis_peptide 1 A 1 MET start . . 2 A 2 VAL middle . . 3 A 3 ASP middle . . 4 A 4 LEU middle . . 5 A 5 LYS middle . . 6 A 6 ILE middle . . 7 A 7 ASP middle . . 8 A 8 VAL middle . . 9 A 9 SER middle . . 10 A 10 ASP middle . . 11 A 11 ASP middle . . 12 A 12 GLU middle . . 13 A 13 GLU middle . . 14 A 14 ALA middle . . 15 A 15 GLU middle . . 16 A 16 LYS middle . . 17 A 17 ILE middle . . 18 A 18 ILE middle . . 19 A 19 ARG middle . . 20 A 20 GLU middle . . 21 A 21 ILE middle . . 22 A 22 ARG middle . . 23 A 23 GLU middle . . 24 A 24 GLN middle . . 25 A 25 TRP middle . . 26 A 26 PRO middle . false 27 A 27 LYS middle . . 28 A 28 ALA middle . . 29 A 29 THR middle . . 30 A 30 VAL middle . . 31 A 31 THR middle . . 32 A 32 ARG middle . . 33 A 33 THR middle . . 34 A 34 ASN middle . . 35 A 35 GLY middle . false 36 A 36 ASP middle . . 37 A 37 ILE middle . . 38 A 38 LYS middle . . 39 A 39 LEU middle . . 40 A 40 ASP middle . . 41 A 41 ALA middle . . 42 A 42 GLN middle . . 43 A 43 THR middle . . 44 A 44 GLU middle . . 45 A 45 LYS middle . . 46 A 46 GLU middle . . 47 A 47 ALA middle . . 48 A 48 GLU middle . . 49 A 49 LYS middle . . 50 A 50 MET middle . . 51 A 51 GLU middle . . 52 A 52 LYS middle . . 53 A 53 ALA middle . . 54 A 54 VAL middle . . 55 A 55 LYS middle . . 56 A 56 LYS middle . . 57 A 57 VAL middle . . 58 A 58 LYS middle . . 59 A 59 PRO middle . false 60 A 60 ASN middle . . 61 A 61 ALA middle . . 62 A 62 THR middle . . 63 A 63 ILE middle . . 64 A 64 ARG middle . . 65 A 65 LYS middle . . 66 A 66 THR middle . . 67 A 67 GLY middle . false 68 A 68 GLY middle . false 69 A 69 SER middle . . 70 A 70 LEU middle . . 71 A 71 GLU middle . . 72 A 72 HIS middle . . 73 A 73 HIS middle . . 74 A 74 HIS middle . . 75 A 75 HIS middle . . 76 A 76 HIS middle . . 77 A 77 HIS 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 2 VAL H H 1 8.175 0.020 A 2 VAL HA H 1 3.562 0.020 A 2 VAL HB H 1 1.907 0.020 A 2 VAL HGx% H 1 0.775 0.020 A 2 VAL HGy% H 1 0.814 0.020 A 2 VAL C C 13 171.111 0.400 A 2 VAL CA C 13 61.505 0.400 A 2 VAL CB C 13 32.731 0.400 A 2 VAL CG1 C 13 20.486 0.400 A 2 VAL CG2 C 13 20.226 0.400 A 3 ASP H H 1 8.774 0.020 A 3 ASP HA H 1 5.267 0.020 A 3 ASP HBx H 1 2.389 0.020 A 3 ASP HBy H 1 2.622 0.020 A 3 ASP C C 13 174.883 0.400 A 3 ASP CA C 13 53.401 0.400 A 3 ASP CB C 13 41.911 0.400 A 3 ASP N N 15 127.782 0.400 A 4 LEU H H 1 8.860 0.020 A 4 LEU HA H 1 5.041 0.020 A 4 LEU HBx H 1 1.179 0.020 A 4 LEU HBy H 1 1.620 0.020 A 4 LEU HDx% H 1 0.751 0.020 A 4 LEU HDy% H 1 0.720 0.020 A 4 LEU HG H 1 1.497 0.020 A 4 LEU C C 13 175.087 0.400 A 4 LEU CA C 13 53.573 0.400 A 4 LEU CB C 13 44.479 0.400 A 4 LEU CD1 C 13 25.721 0.400 A 4 LEU CD2 C 13 25.074 0.400 A 4 LEU CG C 13 27.672 0.400 A 4 LEU N N 15 121.715 0.400 A 5 LYS H H 1 8.863 0.020 A 5 LYS HA H 1 5.397 0.020 A 5 LYS HBx H 1 1.580 0.020 A 5 LYS HBy H 1 1.677 0.020 A 5 LYS HDx H 1 1.563 0.020 A 5 LYS HDy H 1 1.566 0.020 A 5 LYS HEy H 1 2.816 0.020 A 5 LYS HEx H 1 2.807 0.020 A 5 LYS HGx H 1 1.187 0.020 A 5 LYS HGy H 1 1.329 0.020 A 5 LYS C C 13 175.266 0.400 A 5 LYS CA C 13 54.751 0.400 A 5 LYS CB C 13 34.781 0.400 A 5 LYS CD C 13 29.184 0.400 A 5 LYS CE C 13 41.160 0.400 A 5 LYS CG C 13 25.103 0.400 A 5 LYS N N 15 122.519 0.400 A 6 ILE H H 1 9.271 0.020 A 6 ILE HA H 1 4.648 0.020 A 6 ILE HB H 1 1.699 0.020 A 6 ILE HD1% H 1 0.740 0.020 A 6 ILE HG1y H 1 1.422 0.020 A 6 ILE HG1x H 1 1.030 0.020 A 6 ILE HG2% H 1 0.838 0.020 A 6 ILE C C 13 174.399 0.400 A 6 ILE CA C 13 59.953 0.400 A 6 ILE CB C 13 41.376 0.400 A 6 ILE CD1 C 13 16.063 0.400 A 6 ILE CG1 C 13 28.742 0.400 A 6 ILE CG2 C 13 18.768 0.400 A 6 ILE N N 15 125.951 0.400 A 7 ASP H H 1 8.265 0.020 A 7 ASP HA H 1 4.943 0.020 A 7 ASP HBy H 1 2.654 0.020 A 7 ASP HBx H 1 2.599 0.020 A 7 ASP C C 13 175.648 0.400 A 7 ASP CA C 13 54.261 0.400 A 7 ASP CB C 13 40.497 0.400 A 7 ASP N N 15 127.145 0.400 A 8 VAL H H 1 8.504 0.020 A 8 VAL HA H 1 4.628 0.020 A 8 VAL HB H 1 2.140 0.020 A 8 VAL HGx% H 1 0.904 0.020 A 8 VAL HGy% H 1 0.839 0.020 A 8 VAL C C 13 175.444 0.400 A 8 VAL CA C 13 60.014 0.400 A 8 VAL CB C 13 34.799 0.400 A 8 VAL CG1 C 13 22.762 0.400 A 8 VAL CG2 C 13 19.652 0.400 A 8 VAL N N 15 118.371 0.400 A 9 SER H H 1 9.070 0.020 A 9 SER HA H 1 4.333 0.020 A 9 SER HBy H 1 3.816 0.020 A 9 SER HBx H 1 3.785 0.020 A 9 SER C C 13 173.838 0.400 A 9 SER CA C 13 59.433 0.400 A 9 SER CB C 13 64.100 0.400 A 9 SER N N 15 119.097 0.400 A 10 ASP H H 1 7.600 0.020 A 10 ASP HA H 1 4.646 0.020 A 10 ASP HBy H 1 2.988 0.020 A 10 ASP HBx H 1 2.889 0.020 A 10 ASP C C 13 175.368 0.400 A 10 ASP CA C 13 53.463 0.400 A 10 ASP CB C 13 42.608 0.400 A 10 ASP N N 15 117.373 0.400 A 11 ASP H H 1 8.692 0.020 A 11 ASP HA H 1 4.395 0.020 A 11 ASP HBy H 1 2.768 0.020 A 11 ASP HBx H 1 2.637 0.020 A 11 ASP C C 13 177.790 0.400 A 11 ASP CA C 13 57.312 0.400 A 11 ASP CB C 13 40.940 0.400 A 11 ASP N N 15 120.820 0.400 A 12 GLU H H 1 8.325 0.020 A 12 GLU HA H 1 4.095 0.020 A 12 GLU HBx H 1 2.079 0.020 A 12 GLU HBy H 1 2.129 0.020 A 12 GLU HGy H 1 2.344 0.020 A 12 GLU HGx H 1 2.220 0.020 A 12 GLU C C 13 179.243 0.400 A 12 GLU CA C 13 59.462 0.400 A 12 GLU CB C 13 28.898 0.400 A 12 GLU CG C 13 36.605 0.400 A 12 GLU N N 15 121.717 0.400 A 13 GLU H H 1 8.531 0.020 A 13 GLU HA H 1 3.977 0.020 A 13 GLU HBy H 1 2.209 0.020 A 13 GLU HBx H 1 2.090 0.020 A 13 GLU HGx H 1 2.205 0.020 A 13 GLU HGy H 1 2.362 0.020 A 13 GLU C C 13 178.376 0.400 A 13 GLU CA C 13 59.429 0.400 A 13 GLU CB C 13 30.260 0.400 A 13 GLU CG C 13 37.572 0.400 A 13 GLU N N 15 121.729 0.400 A 14 ALA H H 1 8.089 0.020 A 14 ALA HA H 1 3.929 0.020 A 14 ALA HB% H 1 1.517 0.020 A 14 ALA C C 13 178.605 0.400 A 14 ALA CA C 13 55.464 0.400 A 14 ALA CB C 13 17.807 0.400 A 14 ALA N N 15 119.585 0.400 A 15 GLU H H 1 8.152 0.020 A 15 GLU HA H 1 3.982 0.020 A 15 GLU HBy H 1 2.127 0.020 A 15 GLU HBx H 1 2.122 0.020 A 15 GLU HGx H 1 2.371 0.020 A 15 GLU HGy H 1 2.403 0.020 A 15 GLU C C 13 179.039 0.400 A 15 GLU CA C 13 59.047 0.400 A 15 GLU CB C 13 28.912 0.400 A 15 GLU CG C 13 35.899 0.400 A 15 GLU N N 15 115.995 0.400 A 16 LYS H H 1 7.824 0.020 A 16 LYS HA H 1 4.001 0.020 A 16 LYS HBx H 1 1.938 0.020 A 16 LYS HBy H 1 2.024 0.020 A 16 LYS HD2 H 1 1.738 0.020 A 16 LYS HD3 H 1 1.737 0.020 A 16 LYS HEx H 1 2.965 0.020 A 16 LYS HEy H 1 2.984 0.020 A 16 LYS HGy H 1 1.735 0.020 A 16 LYS HGx H 1 1.443 0.020 A 16 LYS C C 13 179.396 0.400 A 16 LYS CA C 13 59.588 0.400 A 16 LYS CB C 13 32.772 0.400 A 16 LYS CD C 13 29.402 0.400 A 16 LYS CE C 13 41.780 0.400 A 16 LYS CG C 13 25.602 0.400 A 16 LYS N N 15 119.577 0.400 A 17 ILE H H 1 8.115 0.020 A 17 ILE HA H 1 3.578 0.020 A 17 ILE HB H 1 1.938 0.020 A 17 ILE HD1% H 1 0.818 0.020 A 17 ILE HG1y H 1 2.007 0.020 A 17 ILE HG1x H 1 0.873 0.020 A 17 ILE HG2% H 1 0.830 0.020 A 17 ILE C C 13 176.872 0.400 A 17 ILE CA C 13 66.011 0.400 A 17 ILE CB C 13 38.080 0.400 A 17 ILE CD1 C 13 14.423 0.400 A 17 ILE CG1 C 13 29.251 0.400 A 17 ILE CG2 C 13 17.823 0.400 A 17 ILE N N 15 119.975 0.400 A 18 ILE H H 1 8.636 0.020 A 18 ILE HA H 1 3.359 0.020 A 18 ILE HB H 1 1.849 0.020 A 18 ILE HD1% H 1 0.771 0.020 A 18 ILE HG1y H 1 1.901 0.020 A 18 ILE HG1x H 1 0.796 0.020 A 18 ILE HG2% H 1 0.910 0.020 A 18 ILE C C 13 177.203 0.400 A 18 ILE CA C 13 66.524 0.400 A 18 ILE CB C 13 37.854 0.400 A 18 ILE CD1 C 13 13.200 0.400 A 18 ILE CG1 C 13 30.288 0.400 A 18 ILE CG2 C 13 17.136 0.400 A 18 ILE N N 15 119.725 0.400 A 19 ARG H H 1 8.290 0.020 A 19 ARG HA H 1 3.959 0.020 A 19 ARG HBy H 1 1.992 0.020 A 19 ARG HBx H 1 1.927 0.020 A 19 ARG HDx H 1 3.236 0.020 A 19 ARG HDy H 1 3.238 0.020 A 19 ARG HGx H 1 1.626 0.020 A 19 ARG HGy H 1 1.826 0.020 A 19 ARG C C 13 178.554 0.400 A 19 ARG CA C 13 59.504 0.400 A 19 ARG CB C 13 29.797 0.400 A 19 ARG CD C 13 43.432 0.400 A 19 ARG CG C 13 27.310 0.400 A 19 ARG N N 15 118.535 0.400 A 20 GLU H H 1 7.514 0.020 A 20 GLU HA H 1 4.036 0.020 A 20 GLU HBx H 1 2.106 0.020 A 20 GLU HBy H 1 2.189 0.020 A 20 GLU HGx H 1 2.199 0.020 A 20 GLU HGy H 1 2.485 0.020 A 20 GLU C C 13 179.447 0.400 A 20 GLU CA C 13 58.816 0.400 A 20 GLU CB C 13 29.212 0.400 A 20 GLU CG C 13 35.050 0.400 A 20 GLU N N 15 118.975 0.400 A 21 ILE H H 1 8.314 0.020 A 21 ILE HA H 1 4.170 0.020 A 21 ILE HB H 1 2.312 0.020 A 21 ILE HD1% H 1 0.764 0.020 A 21 ILE HG1y H 1 1.788 0.020 A 21 ILE HG1x H 1 1.343 0.020 A 21 ILE HG2% H 1 1.019 0.020 A 21 ILE C C 13 178.172 0.400 A 21 ILE CA C 13 62.301 0.400 A 21 ILE CB C 13 35.852 0.400 A 21 ILE CD1 C 13 10.184 0.400 A 21 ILE CG1 C 13 26.988 0.400 A 21 ILE CG2 C 13 17.360 0.400 A 21 ILE N N 15 118.778 0.400 A 22 ARG H H 1 8.837 0.020 A 22 ARG HA H 1 4.026 0.020 A 22 ARG HBy H 1 1.981 0.020 A 22 ARG HBx H 1 1.844 0.020 A 22 ARG HDx H 1 3.205 0.020 A 22 ARG HDy H 1 3.249 0.020 A 22 ARG HGx H 1 1.734 0.020 A 22 ARG HGy H 1 1.892 0.020 A 22 ARG C C 13 177.509 0.400 A 22 ARG CA C 13 58.404 0.400 A 22 ARG CB C 13 29.383 0.400 A 22 ARG CD C 13 43.100 0.400 A 22 ARG CG C 13 27.950 0.400 A 22 ARG N N 15 118.602 0.400 A 23 GLU H H 1 7.590 0.020 A 23 GLU HA H 1 3.973 0.020 A 23 GLU HBx H 1 2.020 0.020 A 23 GLU HBy H 1 2.138 0.020 A 23 GLU HGy H 1 2.373 0.020 A 23 GLU HGx H 1 2.257 0.020 A 23 GLU C C 13 177.458 0.400 A 23 GLU CA C 13 58.636 0.400 A 23 GLU CB C 13 29.583 0.400 A 23 GLU CG C 13 36.010 0.400 A 23 GLU N N 15 116.718 0.400 A 24 GLN H H 1 6.954 0.020 A 24 GLN HA H 1 3.990 0.020 A 24 GLN HBy H 1 1.227 0.020 A 24 GLN HBx H 1 0.829 0.020 A 24 GLN HE2y H 1 7.689 0.020 A 24 GLN HE2x H 1 6.700 0.020 A 24 GLN HGx H 1 1.525 0.020 A 24 GLN HGy H 1 1.941 0.020 A 24 GLN C C 13 175.062 0.400 A 24 GLN CA C 13 55.992 0.400 A 24 GLN CB C 13 29.740 0.400 A 24 GLN CG C 13 34.088 0.400 A 24 GLN N N 15 114.802 0.400 A 24 GLN NE2 N 15 112.275 0.400 A 25 TRP H H 1 8.920 0.020 A 25 TRP HA H 1 5.006 0.020 A 25 TRP HBy H 1 3.214 0.020 A 25 TRP HBx H 1 3.082 0.020 A 25 TRP HD1 H 1 7.218 0.020 A 25 TRP HE1 H 1 10.230 0.020 A 25 TRP HE3 H 1 8.202 0.020 A 25 TRP HH2 H 1 6.755 0.020 A 25 TRP HZ2 H 1 7.266 0.020 A 25 TRP HZ3 H 1 6.794 0.020 A 25 TRP CA C 13 57.645 0.400 A 25 TRP CB C 13 28.522 0.400 A 25 TRP CD1 C 13 126.779 0.400 A 25 TRP CE3 C 13 122.515 0.400 A 25 TRP CH2 C 13 123.265 0.400 A 25 TRP CZ2 C 13 113.717 0.400 A 25 TRP CZ3 C 13 120.436 0.400 A 25 TRP N N 15 119.538 0.400 A 25 TRP NE1 N 15 129.609 0.400 A 26 PRO HA H 1 4.601 0.020 A 26 PRO HBy H 1 2.483 0.020 A 26 PRO HBx H 1 1.946 0.020 A 26 PRO HDx H 1 3.172 0.020 A 26 PRO HDy H 1 3.617 0.020 A 26 PRO HGy H 1 2.022 0.020 A 26 PRO HGx H 1 1.916 0.020 A 26 PRO C C 13 178.121 0.400 A 26 PRO CA C 13 65.051 0.400 A 26 PRO CB C 13 32.000 0.400 A 26 PRO CD C 13 50.021 0.400 A 26 PRO CG C 13 27.140 0.400 A 27 LYS H H 1 8.768 0.020 A 27 LYS HA H 1 4.479 0.020 A 27 LYS HBy H 1 2.072 0.020 A 27 LYS HBx H 1 1.769 0.020 A 27 LYS HDx H 1 1.669 0.020 A 27 LYS HDy H 1 1.673 0.020 A 27 LYS HE2 H 1 2.975 0.020 A 27 LYS HE3 H 1 2.975 0.020 A 27 LYS HGy H 1 1.459 0.020 A 27 LYS HGx H 1 1.372 0.020 A 27 LYS C C 13 176.744 0.400 A 27 LYS CA C 13 54.717 0.400 A 27 LYS CB C 13 31.719 0.400 A 27 LYS CD C 13 28.512 0.400 A 27 LYS CE C 13 41.780 0.400 A 27 LYS CG C 13 24.910 0.400 A 27 LYS N N 15 115.537 0.400 A 28 ALA H H 1 7.677 0.020 A 28 ALA HA H 1 4.305 0.020 A 28 ALA HB% H 1 1.384 0.020 A 28 ALA C C 13 177.993 0.400 A 28 ALA CA C 13 52.585 0.400 A 28 ALA CB C 13 18.712 0.400 A 28 ALA N N 15 123.662 0.400 A 29 THR H H 1 8.953 0.020 A 29 THR HA H 1 4.240 0.020 A 29 THR HB H 1 4.111 0.020 A 29 THR HG2% H 1 1.179 0.020 A 29 THR C C 13 173.048 0.400 A 29 THR CA C 13 63.146 0.400 A 29 THR CB C 13 68.819 0.400 A 29 THR CG2 C 13 21.652 0.400 A 29 THR N N 15 120.525 0.400 A 30 VAL H H 1 8.416 0.020 A 30 VAL HA H 1 4.780 0.020 A 30 VAL HB H 1 1.939 0.020 A 30 VAL HGx% H 1 0.850 0.020 A 30 VAL HGy% H 1 0.840 0.020 A 30 VAL C C 13 175.138 0.400 A 30 VAL CA C 13 60.468 0.400 A 30 VAL CB C 13 33.710 0.400 A 30 VAL CG1 C 13 21.180 0.400 A 30 VAL CG2 C 13 20.944 0.400 A 30 VAL N N 15 127.607 0.400 A 31 THR H H 1 8.775 0.020 A 31 THR HA H 1 4.650 0.020 A 31 THR HB H 1 4.023 0.020 A 31 THR HG2% H 1 1.117 0.020 A 31 THR C C 13 172.615 0.400 A 31 THR CA C 13 60.641 0.400 A 31 THR CB C 13 71.524 0.400 A 31 THR CG2 C 13 21.274 0.400 A 31 THR N N 15 120.920 0.400 A 32 ARG H H 1 8.757 0.020 A 32 ARG HA H 1 5.213 0.020 A 32 ARG HBy H 1 2.044 0.020 A 32 ARG HBx H 1 1.694 0.020 A 32 ARG HDy H 1 3.117 0.020 A 32 ARG HDx H 1 3.066 0.020 A 32 ARG HGy H 1 1.735 0.020 A 32 ARG HGx H 1 1.581 0.020 A 32 ARG C C 13 176.387 0.400 A 32 ARG CA C 13 53.871 0.400 A 32 ARG CB C 13 30.449 0.400 A 32 ARG CD C 13 42.207 0.400 A 32 ARG CG C 13 26.819 0.400 A 32 ARG N N 15 123.505 0.400 A 33 THR H H 1 8.403 0.020 A 33 THR HA H 1 4.481 0.020 A 33 THR HB H 1 4.174 0.020 A 33 THR HG2% H 1 1.048 0.020 A 33 THR C C 13 172.334 0.400 A 33 THR CA C 13 60.710 0.400 A 33 THR CB C 13 69.273 0.400 A 33 THR CG2 C 13 20.756 0.400 A 33 THR N N 15 117.278 0.400 A 34 ASN H H 1 7.987 0.020 A 34 ASN HA H 1 4.661 0.020 A 34 ASN HBy H 1 2.938 0.020 A 34 ASN HBx H 1 2.614 0.020 A 34 ASN HD2y H 1 7.664 0.020 A 34 ASN HD2x H 1 6.950 0.020 A 34 ASN C C 13 176.362 0.400 A 34 ASN CA C 13 53.833 0.400 A 34 ASN CB C 13 41.820 0.400 A 34 ASN N N 15 127.725 0.400 A 34 ASN ND2 N 15 112.952 0.400 A 35 GLY H H 1 8.419 0.020 A 35 GLY HAx H 1 3.653 0.020 A 35 GLY HAy H 1 4.176 0.020 A 35 GLY C C 13 174.040 0.400 A 35 GLY CA C 13 45.555 0.400 A 35 GLY N N 15 112.162 0.400 A 36 ASP H H 1 7.867 0.020 A 36 ASP HA H 1 5.358 0.020 A 36 ASP HBy H 1 2.658 0.020 A 36 ASP HBx H 1 2.642 0.020 A 36 ASP C C 13 176.184 0.400 A 36 ASP CA C 13 53.624 0.400 A 36 ASP CB C 13 42.643 0.400 A 36 ASP N N 15 118.367 0.400 A 37 ILE H H 1 8.697 0.020 A 37 ILE HA H 1 4.741 0.020 A 37 ILE HB H 1 1.643 0.020 A 37 ILE HD1% H 1 0.836 0.020 A 37 ILE HG1x H 1 0.939 0.020 A 37 ILE HG1y H 1 1.652 0.020 A 37 ILE HG2% H 1 0.777 0.020 A 37 ILE C C 13 173.711 0.400 A 37 ILE CA C 13 60.495 0.400 A 37 ILE CB C 13 40.712 0.400 A 37 ILE CD1 C 13 14.514 0.400 A 37 ILE CG1 C 13 27.374 0.400 A 37 ILE CG2 C 13 17.729 0.400 A 37 ILE N N 15 118.568 0.400 A 38 LYS H H 1 9.089 0.020 A 38 LYS HA H 1 5.383 0.020 A 38 LYS HBy H 1 1.757 0.020 A 38 LYS HBx H 1 1.399 0.020 A 38 LYS HDx H 1 1.450 0.020 A 38 LYS HDy H 1 1.557 0.020 A 38 LYS HEy H 1 2.775 0.020 A 38 LYS HEx H 1 2.767 0.020 A 38 LYS HGy H 1 1.250 0.020 A 38 LYS HGx H 1 1.206 0.020 A 38 LYS C C 13 174.552 0.400 A 38 LYS CA C 13 54.305 0.400 A 38 LYS CB C 13 34.682 0.400 A 38 LYS CD C 13 29.279 0.400 A 38 LYS CE C 13 41.495 0.400 A 38 LYS CG C 13 24.910 0.400 A 38 LYS N N 15 127.000 0.400 A 39 LEU H H 1 9.124 0.020 A 39 LEU HA H 1 4.966 0.020 A 39 LEU HBx H 1 1.511 0.020 A 39 LEU HBy H 1 1.524 0.020 A 39 LEU HDx% H 1 0.715 0.020 A 39 LEU HDy% H 1 0.775 0.020 A 39 LEU HG H 1 1.507 0.020 A 39 LEU C C 13 174.501 0.400 A 39 LEU CA C 13 53.122 0.400 A 39 LEU CB C 13 44.895 0.400 A 39 LEU CD1 C 13 25.753 0.400 A 39 LEU CD2 C 13 25.734 0.400 A 39 LEU CG C 13 26.770 0.400 A 39 LEU N N 15 126.188 0.400 A 40 ASP H H 1 8.039 0.020 A 40 ASP HA H 1 5.035 0.020 A 40 ASP HBx H 1 2.463 0.020 A 40 ASP HBy H 1 2.670 0.020 A 40 ASP C C 13 174.093 0.400 A 40 ASP CA C 13 52.858 0.400 A 40 ASP CB C 13 42.110 0.400 A 40 ASP N N 15 121.917 0.400 A 41 ALA H H 1 8.563 0.020 A 41 ALA HA H 1 4.591 0.020 A 41 ALA HB% H 1 1.281 0.020 A 41 ALA C C 13 177.968 0.400 A 41 ALA CA C 13 49.812 0.400 A 41 ALA CB C 13 21.039 0.400 A 41 ALA N N 15 125.037 0.400 A 42 GLN H H 1 9.312 0.020 A 42 GLN HA H 1 4.051 0.020 A 42 GLN HBy H 1 2.153 0.020 A 42 GLN HBx H 1 2.060 0.020 A 42 GLN HE2y H 1 7.740 0.020 A 42 GLN HE2x H 1 6.839 0.020 A 42 GLN HGx H 1 2.438 0.020 A 42 GLN HGy H 1 2.539 0.020 A 42 GLN C C 13 176.591 0.400 A 42 GLN CA C 13 58.089 0.400 A 42 GLN CB C 13 29.814 0.400 A 42 GLN CG C 13 34.207 0.400 A 42 GLN N N 15 120.537 0.400 A 42 GLN NE2 N 15 113.631 0.400 A 43 THR H H 1 7.093 0.020 A 43 THR HA H 1 4.731 0.020 A 43 THR HB H 1 4.671 0.020 A 43 THR HG2% H 1 1.234 0.020 A 43 THR CA C 13 58.158 0.400 A 43 THR CB C 13 73.558 0.400 A 43 THR CG2 C 13 21.699 0.400 A 43 THR N N 15 103.287 0.400 A 44 GLU HA H 1 4.260 0.020 A 45 LYS HA H 1 4.135 0.020 A 45 LYS HBy H 1 1.874 0.020 A 45 LYS HBx H 1 1.801 0.020 A 45 LYS HD2 H 1 1.723 0.020 A 45 LYS HD3 H 1 1.724 0.020 A 45 LYS HEy H 1 3.010 0.020 A 45 LYS HEx H 1 3.007 0.020 A 45 LYS HGx H 1 1.496 0.020 A 45 LYS HGy H 1 1.571 0.020 A 45 LYS C C 13 179.268 0.400 A 45 LYS CA C 13 58.877 0.400 A 45 LYS CB C 13 31.470 0.400 A 45 LYS CD C 13 28.503 0.400 A 45 LYS CE C 13 41.780 0.400 A 45 LYS CG C 13 24.910 0.400 A 46 GLU H H 1 8.008 0.020 A 46 GLU HA H 1 4.089 0.020 A 46 GLU HBy H 1 2.128 0.020 A 46 GLU HBx H 1 2.049 0.020 A 46 GLU HGx H 1 2.135 0.020 A 46 GLU HGy H 1 2.297 0.020 A 46 GLU C C 13 177.713 0.400 A 46 GLU CA C 13 59.408 0.400 A 46 GLU CB C 13 30.261 0.400 A 46 GLU CG C 13 37.502 0.400 A 46 GLU N N 15 120.787 0.400 A 47 ALA H H 1 8.171 0.020 A 47 ALA HA H 1 3.674 0.020 A 47 ALA HB% H 1 1.334 0.020 A 47 ALA C C 13 178.988 0.400 A 47 ALA CA C 13 54.853 0.400 A 47 ALA CB C 13 17.556 0.400 A 47 ALA N N 15 121.162 0.400 A 48 GLU H H 1 7.922 0.020 A 48 GLU HA H 1 4.101 0.020 A 48 GLU HBy H 1 2.198 0.020 A 48 GLU HBx H 1 2.171 0.020 A 48 GLU HGx H 1 2.202 0.020 A 48 GLU HGy H 1 2.483 0.020 A 48 GLU C C 13 179.243 0.400 A 48 GLU CA C 13 59.134 0.400 A 48 GLU CB C 13 29.496 0.400 A 48 GLU CG C 13 36.010 0.400 A 48 GLU N N 15 118.010 0.400 A 49 LYS H H 1 7.577 0.020 A 49 LYS HA H 1 4.103 0.020 A 49 LYS HB2 H 1 2.276 0.020 A 49 LYS HB3 H 1 2.275 0.020 A 49 LYS HD2 H 1 1.893 0.020 A 49 LYS HD3 H 1 1.892 0.020 A 49 LYS HEx H 1 3.034 0.020 A 49 LYS HEy H 1 3.037 0.020 A 49 LYS HGx H 1 1.649 0.020 A 49 LYS HGy H 1 1.890 0.020 A 49 LYS C C 13 180.007 0.400 A 49 LYS CA C 13 59.527 0.400 A 49 LYS CB C 13 32.941 0.400 A 49 LYS CD C 13 29.402 0.400 A 49 LYS CE C 13 41.953 0.400 A 49 LYS CG C 13 25.668 0.400 A 49 LYS N N 15 119.676 0.400 A 50 MET H H 1 8.646 0.020 A 50 MET HA H 1 3.740 0.020 A 50 MET HBx H 1 1.292 0.020 A 50 MET HBy H 1 1.657 0.020 A 50 MET HE% H 1 1.189 0.020 A 50 MET HGy H 1 1.637 0.020 A 50 MET HGx H 1 0.485 0.020 A 50 MET C C 13 177.560 0.400 A 50 MET CA C 13 60.040 0.400 A 50 MET CB C 13 32.109 0.400 A 50 MET CE C 13 17.361 0.400 A 50 MET CG C 13 32.070 0.400 A 50 MET N N 15 122.341 0.400 A 51 GLU H H 1 8.330 0.020 A 51 GLU HA H 1 3.559 0.020 A 51 GLU HBy H 1 2.132 0.020 A 51 GLU HBx H 1 2.066 0.020 A 51 GLU HGy H 1 2.283 0.020 A 51 GLU HGx H 1 2.052 0.020 A 51 GLU C C 13 177.739 0.400 A 51 GLU CA C 13 60.131 0.400 A 51 GLU CB C 13 29.184 0.400 A 51 GLU CG C 13 36.511 0.400 A 51 GLU N N 15 119.475 0.400 A 52 LYS H H 1 7.502 0.020 A 52 LYS HA H 1 3.904 0.020 A 52 LYS HBy H 1 1.962 0.020 A 52 LYS HBx H 1 1.921 0.020 A 52 LYS HD2 H 1 1.704 0.020 A 52 LYS HD3 H 1 1.703 0.020 A 52 LYS HE2 H 1 2.995 0.020 A 52 LYS HE3 H 1 2.995 0.020 A 52 LYS HGx H 1 1.483 0.020 A 52 LYS HGy H 1 1.697 0.020 A 52 LYS C C 13 178.733 0.400 A 52 LYS CA C 13 59.408 0.400 A 52 LYS CB C 13 32.209 0.400 A 52 LYS CD C 13 28.780 0.400 A 52 LYS CE C 13 41.780 0.400 A 52 LYS CG C 13 25.433 0.400 A 52 LYS N N 15 116.912 0.400 A 53 ALA H H 1 7.822 0.020 A 53 ALA HA H 1 4.243 0.020 A 53 ALA HB% H 1 1.774 0.020 A 53 ALA C C 13 179.625 0.400 A 53 ALA CA C 13 54.852 0.400 A 53 ALA CB C 13 18.305 0.400 A 53 ALA N N 15 122.586 0.400 A 54 VAL H H 1 8.295 0.020 A 54 VAL HA H 1 3.404 0.020 A 54 VAL HB H 1 2.180 0.020 A 54 VAL HGx% H 1 0.820 0.020 A 54 VAL HGy% H 1 0.938 0.020 A 54 VAL C C 13 178.019 0.400 A 54 VAL CA C 13 66.661 0.400 A 54 VAL CB C 13 31.100 0.400 A 54 VAL CG1 C 13 21.699 0.400 A 54 VAL CG2 C 13 22.359 0.400 A 54 VAL N N 15 117.225 0.400 A 55 LYS H H 1 8.038 0.020 A 55 LYS HA H 1 4.103 0.020 A 55 LYS HBy H 1 1.898 0.020 A 55 LYS HBx H 1 1.819 0.020 A 55 LYS HDx H 1 1.699 0.020 A 55 LYS HDy H 1 1.729 0.020 A 55 LYS HEy H 1 3.013 0.020 A 55 LYS HEx H 1 2.930 0.020 A 55 LYS HGy H 1 1.632 0.020 A 55 LYS HGx H 1 1.473 0.020 A 55 LYS C C 13 177.484 0.400 A 55 LYS CA C 13 57.868 0.400 A 55 LYS CB C 13 32.232 0.400 A 55 LYS CD C 13 29.396 0.400 A 55 LYS CE C 13 41.780 0.400 A 55 LYS CG C 13 26.564 0.400 A 55 LYS N N 15 117.350 0.400 A 56 LYS H H 1 7.456 0.020 A 56 LYS HA H 1 4.006 0.020 A 56 LYS HBx H 1 1.962 0.020 A 56 LYS HBy H 1 2.035 0.020 A 56 LYS HDx H 1 1.664 0.020 A 56 LYS HDy H 1 1.726 0.020 A 56 LYS HEy H 1 2.944 0.020 A 56 LYS HEx H 1 2.942 0.020 A 56 LYS HGx H 1 1.340 0.020 A 56 LYS HGy H 1 1.584 0.020 A 56 LYS C C 13 177.764 0.400 A 56 LYS CA C 13 58.861 0.400 A 56 LYS CB C 13 32.220 0.400 A 56 LYS CD C 13 29.355 0.400 A 56 LYS CE C 13 41.780 0.400 A 56 LYS CG C 13 24.773 0.400 A 56 LYS N N 15 118.850 0.400 A 57 VAL H H 1 7.070 0.020 A 57 VAL HA H 1 4.055 0.020 A 57 VAL HB H 1 2.127 0.020 A 57 VAL HGx% H 1 0.942 0.020 A 57 VAL HGy% H 1 1.020 0.020 A 57 VAL C C 13 175.546 0.400 A 57 VAL CA C 13 62.870 0.400 A 57 VAL CB C 13 32.643 0.400 A 57 VAL CG1 C 13 22.217 0.400 A 57 VAL CG2 C 13 20.992 0.400 A 57 VAL N N 15 114.412 0.400 A 58 LYS H H 1 8.584 0.020 A 58 LYS HA H 1 4.758 0.020 A 58 LYS HBy H 1 1.804 0.020 A 58 LYS HBx H 1 1.271 0.020 A 58 LYS HDy H 1 1.645 0.020 A 58 LYS HDx H 1 1.310 0.020 A 58 LYS HEy H 1 3.066 0.020 A 58 LYS HEx H 1 2.813 0.020 A 58 LYS HGx H 1 1.117 0.020 A 58 LYS HGy H 1 1.449 0.020 A 58 LYS CA C 13 53.392 0.400 A 58 LYS CB C 13 34.154 0.400 A 58 LYS CD C 13 29.449 0.400 A 58 LYS CE C 13 42.515 0.400 A 58 LYS CG C 13 25.668 0.400 A 58 LYS N N 15 121.959 0.400 A 59 PRO HA H 1 4.664 0.020 A 59 PRO HBx H 1 1.907 0.020 A 59 PRO HBy H 1 2.418 0.020 A 59 PRO HDy H 1 3.777 0.020 A 59 PRO HDx H 1 3.360 0.020 A 59 PRO HG2 H 1 2.032 0.020 A 59 PRO HG3 H 1 2.032 0.020 A 59 PRO C C 13 177.433 0.400 A 59 PRO CA C 13 64.914 0.400 A 59 PRO CB C 13 31.759 0.400 A 59 PRO CD C 13 50.111 0.400 A 59 PRO CG C 13 27.007 0.400 A 60 ASN H H 1 8.231 0.020 A 60 ASN HA H 1 4.818 0.020 A 60 ASN HBy H 1 2.992 0.020 A 60 ASN HBx H 1 2.790 0.020 A 60 ASN HD2y H 1 7.561 0.020 A 60 ASN HD2x H 1 6.959 0.020 A 60 ASN C C 13 175.160 0.400 A 60 ASN CA C 13 51.961 0.400 A 60 ASN CB C 13 36.979 0.400 A 60 ASN N N 15 113.498 0.400 A 60 ASN ND2 N 15 111.645 0.400 A 61 ALA H H 1 7.783 0.020 A 61 ALA HA H 1 4.129 0.020 A 61 ALA HB% H 1 1.273 0.020 A 61 ALA C C 13 176.974 0.400 A 61 ALA CA C 13 52.946 0.400 A 61 ALA CB C 13 18.945 0.400 A 61 ALA N N 15 121.662 0.400 A 62 THR H H 1 9.311 0.020 A 62 THR HA H 1 4.306 0.020 A 62 THR HB H 1 4.089 0.020 A 62 THR HG2% H 1 1.136 0.020 A 62 THR C C 13 172.946 0.400 A 62 THR CA C 13 62.097 0.400 A 62 THR CB C 13 69.363 0.400 A 62 THR CG2 C 13 21.237 0.400 A 62 THR N N 15 120.549 0.400 A 63 ILE H H 1 8.580 0.020 A 63 ILE HA H 1 4.664 0.020 A 63 ILE HB H 1 1.772 0.020 A 63 ILE HD1% H 1 0.827 0.020 A 63 ILE HG1y H 1 1.473 0.020 A 63 ILE HG1x H 1 0.965 0.020 A 63 ILE HG2% H 1 0.708 0.020 A 63 ILE C C 13 175.342 0.400 A 63 ILE CA C 13 60.127 0.400 A 63 ILE CB C 13 39.375 0.400 A 63 ILE CD1 C 13 14.467 0.400 A 63 ILE CG1 C 13 27.960 0.400 A 63 ILE CG2 C 13 18.201 0.400 A 63 ILE N N 15 126.975 0.400 A 64 ARG H H 1 9.046 0.020 A 64 ARG HA H 1 4.654 0.020 A 64 ARG HBy H 1 1.792 0.020 A 64 ARG HBx H 1 1.684 0.020 A 64 ARG HDy H 1 3.183 0.020 A 64 ARG HDx H 1 3.078 0.020 A 64 ARG HGx H 1 1.528 0.020 A 64 ARG HGy H 1 1.598 0.020 A 64 ARG C C 13 175.087 0.400 A 64 ARG CA C 13 55.260 0.400 A 64 ARG CB C 13 31.591 0.400 A 64 ARG CD C 13 43.100 0.400 A 64 ARG CG C 13 27.310 0.400 A 64 ARG N N 15 128.037 0.400 A 65 LYS H H 1 8.818 0.020 A 65 LYS HA H 1 5.253 0.020 A 65 LYS HBx H 1 1.595 0.020 A 65 LYS HBy H 1 1.716 0.020 A 65 LYS HDy H 1 1.568 0.020 A 65 LYS HDx H 1 1.565 0.020 A 65 LYS HE2 H 1 2.828 0.020 A 65 LYS HE3 H 1 2.828 0.020 A 65 LYS HGx H 1 1.242 0.020 A 65 LYS HGy H 1 1.324 0.020 A 65 LYS C C 13 176.209 0.400 A 65 LYS CA C 13 55.138 0.400 A 65 LYS CB C 13 34.064 0.400 A 65 LYS CD C 13 28.780 0.400 A 65 LYS CE C 13 41.588 0.400 A 65 LYS CG C 13 24.631 0.400 A 65 LYS N N 15 125.975 0.400 A 66 THR H H 1 8.635 0.020 A 66 THR HA H 1 4.527 0.020 A 66 THR HB H 1 4.224 0.020 A 66 THR HG2% H 1 1.162 0.020 A 66 THR C C 13 173.915 0.400 A 66 THR CA C 13 61.368 0.400 A 66 THR CB C 13 70.613 0.400 A 66 THR CG2 C 13 21.746 0.400 A 66 THR N N 15 117.100 0.400 A 67 GLY H H 1 8.612 0.020 A 67 GLY HAx H 1 3.939 0.020 A 67 GLY HAy H 1 4.112 0.020 A 67 GLY C C 13 174.399 0.400 A 67 GLY CA C 13 44.964 0.400 A 67 GLY N N 15 110.581 0.400 A 68 GLY H H 1 8.421 0.020 A 68 GLY HAx H 1 3.946 0.020 A 68 GLY HAy H 1 4.037 0.020 A 68 GLY C C 13 174.040 0.400 A 68 GLY CA C 13 44.874 0.400 A 68 GLY N N 15 108.425 0.400 A 69 SER H H 1 8.501 0.020 A 69 SER HA H 1 4.430 0.020 A 69 SER HBx H 1 3.837 0.020 A 69 SER HBy H 1 3.871 0.020 A 69 SER C C 13 174.530 0.400 A 69 SER CA C 13 58.442 0.400 A 69 SER CB C 13 63.695 0.400 A 69 SER N N 15 116.081 0.400 A 70 LEU H H 1 8.407 0.020 A 70 LEU HA H 1 4.316 0.020 A 70 LEU HBx H 1 1.524 0.020 A 70 LEU HBy H 1 1.590 0.020 A 70 LEU HDx% H 1 0.888 0.020 A 70 LEU HDy% H 1 0.820 0.020 A 70 LEU HG H 1 1.583 0.020 A 70 LEU C C 13 177.101 0.400 A 70 LEU CA C 13 54.991 0.400 A 70 LEU CB C 13 41.971 0.400 A 70 LEU CD1 C 13 24.614 0.400 A 70 LEU CD2 C 13 23.160 0.400 A 70 LEU CG C 13 26.770 0.400 A 70 LEU N N 15 124.037 0.400 A 71 GLU H H 1 8.304 0.020 A 71 GLU HA H 1 4.163 0.020 A 71 GLU HBy H 1 1.888 0.020 A 71 GLU HBx H 1 1.815 0.020 A 71 GLU HGy H 1 2.167 0.020 A 71 GLU HGx H 1 2.098 0.020 A 71 GLU CA C 13 56.554 0.400 A 71 GLU CB C 13 29.799 0.400 A 71 GLU CG C 13 36.010 0.400 A 71 GLU N N 15 121.072 0.400 stop_ save_ save_CNS/XPLOR_distance_constraints_2 _nef_distance_restraint_list.sf_category nef_distance_restraint_list _nef_distance_restraint_list.sf_framecode CNS/XPLOR_distance_constraints_2 _nef_distance_restraint_list.restraint_origin noe _nef_distance_restraint_list.potential_type square-well-parabolic loop_ _nef_distance_restraint.index _nef_distance_restraint.restraint_id _nef_distance_restraint.chain_code_1 _nef_distance_restraint.sequence_code_1 _nef_distance_restraint.residue_name_1 _nef_distance_restraint.atom_name_1 _nef_distance_restraint.chain_code_2 _nef_distance_restraint.sequence_code_2 _nef_distance_restraint.residue_name_2 _nef_distance_restraint.atom_name_2 _nef_distance_restraint.weight _nef_distance_restraint.lower_limit _nef_distance_restraint.upper_limit 1 1 A 2 VAL HA A 3 ASP H 1.0 1.8 3.60 2 2 A 3 ASP H A 2 VAL HB 1.0 1.8 5.66 3 3 A 3 ASP H A 2 VAL HGx% 1.0 1.8 4.89 4 4 A 3 ASP HA A 4 LEU H 1.0 1.8 3.38 5 5 A 4 LEU H A 3 ASP HBx 1.0 1.8 5.36 6 6 A 4 LEU H A 3 ASP HBy 1.0 1.8 5.36 7 7 A 4 LEU HA A 5 LYS H 1.0 1.8 3.43 8 8 A 5 LYS H A 4 LEU HBx 1.0 1.8 5.27 9 9 A 5 LYS H A 5 LYS HGx 1.0 1.8 5.81 10 10 A 5 LYS H A 4 LEU HBy 1.0 1.8 4.29 11 11 A 5 LYS H A 4 LEU HG 1.0 1.8 6.64 12 12 A 5 LYS H A 63 ILE HG1y 1.0 1.8 6.90 13 13 A 5 LYS H A 6 ILE HD1% 1.0 1.8 4.74 14 14 A 5 LYS H A 63 ILE HG2% 1.0 1.8 4.51 15 15 A 5 LYS HA A 6 ILE H 1.0 1.8 3.70 16 16 A 6 ILE H A 6 ILE HB 1.0 1.8 4.20 17 17 A 6 ILE H A 5 LYS HGx 1.0 1.8 5.50 18 18 A 6 ILE H A 5 LYS HGy 1.0 1.8 5.50 19 19 A 6 ILE H A 7 ASP H 1.0 1.8 5.99 20 20 A 7 ASP H A 6 ILE HA 1.0 1.8 3.52 21 21 A 6 ILE HB A 7 ASP H 1.0 1.8 5.76 22 22 A 7 ASP H A 6 ILE HG2% 1.0 1.8 4.03 23 23 A 7 ASP H A 6 ILE HG1y 1.0 1.8 6.30 24 24 A 7 ASP H A 6 ILE HG1x 1.0 1.8 6.30 25 25 A 6 ILE HD1% A 7 ASP H 1.0 1.8 5.80 26 26 A 7 ASP HA A 8 VAL H 1.0 1.8 3.24 27 27 A 8 VAL H A 7 ASP HBy 1.0 1.8 4.93 28 28 A 8 VAL H A 7 ASP HBx 1.0 1.8 4.93 29 29 A 8 VAL HB A 9 SER H 1.0 1.8 5.95 30 30 A 9 SER H A 8 VAL HGy% 1.0 1.8 6.04 31 31 A 10 ASP H A 9 SER HBy 1.0 1.8 5.52 32 32 A 10 ASP H A 9 SER HBx 1.0 1.8 5.52 33 33 A 11 ASP H A 10 ASP HBy 1.0 1.8 5.16 34 34 A 11 ASP H A 10 ASP HBx 1.0 1.8 5.16 35 35 A 11 ASP H A 12 GLU H 1.0 1.8 4.47 36 36 A 12 GLU H A 11 ASP HBy 1.0 1.8 4.80 37 37 A 12 GLU H A 11 ASP HBx 1.0 1.8 4.80 38 38 A 12 GLU HBy A 13 GLU H 1.0 1.8 3.48 39 39 A 14 ALA H A 13 GLU HGx 1.0 1.8 6.07 40 40 A 14 ALA H A 13 GLU HGy 1.0 1.8 6.07 41 41 A 14 ALA HB% A 15 GLU H 1.0 1.8 3.53 42 42 A 15 GLU H A 16 LYS H 1.0 1.8 3.37 43 43 A 16 LYS H A 15 GLU HBy 1.0 1.8 3.59 44 44 A 16 LYS H A 15 GLU HGx 1.0 1.8 5.80 45 45 A 16 LYS H A 15 GLU HGy 1.0 1.8 5.80 46 46 A 15 GLU HA A 17 ILE H 1.0 1.8 4.92 47 47 A 17 ILE H A 18 ILE H 1.0 1.8 3.96 48 48 A 18 ILE H A 17 ILE HB 1.0 1.8 3.50 49 49 A 18 ILE H A 17 ILE HG2% 1.0 1.8 4.26 50 50 A 18 ILE H A 17 ILE HG1x 1.0 1.8 5.92 51 51 A 18 ILE H A 17 ILE HG1y 1.0 1.8 4.58 52 52 A 18 ILE H A 19 ARG H 1.0 1.8 4.01 53 53 A 19 ARG H A 18 ILE HB 1.0 1.8 3.74 54 54 A 19 ARG H A 18 ILE HG2% 1.0 1.8 4.31 55 55 A 19 ARG H A 19 ARG HBx 1.0 1.8 4.09 56 56 A 20 GLU H A 19 ARG HBy 1.0 1.8 4.55 57 57 A 20 GLU H A 19 ARG HBx 1.0 1.8 4.55 58 58 A 20 GLU H A 19 ARG HGx 1.0 1.8 5.77 59 59 A 20 GLU H A 19 ARG HGy 1.0 1.8 5.77 60 60 A 21 ILE H A 20 GLU HGx 1.0 1.8 5.54 61 61 A 21 ILE H A 20 GLU HGy 1.0 1.8 5.54 62 62 A 21 ILE HB A 22 ARG H 1.0 1.8 4.07 63 63 A 22 ARG H A 21 ILE HG2% 1.0 1.8 4.65 64 64 A 22 ARG H A 21 ILE HG1y 1.0 1.8 5.08 65 65 A 22 ARG H A 21 ILE HG1x 1.0 1.8 6.04 66 66 A 22 ARG H A 21 ILE HD1% 1.0 1.8 5.77 67 67 A 22 ARG HBy A 23 GLU H 1.0 1.8 4.00 68 68 A 23 GLU H A 22 ARG HBx 1.0 1.8 4.72 69 69 A 23 GLU H A 22 ARG HGx 1.0 1.8 6.31 70 70 A 23 GLU H A 22 ARG HGy 1.0 1.8 6.31 71 71 A 24 GLN H A 23 GLU HBx 1.0 1.8 4.65 72 72 A 24 GLN H A 23 GLU HBy 1.0 1.8 4.65 73 73 A 24 GLN H A 25 TRP H 1.0 1.8 3.50 74 74 A 25 TRP H A 24 GLN HBy 1.0 1.8 4.91 75 75 A 25 TRP H A 24 GLN HBx 1.0 1.8 4.91 76 76 A 26 PRO HGx A 27 LYS H 1.0 1.8 5.42 77 77 A 27 LYS H A 26 PRO HGy 1.0 1.8 4.62 78 78 A 27 LYS H A 26 PRO HDy 1.0 1.8 6.28 79 79 A 27 LYS H A 26 PRO HDx 1.0 1.8 5.28 80 80 A 28 ALA H A 27 LYS HBy 1.0 1.8 5.76 81 81 A 28 ALA H A 27 LYS HBx 1.0 1.8 5.76 82 82 A 28 ALA HA A 29 THR H 1.0 1.8 3.78 83 83 A 29 THR H A 28 ALA HB% 1.0 1.8 4.54 84 84 A 29 THR HA A 30 VAL H 1.0 1.8 3.75 85 85 A 30 VAL H A 29 THR HB 1.0 1.8 5.30 86 86 A 30 VAL H A 29 THR HG2% 1.0 1.8 4.58 87 87 A 30 VAL HA A 31 THR H 1.0 1.8 3.38 88 88 A 31 THR H A 30 VAL HB 1.0 1.8 5.58 89 89 A 31 THR H A 30 VAL HGx% 1.0 1.8 3.99 90 90 A 31 THR HA A 32 ARG H 1.0 1.8 4.09 91 91 A 32 ARG H A 31 THR HB 1.0 1.8 4.80 92 92 A 32 ARG HA A 33 THR H 1.0 1.8 3.81 93 93 A 33 THR H A 32 ARG HBy 1.0 1.8 5.34 94 94 A 33 THR H A 32 ARG HBx 1.0 1.8 5.34 95 95 A 33 THR H A 32 ARG HGy 1.0 1.8 5.76 96 96 A 33 THR H A 32 ARG HGx 1.0 1.8 5.76 97 97 A 33 THR HA A 34 ASN H 1.0 1.8 3.63 98 98 A 34 ASN H A 33 THR HB 1.0 1.8 4.93 99 99 A 34 ASN H A 33 THR HG2% 1.0 1.8 5.29 100 100 A 35 GLY H A 36 ASP H 1.0 1.8 4.14 101 101 A 33 THR HB A 36 ASP H 1.0 1.8 5.27 102 102 A 36 ASP HA A 37 ILE H 1.0 1.8 3.65 103 103 A 37 ILE H A 36 ASP HBx 1.0 1.8 3.90 104 104 A 37 ILE HA A 38 LYS H 1.0 1.8 3.61 105 105 A 38 LYS H A 37 ILE HB 1.0 1.8 5.04 106 106 A 38 LYS H A 37 ILE HG2% 1.0 1.8 4.19 107 107 A 30 VAL HGx% A 38 LYS H 1.0 1.8 5.54 108 108 A 38 LYS H A 37 ILE HD1% 1.0 1.8 5.76 109 109 A 38 LYS HA A 39 LEU H 1.0 1.8 3.61 110 110 A 39 LEU H A 38 LYS HBx 1.0 1.8 5.24 111 111 A 39 LEU H A 38 LYS HGy 1.0 1.8 5.69 112 112 A 4 LEU HBx A 39 LEU H 1.0 1.8 5.91 113 113 A 39 LEU HA A 40 ASP H 1.0 1.8 3.39 114 114 A 40 ASP H A 39 LEU HG 1.0 1.8 4.12 115 115 A 40 ASP H A 39 LEU HDy% 1.0 1.8 5.46 116 116 A 40 ASP H A 39 LEU HDx% 1.0 1.8 5.46 117 117 A 40 ASP H A 41 ALA H 1.0 1.8 5.60 118 118 A 41 ALA H A 40 ASP HA 1.0 1.8 3.51 119 119 A 41 ALA H A 40 ASP HBx 1.0 1.8 5.16 120 120 A 41 ALA H A 40 ASP HBy 1.0 1.8 5.16 121 121 A 41 ALA HA A 42 GLN H 1.0 1.8 4.05 122 122 A 43 THR H A 42 GLN HBy 1.0 1.8 5.01 123 123 A 43 THR H A 42 GLN HBx 1.0 1.8 5.01 124 124 A 46 GLU H A 45 LYS HBy 1.0 1.8 4.42 125 125 A 46 GLU H A 45 LYS HBx 1.0 1.8 4.42 126 126 A 46 GLU H A 45 LYS HGx 1.0 1.8 6.37 127 127 A 46 GLU H A 45 LYS HGy 1.0 1.8 6.37 128 128 A 47 ALA H A 46 GLU HBx 1.0 1.8 4.34 129 129 A 47 ALA H A 46 GLU HBy 1.0 1.8 4.34 130 130 A 47 ALA HB% A 48 GLU H 1.0 1.8 3.76 131 131 A 48 GLU HBy A 49 LYS H 1.0 1.8 3.91 132 132 A 49 LYS H A 50 MET H 1.0 1.8 4.07 133 133 A 50 MET H A 49 LYS HB2 1.0 1.8 4.22 134 134 A 50 MET H A 51 GLU H 1.0 1.8 3.99 135 135 A 51 GLU H A 50 MET HBx 1.0 1.8 4.53 136 136 A 51 GLU H A 50 MET HBy 1.0 1.8 4.53 137 137 A 51 GLU HBx A 52 LYS H 1.0 1.8 4.61 138 138 A 52 LYS H A 51 GLU HGy 1.0 1.8 4.06 139 139 A 52 LYS H A 51 GLU HGx 1.0 1.8 5.03 140 140 A 52 LYS HBx A 53 ALA H 1.0 1.8 3.97 141 141 A 53 ALA HB% A 54 VAL H 1.0 1.8 3.84 142 142 A 54 VAL H A 55 LYS H 1.0 1.8 3.80 143 143 A 55 LYS H A 54 VAL HB 1.0 1.8 3.76 144 144 A 55 LYS H A 54 VAL HGy% 1.0 1.8 4.68 145 145 A 55 LYS H A 54 VAL HGx% 1.0 1.8 4.36 146 146 A 55 LYS H A 63 ILE HD1% 1.0 1.8 4.84 147 147 A 55 LYS HBx A 56 LYS H 1.0 1.8 4.26 148 148 A 56 LYS H A 55 LYS HBy 1.0 1.8 4.42 149 149 A 56 LYS H A 55 LYS HGx 1.0 1.8 5.65 150 150 A 57 VAL H A 56 LYS HBx 1.0 1.8 4.76 151 151 A 57 VAL H A 56 LYS HBy 1.0 1.8 4.76 152 152 A 57 VAL H A 58 LYS H 1.0 1.8 3.39 153 153 A 58 LYS H A 57 VAL HA 1.0 1.8 4.08 154 154 A 58 LYS H A 57 VAL HB 1.0 1.8 3.84 155 155 A 58 LYS H A 57 VAL HGx% 1.0 1.8 4.83 156 156 A 58 LYS H A 57 VAL HGy% 1.0 1.8 4.63 157 157 A 59 PRO HDy A 60 ASN H 1.0 1.8 5.92 158 158 A 60 ASN H A 61 ALA H 1.0 1.8 5.09 159 159 A 61 ALA H A 60 ASN HA 1.0 1.8 3.73 160 160 A 61 ALA HA A 62 THR H 1.0 1.8 3.68 161 161 A 42 GLN H A 41 ALA HB% 1.0 1.8 4.45 162 162 A 62 THR HA A 63 ILE H 1.0 1.8 3.51 163 163 A 63 ILE H A 62 THR HB 1.0 1.8 5.40 164 164 A 63 ILE H A 62 THR HG2% 1.0 1.8 4.51 165 165 A 63 ILE HG2% A 64 ARG H 1.0 1.8 4.14 166 166 A 63 ILE HG1y A 64 ARG H 1.0 1.8 5.37 167 167 A 64 ARG H A 63 ILE HG1x 1.0 1.8 5.66 168 168 A 6 ILE HG2% A 64 ARG H 1.0 1.8 6.47 169 169 A 63 ILE HD1% A 64 ARG H 1.0 1.8 6.90 170 170 A 63 ILE HB A 65 LYS H 1.0 1.8 6.66 171 171 A 65 LYS H A 64 ARG HBx 1.0 1.8 5.45 172 172 A 65 LYS HA A 66 THR H 1.0 1.8 4.09 173 173 A 66 THR H A 65 LYS HBx 1.0 1.8 5.55 174 174 A 66 THR H A 65 LYS HBy 1.0 1.8 5.62 175 175 A 66 THR HB A 67 GLY H 1.0 1.8 6.90 176 176 A 70 LEU H A 71 GLU H 1.0 1.8 5.53 177 177 A 71 GLU H A 70 LEU HBx 1.0 1.8 5.98 178 178 A 71 GLU H A 70 LEU HBy 1.0 1.8 5.98 179 179 A 60 ASN HA A 60 ASN HD2y 1.0 1.8 4.14 180 180 A 60 ASN HA A 60 ASN HD2x 1.0 1.8 4.14 181 181 A 3 ASP H A 3 ASP HBx 1.0 1.8 4.77 182 182 A 3 ASP H A 3 ASP HBy 1.0 1.8 4.77 183 183 A 4 LEU H A 4 LEU HBx 1.0 1.8 4.60 184 184 A 4 LEU H A 4 LEU HBy 1.0 1.8 4.39 185 185 A 4 LEU H A 4 LEU HG 1.0 1.8 4.23 186 186 A 4 LEU H A 4 LEU HDx% 1.0 1.8 4.28 187 187 A 4 LEU H A 4 LEU HDy% 1.0 1.8 4.65 188 188 A 5 LYS H A 5 LYS HBy 1.0 1.8 4.08 189 189 A 5 LYS H A 5 LYS HGy 1.0 1.8 5.81 190 190 A 5 LYS H A 5 LYS HBx 1.0 1.8 4.08 191 191 A 6 ILE H A 6 ILE HG2% 1.0 1.8 4.96 192 192 A 6 ILE HD1% A 6 ILE H 1.0 1.8 4.74 193 193 A 7 ASP H A 7 ASP HBy 1.0 1.8 4.23 194 194 A 7 ASP H A 7 ASP HBx 1.0 1.8 4.23 195 195 A 8 VAL H A 8 VAL HB 1.0 1.8 4.51 196 196 A 8 VAL H A 8 VAL HGy% 1.0 1.8 3.69 197 197 A 8 VAL H A 8 VAL HGx% 1.0 1.8 4.31 198 198 A 12 GLU H A 12 GLU HBx 1.0 1.8 3.47 199 199 A 12 GLU H A 12 GLU HBy 1.0 1.8 3.29 200 200 A 13 GLU H A 13 GLU HBx 1.0 1.8 3.39 201 201 A 13 GLU H A 13 GLU HBy 1.0 1.8 3.39 202 202 A 13 GLU H A 12 GLU HGy 1.0 1.8 6.22 203 203 A 14 ALA H A 14 ALA HB% 1.0 1.8 3.24 204 204 A 15 GLU H A 15 GLU HBy 1.0 1.8 3.14 205 205 A 15 GLU H A 15 GLU HGx 1.0 1.8 3.99 206 206 A 15 GLU H A 15 GLU HGy 1.0 1.8 3.99 207 207 A 16 LYS H A 16 LYS HBx 1.0 1.8 3.40 208 208 A 17 ILE H A 17 ILE HB 1.0 1.8 3.27 209 209 A 17 ILE H A 17 ILE HD1% 1.0 1.8 3.65 210 210 A 17 ILE H A 16 LYS HBx 1.0 1.8 3.67 211 211 A 17 ILE H A 17 ILE HG1y 1.0 1.8 3.88 212 212 A 18 ILE H A 18 ILE HB 1.0 1.8 3.45 213 213 A 18 ILE H A 18 ILE HG2% 1.0 1.8 4.57 214 214 A 19 ARG H A 19 ARG HBy 1.0 1.8 4.09 215 215 A 19 ARG H A 19 ARG HGx 1.0 1.8 5.51 216 216 A 19 ARG H A 19 ARG HDx 1.0 1.8 6.90 217 217 A 19 ARG H A 19 ARG HDy 1.0 1.8 6.90 218 218 A 20 GLU H A 20 GLU HBx 1.0 1.8 4.08 219 219 A 20 GLU H A 20 GLU HBy 1.0 1.8 4.08 220 220 A 21 ILE H A 21 ILE HB 1.0 1.8 3.43 221 221 A 21 ILE H A 21 ILE HG2% 1.0 1.8 4.53 222 222 A 21 ILE H A 21 ILE HG1y 1.0 1.8 3.62 223 223 A 21 ILE H A 21 ILE HG1x 1.0 1.8 4.55 224 224 A 21 ILE H A 21 ILE HD1% 1.0 1.8 4.28 225 225 A 22 ARG H A 22 ARG HBy 1.0 1.8 3.86 226 226 A 22 ARG H A 22 ARG HBx 1.0 1.8 4.27 227 227 A 22 ARG H A 22 ARG HGx 1.0 1.8 4.69 228 228 A 22 ARG H A 22 ARG HGy 1.0 1.8 4.69 229 229 A 23 GLU H A 23 GLU HBx 1.0 1.8 4.29 230 230 A 23 GLU H A 23 GLU HBy 1.0 1.8 4.29 231 231 A 23 GLU H A 23 GLU HGy 1.0 1.8 4.78 232 232 A 23 GLU H A 23 GLU HGx 1.0 1.8 4.78 233 233 A 24 GLN H A 24 GLN HBy 1.0 1.8 4.50 234 234 A 24 GLN H A 24 GLN HBx 1.0 1.8 4.50 235 235 A 24 GLN H A 24 GLN HGx 1.0 1.8 5.22 236 236 A 24 GLN H A 24 GLN HGy 1.0 1.8 5.22 237 237 A 25 TRP H A 25 TRP HBy 1.0 1.8 4.01 238 238 A 25 TRP H A 25 TRP HBx 1.0 1.8 4.65 239 239 A 27 LYS H A 27 LYS HBy 1.0 1.8 4.70 240 240 A 27 LYS H A 27 LYS HBx 1.0 1.8 4.70 241 241 A 27 LYS H A 27 LYS HGy 1.0 1.8 4.73 242 242 A 27 LYS H A 27 LYS HGx 1.0 1.8 4.73 243 243 A 28 ALA H A 28 ALA HB% 1.0 1.8 3.44 244 244 A 29 THR H A 29 THR HB 1.0 1.8 4.40 245 245 A 29 THR H A 29 THR HG2% 1.0 1.8 5.51 246 246 A 30 VAL H A 30 VAL HB 1.0 1.8 4.36 247 247 A 30 VAL H A 30 VAL HGy% 1.0 1.8 4.38 248 248 A 31 THR H A 31 THR HG2% 1.0 1.8 4.72 249 249 A 32 ARG H A 32 ARG HGy 1.0 1.8 5.59 250 250 A 32 ARG H A 32 ARG HGx 1.0 1.8 5.59 251 251 A 33 THR H A 33 THR HG2% 1.0 1.8 4.12 252 252 A 36 ASP H A 36 ASP HBy 1.0 1.8 3.74 253 253 A 37 ILE H A 37 ILE HG2% 1.0 1.8 4.72 254 254 A 37 ILE H A 37 ILE HG1y 1.0 1.8 5.09 255 255 A 37 ILE H A 37 ILE HB 1.0 1.8 3.93 256 256 A 37 ILE H A 37 ILE HG1x 1.0 1.8 4.29 257 257 A 37 ILE H A 37 ILE HD1% 1.0 1.8 4.27 258 258 A 38 LYS H A 38 LYS HBy 1.0 1.8 4.47 259 259 A 38 LYS H A 38 LYS HBx 1.0 1.8 4.47 260 260 A 38 LYS H A 38 LYS HGx 1.0 1.8 5.85 261 261 A 39 LEU H A 39 LEU HBx 1.0 1.8 4.69 262 262 A 39 LEU H A 39 LEU HBy 1.0 1.8 4.69 263 263 A 37 ILE HG2% A 39 LEU H 1.0 1.8 5.67 264 264 A 39 LEU H A 39 LEU HDx% 1.0 1.8 5.70 265 265 A 40 ASP H A 40 ASP HBx 1.0 1.8 4.34 266 266 A 40 ASP H A 40 ASP HBy 1.0 1.8 4.34 267 267 A 41 ALA H A 41 ALA HB% 1.0 1.8 3.68 268 268 A 42 GLN H A 42 GLN HGx 1.0 1.8 5.42 269 269 A 42 GLN H A 42 GLN HGy 1.0 1.8 5.42 270 270 A 43 THR H A 43 THR HG2% 1.0 1.8 4.85 271 271 A 46 GLU H A 46 GLU HBx 1.0 1.8 3.97 272 272 A 46 GLU H A 46 GLU HBy 1.0 1.8 3.97 273 273 A 46 GLU H A 46 GLU HGy 1.0 1.8 5.36 274 274 A 47 ALA H A 47 ALA HB% 1.0 1.8 3.31 275 275 A 48 GLU H A 48 GLU HBy 1.0 1.8 3.35 276 276 A 48 GLU H A 48 GLU HGx 1.0 1.8 4.23 277 277 A 48 GLU H A 48 GLU HGy 1.0 1.8 4.23 278 278 A 49 LYS H A 49 LYS HB2 1.0 1.8 3.67 279 279 A 49 LYS H A 49 LYS HGx 1.0 1.8 4.46 280 280 A 49 LYS H A 49 LYS HGy 1.0 1.8 4.46 281 281 A 50 MET H A 50 MET HBx 1.0 1.8 4.53 282 282 A 50 MET H A 50 MET HBy 1.0 1.8 4.53 283 283 A 50 MET H A 50 MET HGy 1.0 1.8 5.04 284 284 A 50 MET H A 50 MET HGx 1.0 1.8 5.04 285 285 A 51 GLU H A 51 GLU HBx 1.0 1.8 3.60 286 286 A 51 GLU H A 51 GLU HGy 1.0 1.8 3.50 287 287 A 51 GLU H A 51 GLU HGx 1.0 1.8 4.62 288 288 A 52 LYS H A 52 LYS HBx 1.0 1.8 3.45 289 289 A 52 LYS H A 52 LYS HBy 1.0 1.8 3.57 290 290 A 52 LYS H A 52 LYS HGx 1.0 1.8 5.44 291 291 A 53 ALA H A 53 ALA HB% 1.0 1.8 3.40 292 292 A 54 VAL H A 54 VAL HB 1.0 1.8 3.54 293 293 A 54 VAL H A 54 VAL HGy% 1.0 1.8 3.52 294 294 A 54 VAL H A 54 VAL HGx% 1.0 1.8 4.38 295 295 A 55 LYS H A 55 LYS HBx 1.0 1.8 4.31 296 296 A 55 LYS H A 55 LYS HBy 1.0 1.8 3.65 297 297 A 55 LYS H A 55 LYS HGx 1.0 1.8 3.82 298 298 A 55 LYS H A 55 LYS HGy 1.0 1.8 4.89 299 299 A 55 LYS H A 55 LYS HDx 1.0 1.8 4.74 300 300 A 55 LYS H A 55 LYS HDy 1.0 1.8 5.24 301 301 A 56 LYS H A 56 LYS HBx 1.0 1.8 4.19 302 302 A 56 LYS H A 56 LYS HBy 1.0 1.8 4.19 303 303 A 56 LYS H A 56 LYS HGx 1.0 1.8 5.22 304 304 A 56 LYS H A 56 LYS HGy 1.0 1.8 5.22 305 305 A 56 LYS H A 56 LYS HDx 1.0 1.8 5.45 306 306 A 56 LYS H A 56 LYS HDy 1.0 1.8 5.45 307 307 A 57 VAL H A 57 VAL HB 1.0 1.8 4.01 308 308 A 57 VAL H A 57 VAL HGx% 1.0 1.8 4.72 309 309 A 57 VAL H A 57 VAL HGy% 1.0 1.8 3.81 310 310 A 58 LYS H A 58 LYS HBy 1.0 1.8 4.32 311 311 A 58 LYS H A 58 LYS HBx 1.0 1.8 4.68 312 312 A 58 LYS H A 61 ALA HB% 1.0 1.8 5.14 313 313 A 58 LYS H A 58 LYS HGy 1.0 1.8 5.74 314 314 A 58 LYS H A 58 LYS HGx 1.0 1.8 5.54 315 315 A 58 LYS H A 58 LYS HDy 1.0 1.8 5.87 316 316 A 58 LYS H A 58 LYS HDx 1.0 1.8 5.87 317 317 A 61 ALA H A 61 ALA HB% 1.0 1.8 3.36 318 318 A 62 THR H A 62 THR HB 1.0 1.8 3.83 319 319 A 62 THR H A 62 THR HG2% 1.0 1.8 5.26 320 320 A 63 ILE H A 63 ILE HB 1.0 1.8 3.98 321 321 A 63 ILE HG2% A 63 ILE H 1.0 1.8 5.11 322 322 A 63 ILE HG1y A 63 ILE H 1.0 1.8 4.77 323 323 A 63 ILE H A 63 ILE HG1x 1.0 1.8 5.31 324 324 A 6 ILE HG2% A 63 ILE H 1.0 1.8 5.65 325 325 A 64 ARG H A 63 ILE HA 1.0 1.8 3.50 326 326 A 65 LYS H A 65 LYS HGy 1.0 1.8 6.12 327 327 A 65 LYS H A 65 LYS HBx 1.0 1.8 4.81 328 328 A 66 THR H A 66 THR HG2% 1.0 1.8 5.03 329 329 A 70 LEU H A 70 LEU HG 1.0 1.8 6.29 330 330 A 71 GLU H A 71 GLU HGy 1.0 1.8 5.49 331 331 A 71 GLU H A 71 GLU HGx 1.0 1.8 5.49 332 332 A 7 ASP H A 8 VAL H 1.0 1.8 5.81 333 333 A 12 GLU H A 13 GLU H 1.0 1.8 3.51 334 334 A 13 GLU H A 14 ALA H 1.0 1.8 3.67 335 335 A 14 ALA H A 15 GLU H 1.0 1.8 3.05 336 336 A 16 LYS H A 17 ILE H 1.0 1.8 3.42 337 337 A 19 ARG H A 20 GLU H 1.0 1.8 3.71 338 338 A 20 GLU H A 21 ILE H 1.0 1.8 4.05 339 339 A 21 ILE H A 22 ARG H 1.0 1.8 3.91 340 340 A 22 ARG H A 23 GLU H 1.0 1.8 4.07 341 341 A 23 GLU H A 24 GLN H 1.0 1.8 3.88 342 342 A 27 LYS H A 28 ALA H 1.0 1.8 4.17 343 343 A 33 THR H A 34 ASN H 1.0 1.8 4.81 344 344 A 36 ASP H A 37 ILE H 1.0 1.8 5.38 345 345 A 42 GLN H A 43 THR H 1.0 1.8 5.16 346 346 A 46 GLU H A 47 ALA H 1.0 1.8 3.83 347 347 A 47 ALA H A 48 GLU H 1.0 1.8 3.98 348 348 A 48 GLU H A 49 LYS H 1.0 1.8 3.82 349 349 A 51 GLU H A 52 LYS H 1.0 1.8 3.89 350 350 A 52 LYS H A 53 ALA H 1.0 1.8 3.89 351 351 A 53 ALA H A 54 VAL H 1.0 1.8 3.92 352 352 A 55 LYS H A 56 LYS H 1.0 1.8 3.94 353 353 A 56 LYS H A 57 VAL H 1.0 1.8 3.74 354 354 A 11 ASP H A 13 GLU H 1.0 1.8 5.04 355 355 A 14 ALA H A 12 GLU HA 1.0 1.8 5.37 356 356 A 12 GLU H A 14 ALA H 1.0 1.8 4.83 357 357 A 14 ALA H A 11 ASP HA 1.0 1.8 4.45 358 358 A 14 ALA H A 16 LYS H 1.0 1.8 5.61 359 359 A 13 GLU H A 15 GLU H 1.0 1.8 5.39 360 360 A 15 GLU H A 12 GLU HA 1.0 1.8 4.27 361 361 A 15 GLU H A 11 ASP HA 1.0 1.8 5.78 362 362 A 16 LYS H A 18 ILE H 1.0 1.8 5.50 363 363 A 17 ILE H A 14 ALA HA 1.0 1.8 4.76 364 364 A 17 ILE H A 19 ARG H 1.0 1.8 4.86 365 365 A 15 GLU HA A 18 ILE H 1.0 1.8 4.38 366 366 A 18 ILE H A 14 ALA HA 1.0 1.8 5.40 367 367 A 20 GLU H A 17 ILE HA 1.0 1.8 5.11 368 368 A 20 GLU H A 16 LYS HA 1.0 1.8 4.97 369 369 A 20 GLU H A 22 ARG H 1.0 1.8 5.64 370 370 A 21 ILE H A 18 ILE HA 1.0 1.8 5.23 371 371 A 19 ARG H A 17 ILE HA 1.0 1.8 5.82 372 372 A 21 ILE H A 17 ILE HA 1.0 1.8 6.15 373 373 A 22 ARG H A 19 ARG HA 1.0 1.8 4.62 374 374 A 22 ARG H A 18 ILE HA 1.0 1.8 5.62 375 375 A 23 GLU H A 21 ILE HA 1.0 1.8 5.45 376 376 A 21 ILE H A 23 GLU H 1.0 1.8 5.55 377 377 A 23 GLU H A 20 GLU HA 1.0 1.8 4.69 378 378 A 22 ARG H A 24 GLN H 1.0 1.8 5.84 379 379 A 24 GLN H A 21 ILE HA 1.0 1.8 5.38 380 380 A 24 GLN H A 20 GLU HA 1.0 1.8 5.76 381 381 A 24 GLN H A 22 ARG HA 1.0 1.8 6.07 382 382 A 46 GLU H A 48 GLU H 1.0 1.8 4.77 383 383 A 47 ALA H A 45 LYS HA 1.0 1.8 5.35 384 384 A 47 ALA H A 49 LYS H 1.0 1.8 6.01 385 385 A 48 GLU H A 45 LYS HA 1.0 1.8 4.32 386 386 A 48 GLU H A 50 MET H 1.0 1.8 5.31 387 387 A 50 MET H A 47 ALA HA 1.0 1.8 4.67 388 388 A 50 MET H A 46 GLU HA 1.0 1.8 5.45 389 389 A 49 LYS H A 51 GLU H 1.0 1.8 5.40 390 390 A 51 GLU H A 47 ALA HA 1.0 1.8 5.07 391 391 A 52 LYS H A 49 LYS HA 1.0 1.8 4.49 392 392 A 52 LYS H A 54 VAL H 1.0 1.8 4.58 393 393 A 51 GLU H A 53 ALA H 1.0 1.8 5.27 394 394 A 53 ALA H A 50 MET HA 1.0 1.8 4.92 395 395 A 53 ALA H A 55 LYS H 1.0 1.8 5.24 396 396 A 55 LYS H A 53 ALA HA 1.0 1.8 6.00 397 397 A 55 LYS H A 52 LYS HA 1.0 1.8 4.57 398 398 A 55 LYS H A 51 GLU HA 1.0 1.8 5.45 399 399 A 55 LYS H A 57 VAL H 1.0 1.8 5.55 400 400 A 54 VAL H A 56 LYS H 1.0 1.8 5.29 401 401 A 56 LYS H A 53 ALA HA 1.0 1.8 4.65 402 402 A 56 LYS H A 52 LYS HA 1.0 1.8 5.78 403 403 A 57 VAL H A 55 LYS HA 1.0 1.8 4.60 404 404 A 57 VAL H A 54 VAL HA 1.0 1.8 5.32 405 405 A 5 LYS H A 64 ARG H 1.0 1.8 4.39 406 406 A 6 ILE H A 36 ASP HA 1.0 1.8 5.34 407 407 A 8 VAL H A 36 ASP HA 1.0 1.8 4.30 408 408 A 8 VAL HGy% A 10 ASP H 1.0 1.8 5.14 409 409 A 13 GLU H A 14 ALA HB% 1.0 1.8 5.09 410 410 A 14 ALA H A 8 VAL HGx% 1.0 1.8 4.83 411 411 A 15 GLU H A 18 ILE HD1% 1.0 1.8 5.75 412 412 A 16 LYS H A 17 ILE HD1% 1.0 1.8 5.28 413 413 A 17 ILE H A 57 VAL HGy% 1.0 1.8 5.46 414 414 A 17 ILE HG2% A 20 GLU H 1.0 1.8 6.03 415 415 A 20 GLU H A 17 ILE HD1% 1.0 1.8 6.67 416 416 A 18 ILE HG2% A 22 ARG H 1.0 1.8 5.39 417 417 A 24 GLN H A 25 TRP HBy 1.0 1.8 6.27 418 418 A 24 GLN H A 26 PRO HDy 1.0 1.8 6.62 419 419 A 53 ALA HB% A 24 GLN HE2y 1.0 1.8 4.93 420 420 A 53 ALA HB% A 24 GLN HE2x 1.0 1.8 4.93 421 421 A 24 GLN H A 25 TRP HE3 1.0 1.8 5.75 422 422 A 21 ILE HG2% A 25 TRP H 1.0 1.8 5.08 423 423 A 25 TRP H A 28 ALA HB% 1.0 1.8 5.68 424 424 A 25 TRP H A 26 PRO HDx 1.0 1.8 5.64 425 425 A 25 TRP HE1 A 46 GLU HGy 1.0 1.8 5.13 426 426 A 25 TRP HE1 A 46 GLU HGx 1.0 1.8 5.13 427 427 A 46 GLU HA A 25 TRP HE1 1.0 1.8 5.95 428 428 A 25 TRP H A 21 ILE HA 1.0 1.8 5.34 429 429 A 25 TRP H A 26 PRO HA 1.0 1.8 6.43 430 430 A 27 LYS H A 25 TRP HA 1.0 1.8 5.50 431 431 A 28 ALA H A 25 TRP HBx 1.0 1.8 4.84 432 432 A 28 ALA H A 25 TRP HBy 1.0 1.8 5.15 433 433 A 31 THR H A 38 LYS HBx 1.0 1.8 5.83 434 434 A 31 THR H A 38 LYS HBy 1.0 1.8 5.83 435 435 A 33 THR H A 36 ASP HBy 1.0 1.8 6.90 436 436 A 36 ASP H A 34 ASN HA 1.0 1.8 4.85 437 437 A 31 THR H A 38 LYS H 1.0 1.8 4.98 438 438 A 4 LEU H A 39 LEU H 1.0 1.8 4.85 439 439 A 30 VAL HA A 40 ASP H 1.0 1.8 5.14 440 440 A 41 ALA H A 4 LEU HDx% 1.0 1.8 5.11 441 441 A 39 LEU HG A 41 ALA H 1.0 1.8 6.46 442 442 A 2 VAL HB A 41 ALA H 1.0 1.8 5.52 443 443 A 3 ASP HA A 41 ALA H 1.0 1.8 5.24 444 444 A 43 THR H A 41 ALA HB% 1.0 1.8 5.05 445 445 A 46 GLU H A 47 ALA HB% 1.0 1.8 5.13 446 446 A 46 GLU H A 43 THR HG2% 1.0 1.8 5.36 447 447 A 43 THR H A 46 GLU H 1.0 1.8 5.18 448 448 A 46 GLU H A 43 THR HB 1.0 1.8 5.36 449 449 A 47 ALA H A 4 LEU HDx% 1.0 1.8 5.37 450 450 A 48 GLU H A 4 LEU HDx% 1.0 1.8 5.91 451 451 A 47 ALA HB% A 49 LYS H 1.0 1.8 5.82 452 452 A 50 MET H A 4 LEU HDx% 1.0 1.8 6.24 453 453 A 50 MET H A 25 TRP HH2 1.0 1.8 5.75 454 454 A 51 GLU H A 4 LEU HDx% 1.0 1.8 4.49 455 455 A 51 GLU H A 54 VAL HGy% 1.0 1.8 5.72 456 456 A 53 ALA H A 54 VAL HGy% 1.0 1.8 5.64 457 457 A 21 ILE HD1% A 53 ALA H 1.0 1.8 5.46 458 458 A 53 ALA H A 54 VAL HB 1.0 1.8 6.12 459 459 A 53 ALA H A 25 TRP HZ3 1.0 1.8 6.16 460 460 A 53 ALA H A 25 TRP HH2 1.0 1.8 6.46 461 461 A 56 LYS H A 57 VAL HGy% 1.0 1.8 5.20 462 462 A 54 VAL HGx% A 56 LYS H 1.0 1.8 5.59 463 463 A 57 VAL H A 17 ILE HD1% 1.0 1.8 5.77 464 464 A 54 VAL HGx% A 57 VAL H 1.0 1.8 6.18 465 465 A 56 LYS H A 58 LYS H 1.0 1.8 5.15 466 466 A 58 LYS H A 59 PRO HDx 1.0 1.8 4.80 467 467 A 58 LYS H A 59 PRO HDy 1.0 1.8 5.49 468 468 A 58 LYS H A 17 ILE HD1% 1.0 1.8 5.26 469 469 A 61 ALA H A 58 LYS HGy 1.0 1.8 4.84 470 470 A 6 ILE HG2% A 61 ALA H 1.0 1.8 5.82 471 471 A 61 ALA H A 55 LYS HGy 1.0 1.8 5.14 472 472 A 61 ALA H A 58 LYS HBy 1.0 1.8 5.07 473 473 A 61 ALA H A 59 PRO HA 1.0 1.8 5.14 474 474 A 4 LEU H A 47 ALA HB% 1.0 1.8 6.90 475 475 A 5 LYS H A 65 LYS HA 1.0 1.8 5.53 476 476 A 5 LYS H A 63 ILE HA 1.0 1.8 5.37 477 477 A 2 VAL HGx% A 66 THR H 1.0 1.8 5.75 478 478 A 6 ILE H A 37 ILE H 1.0 1.8 4.58 479 479 A 40 ASP H A 50 MET HE% 1.0 1.8 5.57 480 480 A 28 ALA HB% A 40 ASP H 1.0 1.8 5.42 481 481 A 3 ASP H A 4 LEU HA 1.0 1.8 5.99 482 482 A 25 TRP H A 26 PRO HGx 1.0 1.8 6.90 483 483 A 23 GLU H A 25 TRP H 1.0 1.8 5.42 484 484 A 28 ALA H A 26 PRO HA 1.0 1.8 5.62 485 485 A 43 THR H A 47 ALA H 1.0 1.8 5.46 486 486 A 4 LEU HBx A 64 ARG H 1.0 1.8 6.90 487 487 A 63 ILE H A 61 ALA HB% 1.0 1.8 5.55 488 488 A 6 ILE HG2% A 62 THR H 1.0 1.8 5.50 489 489 A 21 ILE HD1% A 54 VAL H 1.0 1.8 4.80 490 490 A 47 ALA H A 41 ALA HB% 1.0 1.8 3.91 491 491 A 33 THR H A 36 ASP H 1.0 1.8 5.78 492 492 A 4 LEU H A 41 ALA H 1.0 1.8 5.45 493 493 A 6 ILE H A 36 ASP HBx 1.0 1.8 5.65 494 494 A 8 VAL H A 37 ILE H 1.0 1.8 6.26 495 495 A 7 ASP H A 62 THR HB 1.0 1.8 5.52 496 496 A 10 ASP H A 14 ALA H 1.0 1.8 5.85 497 497 A 9 SER H A 10 ASP H 1.0 1.8 5.69 498 498 A 8 VAL HB A 10 ASP H 1.0 1.8 4.80 499 499 A 10 ASP H A 13 GLU HBx 1.0 1.8 5.43 500 500 A 10 ASP H A 13 GLU HBy 1.0 1.8 5.43 501 501 A 12 GLU H A 10 ASP HBy 1.0 1.8 5.74 502 502 A 12 GLU H A 13 GLU HA 1.0 1.8 6.04 503 503 A 10 ASP H A 13 GLU H 1.0 1.8 5.90 504 504 A 15 GLU H A 17 ILE HG1y 1.0 1.8 5.44 505 505 A 16 LYS H A 57 VAL HGx% 1.0 1.8 5.31 506 506 A 22 ARG H A 22 ARG HDy 1.0 1.8 6.19 507 507 A 25 TRP H A 22 ARG HA 1.0 1.8 4.47 508 508 A 31 THR H A 37 ILE HG2% 1.0 1.8 5.89 509 509 A 33 THR HG2% A 36 ASP H 1.0 1.8 5.21 510 510 A 8 VAL HGy% A 36 ASP H 1.0 1.8 5.53 511 511 A 7 ASP HA A 37 ILE H 1.0 1.8 5.11 512 512 A 55 LYS HBy A 57 VAL H 1.0 1.8 6.00 513 513 A 58 LYS H A 55 LYS HA 1.0 1.8 4.07 514 514 A 55 LYS H A 58 LYS H 1.0 1.8 5.52 515 515 A 55 LYS HGx A 61 ALA H 1.0 1.8 6.16 516 516 A 2 VAL HA A 2 VAL HGy% 1.0 1.8 4.04 517 517 A 2 VAL HA A 2 VAL HGx% 1.0 1.8 3.97 518 518 A 2 VAL HGy% A 2 VAL H 1.0 1.8 5.81 519 519 A 2 VAL HGx% A 2 VAL H 1.0 1.8 6.08 520 520 A 2 VAL HGx% A 4 LEU HA 1.0 1.8 5.55 521 521 A 4 LEU HA A 4 LEU HDx% 1.0 1.8 6.04 522 522 A 4 LEU HA A 6 ILE HD1% 1.0 1.8 6.31 523 523 A 4 LEU HBx A 4 LEU HDx% 1.0 1.8 4.42 524 524 A 4 LEU HBx A 4 LEU HDy% 1.0 1.8 4.22 525 525 A 4 LEU HBx A 6 ILE HD1% 1.0 1.8 4.59 526 526 A 4 LEU HBy A 4 LEU HDy% 1.0 1.8 4.31 527 527 A 4 LEU HA A 4 LEU HG 1.0 1.8 4.83 528 528 A 63 ILE HG1y A 63 ILE HG2% 1.0 1.8 4.17 529 529 A 4 LEU HBy A 4 LEU HDx% 1.0 1.8 3.90 530 530 A 5 LYS H A 4 LEU HDy% 1.0 1.8 5.77 531 531 A 4 LEU HA A 4 LEU HDy% 1.0 1.8 4.34 532 532 A 5 LYS HBx A 5 LYS HEy 1.0 1.8 6.61 533 533 A 5 LYS HBx A 5 LYS HEx 1.0 1.8 6.61 534 534 A 5 LYS HEy A 5 LYS HBy 1.0 1.8 6.61 535 535 A 5 LYS HBy A 5 LYS HEx 1.0 1.8 6.61 536 536 A 6 ILE HA A 6 ILE HG2% 1.0 1.8 3.69 537 537 A 6 ILE HD1% A 6 ILE HA 1.0 1.8 4.23 538 538 A 63 ILE HA A 6 ILE HG1y 1.0 1.8 5.62 539 539 A 6 ILE HG2% A 6 ILE HG1y 1.0 1.8 3.97 540 540 A 63 ILE HA A 6 ILE HG1x 1.0 1.8 5.62 541 541 A 6 ILE HG2% A 6 ILE HG1x 1.0 1.8 3.97 542 542 A 6 ILE HD1% A 63 ILE HA 1.0 1.8 5.83 543 543 A 6 ILE HD1% A 6 ILE HB 1.0 1.8 4.06 544 544 A 6 ILE HD1% A 6 ILE HG2% 1.0 1.8 3.97 545 545 A 8 VAL HGx% A 8 VAL HA 1.0 1.8 4.07 546 546 A 37 ILE HD1% A 8 VAL HGx% 1.0 1.8 3.53 547 547 A 12 GLU HBx A 12 GLU HA 1.0 1.8 3.40 548 548 A 12 GLU HA A 12 GLU HGy 1.0 1.8 4.23 549 549 A 12 GLU HA A 12 GLU HGx 1.0 1.8 4.23 550 550 A 12 GLU H A 12 GLU HGy 1.0 1.8 5.49 551 551 A 12 GLU H A 12 GLU HGx 1.0 1.8 5.49 552 552 A 13 GLU HA A 13 GLU HGy 1.0 1.8 4.38 553 553 A 15 GLU HA A 15 GLU HGx 1.0 1.8 4.61 554 554 A 13 GLU H A 13 GLU HGx 1.0 1.8 5.52 555 555 A 13 GLU HA A 13 GLU HGx 1.0 1.8 4.38 556 556 A 13 GLU H A 13 GLU HGy 1.0 1.8 5.52 557 557 A 15 GLU HA A 15 GLU HBx 1.0 1.8 3.47 558 558 A 15 GLU HA A 15 GLU HGy 1.0 1.8 4.61 559 559 A 13 GLU HA A 16 LYS HGx 1.0 1.8 5.34 560 560 A 16 LYS HA A 16 LYS HD3 1.0 1.8 5.07 561 561 A 16 LYS H A 16 LYS HBy 1.0 1.8 4.28 562 562 A 16 LYS HBy A 16 LYS HD2 1.0 1.8 4.14 563 563 A 16 LYS HBy A 16 LYS HD3 1.0 1.8 4.14 564 564 A 16 LYS HBy A 16 LYS HEx 1.0 1.8 5.93 565 565 A 16 LYS HBx A 16 LYS HEx 1.0 1.8 6.66 566 566 A 16 LYS HBx A 16 LYS HEy 1.0 1.8 6.66 567 567 A 13 GLU HA A 16 LYS HGy 1.0 1.8 5.34 568 568 A 16 LYS H A 16 LYS HD2 1.0 1.8 6.22 569 569 A 16 LYS H A 16 LYS HD3 1.0 1.8 6.22 570 570 A 16 LYS HA A 16 LYS HD2 1.0 1.8 5.07 571 571 A 16 LYS HA A 16 LYS HEy 1.0 1.8 6.44 572 572 A 56 LYS HA A 56 LYS HEy 1.0 1.8 6.90 573 573 A 17 ILE HG1x A 17 ILE HA 1.0 1.8 4.57 574 574 A 17 ILE HG1y A 17 ILE HA 1.0 1.8 3.96 575 575 A 17 ILE H A 17 ILE HG2% 1.0 1.8 5.40 576 576 A 17 ILE HG2% A 17 ILE HA 1.0 1.8 3.91 577 577 A 17 ILE H A 17 ILE HG1x 1.0 1.8 4.49 578 578 A 17 ILE HB A 17 ILE HG1x 1.0 1.8 3.13 579 579 A 17 ILE HG2% A 17 ILE HG1x 1.0 1.8 3.75 580 580 A 17 ILE HD1% A 17 ILE HA 1.0 1.8 4.14 581 581 A 17 ILE HB A 37 ILE HD1% 1.0 1.8 4.29 582 582 A 18 ILE HG2% A 18 ILE HA 1.0 1.8 3.98 583 583 A 18 ILE HA A 18 ILE HG1y 1.0 1.8 4.37 584 584 A 18 ILE HA A 18 ILE HG1x 1.0 1.8 4.37 585 585 A 18 ILE HG2% A 22 ARG HGy 1.0 1.8 4.77 586 586 A 18 ILE H A 18 ILE HD1% 1.0 1.8 4.62 587 587 A 18 ILE HA A 18 ILE HD1% 1.0 1.8 4.50 588 588 A 18 ILE HB A 18 ILE HD1% 1.0 1.8 3.58 589 589 A 18 ILE HG2% A 18 ILE HD1% 1.0 1.8 3.35 590 590 A 19 ARG HA A 19 ARG HGy 1.0 1.8 4.44 591 591 A 19 ARG HA A 19 ARG HGx 1.0 1.8 4.44 592 592 A 19 ARG H A 19 ARG HGy 1.0 1.8 5.51 593 593 A 19 ARG HA A 19 ARG HDx 1.0 1.8 6.19 594 594 A 19 ARG HA A 19 ARG HDy 1.0 1.8 6.19 595 595 A 20 GLU HA A 20 GLU HGx 1.0 1.8 4.76 596 596 A 20 GLU HA A 20 GLU HGy 1.0 1.8 4.76 597 597 A 20 GLU H A 20 GLU HGx 1.0 1.8 5.45 598 598 A 20 GLU H A 20 GLU HGy 1.0 1.8 5.45 599 599 A 21 ILE HG2% A 21 ILE HA 1.0 1.8 4.03 600 600 A 21 ILE HG1y A 21 ILE HA 1.0 1.8 4.69 601 601 A 21 ILE HB A 21 ILE HD1% 1.0 1.8 4.59 602 602 A 21 ILE HG2% A 21 ILE HG1y 1.0 1.8 4.38 603 603 A 21 ILE HG2% A 21 ILE HG1x 1.0 1.8 4.04 604 604 A 21 ILE HG2% A 21 ILE HD1% 1.0 1.8 3.54 605 605 A 21 ILE HD1% A 21 ILE HA 1.0 1.8 3.76 606 606 A 22 ARG HA A 22 ARG HGx 1.0 1.8 4.30 607 607 A 22 ARG HA A 22 ARG HGy 1.0 1.8 4.30 608 608 A 25 TRP HBy A 22 ARG HA 1.0 1.8 6.08 609 609 A 22 ARG HA A 22 ARG HDy 1.0 1.8 5.59 610 610 A 22 ARG HBy A 22 ARG HDy 1.0 1.8 4.70 611 611 A 22 ARG H A 22 ARG HDx 1.0 1.8 6.19 612 612 A 22 ARG HA A 22 ARG HDx 1.0 1.8 5.59 613 613 A 22 ARG HBy A 22 ARG HDx 1.0 1.8 4.70 614 614 A 23 GLU HA A 23 GLU HGy 1.0 1.8 4.75 615 615 A 23 GLU HA A 23 GLU HGx 1.0 1.8 4.75 616 616 A 25 TRP HE3 A 25 TRP HA 1.0 1.8 6.64 617 617 A 27 LYS HA A 27 LYS HGx 1.0 1.8 4.70 618 618 A 27 LYS HA A 27 LYS HDx 1.0 1.8 6.37 619 619 A 27 LYS HA A 27 LYS HDy 1.0 1.8 6.37 620 620 A 27 LYS HA A 27 LYS HGy 1.0 1.8 4.70 621 621 A 27 LYS H A 27 LYS HDx 1.0 1.8 6.90 622 622 A 27 LYS H A 27 LYS HDy 1.0 1.8 6.90 623 623 A 27 LYS HBy A 27 LYS HE2 1.0 1.8 6.90 624 624 A 27 LYS HBy A 27 LYS HE3 1.0 1.8 6.90 625 625 A 27 LYS HE2 A 27 LYS HBx 1.0 1.8 6.90 626 626 A 27 LYS HBx A 27 LYS HE3 1.0 1.8 6.90 627 627 A 30 VAL HA A 30 VAL HGx% 1.0 1.8 3.76 628 628 A 30 VAL HA A 30 VAL HGy% 1.0 1.8 4.15 629 629 A 31 THR HA A 31 THR HG2% 1.0 1.8 3.92 630 630 A 32 ARG HA A 32 ARG HDx 1.0 1.8 5.34 631 631 A 32 ARG HA A 32 ARG HDy 1.0 1.8 5.34 632 632 A 33 THR HA A 33 THR HG2% 1.0 1.8 3.81 633 633 A 37 ILE HA A 37 ILE HD1% 1.0 1.8 4.68 634 634 A 37 ILE HB A 37 ILE HD1% 1.0 1.8 3.88 635 635 A 37 ILE HA A 37 ILE HG2% 1.0 1.8 4.50 636 636 A 37 ILE HG2% A 37 ILE HG1y 1.0 1.8 3.74 637 637 A 37 ILE HG2% A 37 ILE HG1x 1.0 1.8 4.14 638 638 A 37 ILE HG2% A 37 ILE HD1% 1.0 1.8 2.76 639 639 A 38 LYS HA A 38 LYS HGy 1.0 1.8 4.72 640 640 A 38 LYS HA A 38 LYS HGx 1.0 1.8 4.72 641 641 A 38 LYS HA A 38 LYS HDx 1.0 1.8 5.40 642 642 A 38 LYS HA A 38 LYS HDy 1.0 1.8 5.40 643 643 A 38 LYS HBy A 38 LYS HDx 1.0 1.8 4.63 644 644 A 38 LYS HBy A 38 LYS HDy 1.0 1.8 4.63 645 645 A 38 LYS H A 38 LYS HGy 1.0 1.8 5.85 646 646 A 38 LYS HDx A 38 LYS HBx 1.0 1.8 4.63 647 647 A 38 LYS HBx A 38 LYS HDy 1.0 1.8 4.63 648 648 A 38 LYS HBy A 38 LYS HEy 1.0 1.8 6.51 649 649 A 38 LYS HBy A 38 LYS HEx 1.0 1.8 6.51 650 650 A 38 LYS HEy A 38 LYS HBx 1.0 1.8 6.51 651 651 A 38 LYS HBx A 38 LYS HEx 1.0 1.8 6.51 652 652 A 39 LEU HA A 39 LEU HDy% 1.0 1.8 4.55 653 653 A 39 LEU HA A 39 LEU HDx% 1.0 1.8 4.55 654 654 A 39 LEU H A 39 LEU HG 1.0 1.8 5.44 655 655 A 43 THR HG2% A 43 THR HA 1.0 1.8 4.00 656 656 A 45 LYS HA A 45 LYS HD2 1.0 1.8 5.97 657 657 A 45 LYS HA A 45 LYS HD3 1.0 1.8 5.97 658 658 A 45 LYS HD2 A 45 LYS HBx 1.0 1.8 4.86 659 659 A 45 LYS HBx A 45 LYS HD3 1.0 1.8 4.86 660 660 A 45 LYS HD2 A 45 LYS HBy 1.0 1.8 4.86 661 661 A 45 LYS HBy A 45 LYS HD3 1.0 1.8 4.86 662 662 A 55 LYS HBx A 55 LYS HEy 1.0 1.8 6.90 663 663 A 46 GLU H A 46 GLU HGx 1.0 1.8 5.36 664 664 A 48 GLU H A 48 GLU HBx 1.0 1.8 4.20 665 665 A 48 GLU HA A 48 GLU HGx 1.0 1.8 4.83 666 666 A 48 GLU HA A 48 GLU HGy 1.0 1.8 4.83 667 667 A 49 LYS HA A 49 LYS HGx 1.0 1.8 4.09 668 668 A 49 LYS HA A 49 LYS HGy 1.0 1.8 4.09 669 669 A 52 LYS HBy A 49 LYS HA 1.0 1.8 4.06 670 670 A 46 GLU HA A 49 LYS HEx 1.0 1.8 6.90 671 671 A 46 GLU HA A 49 LYS HEy 1.0 1.8 6.90 672 672 A 49 LYS H A 49 LYS HD2 1.0 1.8 5.82 673 673 A 49 LYS H A 49 LYS HD3 1.0 1.8 5.82 674 674 A 50 MET H A 50 MET HE% 1.0 1.8 6.19 675 675 A 50 MET HA A 50 MET HE% 1.0 1.8 5.93 676 676 A 50 MET HE% A 50 MET HGy 1.0 1.8 4.17 677 677 A 50 MET HE% A 50 MET HGx 1.0 1.8 4.17 678 678 A 51 GLU HGx A 51 GLU HA 1.0 1.8 4.57 679 679 A 51 GLU HGy A 51 GLU HA 1.0 1.8 4.70 680 680 A 51 GLU HBx A 51 GLU HGy 1.0 1.8 3.40 681 681 A 52 LYS HA A 52 LYS HGx 1.0 1.8 4.68 682 682 A 52 LYS HA A 52 LYS HGy 1.0 1.8 4.68 683 683 A 55 LYS HDx A 52 LYS HA 1.0 1.8 5.12 684 684 A 52 LYS HA A 52 LYS HE2 1.0 1.8 6.90 685 685 A 52 LYS HA A 52 LYS HE3 1.0 1.8 6.90 686 686 A 52 LYS HBx A 52 LYS HE2 1.0 1.8 6.90 687 687 A 52 LYS H A 52 LYS HGy 1.0 1.8 5.44 688 688 A 52 LYS H A 52 LYS HD2 1.0 1.8 6.90 689 689 A 52 LYS H A 52 LYS HD3 1.0 1.8 6.90 690 690 A 52 LYS HA A 52 LYS HD2 1.0 1.8 6.81 691 691 A 52 LYS HA A 52 LYS HD3 1.0 1.8 6.81 692 692 A 52 LYS HBx A 52 LYS HE3 1.0 1.8 6.90 693 693 A 16 LYS HBy A 16 LYS HEy 1.0 1.8 5.93 694 694 A 17 ILE HG2% A 54 VAL HA 1.0 1.8 4.21 695 695 A 54 VAL HGy% A 54 VAL HA 1.0 1.8 3.62 696 696 A 57 VAL HGx% A 17 ILE HD1% 1.0 1.8 3.39 697 697 A 54 VAL HGx% A 54 VAL HA 1.0 1.8 3.94 698 698 A 55 LYS HGx A 55 LYS HA 1.0 1.8 4.40 699 699 A 55 LYS HGy A 55 LYS HA 1.0 1.8 4.21 700 700 A 55 LYS HDx A 55 LYS HA 1.0 1.8 5.32 701 701 A 55 LYS HBy A 55 LYS HDx 1.0 1.8 3.37 702 702 A 55 LYS HBy A 55 LYS HDy 1.0 1.8 3.17 703 703 A 55 LYS HBx A 55 LYS HDx 1.0 1.8 4.23 704 704 A 55 LYS HGx A 55 LYS HDx 1.0 1.8 2.76 705 705 A 55 LYS HDy A 55 LYS HA 1.0 1.8 5.31 706 706 A 55 LYS HBx A 55 LYS HDy 1.0 1.8 3.66 707 707 A 55 LYS HGx A 55 LYS HDy 1.0 1.8 3.45 708 708 A 55 LYS HGy A 55 LYS HDy 1.0 1.8 3.31 709 709 A 55 LYS HBx A 55 LYS HEx 1.0 1.8 6.90 710 710 A 56 LYS HA A 56 LYS HGx 1.0 1.8 4.68 711 711 A 56 LYS HA A 56 LYS HGy 1.0 1.8 4.68 712 712 A 56 LYS H A 56 LYS HEy 1.0 1.8 6.90 713 713 A 56 LYS H A 56 LYS HEx 1.0 1.8 6.90 714 714 A 16 LYS HA A 16 LYS HEx 1.0 1.8 6.44 715 715 A 56 LYS HA A 56 LYS HEx 1.0 1.8 6.90 716 716 A 57 VAL HA A 57 VAL HGx% 1.0 1.8 3.78 717 717 A 57 VAL HA A 57 VAL HGy% 1.0 1.8 3.85 718 718 A 58 LYS HA A 58 LYS HDy 1.0 1.8 6.46 719 719 A 58 LYS HA A 58 LYS HDx 1.0 1.8 6.46 720 720 A 61 ALA HB% A 58 LYS HGy 1.0 1.8 4.07 721 721 A 58 LYS HGx A 58 LYS HA 1.0 1.8 4.85 722 722 A 58 LYS HBy A 58 LYS HEy 1.0 1.8 5.89 723 723 A 58 LYS HGy A 58 LYS HEy 1.0 1.8 4.84 724 724 A 58 LYS HBy A 58 LYS HEx 1.0 1.8 5.89 725 725 A 61 ALA HB% A 58 LYS HEx 1.0 1.8 4.90 726 726 A 58 LYS HGy A 58 LYS HEx 1.0 1.8 4.84 727 727 A 62 THR HA A 62 THR HG2% 1.0 1.8 3.82 728 728 A 63 ILE HG2% A 63 ILE HA 1.0 1.8 4.17 729 729 A 63 ILE HG1x A 63 ILE HA 1.0 1.8 4.51 730 730 A 63 ILE HG2% A 63 ILE HG1x 1.0 1.8 4.03 731 731 A 4 LEU HG A 41 ALA H 1.0 1.8 5.92 732 732 A 63 ILE HD1% A 63 ILE H 1.0 1.8 5.76 733 733 A 63 ILE HD1% A 63 ILE HA 1.0 1.8 5.08 734 734 A 63 ILE HD1% A 63 ILE HB 1.0 1.8 3.88 735 735 A 63 ILE HG2% A 63 ILE HD1% 1.0 1.8 3.24 736 736 A 65 LYS HA A 65 LYS HDy 1.0 1.8 6.23 737 737 A 65 LYS HA A 65 LYS HDx 1.0 1.8 6.23 738 738 A 65 LYS HBy A 65 LYS HDy 1.0 1.8 4.32 739 739 A 65 LYS HBy A 65 LYS HDx 1.0 1.8 4.32 740 740 A 65 LYS H A 65 LYS HGx 1.0 1.8 6.12 741 741 A 66 THR HG2% A 66 THR HA 1.0 1.8 3.82 742 742 A 67 GLY H A 66 THR HG2% 1.0 1.8 6.47 743 743 A 29 THR HA A 29 THR HG2% 1.0 1.8 3.81 744 744 A 70 LEU HA A 70 LEU HDx% 1.0 1.8 5.52 745 745 A 70 LEU HA A 70 LEU HDy% 1.0 1.8 5.52 746 746 A 70 LEU HDx% A 70 LEU HBy 1.0 1.8 4.73 747 747 A 70 LEU HDx% A 70 LEU HBx 1.0 1.8 4.73 748 748 A 70 LEU HBx A 70 LEU HDy% 1.0 1.8 4.73 749 749 A 70 LEU HBy A 70 LEU HDy% 1.0 1.8 4.73 750 750 A 3 ASP H A 2 VAL HGy% 1.0 1.8 4.91 751 751 A 6 ILE HD1% A 54 VAL H 1.0 1.8 6.90 752 752 A 9 SER H A 8 VAL HGx% 1.0 1.8 6.90 753 753 A 13 GLU H A 12 GLU HBx 1.0 1.8 4.66 754 754 A 13 GLU H A 12 GLU HGx 1.0 1.8 6.22 755 755 A 16 LYS H A 13 GLU HA 1.0 1.8 5.53 756 756 A 17 ILE H A 16 LYS HBy 1.0 1.8 4.78 757 757 A 18 ILE H A 17 ILE HD1% 1.0 1.8 5.64 758 758 A 18 ILE H A 37 ILE HD1% 1.0 1.8 6.00 759 759 A 19 ARG H A 18 ILE HD1% 1.0 1.8 5.77 760 760 A 20 GLU H A 19 ARG HDx 1.0 1.8 6.90 761 761 A 20 GLU H A 19 ARG HDy 1.0 1.8 6.90 762 762 A 31 THR H A 31 THR HB 1.0 1.8 4.39 763 763 A 32 ARG H A 31 THR HG2% 1.0 1.8 4.61 764 764 A 38 LYS H A 37 ILE HG1x 1.0 1.8 6.23 765 765 A 39 LEU H A 38 LYS HBy 1.0 1.8 5.24 766 766 A 39 LEU H A 38 LYS HGx 1.0 1.8 5.69 767 767 A 40 ASP H A 39 LEU HBx 1.0 1.8 5.95 768 768 A 40 ASP H A 39 LEU HBy 1.0 1.8 5.95 769 769 A 47 ALA H A 46 GLU HGx 1.0 1.8 5.84 770 770 A 47 ALA H A 46 GLU HGy 1.0 1.8 5.84 771 771 A 49 LYS H A 48 GLU HBx 1.0 1.8 4.59 772 772 A 51 GLU H A 50 MET HE% 1.0 1.8 6.80 773 773 A 52 LYS H A 51 GLU HBy 1.0 1.8 5.04 774 774 A 53 ALA H A 52 LYS HBy 1.0 1.8 4.44 775 775 A 53 ALA H A 52 LYS HGx 1.0 1.8 6.14 776 776 A 53 ALA H A 52 LYS HGy 1.0 1.8 6.14 777 777 A 56 LYS H A 55 LYS HDx 1.0 1.8 6.60 778 778 A 62 THR H A 61 ALA HB% 1.0 1.8 4.76 779 779 A 65 LYS H A 64 ARG HBy 1.0 1.8 5.45 780 780 A 70 LEU H A 69 SER HBx 1.0 1.8 6.90 781 781 A 70 LEU H A 69 SER HBy 1.0 1.8 6.90 782 782 A 14 ALA HB% A 11 ASP HA 1.0 1.8 3.81 783 783 A 15 GLU HBy A 12 GLU HA 1.0 1.8 4.21 784 784 A 46 GLU HA A 46 GLU HGx 1.0 1.8 3.89 785 785 A 16 LYS H A 12 GLU HA 1.0 1.8 5.91 786 786 A 16 LYS HBx A 13 GLU HA 1.0 1.8 4.47 787 787 A 16 LYS H A 14 ALA HA 1.0 1.8 6.12 788 788 A 17 ILE HB A 14 ALA HA 1.0 1.8 4.44 789 789 A 15 GLU HA A 18 ILE HB 1.0 1.8 3.85 790 790 A 15 GLU HA A 19 ARG H 1.0 1.8 5.07 791 791 A 18 ILE H A 16 LYS HA 1.0 1.8 5.95 792 792 A 19 ARG H A 16 LYS HA 1.0 1.8 4.67 793 793 A 20 GLU H A 18 ILE HA 1.0 1.8 6.30 794 794 A 21 ILE HB A 18 ILE HA 1.0 1.8 4.43 795 795 A 22 ARG HBy A 19 ARG HA 1.0 1.8 4.16 796 796 A 22 ARG HBx A 19 ARG HA 1.0 1.8 5.40 797 797 A 22 ARG HBx A 23 GLU HA 1.0 1.8 5.88 798 798 A 23 GLU H A 19 ARG HA 1.0 1.8 5.75 799 799 A 22 ARG H A 20 GLU HA 1.0 1.8 5.60 800 800 A 17 ILE HG2% A 21 ILE HA 1.0 1.8 6.90 801 801 A 30 VAL HGy% A 21 ILE HA 1.0 1.8 6.90 802 802 A 45 LYS HA A 48 GLU HGx 1.0 1.8 5.54 803 803 A 48 GLU HBy A 45 LYS HA 1.0 1.8 4.26 804 804 A 45 LYS HA A 48 GLU HBx 1.0 1.8 5.89 805 805 A 49 LYS H A 45 LYS HA 1.0 1.8 6.47 806 806 A 46 GLU HA A 46 GLU HGy 1.0 1.8 3.89 807 807 A 41 ALA HB% A 47 ALA HA 1.0 1.8 3.80 808 808 A 47 ALA HA A 50 MET HBx 1.0 1.8 5.22 809 809 A 47 ALA HA A 50 MET HBy 1.0 1.8 5.22 810 810 A 52 LYS HBx A 49 LYS HA 1.0 1.8 4.01 811 811 A 53 ALA H A 49 LYS HA 1.0 1.8 5.14 812 812 A 53 ALA HB% A 50 MET HA 1.0 1.8 4.14 813 813 A 54 VAL H A 50 MET HA 1.0 1.8 5.93 814 814 A 54 VAL H A 51 GLU HA 1.0 1.8 4.45 815 815 A 54 VAL HB A 51 GLU HA 1.0 1.8 4.14 816 816 A 54 VAL H A 52 LYS HA 1.0 1.8 5.74 817 817 A 55 LYS HBy A 52 LYS HA 1.0 1.8 4.16 818 818 A 52 LYS HBx A 53 ALA HA 1.0 1.8 4.80 819 819 A 56 LYS H A 54 VAL HA 1.0 1.8 6.90 820 820 A 57 VAL HB A 54 VAL HA 1.0 1.8 5.08 821 821 A 2 VAL HGx% A 47 ALA HB% 1.0 1.8 4.58 822 822 A 2 VAL HGx% A 65 LYS HGy 1.0 1.8 5.16 823 823 A 2 VAL HGx% A 65 LYS HDy 1.0 1.8 6.57 824 824 A 47 ALA HB% A 2 VAL HGy% 1.0 1.8 4.46 825 825 A 2 VAL HA A 67 GLY HAx 1.0 1.8 6.27 826 826 A 2 VAL HA A 67 GLY HAy 1.0 1.8 6.27 827 827 A 3 ASP HA A 40 ASP HA 1.0 1.8 4.47 828 828 A 2 VAL HGx% A 3 ASP HA 1.0 1.8 6.10 829 829 A 3 ASP HA A 4 LEU HDx% 1.0 1.8 6.80 830 830 A 4 LEU HBy A 65 LYS HA 1.0 1.8 6.59 831 831 A 3 ASP HA A 4 LEU HG 1.0 1.8 5.96 832 832 A 4 LEU HDy% A 47 ALA HA 1.0 1.8 5.29 833 833 A 2 VAL HA A 4 LEU HDy% 1.0 1.8 6.50 834 834 A 4 LEU HDy% A 51 GLU HA 1.0 1.8 6.90 835 835 A 47 ALA HB% A 4 LEU HDy% 1.0 1.8 4.29 836 836 A 4 LEU HDy% A 65 LYS HGy 1.0 1.8 4.65 837 837 A 4 LEU HDy% A 51 GLU HBy 1.0 1.8 5.52 838 838 A 4 LEU HDx% A 51 GLU HBy 1.0 1.8 5.38 839 839 A 51 GLU HGy A 4 LEU HDx% 1.0 1.8 6.08 840 840 A 4 LEU HBy A 39 LEU H 1.0 1.8 6.69 841 841 A 6 ILE HB A 37 ILE H 1.0 1.8 5.66 842 842 A 6 ILE HD1% A 5 LYS HA 1.0 1.8 5.13 843 843 A 6 ILE HD1% A 54 VAL HGy% 1.0 1.8 3.60 844 844 A 4 LEU HBy A 6 ILE HD1% 1.0 1.8 4.40 845 845 A 62 THR HB A 7 ASP HBy 1.0 1.8 5.20 846 846 A 7 ASP HA A 8 VAL HGy% 1.0 1.8 5.80 847 847 A 8 VAL HGy% A 36 ASP HA 1.0 1.8 4.59 848 848 A 36 ASP HA A 8 VAL HGx% 1.0 1.8 6.08 849 849 A 8 VAL HGx% A 14 ALA HA 1.0 1.8 4.15 850 850 A 8 VAL HGy% A 14 ALA HA 1.0 1.8 5.75 851 851 A 8 VAL HGy% A 14 ALA HB% 1.0 1.8 3.99 852 852 A 14 ALA HB% A 8 VAL HGx% 1.0 1.8 4.21 853 853 A 8 VAL HGx% A 37 ILE HG1x 1.0 1.8 4.42 854 854 A 8 VAL HGy% A 37 ILE HG1x 1.0 1.8 4.63 855 855 A 8 VAL HB A 10 ASP HBy 1.0 1.8 6.90 856 856 A 8 VAL HGy% A 10 ASP HBy 1.0 1.8 6.90 857 857 A 8 VAL HB A 10 ASP HBx 1.0 1.8 6.90 858 858 A 8 VAL HGy% A 10 ASP HBx 1.0 1.8 6.90 859 859 A 15 GLU HA A 18 ILE HD1% 1.0 1.8 4.00 860 860 A 17 ILE HD1% A 13 GLU HGx 1.0 1.8 4.98 861 861 A 17 ILE HD1% A 13 GLU HGy 1.0 1.8 4.98 862 862 A 37 ILE HD1% A 14 ALA HA 1.0 1.8 3.65 863 863 A 14 ALA HB% A 37 ILE HD1% 1.0 1.8 3.44 864 864 A 8 VAL HB A 14 ALA HB% 1.0 1.8 4.61 865 865 A 14 ALA HB% A 16 LYS H 1.0 1.8 5.74 866 866 A 51 GLU H A 63 ILE HD1% 1.0 1.8 6.05 867 867 A 17 ILE HA A 16 LYS HA 1.0 1.8 6.29 868 868 A 17 ILE HA A 20 GLU HA 1.0 1.8 6.90 869 869 A 17 ILE HG2% A 18 ILE HA 1.0 1.8 4.58 870 870 A 17 ILE HD1% A 14 ALA HA 1.0 1.8 4.40 871 871 A 63 ILE HD1% A 55 LYS HEy 1.0 1.8 5.32 872 872 A 17 ILE HG2% A 14 ALA HA 1.0 1.8 5.98 873 873 A 63 ILE HD1% A 61 ALA HB% 1.0 1.8 4.30 874 874 A 17 ILE HD1% A 58 LYS HGx 1.0 1.8 3.82 875 875 A 17 ILE HG2% A 54 VAL HB 1.0 1.8 5.68 876 876 A 17 ILE HG2% A 57 VAL HB 1.0 1.8 6.24 877 877 A 17 ILE HG2% A 21 ILE HG1y 1.0 1.8 4.65 878 878 A 17 ILE HG2% A 21 ILE HG1x 1.0 1.8 4.90 879 879 A 21 ILE HG1x A 18 ILE HA 1.0 1.8 5.62 880 880 A 18 ILE HG2% A 22 ARG HGx 1.0 1.8 4.77 881 881 A 18 ILE HG2% A 22 ARG HDx 1.0 1.8 5.19 882 882 A 18 ILE HG2% A 19 ARG HA 1.0 1.8 4.65 883 883 A 14 ALA HB% A 18 ILE HD1% 1.0 1.8 4.40 884 884 A 15 GLU HA A 18 ILE HA 1.0 1.8 6.90 885 885 A 18 ILE HA A 19 ARG HA 1.0 1.8 6.90 886 886 A 57 VAL HGy% A 20 GLU HBx 1.0 1.8 5.32 887 887 A 57 VAL HGy% A 20 GLU HBy 1.0 1.8 5.32 888 888 A 53 ALA HB% A 20 GLU HGx 1.0 1.8 5.40 889 889 A 17 ILE HA A 20 GLU HGx 1.0 1.8 6.31 890 890 A 17 ILE HA A 20 GLU HGy 1.0 1.8 6.31 891 891 A 21 ILE HG2% A 24 GLN H 1.0 1.8 6.90 892 892 A 21 ILE HG2% A 22 ARG HA 1.0 1.8 5.09 893 893 A 21 ILE HG2% A 25 TRP HBy 1.0 1.8 4.63 894 894 A 21 ILE HD1% A 50 MET HA 1.0 1.8 4.91 895 895 A 21 ILE HD1% A 54 VAL HA 1.0 1.8 5.57 896 896 A 25 TRP HBy A 21 ILE HA 1.0 1.8 6.18 897 897 A 21 ILE HD1% A 50 MET HBy 1.0 1.8 6.13 898 898 A 21 ILE HD1% A 54 VAL HGy% 1.0 1.8 3.54 899 899 A 21 ILE HA A 20 GLU HBx 1.0 1.8 6.90 900 900 A 21 ILE HA A 20 GLU HBy 1.0 1.8 6.90 901 901 A 18 ILE HG2% A 22 ARG HBx 1.0 1.8 6.07 902 902 A 18 ILE HG2% A 22 ARG HDy 1.0 1.8 5.19 903 903 A 18 ILE HG2% A 22 ARG HBy 1.0 1.8 4.38 904 904 A 25 TRP HA A 24 GLN HA 1.0 1.8 6.90 905 905 A 21 ILE HG2% A 25 TRP HBx 1.0 1.8 5.23 906 906 A 26 PRO HDy A 23 GLU HA 1.0 1.8 6.90 907 907 A 26 PRO HDy A 24 GLN HA 1.0 1.8 6.90 908 908 A 26 PRO HDx A 24 GLN HA 1.0 1.8 5.97 909 909 A 22 ARG HA A 26 PRO HA 1.0 1.8 4.57 910 910 A 26 PRO HGx A 23 GLU HA 1.0 1.8 6.90 911 911 A 26 PRO HGx A 24 GLN HA 1.0 1.8 6.90 912 912 A 26 PRO HDy A 25 TRP HA 1.0 1.8 4.28 913 913 A 26 PRO HDx A 25 TRP HA 1.0 1.8 3.77 914 914 A 26 PRO HGx A 25 TRP HA 1.0 1.8 6.14 915 915 A 26 PRO HGy A 25 TRP HA 1.0 1.8 5.99 916 916 A 25 TRP H A 26 PRO HDy 1.0 1.8 5.85 917 917 A 21 ILE HG2% A 28 ALA HB% 1.0 1.8 3.98 918 918 A 28 ALA HB% A 30 VAL HGy% 1.0 1.8 4.14 919 919 A 28 ALA HB% A 25 TRP HBx 1.0 1.8 4.11 920 920 A 28 ALA HB% A 25 TRP HBy 1.0 1.8 4.21 921 921 A 29 THR HA A 30 VAL HGy% 1.0 1.8 5.59 922 922 A 29 THR HB A 30 VAL HGy% 1.0 1.8 6.44 923 923 A 29 THR HB A 40 ASP HBx 1.0 1.8 4.73 924 924 A 29 THR HB A 40 ASP HBy 1.0 1.8 4.73 925 925 A 28 ALA HA A 50 MET HE% 1.0 1.8 6.01 926 926 A 28 ALA HA A 40 ASP H 1.0 1.8 6.24 927 927 A 29 THR HB A 40 ASP H 1.0 1.8 5.47 928 928 A 31 THR HB A 38 LYS H 1.0 1.8 5.78 929 929 A 31 THR HG2% A 38 LYS HEy 1.0 1.8 6.69 930 930 A 31 THR HG2% A 38 LYS HEx 1.0 1.8 6.69 931 931 A 31 THR HB A 38 LYS HBx 1.0 1.8 5.05 932 932 A 31 THR HB A 38 LYS HBy 1.0 1.8 5.05 933 933 A 31 THR HB A 38 LYS HEy 1.0 1.8 6.90 934 934 A 31 THR HB A 38 LYS HEx 1.0 1.8 6.90 935 935 A 33 THR HG2% A 38 LYS HEy 1.0 1.8 5.26 936 936 A 33 THR HG2% A 38 LYS HEx 1.0 1.8 5.26 937 937 A 33 THR HG2% A 36 ASP HBy 1.0 1.8 4.63 938 938 A 7 ASP HA A 36 ASP HA 1.0 1.8 4.78 939 939 A 7 ASP HA A 36 ASP HBx 1.0 1.8 5.14 940 940 A 29 THR HG2% A 40 ASP HBx 1.0 1.8 5.47 941 941 A 29 THR HG2% A 40 ASP HBy 1.0 1.8 5.47 942 942 A 41 ALA HB% A 4 LEU HDx% 1.0 1.8 3.70 943 943 A 2 VAL HB A 41 ALA HB% 1.0 1.8 4.11 944 944 A 41 ALA HB% A 46 GLU HBx 1.0 1.8 5.08 945 945 A 41 ALA HB% A 46 GLU HBy 1.0 1.8 5.08 946 946 A 40 ASP HA A 41 ALA HB% 1.0 1.8 5.93 947 947 A 41 ALA HB% A 2 VAL H 1.0 1.8 5.54 948 948 A 46 GLU H A 41 ALA HB% 1.0 1.8 5.89 949 949 A 43 THR HG2% A 42 GLN HBx 1.0 1.8 4.69 950 950 A 43 THR HG2% A 46 GLU HBx 1.0 1.8 5.14 951 951 A 43 THR HG2% A 42 GLN HBy 1.0 1.8 4.69 952 952 A 45 LYS HA A 48 GLU HGy 1.0 1.8 5.54 953 953 A 45 LYS HA A 45 LYS HEy 1.0 1.8 6.90 954 954 A 45 LYS HA A 45 LYS HEx 1.0 1.8 6.90 955 955 A 43 THR HG2% A 46 GLU HBy 1.0 1.8 5.14 956 956 A 50 MET HE% A 46 GLU HGx 1.0 1.8 5.11 957 957 A 43 THR H A 46 GLU HBx 1.0 1.8 4.84 958 958 A 43 THR H A 46 GLU HBy 1.0 1.8 4.84 959 959 A 47 ALA HB% A 4 LEU HDx% 1.0 1.8 3.63 960 960 A 2 VAL HB A 47 ALA HB% 1.0 1.8 5.23 961 961 A 47 ALA HB% A 51 GLU HBy 1.0 1.8 6.12 962 962 A 47 ALA HB% A 48 GLU HA 1.0 1.8 5.31 963 963 A 47 ALA HB% A 50 MET H 1.0 1.8 6.21 964 964 A 25 TRP HH2 A 49 LYS HD2 1.0 1.8 6.68 965 965 A 25 TRP HZ2 A 49 LYS HGy 1.0 1.8 6.23 966 966 A 25 TRP HZ2 A 49 LYS HGx 1.0 1.8 6.23 967 967 A 49 LYS HA A 25 TRP HZ2 1.0 1.8 6.90 968 968 A 4 LEU HDx% A 50 MET HBx 1.0 1.8 5.11 969 969 A 21 ILE HD1% A 50 MET HBx 1.0 1.8 6.13 970 970 A 4 LEU HDx% A 50 MET HBy 1.0 1.8 5.11 971 971 A 50 MET HE% A 46 GLU HGy 1.0 1.8 5.11 972 972 A 25 TRP HBx A 50 MET HE% 1.0 1.8 4.84 973 973 A 25 TRP HBy A 50 MET HE% 1.0 1.8 4.68 974 974 A 39 LEU HG A 50 MET HE% 1.0 1.8 4.43 975 975 A 28 ALA HB% A 50 MET HE% 1.0 1.8 3.54 976 976 A 41 ALA HA A 50 MET HE% 1.0 1.8 4.38 977 977 A 25 TRP HE3 A 50 MET HE% 1.0 1.8 5.29 978 978 A 25 TRP HZ3 A 50 MET HE% 1.0 1.8 6.54 979 979 A 25 TRP HH2 A 50 MET HE% 1.0 1.8 6.90 980 980 A 25 TRP HE1 A 50 MET HE% 1.0 1.8 5.31 981 981 A 50 MET HA A 51 GLU HA 1.0 1.8 5.78 982 982 A 53 ALA HB% A 51 GLU HA 1.0 1.8 6.77 983 983 A 63 ILE HB A 51 GLU HA 1.0 1.8 6.90 984 984 A 55 LYS HGx A 51 GLU HA 1.0 1.8 6.90 985 985 A 63 ILE HD1% A 51 GLU HA 1.0 1.8 4.16 986 986 A 4 LEU HDx% A 51 GLU HA 1.0 1.8 5.11 987 987 A 6 ILE HD1% A 51 GLU HA 1.0 1.8 5.69 988 988 A 63 ILE HG2% A 51 GLU HA 1.0 1.8 5.82 989 989 A 51 GLU HGx A 55 LYS HGx 1.0 1.8 6.07 990 990 A 63 ILE HG2% A 51 GLU HGx 1.0 1.8 5.04 991 991 A 51 GLU HGy A 55 LYS HDx 1.0 1.8 6.53 992 992 A 63 ILE HG1y A 51 GLU HGy 1.0 1.8 6.90 993 993 A 51 GLU HGy A 63 ILE HD1% 1.0 1.8 4.86 994 994 A 51 GLU HGy A 4 LEU HDy% 1.0 1.8 6.90 995 995 A 63 ILE HG2% A 51 GLU HGy 1.0 1.8 6.90 996 996 A 51 GLU HGy A 48 GLU HA 1.0 1.8 5.55 997 997 A 51 GLU HGx A 48 GLU HA 1.0 1.8 5.64 998 998 A 53 ALA HB% A 54 VAL HGy% 1.0 1.8 4.61 999 999 A 21 ILE HD1% A 53 ALA HB% 1.0 1.8 3.92 1000 1000 A 53 ALA HB% A 20 GLU HGy 1.0 1.8 5.40 1001 1001 A 21 ILE HG2% A 53 ALA HB% 1.0 1.8 5.76 1002 1002 A 53 ALA HB% A 57 VAL HGy% 1.0 1.8 6.20 1003 1003 A 52 LYS HBx A 53 ALA HB% 1.0 1.8 5.57 1004 1004 A 52 LYS H A 53 ALA HB% 1.0 1.8 5.85 1005 1005 A 54 VAL HGx% A 58 LYS H 1.0 1.8 4.99 1006 1006 A 54 VAL HGy% A 51 GLU HA 1.0 1.8 4.22 1007 1007 A 54 VAL HGx% A 17 ILE HA 1.0 1.8 5.66 1008 1008 A 54 VAL HGx% A 51 GLU HA 1.0 1.8 6.26 1009 1009 A 57 VAL HA A 54 VAL HA 1.0 1.8 6.90 1010 1010 A 53 ALA HB% A 54 VAL HA 1.0 1.8 5.53 1011 1011 A 63 ILE HG1y A 54 VAL HB 1.0 1.8 6.53 1012 1012 A 54 VAL HB A 55 LYS HGx 1.0 1.8 5.73 1013 1013 A 54 VAL HB A 55 LYS HBy 1.0 1.8 5.62 1014 1014 A 57 VAL HGx% A 16 LYS HGx 1.0 1.8 5.81 1015 1015 A 57 VAL HGx% A 58 LYS HGx 1.0 1.8 6.21 1016 1016 A 54 VAL HGx% A 58 LYS HBy 1.0 1.8 5.20 1017 1017 A 54 VAL HGx% A 58 LYS HGx 1.0 1.8 4.43 1018 1018 A 54 VAL HGx% A 61 ALA HB% 1.0 1.8 3.97 1019 1019 A 61 ALA HB% A 55 LYS HA 1.0 1.8 5.15 1020 1020 A 54 VAL HGx% A 55 LYS HA 1.0 1.8 4.78 1021 1021 A 63 ILE HD1% A 55 LYS HGy 1.0 1.8 4.68 1022 1022 A 63 ILE HD1% A 55 LYS HGx 1.0 1.8 4.63 1023 1023 A 63 ILE HD1% A 55 LYS HDy 1.0 1.8 5.13 1024 1024 A 63 ILE HD1% A 55 LYS HDx 1.0 1.8 5.93 1025 1025 A 55 LYS HA A 59 PRO HA 1.0 1.8 4.60 1026 1026 A 55 LYS HBy A 59 PRO HA 1.0 1.8 6.49 1027 1027 A 55 LYS HGy A 59 PRO HA 1.0 1.8 5.46 1028 1028 A 55 LYS HBx A 59 PRO HA 1.0 1.8 4.62 1029 1029 A 15 GLU HA A 18 ILE HG2% 1.0 1.8 5.26 1030 1030 A 57 VAL HB A 17 ILE HA 1.0 1.8 5.83 1031 1031 A 57 VAL HGy% A 17 ILE HA 1.0 1.8 4.35 1032 1032 A 57 VAL HGy% A 16 LYS HBx 1.0 1.8 5.15 1033 1033 A 57 VAL HGy% A 16 LYS HBy 1.0 1.8 4.88 1034 1034 A 57 VAL HGy% A 17 ILE HD1% 1.0 1.8 4.38 1035 1035 A 57 VAL HGx% A 16 LYS HGy 1.0 1.8 5.81 1036 1036 A 20 GLU H A 57 VAL HGy% 1.0 1.8 5.62 1037 1037 A 54 VAL H A 57 VAL HGy% 1.0 1.8 6.10 1038 1038 A 6 ILE HG2% A 58 LYS HBy 1.0 1.8 5.64 1039 1039 A 57 VAL HGx% A 58 LYS HBx 1.0 1.8 5.54 1040 1040 A 17 ILE HD1% A 58 LYS HBx 1.0 1.8 4.85 1041 1041 A 57 VAL HGx% A 58 LYS HBy 1.0 1.8 6.65 1042 1042 A 54 VAL HGx% A 58 LYS HGy 1.0 1.8 5.44 1043 1043 A 59 PRO HDy A 58 LYS HA 1.0 1.8 3.90 1044 1044 A 59 PRO HDx A 58 LYS HA 1.0 1.8 4.04 1045 1045 A 58 LYS HA A 59 PRO HG2 1.0 1.8 6.46 1046 1046 A 58 LYS HA A 59 PRO HG3 1.0 1.8 6.46 1047 1047 A 58 LYS HBx A 59 PRO HDx 1.0 1.8 6.14 1048 1048 A 59 PRO HDy A 58 LYS HGx 1.0 1.8 6.24 1049 1049 A 59 PRO HDy A 58 LYS HBx 1.0 1.8 5.96 1050 1050 A 61 ALA HA A 58 LYS HGy 1.0 1.8 5.19 1051 1051 A 6 ILE HG2% A 61 ALA HA 1.0 1.8 5.36 1052 1052 A 63 ILE HG1x A 61 ALA HB% 1.0 1.8 4.20 1053 1053 A 6 ILE HG2% A 61 ALA HB% 1.0 1.8 3.23 1054 1054 A 55 LYS HGy A 61 ALA HB% 1.0 1.8 4.22 1055 1055 A 61 ALA HB% A 58 LYS HGx 1.0 1.8 4.57 1056 1056 A 55 LYS HGx A 61 ALA HB% 1.0 1.8 4.80 1057 1057 A 58 LYS HBy A 61 ALA HB% 1.0 1.8 4.00 1058 1058 A 61 ALA HB% A 58 LYS HEy 1.0 1.8 4.90 1059 1059 A 61 ALA HA A 62 THR HA 1.0 1.8 5.26 1060 1060 A 60 ASN HA A 61 ALA HB% 1.0 1.8 5.44 1061 1061 A 7 ASP H A 61 ALA HB% 1.0 1.8 5.57 1062 1062 A 6 ILE HG2% A 62 THR HA 1.0 1.8 6.14 1063 1063 A 63 ILE HD1% A 62 THR HA 1.0 1.8 6.79 1064 1064 A 62 THR HA A 61 ALA HB% 1.0 1.8 6.12 1065 1065 A 62 THR HA A 63 ILE HB 1.0 1.8 5.84 1066 1066 A 4 LEU HA A 63 ILE HG2% 1.0 1.8 6.18 1067 1067 A 63 ILE HG2% A 51 GLU HBy 1.0 1.8 5.09 1068 1068 A 63 ILE HG2% A 65 LYS HBx 1.0 1.8 4.83 1069 1069 A 4 LEU HBx A 63 ILE HG2% 1.0 1.8 4.83 1070 1070 A 4 LEU HG A 41 ALA HB% 1.0 1.8 4.37 1071 1071 A 65 LYS HA A 4 LEU HDy% 1.0 1.8 4.84 1072 1072 A 65 LYS HBx A 4 LEU HDy% 1.0 1.8 5.62 1073 1073 A 65 LYS HBy A 4 LEU HDy% 1.0 1.8 5.64 1074 1074 A 4 LEU HDy% A 65 LYS HGx 1.0 1.8 4.65 1075 1075 A 4 LEU HDy% A 65 LYS HDy 1.0 1.8 4.67 1076 1076 A 4 LEU HDy% A 65 LYS HDx 1.0 1.8 4.67 1077 1077 A 4 LEU HA A 65 LYS HA 1.0 1.8 4.58 1078 1078 A 2 VAL HA A 3 ASP HA 1.0 1.8 6.05 1079 1079 A 4 LEU HG A 47 ALA HB% 1.0 1.8 4.57 1080 1080 A 7 ASP H A 62 THR HG2% 1.0 1.8 5.45 1081 1081 A 7 ASP HA A 36 ASP H 1.0 1.8 6.90 1082 1082 A 6 ILE H A 37 ILE HB 1.0 1.8 5.77 1083 1083 A 2 VAL HGx% A 41 ALA HB% 1.0 1.8 6.90 1084 1084 A 17 ILE HG1y A 14 ALA HA 1.0 1.8 4.74 1085 1085 A 14 ALA HB% A 17 ILE HG1y 1.0 1.8 4.80 1086 1086 A 16 LYS HBx A 14 ALA HA 1.0 1.8 5.89 1087 1087 A 30 VAL HA A 39 LEU HA 1.0 1.8 4.32 1088 1088 A 2 VAL HGx% A 65 LYS HGx 1.0 1.8 5.16 1089 1089 A 2 VAL HGx% A 65 LYS HDx 1.0 1.8 6.57 1090 1090 A 62 THR HG2% A 64 ARG HDy 1.0 1.8 6.11 1091 1091 A 62 THR HG2% A 64 ARG HDx 1.0 1.8 6.11 1092 1092 A 63 ILE HB A 61 ALA HB% 1.0 1.8 6.39 1093 1093 A 63 ILE HG1y A 62 THR HA 1.0 1.8 6.56 1094 1094 A 37 ILE HD1% A 18 ILE HA 1.0 1.8 6.15 1095 1095 A 17 ILE HB A 17 ILE HD1% 1.0 1.8 4.15 1096 1096 A 55 LYS H A 61 ALA HB% 1.0 1.8 6.20 1097 1097 A 57 VAL HA A 59 PRO HDx 1.0 1.8 5.75 1098 1098 A 6 ILE HG2% A 58 LYS HEx 1.0 1.8 5.57 1099 1099 A 6 ILE HG2% A 58 LYS HEy 1.0 1.8 5.57 1100 1100 A 57 VAL HGx% A 16 LYS HBx 1.0 1.8 4.13 1101 1101 A 57 VAL HGx% A 16 LYS HBy 1.0 1.8 4.36 1102 1102 A 17 ILE H A 57 VAL HGx% 1.0 1.8 5.30 1103 1103 A 52 LYS H A 54 VAL HGy% 1.0 1.8 5.67 1104 1104 A 57 VAL HB A 17 ILE HD1% 1.0 1.8 4.62 1105 1105 A 57 VAL HGx% A 16 LYS HD2 1.0 1.8 6.18 1106 1106 A 57 VAL HGx% A 16 LYS HD3 1.0 1.8 6.18 1107 1107 A 57 VAL HGy% A 16 LYS HD2 1.0 1.8 6.90 1108 1108 A 57 VAL HGy% A 16 LYS HD3 1.0 1.8 6.90 1109 1109 A 55 LYS HDy A 52 LYS HA 1.0 1.8 5.32 1110 1110 A 55 LYS HGx A 52 LYS HA 1.0 1.8 6.37 1111 1111 A 55 LYS HGy A 52 LYS HA 1.0 1.8 5.98 1112 1112 A 6 ILE HD1% A 54 VAL HGx% 1.0 1.8 3.91 1113 1113 A 57 VAL HGy% A 54 VAL HA 1.0 1.8 4.66 1114 1114 A 53 ALA HA A 52 LYS HA 1.0 1.8 5.82 1115 1115 A 14 ALA HB% A 15 GLU HBy 1.0 1.8 6.46 1116 1116 A 63 ILE HG1y A 51 GLU HBx 1.0 1.8 6.28 1117 1117 A 51 GLU HBx A 63 ILE HD1% 1.0 1.8 5.16 1118 1118 A 51 GLU HBx A 4 LEU HDx% 1.0 1.8 5.58 1119 1119 A 51 GLU HBx A 4 LEU HDy% 1.0 1.8 6.42 1120 1120 A 63 ILE HD1% A 51 GLU HBy 1.0 1.8 4.80 1121 1121 A 49 LYS HB2 A 53 ALA HB% 1.0 1.8 6.03 1122 1122 A 53 ALA HB% A 49 LYS HB3 1.0 1.8 6.36 1123 1123 A 47 ALA HB% A 48 GLU HBy 1.0 1.8 6.90 1124 1124 A 4 LEU HDx% A 65 LYS HE2 1.0 1.8 6.90 1125 1125 A 4 LEU HDx% A 65 LYS HE3 1.0 1.8 6.90 1126 1126 A 3 ASP HA A 4 LEU HBx 1.0 1.8 5.98 1127 1127 A 2 VAL HB A 4 LEU HDx% 1.0 1.8 5.60 1128 1128 A 4 LEU HDx% A 47 ALA HA 1.0 1.8 4.39 1129 1129 A 51 GLU H A 4 LEU HDy% 1.0 1.8 5.51 1130 1130 A 5 LYS HA A 6 ILE HB 1.0 1.8 6.04 1131 1131 A 6 ILE HB A 36 ASP HA 1.0 1.8 6.61 1132 1132 A 6 ILE HG2% A 7 ASP HBy 1.0 1.8 6.11 1133 1133 A 6 ILE HG2% A 7 ASP HBx 1.0 1.8 6.11 1134 1134 A 8 VAL HB A 37 ILE HG1x 1.0 1.8 5.76 1135 1135 A 8 VAL HB A 36 ASP HA 1.0 1.8 6.90 1136 1136 A 8 VAL HB A 14 ALA HA 1.0 1.8 6.03 1137 1137 A 8 VAL HB A 14 ALA H 1.0 1.8 5.88 1138 1138 A 8 VAL HGy% A 14 ALA H 1.0 1.8 5.55 1139 1139 A 12 GLU H A 10 ASP HBx 1.0 1.8 5.74 1140 1140 A 12 GLU H A 14 ALA HB% 1.0 1.8 5.82 1141 1141 A 57 VAL HGx% A 16 LYS HA 1.0 1.8 4.98 1142 1142 A 17 ILE HG1x A 57 VAL HGy% 1.0 1.8 6.14 1143 1143 A 17 ILE HG1y A 57 VAL HGy% 1.0 1.8 5.62 1144 1144 A 26 PRO HGy A 27 LYS HGx 1.0 1.8 5.53 1145 1145 A 26 PRO HGy A 27 LYS HGy 1.0 1.8 5.53 1146 1146 A 29 THR HA A 30 VAL HB 1.0 1.8 5.98 1147 1147 A 18 ILE HG2% A 32 ARG HA 1.0 1.8 6.43 1148 1148 A 32 ARG HA A 18 ILE HD1% 1.0 1.8 5.68 1149 1149 A 33 THR HB A 36 ASP HBy 1.0 1.8 6.05 1150 1150 A 36 ASP HA A 37 ILE HG1x 1.0 1.8 5.96 1151 1151 A 36 ASP HBx A 37 ILE HB 1.0 1.8 6.90 1152 1152 A 36 ASP HBx A 37 ILE HG1x 1.0 1.8 6.90 1153 1153 A 36 ASP HBx A 5 LYS HDx 1.0 1.8 6.90 1154 1154 A 36 ASP HBx A 5 LYS HDy 1.0 1.8 6.90 1155 1155 A 36 ASP HBx A 5 LYS HGy 1.0 1.8 6.00 1156 1156 A 36 ASP HBx A 5 LYS HGx 1.0 1.8 6.00 1157 1157 A 37 ILE HD1% A 36 ASP HBy 1.0 1.8 6.90 1158 1158 A 36 ASP HBx A 37 ILE HD1% 1.0 1.8 6.90 1159 1159 A 5 LYS HA A 37 ILE HB 1.0 1.8 6.18 1160 1160 A 36 ASP HA A 37 ILE HB 1.0 1.8 6.90 1161 1161 A 63 ILE HD1% A 55 LYS HEx 1.0 1.8 5.32 1162 1162 A 36 ASP H A 37 ILE HD1% 1.0 1.8 5.30 1163 1163 A 54 VAL H A 63 ILE HD1% 1.0 1.8 5.44 1164 1164 A 39 LEU H A 39 LEU HDy% 1.0 1.8 5.70 1165 1165 A 41 ALA HB% A 50 MET HE% 1.0 1.8 3.59 1166 1166 A 51 GLU HBx A 47 ALA HA 1.0 1.8 6.90 1167 1167 A 63 ILE HG1y A 51 GLU HGx 1.0 1.8 6.90 1168 1168 A 63 ILE HD1% A 52 LYS HA 1.0 1.8 6.01 1169 1169 A 54 VAL HB A 61 ALA HB% 1.0 1.8 5.76 1170 1170 A 55 LYS HGx A 59 PRO HA 1.0 1.8 6.52 1171 1171 A 57 VAL HB A 58 LYS HBx 1.0 1.8 6.72 1172 1172 A 58 LYS HGy A 55 LYS HA 1.0 1.8 6.21 1173 1173 A 55 LYS HA A 58 LYS HDy 1.0 1.8 6.90 1174 1174 A 55 LYS HA A 58 LYS HDx 1.0 1.8 6.90 1175 1175 A 59 PRO HDy A 58 LYS HGy 1.0 1.8 6.72 1176 1176 A 61 ALA HA A 55 LYS HGy 1.0 1.8 6.90 1177 1177 A 61 ALA HA A 58 LYS HGx 1.0 1.8 6.90 1178 1178 A 62 THR HB A 7 ASP HBx 1.0 1.8 5.20 1179 1179 A 62 THR HG2% A 63 ILE HG1x 1.0 1.8 6.01 1180 1180 A 54 VAL HB A 63 ILE HD1% 1.0 1.8 4.07 1181 1181 A 51 GLU HGx A 63 ILE HD1% 1.0 1.8 4.31 1182 1182 A 65 LYS HA A 66 THR HG2% 1.0 1.8 6.45 1183 1183 A 17 ILE HG2% A 37 ILE HB 1.0 1.8 6.90 1184 1184 A 30 VAL HGx% A 18 ILE HA 1.0 1.8 6.90 1185 1185 A 66 THR H A 2 VAL HGy% 1.0 1.8 6.90 1186 1186 A 67 GLY H A 2 VAL HGy% 1.0 1.8 6.90 1187 1187 A 21 ILE HG2% A 30 VAL HGy% 1.0 1.8 6.90 1188 1188 A 21 ILE HB A 30 VAL HGy% 1.0 1.8 6.90 1189 1189 A 21 ILE HG2% A 18 ILE HA 1.0 1.8 6.90 1190 1190 A 21 ILE HG1x A 54 VAL HGy% 1.0 1.8 6.90 1191 1191 A 21 ILE HG1y A 54 VAL HGy% 1.0 1.8 6.90 1192 1192 A 21 ILE HG2% A 39 LEU HG 1.0 1.8 6.90 1193 1193 A 21 ILE HD1% A 39 LEU HG 1.0 1.8 6.90 1194 1194 A 30 VAL HGy% A 22 ARG HGx 1.0 1.8 6.90 1195 1195 A 30 VAL HGy% A 22 ARG HGy 1.0 1.8 6.90 1196 1196 A 25 TRP HA A 25 TRP HD1 1.0 1.8 3.73 1197 1197 A 25 TRP HBx A 25 TRP HD1 1.0 1.8 3.62 1198 1198 A 25 TRP H A 25 TRP HE3 1.0 1.8 4.04 1199 1199 A 21 ILE HA A 25 TRP HE3 1.0 1.8 3.40 1200 1200 A 26 PRO HDx A 25 TRP HD1 1.0 1.8 5.65 1201 1201 A 25 TRP HD1 A 46 GLU HGy 1.0 1.8 5.13 1202 1202 A 25 TRP HD1 A 46 GLU HGx 1.0 1.8 5.13 1203 1203 A 28 ALA HB% A 25 TRP HD1 1.0 1.8 5.22 1204 1204 A 50 MET HE% A 25 TRP HD1 1.0 1.8 4.50 1205 1205 A 22 ARG HA A 25 TRP HE3 1.0 1.8 6.84 1206 1206 A 25 TRP HE3 A 24 GLN HA 1.0 1.8 6.90 1207 1207 A 25 TRP HBy A 25 TRP HE3 1.0 1.8 3.82 1208 1208 A 21 ILE HB A 25 TRP HE3 1.0 1.8 5.58 1209 1209 A 21 ILE HG1y A 25 TRP HE3 1.0 1.8 6.44 1210 1210 A 53 ALA HB% A 25 TRP HE3 1.0 1.8 6.70 1211 1211 A 28 ALA HB% A 25 TRP HE3 1.0 1.8 4.89 1212 1212 A 21 ILE HG2% A 25 TRP HE3 1.0 1.8 3.46 1213 1213 A 21 ILE HD1% A 25 TRP HE3 1.0 1.8 3.84 1214 1214 A 46 GLU HA A 25 TRP HZ2 1.0 1.8 5.16 1215 1215 A 50 MET H A 25 TRP HZ2 1.0 1.8 5.35 1216 1216 A 49 LYS HA A 25 TRP HH2 1.0 1.8 5.32 1217 1217 A 50 MET HA A 25 TRP HH2 1.0 1.8 3.84 1218 1218 A 49 LYS HB2 A 25 TRP HH2 1.0 1.8 3.85 1219 1219 A 25 TRP HH2 A 49 LYS HB3 1.0 1.8 4.24 1220 1220 A 25 TRP HH2 A 49 LYS HD3 1.0 1.8 6.68 1221 1221 A 53 ALA HB% A 25 TRP HH2 1.0 1.8 3.98 1222 1222 A 25 TRP HH2 A 50 MET HGy 1.0 1.8 5.15 1223 1223 A 50 MET HA A 25 TRP HZ2 1.0 1.8 5.44 1224 1224 A 25 TRP HZ2 A 49 LYS HEx 1.0 1.8 6.90 1225 1225 A 25 TRP HZ2 A 49 LYS HEy 1.0 1.8 6.90 1226 1226 A 49 LYS HB2 A 25 TRP HZ2 1.0 1.8 3.11 1227 1227 A 25 TRP HZ2 A 49 LYS HD2 1.0 1.8 4.37 1228 1228 A 25 TRP HZ2 A 49 LYS HD3 1.0 1.8 4.37 1229 1229 A 21 ILE HA A 25 TRP HZ3 1.0 1.8 4.17 1230 1230 A 50 MET HA A 25 TRP HZ3 1.0 1.8 4.14 1231 1231 A 49 LYS HB2 A 25 TRP HZ3 1.0 1.8 6.50 1232 1232 A 25 TRP HZ3 A 49 LYS HB3 1.0 1.8 6.90 1233 1233 A 53 ALA HB% A 25 TRP HZ3 1.0 1.8 3.39 1234 1234 A 21 ILE HG2% A 25 TRP HZ3 1.0 1.8 5.12 1235 1235 A 21 ILE HD1% A 25 TRP HZ3 1.0 1.8 3.78 1236 1236 A 21 ILE HD1% A 25 TRP HH2 1.0 1.8 5.29 1237 1237 A 25 TRP HH2 A 50 MET HGx 1.0 1.8 5.15 1238 1238 A 2 VAL HA A 67 GLY HAx 1.0 1.8 5.34 1239 1238 A 2 VAL HA A 67 GLY HAy 1.0 1.8 5.34 1240 1239 A 2 VAL HGx% A 65 LYS HGx 1.0 1.8 4.50 1241 1239 A 2 VAL HGx% A 65 LYS HGy 1.0 1.8 4.50 1242 1240 A 2 VAL HGx% A 65 LYS HDx 1.0 1.8 5.80 1243 1240 A 2 VAL HGx% A 65 LYS HDy 1.0 1.8 5.80 1244 1241 A 2 VAL HGx% A 65 LYS HE3 1.0 1.8 6.03 1245 1241 A 2 VAL HGx% A 65 LYS HE2 1.0 1.8 6.03 1246 1242 A 2 VAL HGx% A 67 GLY HAx 1.0 1.8 4.96 1247 1242 A 2 VAL HGx% A 67 GLY HAy 1.0 1.8 4.96 1248 1243 A 2 VAL HGy% A 67 GLY HAx 1.0 1.8 5.57 1249 1243 A 2 VAL HGy% A 67 GLY HAy 1.0 1.8 5.57 1250 1244 A 3 ASP H A 3 ASP HBy 1.0 1.8 3.90 1251 1244 A 3 ASP H A 3 ASP HBx 1.0 1.8 3.90 1252 1245 A 3 ASP H A 67 GLY HAx 1.0 1.8 6.59 1253 1245 A 3 ASP H A 67 GLY HAy 1.0 1.8 6.59 1254 1246 A 4 LEU H A 3 ASP HBy 1.0 1.8 4.65 1255 1246 A 4 LEU H A 3 ASP HBx 1.0 1.8 4.65 1256 1247 A 4 LEU HA A 3 ASP HBy 1.0 1.8 6.68 1257 1247 A 4 LEU HA A 3 ASP HBx 1.0 1.8 6.68 1258 1248 A 40 ASP HA A 3 ASP HBy 1.0 1.8 6.68 1259 1248 A 40 ASP HA A 3 ASP HBx 1.0 1.8 6.68 1260 1249 A 66 THR HB A 3 ASP HBy 1.0 1.8 5.24 1261 1249 A 66 THR HB A 3 ASP HBx 1.0 1.8 5.24 1262 1250 A 66 THR HG2% A 3 ASP HBy 1.0 1.8 5.13 1263 1250 A 66 THR HG2% A 3 ASP HBx 1.0 1.8 5.13 1264 1251 A 4 LEU H A 5 LYS HGx 1.0 1.8 6.68 1265 1251 A 4 LEU H A 5 LYS HGy 1.0 1.8 6.68 1266 1252 A 4 LEU H A 39 LEU HBx 1.0 1.8 5.83 1267 1252 A 4 LEU H A 39 LEU HBy 1.0 1.8 5.83 1268 1253 A 4 LEU HA A 5 LYS HBy 1.0 1.8 6.01 1269 1253 A 4 LEU HA A 5 LYS HBx 1.0 1.8 6.01 1270 1254 A 4 LEU HA A 65 LYS HGx 1.0 1.8 6.61 1271 1254 A 4 LEU HA A 65 LYS HGy 1.0 1.8 6.61 1272 1255 A 4 LEU HBx A 39 LEU HBx 1.0 1.8 4.72 1273 1255 A 4 LEU HBx A 39 LEU HBy 1.0 1.8 4.72 1274 1256 A 4 LEU HDx% A 50 MET HBy 1.0 1.8 4.22 1275 1256 A 4 LEU HDx% A 50 MET HBx 1.0 1.8 4.22 1276 1257 A 4 LEU HDy% A 65 LYS HGx 1.0 1.8 4.01 1277 1257 A 4 LEU HDy% A 65 LYS HGy 1.0 1.8 4.01 1278 1258 A 4 LEU HDy% A 65 LYS HDx 1.0 1.8 3.98 1279 1258 A 4 LEU HDy% A 65 LYS HDy 1.0 1.8 3.98 1280 1259 A 4 LEU HDy% A 65 LYS HE3 1.0 1.8 5.27 1281 1259 A 4 LEU HDy% A 65 LYS HE2 1.0 1.8 5.27 1282 1260 A 5 LYS H A 5 LYS HBy 1.0 1.8 3.57 1283 1260 A 5 LYS H A 5 LYS HBx 1.0 1.8 3.57 1284 1261 A 5 LYS H A 5 LYS HGx 1.0 1.8 4.95 1285 1261 A 5 LYS H A 5 LYS HGy 1.0 1.8 4.95 1286 1262 A 5 LYS H A 64 ARG HBx 1.0 1.8 5.78 1287 1262 A 5 LYS H A 64 ARG HBy 1.0 1.8 5.78 1288 1263 A 5 LYS HA A 5 LYS HGx 1.0 1.8 4.13 1289 1263 A 5 LYS HA A 5 LYS HGy 1.0 1.8 4.13 1290 1264 A 5 LYS HA A 5 LYS HDy 1.0 1.8 6.36 1291 1264 A 5 LYS HA A 5 LYS HDx 1.0 1.8 6.36 1292 1265 A 5 LYS HA A 6 ILE HG1x 1.0 1.8 6.00 1293 1265 A 5 LYS HA A 6 ILE HG1y 1.0 1.8 6.00 1294 1266 A 5 LYS HBy A 5 LYS HDy 1.0 1.8 3.82 1295 1266 A 5 LYS HDx A 5 LYS HBy 1.0 1.8 3.82 1296 1266 A 5 LYS HBx A 5 LYS HDx 1.0 1.8 3.82 1297 1266 A 5 LYS HBx A 5 LYS HDy 1.0 1.8 3.82 1298 1267 A 5 LYS HBy A 5 LYS HEx 1.0 1.8 4.84 1299 1267 A 5 LYS HBx A 5 LYS HEx 1.0 1.8 4.84 1300 1267 A 5 LYS HEy A 5 LYS HBy 1.0 1.8 4.84 1301 1267 A 5 LYS HBx A 5 LYS HEy 1.0 1.8 4.84 1302 1268 A 6 ILE H A 5 LYS HBy 1.0 1.8 4.82 1303 1268 A 6 ILE H A 5 LYS HBx 1.0 1.8 4.82 1304 1269 A 6 ILE HD1% A 5 LYS HBy 1.0 1.8 5.99 1305 1269 A 6 ILE HD1% A 5 LYS HBx 1.0 1.8 5.99 1306 1270 A 36 ASP HBx A 5 LYS HBy 1.0 1.8 6.18 1307 1270 A 36 ASP HBx A 5 LYS HBx 1.0 1.8 6.18 1308 1271 A 63 ILE HG2% A 5 LYS HBy 1.0 1.8 6.59 1309 1271 A 63 ILE HG2% A 5 LYS HBx 1.0 1.8 6.59 1310 1272 A 64 ARG H A 5 LYS HBy 1.0 1.8 4.61 1311 1272 A 64 ARG H A 5 LYS HBx 1.0 1.8 4.61 1312 1273 A 5 LYS HEx A 5 LYS HGx 1.0 1.8 3.83 1313 1273 A 5 LYS HGy A 5 LYS HEx 1.0 1.8 3.83 1314 1273 A 5 LYS HGy A 5 LYS HEy 1.0 1.8 3.83 1315 1273 A 5 LYS HEy A 5 LYS HGx 1.0 1.8 3.83 1316 1274 A 6 ILE H A 5 LYS HGx 1.0 1.8 4.75 1317 1274 A 6 ILE H A 5 LYS HGy 1.0 1.8 4.75 1318 1275 A 36 ASP HBx A 5 LYS HGx 1.0 1.8 5.01 1319 1275 A 36 ASP HBx A 5 LYS HGy 1.0 1.8 5.01 1320 1276 A 64 ARG H A 5 LYS HGx 1.0 1.8 6.68 1321 1276 A 64 ARG H A 5 LYS HGy 1.0 1.8 6.68 1322 1277 A 6 ILE H A 6 ILE HG1x 1.0 1.8 4.70 1323 1277 A 6 ILE H A 6 ILE HG1y 1.0 1.8 4.70 1324 1278 A 6 ILE HA A 7 ASP HBx 1.0 1.8 6.68 1325 1278 A 6 ILE HA A 7 ASP HBy 1.0 1.8 6.68 1326 1279 A 6 ILE HG2% A 58 LYS HEx 1.0 1.8 4.67 1327 1279 A 6 ILE HG2% A 58 LYS HEy 1.0 1.8 4.67 1328 1280 A 7 ASP H A 6 ILE HG1x 1.0 1.8 5.39 1329 1280 A 7 ASP H A 6 ILE HG1y 1.0 1.8 5.39 1330 1281 A 54 VAL HGx% A 6 ILE HG1x 1.0 1.8 3.99 1331 1281 A 54 VAL HGx% A 6 ILE HG1y 1.0 1.8 3.99 1332 1282 A 61 ALA HB% A 6 ILE HG1x 1.0 1.8 5.11 1333 1282 A 61 ALA HB% A 6 ILE HG1y 1.0 1.8 5.11 1334 1283 A 63 ILE HA A 6 ILE HG1x 1.0 1.8 4.85 1335 1283 A 63 ILE HA A 6 ILE HG1y 1.0 1.8 4.85 1336 1284 A 8 VAL H A 7 ASP HBx 1.0 1.8 4.05 1337 1284 A 8 VAL H A 7 ASP HBy 1.0 1.8 4.05 1338 1285 A 8 VAL HA A 7 ASP HBx 1.0 1.8 5.26 1339 1285 A 8 VAL HA A 7 ASP HBy 1.0 1.8 5.26 1340 1286 A 8 VAL HGy% A 7 ASP HBx 1.0 1.8 6.49 1341 1286 A 8 VAL HGy% A 7 ASP HBy 1.0 1.8 6.49 1342 1287 A 62 THR HB A 7 ASP HBx 1.0 1.8 4.49 1343 1287 A 62 THR HB A 7 ASP HBy 1.0 1.8 4.49 1344 1288 A 62 THR HG2% A 7 ASP HBx 1.0 1.8 5.44 1345 1288 A 62 THR HG2% A 7 ASP HBy 1.0 1.8 5.44 1346 1289 A 8 VAL HB A 10 ASP HBx 1.0 1.8 5.97 1347 1289 A 8 VAL HB A 10 ASP HBy 1.0 1.8 5.97 1348 1290 A 8 VAL HGx% A 13 GLU HBx 1.0 1.8 5.61 1349 1290 A 8 VAL HGx% A 13 GLU HBy 1.0 1.8 5.61 1350 1291 A 8 VAL HGx% A 13 GLU HGy 1.0 1.8 5.29 1351 1291 A 8 VAL HGx% A 13 GLU HGx 1.0 1.8 5.29 1352 1292 A 8 VAL HGy% A 9 SER HBy 1.0 1.8 6.29 1353 1292 A 8 VAL HGy% A 9 SER HBx 1.0 1.8 6.29 1354 1293 A 8 VAL HGy% A 35 GLY HAx 1.0 1.8 5.50 1355 1293 A 8 VAL HGy% A 35 GLY HAy 1.0 1.8 5.50 1356 1294 A 10 ASP H A 9 SER HBy 1.0 1.8 4.80 1357 1294 A 10 ASP H A 9 SER HBx 1.0 1.8 4.80 1358 1295 A 10 ASP H A 13 GLU HBx 1.0 1.8 4.77 1359 1295 A 10 ASP H A 13 GLU HBy 1.0 1.8 4.77 1360 1296 A 10 ASP H A 13 GLU HGy 1.0 1.8 5.88 1361 1296 A 10 ASP H A 13 GLU HGx 1.0 1.8 5.88 1362 1297 A 11 ASP H A 10 ASP HBx 1.0 1.8 4.27 1363 1297 A 11 ASP H A 10 ASP HBy 1.0 1.8 4.27 1364 1298 A 12 GLU H A 10 ASP HBx 1.0 1.8 4.96 1365 1298 A 12 GLU H A 10 ASP HBy 1.0 1.8 4.96 1366 1299 A 12 GLU HBx A 10 ASP HBx 1.0 1.8 6.22 1367 1299 A 12 GLU HBx A 10 ASP HBy 1.0 1.8 6.22 1368 1300 A 13 GLU H A 10 ASP HBx 1.0 1.8 5.15 1369 1300 A 13 GLU H A 10 ASP HBy 1.0 1.8 5.15 1370 1301 A 13 GLU HA A 10 ASP HBx 1.0 1.8 6.64 1371 1301 A 13 GLU HA A 10 ASP HBy 1.0 1.8 6.64 1372 1302 A 10 ASP HBy A 13 GLU HBx 1.0 1.8 6.08 1373 1302 A 10 ASP HBx A 13 GLU HBx 1.0 1.8 6.08 1374 1302 A 13 GLU HBy A 10 ASP HBx 1.0 1.8 6.08 1375 1302 A 10 ASP HBy A 13 GLU HBy 1.0 1.8 6.08 1376 1303 A 10 ASP HBx A 13 GLU HGy 1.0 1.8 6.10 1377 1303 A 10 ASP HBy A 13 GLU HGy 1.0 1.8 6.10 1378 1303 A 13 GLU HGx A 10 ASP HBx 1.0 1.8 6.10 1379 1303 A 10 ASP HBy A 13 GLU HGx 1.0 1.8 6.10 1380 1304 A 11 ASP H A 11 ASP HBx 1.0 1.8 4.08 1381 1304 A 11 ASP H A 11 ASP HBy 1.0 1.8 4.08 1382 1305 A 12 GLU H A 11 ASP HBx 1.0 1.8 3.93 1383 1305 A 12 GLU H A 11 ASP HBy 1.0 1.8 3.93 1384 1306 A 12 GLU H A 13 GLU HBx 1.0 1.8 6.10 1385 1306 A 12 GLU H A 13 GLU HBy 1.0 1.8 6.10 1386 1307 A 12 GLU HA A 12 GLU HGx 1.0 1.8 3.69 1387 1307 A 12 GLU HA A 12 GLU HGy 1.0 1.8 3.69 1388 1308 A 12 GLU HA A 15 GLU HGy 1.0 1.8 4.35 1389 1308 A 12 GLU HA A 15 GLU HGx 1.0 1.8 4.35 1390 1309 A 13 GLU H A 12 GLU HGx 1.0 1.8 5.31 1391 1309 A 13 GLU H A 12 GLU HGy 1.0 1.8 5.31 1392 1310 A 13 GLU H A 13 GLU HGy 1.0 1.8 4.84 1393 1310 A 13 GLU H A 13 GLU HGx 1.0 1.8 4.84 1394 1311 A 13 GLU HA A 13 GLU HGy 1.0 1.8 3.75 1395 1311 A 13 GLU HA A 13 GLU HGx 1.0 1.8 3.75 1396 1312 A 13 GLU HA A 16 LYS HGy 1.0 1.8 4.49 1397 1312 A 13 GLU HA A 16 LYS HGx 1.0 1.8 4.49 1398 1313 A 14 ALA H A 13 GLU HBx 1.0 1.8 3.76 1399 1313 A 14 ALA H A 13 GLU HBy 1.0 1.8 3.76 1400 1314 A 17 ILE HD1% A 13 GLU HBx 1.0 1.8 5.91 1401 1314 A 17 ILE HD1% A 13 GLU HBy 1.0 1.8 5.91 1402 1315 A 14 ALA H A 13 GLU HGy 1.0 1.8 5.18 1403 1315 A 14 ALA H A 13 GLU HGx 1.0 1.8 5.18 1404 1316 A 17 ILE HG1y A 13 GLU HGy 1.0 1.8 5.93 1405 1316 A 17 ILE HG1y A 13 GLU HGx 1.0 1.8 5.93 1406 1317 A 17 ILE HD1% A 13 GLU HGy 1.0 1.8 4.22 1407 1317 A 17 ILE HD1% A 13 GLU HGx 1.0 1.8 4.22 1408 1318 A 14 ALA H A 15 GLU HGy 1.0 1.8 6.11 1409 1318 A 14 ALA H A 15 GLU HGx 1.0 1.8 6.11 1410 1319 A 15 GLU HA A 18 ILE HG1x 1.0 1.8 5.77 1411 1319 A 15 GLU HA A 18 ILE HG1y 1.0 1.8 5.77 1412 1320 A 16 LYS H A 15 GLU HGy 1.0 1.8 4.80 1413 1320 A 16 LYS H A 15 GLU HGx 1.0 1.8 4.80 1414 1321 A 16 LYS H A 16 LYS HGy 1.0 1.8 3.46 1415 1321 A 16 LYS H A 16 LYS HGx 1.0 1.8 3.46 1416 1322 A 16 LYS H A 16 LYS HD3 1.0 1.8 5.34 1417 1322 A 16 LYS H A 16 LYS HD2 1.0 1.8 5.34 1418 1323 A 16 LYS HA A 16 LYS HGy 1.0 1.8 4.14 1419 1323 A 16 LYS HA A 16 LYS HGx 1.0 1.8 4.14 1420 1324 A 16 LYS HA A 16 LYS HD3 1.0 1.8 4.46 1421 1324 A 16 LYS HA A 16 LYS HD2 1.0 1.8 4.46 1422 1325 A 16 LYS HA A 19 ARG HBx 1.0 1.8 3.77 1423 1325 A 16 LYS HA A 19 ARG HBy 1.0 1.8 3.77 1424 1326 A 16 LYS HBx A 16 LYS HEy 1.0 1.8 5.67 1425 1326 A 16 LYS HBx A 16 LYS HEx 1.0 1.8 5.67 1426 1327 A 16 LYS HBy A 16 LYS HD3 1.0 1.8 3.57 1427 1327 A 16 LYS HBy A 16 LYS HD2 1.0 1.8 3.57 1428 1328 A 16 LYS HBy A 16 LYS HEy 1.0 1.8 5.22 1429 1328 A 16 LYS HBy A 16 LYS HEx 1.0 1.8 5.22 1430 1329 A 16 LYS HEx A 16 LYS HGy 1.0 1.8 3.84 1431 1329 A 16 LYS HEy A 16 LYS HGy 1.0 1.8 3.84 1432 1329 A 16 LYS HGx A 16 LYS HEy 1.0 1.8 3.84 1433 1329 A 16 LYS HGx A 16 LYS HEx 1.0 1.8 3.84 1434 1330 A 17 ILE H A 16 LYS HGy 1.0 1.8 5.05 1435 1330 A 17 ILE H A 16 LYS HGx 1.0 1.8 5.05 1436 1331 A 57 VAL HGx% A 16 LYS HGy 1.0 1.8 5.07 1437 1331 A 57 VAL HGx% A 16 LYS HGx 1.0 1.8 5.07 1438 1332 A 57 VAL HGx% A 16 LYS HD3 1.0 1.8 5.22 1439 1332 A 57 VAL HGx% A 16 LYS HD2 1.0 1.8 5.22 1440 1333 A 57 VAL HGy% A 16 LYS HEy 1.0 1.8 5.35 1441 1333 A 57 VAL HGy% A 16 LYS HEx 1.0 1.8 5.35 1442 1334 A 17 ILE HA A 20 GLU HBy 1.0 1.8 4.24 1443 1334 A 17 ILE HA A 20 GLU HBx 1.0 1.8 4.24 1444 1335 A 17 ILE HG2% A 58 LYS HDx 1.0 1.8 6.68 1445 1335 A 17 ILE HG2% A 58 LYS HDy 1.0 1.8 6.68 1446 1336 A 17 ILE HG1x A 58 LYS HDx 1.0 1.8 5.24 1447 1336 A 17 ILE HG1x A 58 LYS HDy 1.0 1.8 5.24 1448 1337 A 17 ILE HD1% A 58 LYS HDx 1.0 1.8 3.88 1449 1337 A 17 ILE HD1% A 58 LYS HDy 1.0 1.8 3.88 1450 1338 A 17 ILE HD1% A 58 LYS HEx 1.0 1.8 5.74 1451 1338 A 17 ILE HD1% A 58 LYS HEy 1.0 1.8 5.74 1452 1339 A 18 ILE H A 18 ILE HG1x 1.0 1.8 3.28 1453 1339 A 18 ILE H A 18 ILE HG1y 1.0 1.8 3.28 1454 1340 A 18 ILE H A 19 ARG HBx 1.0 1.8 6.34 1455 1340 A 18 ILE H A 19 ARG HBy 1.0 1.8 6.34 1456 1341 A 18 ILE HA A 18 ILE HG1x 1.0 1.8 3.59 1457 1341 A 18 ILE HA A 18 ILE HG1y 1.0 1.8 3.59 1458 1342 A 18 ILE HB A 18 ILE HG1x 1.0 1.8 2.82 1459 1342 A 18 ILE HB A 18 ILE HG1y 1.0 1.8 2.82 1460 1343 A 18 ILE HG2% A 18 ILE HG1x 1.0 1.8 3.61 1461 1343 A 18 ILE HG2% A 18 ILE HG1y 1.0 1.8 3.61 1462 1344 A 18 ILE HG2% A 22 ARG HGy 1.0 1.8 3.77 1463 1344 A 18 ILE HG2% A 22 ARG HGx 1.0 1.8 3.77 1464 1345 A 18 ILE HG2% A 22 ARG HDy 1.0 1.8 4.52 1465 1345 A 18 ILE HG2% A 22 ARG HDx 1.0 1.8 4.52 1466 1346 A 19 ARG H A 18 ILE HG1x 1.0 1.8 5.37 1467 1346 A 19 ARG H A 18 ILE HG1y 1.0 1.8 5.37 1468 1347 A 18 ILE HD1% A 32 ARG HBx 1.0 1.8 5.09 1469 1347 A 18 ILE HD1% A 32 ARG HBy 1.0 1.8 5.09 1470 1348 A 18 ILE HD1% A 32 ARG HGx 1.0 1.8 6.68 1471 1348 A 18 ILE HD1% A 32 ARG HGy 1.0 1.8 6.68 1472 1349 A 18 ILE HD1% A 32 ARG HDx 1.0 1.8 5.09 1473 1349 A 18 ILE HD1% A 32 ARG HDy 1.0 1.8 5.09 1474 1350 A 19 ARG H A 19 ARG HBx 1.0 1.8 3.29 1475 1350 A 19 ARG H A 19 ARG HBy 1.0 1.8 3.29 1476 1351 A 19 ARG H A 19 ARG HGy 1.0 1.8 4.70 1477 1351 A 19 ARG H A 19 ARG HGx 1.0 1.8 4.70 1478 1352 A 19 ARG H A 19 ARG HDy 1.0 1.8 6.04 1479 1352 A 19 ARG H A 19 ARG HDx 1.0 1.8 6.04 1480 1353 A 19 ARG HA A 19 ARG HGy 1.0 1.8 3.74 1481 1353 A 19 ARG HA A 19 ARG HGx 1.0 1.8 3.74 1482 1354 A 19 ARG HA A 19 ARG HDy 1.0 1.8 5.29 1483 1354 A 19 ARG HA A 19 ARG HDx 1.0 1.8 5.29 1484 1355 A 19 ARG HBy A 19 ARG HDy 1.0 1.8 3.76 1485 1355 A 19 ARG HBx A 19 ARG HDy 1.0 1.8 3.76 1486 1355 A 19 ARG HDx A 19 ARG HBx 1.0 1.8 3.76 1487 1355 A 19 ARG HBy A 19 ARG HDx 1.0 1.8 3.76 1488 1356 A 20 GLU H A 19 ARG HBx 1.0 1.8 3.86 1489 1356 A 20 GLU H A 19 ARG HBy 1.0 1.8 3.86 1490 1357 A 20 GLU HA A 19 ARG HBx 1.0 1.8 5.53 1491 1357 A 20 GLU HA A 19 ARG HBy 1.0 1.8 5.53 1492 1358 A 20 GLU H A 20 GLU HBy 1.0 1.8 3.53 1493 1358 A 20 GLU H A 20 GLU HBx 1.0 1.8 3.53 1494 1359 A 20 GLU H A 20 GLU HGy 1.0 1.8 4.65 1495 1359 A 20 GLU H A 20 GLU HGx 1.0 1.8 4.65 1496 1360 A 20 GLU HA A 20 GLU HGy 1.0 1.8 3.99 1497 1360 A 20 GLU HA A 20 GLU HGx 1.0 1.8 3.99 1498 1361 A 20 GLU HA A 23 GLU HBy 1.0 1.8 3.65 1499 1361 A 20 GLU HA A 23 GLU HBx 1.0 1.8 3.65 1500 1362 A 21 ILE H A 20 GLU HBy 1.0 1.8 3.81 1501 1362 A 21 ILE H A 20 GLU HBx 1.0 1.8 3.81 1502 1363 A 21 ILE HD1% A 20 GLU HBy 1.0 1.8 6.58 1503 1363 A 21 ILE HD1% A 20 GLU HBx 1.0 1.8 6.58 1504 1364 A 53 ALA HB% A 20 GLU HBy 1.0 1.8 4.76 1505 1364 A 53 ALA HB% A 20 GLU HBx 1.0 1.8 4.76 1506 1365 A 57 VAL HGy% A 20 GLU HBy 1.0 1.8 4.63 1507 1365 A 57 VAL HGy% A 20 GLU HBx 1.0 1.8 4.63 1508 1366 A 21 ILE HA A 20 GLU HGy 1.0 1.8 6.68 1509 1366 A 21 ILE HA A 20 GLU HGx 1.0 1.8 6.68 1510 1367 A 21 ILE HD1% A 20 GLU HGy 1.0 1.8 6.68 1511 1367 A 21 ILE HD1% A 20 GLU HGx 1.0 1.8 6.68 1512 1368 A 53 ALA HB% A 20 GLU HGy 1.0 1.8 4.42 1513 1368 A 53 ALA HB% A 20 GLU HGx 1.0 1.8 4.42 1514 1369 A 57 VAL HGx% A 20 GLU HGy 1.0 1.8 5.51 1515 1369 A 57 VAL HGx% A 20 GLU HGx 1.0 1.8 5.51 1516 1370 A 57 VAL HGy% A 20 GLU HGy 1.0 1.8 4.47 1517 1370 A 57 VAL HGy% A 20 GLU HGx 1.0 1.8 4.47 1518 1371 A 21 ILE HA A 23 GLU HBy 1.0 1.8 6.68 1519 1371 A 21 ILE HA A 23 GLU HBx 1.0 1.8 6.68 1520 1372 A 21 ILE HA A 24 GLN HBy 1.0 1.8 5.07 1521 1372 A 21 ILE HA A 24 GLN HBx 1.0 1.8 5.07 1522 1373 A 21 ILE HG2% A 39 LEU HBx 1.0 1.8 6.68 1523 1373 A 21 ILE HG2% A 39 LEU HBy 1.0 1.8 6.68 1524 1374 A 21 ILE HG2% A 50 MET HGx 1.0 1.8 6.68 1525 1374 A 21 ILE HG2% A 50 MET HGy 1.0 1.8 6.68 1526 1375 A 21 ILE HD1% A 24 GLN HBy 1.0 1.8 6.68 1527 1375 A 21 ILE HD1% A 24 GLN HBx 1.0 1.8 6.68 1528 1376 A 21 ILE HD1% A 39 LEU HBx 1.0 1.8 6.68 1529 1376 A 21 ILE HD1% A 39 LEU HBy 1.0 1.8 6.68 1530 1377 A 21 ILE HD1% A 50 MET HBy 1.0 1.8 5.26 1531 1377 A 21 ILE HD1% A 50 MET HBx 1.0 1.8 5.26 1532 1378 A 21 ILE HD1% A 50 MET HGx 1.0 1.8 5.30 1533 1378 A 21 ILE HD1% A 50 MET HGy 1.0 1.8 5.30 1534 1379 A 22 ARG H A 22 ARG HGy 1.0 1.8 3.90 1535 1379 A 22 ARG H A 22 ARG HGx 1.0 1.8 3.90 1536 1380 A 22 ARG H A 22 ARG HDy 1.0 1.8 5.38 1537 1380 A 22 ARG H A 22 ARG HDx 1.0 1.8 5.38 1538 1381 A 22 ARG HA A 22 ARG HDy 1.0 1.8 4.83 1539 1381 A 22 ARG HA A 22 ARG HDx 1.0 1.8 4.83 1540 1382 A 22 ARG HA A 26 PRO HBy 1.0 1.8 6.13 1541 1382 A 22 ARG HA A 26 PRO HBx 1.0 1.8 6.13 1542 1383 A 22 ARG HBy A 22 ARG HGy 1.0 1.8 2.93 1543 1383 A 22 ARG HBy A 22 ARG HGx 1.0 1.8 2.93 1544 1384 A 22 ARG HBx A 22 ARG HDy 1.0 1.8 4.05 1545 1384 A 22 ARG HBx A 22 ARG HDx 1.0 1.8 4.05 1546 1385 A 23 GLU H A 22 ARG HGy 1.0 1.8 5.44 1547 1385 A 23 GLU H A 22 ARG HGx 1.0 1.8 5.44 1548 1386 A 30 VAL HGx% A 22 ARG HDy 1.0 1.8 6.68 1549 1386 A 30 VAL HGx% A 22 ARG HDx 1.0 1.8 6.68 1550 1387 A 30 VAL HGy% A 22 ARG HDy 1.0 1.8 6.68 1551 1387 A 30 VAL HGy% A 22 ARG HDx 1.0 1.8 6.68 1552 1388 A 23 GLU H A 23 GLU HBy 1.0 1.8 3.46 1553 1388 A 23 GLU H A 23 GLU HBx 1.0 1.8 3.46 1554 1389 A 23 GLU H A 23 GLU HGx 1.0 1.8 3.99 1555 1389 A 23 GLU H A 23 GLU HGy 1.0 1.8 3.99 1556 1390 A 23 GLU HA A 23 GLU HGx 1.0 1.8 4.09 1557 1390 A 23 GLU HA A 23 GLU HGy 1.0 1.8 4.09 1558 1391 A 24 GLN H A 23 GLU HBy 1.0 1.8 4.01 1559 1391 A 24 GLN H A 23 GLU HBx 1.0 1.8 4.01 1560 1392 A 24 GLN HA A 23 GLU HBy 1.0 1.8 6.16 1561 1392 A 24 GLN HA A 23 GLU HBx 1.0 1.8 6.16 1562 1393 A 25 TRP H A 23 GLU HBy 1.0 1.8 6.68 1563 1393 A 25 TRP H A 23 GLU HBx 1.0 1.8 6.68 1564 1394 A 24 GLN H A 24 GLN HBy 1.0 1.8 3.76 1565 1394 A 24 GLN H A 24 GLN HBx 1.0 1.8 3.76 1566 1395 A 24 GLN H A 24 GLN HGy 1.0 1.8 4.32 1567 1395 A 24 GLN H A 24 GLN HGx 1.0 1.8 4.32 1568 1396 A 24 GLN HA A 24 GLN HGy 1.0 1.8 4.16 1569 1396 A 24 GLN HA A 24 GLN HGx 1.0 1.8 4.16 1570 1397 A 24 GLN HE2y A 24 GLN HBx 1.0 1.8 4.91 1571 1397 A 24 GLN HE2x A 24 GLN HBx 1.0 1.8 4.91 1572 1397 A 24 GLN HE2x A 24 GLN HBy 1.0 1.8 4.91 1573 1397 A 24 GLN HE2y A 24 GLN HBy 1.0 1.8 4.91 1574 1398 A 25 TRP H A 24 GLN HBy 1.0 1.8 4.20 1575 1398 A 25 TRP H A 24 GLN HBx 1.0 1.8 4.20 1576 1399 A 25 TRP HE3 A 24 GLN HBy 1.0 1.8 4.03 1577 1399 A 25 TRP HE3 A 24 GLN HBx 1.0 1.8 4.03 1578 1400 A 25 TRP HZ3 A 24 GLN HBy 1.0 1.8 4.46 1579 1400 A 25 TRP HZ3 A 24 GLN HBx 1.0 1.8 4.46 1580 1401 A 25 TRP HH2 A 24 GLN HBy 1.0 1.8 4.98 1581 1401 A 25 TRP HH2 A 24 GLN HBx 1.0 1.8 4.98 1582 1402 A 53 ALA HB% A 24 GLN HBy 1.0 1.8 5.39 1583 1402 A 53 ALA HB% A 24 GLN HBx 1.0 1.8 5.39 1584 1403 A 24 GLN HE2y A 24 GLN HGy 1.0 1.8 3.45 1585 1403 A 24 GLN HE2y A 24 GLN HGx 1.0 1.8 3.45 1586 1403 A 24 GLN HE2x A 24 GLN HGx 1.0 1.8 3.45 1587 1403 A 24 GLN HE2x A 24 GLN HGy 1.0 1.8 3.45 1588 1404 A 25 TRP H A 24 GLN HGy 1.0 1.8 5.42 1589 1404 A 25 TRP H A 24 GLN HGx 1.0 1.8 5.42 1590 1405 A 25 TRP HZ3 A 24 GLN HGy 1.0 1.8 5.18 1591 1405 A 25 TRP HZ3 A 24 GLN HGx 1.0 1.8 5.18 1592 1406 A 53 ALA HB% A 24 GLN HGy 1.0 1.8 5.12 1593 1406 A 53 ALA HB% A 24 GLN HGx 1.0 1.8 5.12 1594 1407 A 53 ALA HB% A 24 GLN HE2y 1.0 1.8 4.22 1595 1407 A 53 ALA HB% A 24 GLN HE2x 1.0 1.8 4.22 1596 1408 A 25 TRP HE3 A 50 MET HGx 1.0 1.8 5.37 1597 1408 A 25 TRP HE3 A 50 MET HGy 1.0 1.8 5.37 1598 1409 A 25 TRP HE1 A 46 GLU HGy 1.0 1.8 4.15 1599 1409 A 25 TRP HE1 A 46 GLU HGx 1.0 1.8 4.15 1600 1410 A 25 TRP HE1 A 49 LYS HD3 1.0 1.8 5.47 1601 1410 A 25 TRP HE1 A 49 LYS HD2 1.0 1.8 5.47 1602 1411 A 25 TRP HZ3 A 50 MET HBy 1.0 1.8 5.51 1603 1411 A 25 TRP HZ3 A 50 MET HBx 1.0 1.8 5.51 1604 1412 A 25 TRP HZ3 A 50 MET HGx 1.0 1.8 5.24 1605 1412 A 25 TRP HZ3 A 50 MET HGy 1.0 1.8 5.24 1606 1413 A 25 TRP HZ2 A 46 GLU HGy 1.0 1.8 4.82 1607 1413 A 25 TRP HZ2 A 46 GLU HGx 1.0 1.8 4.82 1608 1414 A 25 TRP HZ2 A 49 LYS HD3 1.0 1.8 3.67 1609 1414 A 25 TRP HZ2 A 49 LYS HD2 1.0 1.8 3.67 1610 1415 A 25 TRP HZ2 A 49 LYS HEy 1.0 1.8 6.07 1611 1415 A 25 TRP HZ2 A 49 LYS HEx 1.0 1.8 6.07 1612 1416 A 25 TRP HZ2 A 50 MET HGx 1.0 1.8 4.52 1613 1416 A 25 TRP HZ2 A 50 MET HGy 1.0 1.8 4.52 1614 1417 A 25 TRP HH2 A 49 LYS HGx 1.0 1.8 6.29 1615 1417 A 25 TRP HH2 A 49 LYS HGy 1.0 1.8 6.29 1616 1418 A 25 TRP HH2 A 50 MET HGx 1.0 1.8 4.42 1617 1418 A 25 TRP HH2 A 50 MET HGy 1.0 1.8 4.42 1618 1419 A 27 LYS H A 26 PRO HBy 1.0 1.8 4.50 1619 1419 A 27 LYS H A 26 PRO HBx 1.0 1.8 4.50 1620 1420 A 26 PRO HGx A 27 LYS HGy 1.0 1.8 5.49 1621 1420 A 26 PRO HGx A 27 LYS HGx 1.0 1.8 5.49 1622 1421 A 27 LYS H A 27 LYS HBx 1.0 1.8 4.03 1623 1421 A 27 LYS H A 27 LYS HBy 1.0 1.8 4.03 1624 1422 A 27 LYS HA A 27 LYS HGy 1.0 1.8 4.01 1625 1422 A 27 LYS HA A 27 LYS HGx 1.0 1.8 4.01 1626 1423 A 27 LYS HA A 27 LYS HDy 1.0 1.8 5.46 1627 1423 A 27 LYS HA A 27 LYS HDx 1.0 1.8 5.46 1628 1424 A 27 LYS HBy A 27 LYS HDy 1.0 1.8 3.81 1629 1424 A 27 LYS HBx A 27 LYS HDy 1.0 1.8 3.81 1630 1424 A 27 LYS HDx A 27 LYS HBx 1.0 1.8 3.81 1631 1424 A 27 LYS HBy A 27 LYS HDx 1.0 1.8 3.81 1632 1425 A 27 LYS HBy A 27 LYS HE3 1.0 1.8 4.88 1633 1425 A 27 LYS HE2 A 27 LYS HBx 1.0 1.8 4.88 1634 1425 A 27 LYS HBy A 27 LYS HE2 1.0 1.8 4.88 1635 1425 A 27 LYS HBx A 27 LYS HE3 1.0 1.8 4.88 1636 1426 A 28 ALA H A 27 LYS HBx 1.0 1.8 4.89 1637 1426 A 28 ALA H A 27 LYS HBy 1.0 1.8 4.89 1638 1427 A 28 ALA H A 27 LYS HGy 1.0 1.8 6.30 1639 1427 A 28 ALA H A 27 LYS HGx 1.0 1.8 6.30 1640 1428 A 28 ALA HB% A 39 LEU HDy% 1.0 1.8 4.55 1641 1428 A 28 ALA HB% A 39 LEU HDx% 1.0 1.8 4.55 1642 1429 A 29 THR H A 40 ASP HBy 1.0 1.8 5.67 1643 1429 A 29 THR H A 40 ASP HBx 1.0 1.8 5.67 1644 1430 A 29 THR HB A 40 ASP HBy 1.0 1.8 4.01 1645 1430 A 29 THR HB A 40 ASP HBx 1.0 1.8 4.01 1646 1431 A 30 VAL HA A 38 LYS HBx 1.0 1.8 6.01 1647 1431 A 30 VAL HA A 38 LYS HBy 1.0 1.8 6.01 1648 1432 A 31 THR H A 38 LYS HBx 1.0 1.8 4.83 1649 1432 A 31 THR H A 38 LYS HBy 1.0 1.8 4.83 1650 1433 A 31 THR HB A 38 LYS HBx 1.0 1.8 4.22 1651 1433 A 31 THR HB A 38 LYS HBy 1.0 1.8 4.22 1652 1434 A 31 THR HB A 38 LYS HDy 1.0 1.8 5.80 1653 1434 A 31 THR HB A 38 LYS HDx 1.0 1.8 5.80 1654 1435 A 31 THR HB A 38 LYS HEx 1.0 1.8 5.95 1655 1435 A 31 THR HB A 38 LYS HEy 1.0 1.8 5.95 1656 1436 A 31 THR HG2% A 38 LYS HEx 1.0 1.8 5.76 1657 1436 A 31 THR HG2% A 38 LYS HEy 1.0 1.8 5.76 1658 1437 A 33 THR H A 32 ARG HBx 1.0 1.8 4.66 1659 1437 A 33 THR H A 32 ARG HBy 1.0 1.8 4.66 1660 1438 A 34 ASN H A 32 ARG HBx 1.0 1.8 6.10 1661 1438 A 34 ASN H A 32 ARG HBy 1.0 1.8 6.10 1662 1439 A 33 THR H A 32 ARG HGx 1.0 1.8 5.03 1663 1439 A 33 THR H A 32 ARG HGy 1.0 1.8 5.03 1664 1440 A 34 ASN H A 32 ARG HGx 1.0 1.8 5.21 1665 1440 A 34 ASN H A 32 ARG HGy 1.0 1.8 5.21 1666 1441 A 33 THR H A 32 ARG HDx 1.0 1.8 6.68 1667 1441 A 33 THR H A 32 ARG HDy 1.0 1.8 6.68 1668 1442 A 33 THR HA A 34 ASN HBy 1.0 1.8 5.50 1669 1442 A 33 THR HA A 34 ASN HBx 1.0 1.8 5.50 1670 1443 A 33 THR HG2% A 38 LYS HBx 1.0 1.8 4.46 1671 1443 A 33 THR HG2% A 38 LYS HBy 1.0 1.8 4.46 1672 1444 A 33 THR HG2% A 38 LYS HDy 1.0 1.8 4.39 1673 1444 A 33 THR HG2% A 38 LYS HDx 1.0 1.8 4.39 1674 1445 A 33 THR HG2% A 38 LYS HEx 1.0 1.8 4.51 1675 1445 A 33 THR HG2% A 38 LYS HEy 1.0 1.8 4.51 1676 1446 A 34 ASN H A 34 ASN HBy 1.0 1.8 4.12 1677 1446 A 34 ASN H A 34 ASN HBx 1.0 1.8 4.12 1678 1447 A 35 GLY H A 34 ASN HBy 1.0 1.8 4.23 1679 1447 A 35 GLY H A 34 ASN HBx 1.0 1.8 4.23 1680 1448 A 37 ILE HA A 38 LYS HBx 1.0 1.8 6.68 1681 1448 A 37 ILE HA A 38 LYS HBy 1.0 1.8 6.68 1682 1449 A 37 ILE HG2% A 39 LEU HBx 1.0 1.8 4.11 1683 1449 A 37 ILE HG2% A 39 LEU HBy 1.0 1.8 4.11 1684 1450 A 37 ILE HG2% A 58 LYS HEx 1.0 1.8 6.68 1685 1450 A 37 ILE HG2% A 58 LYS HEy 1.0 1.8 6.68 1686 1451 A 37 ILE HG1y A 58 LYS HEx 1.0 1.8 6.00 1687 1451 A 37 ILE HG1y A 58 LYS HEy 1.0 1.8 6.00 1688 1452 A 38 LYS H A 38 LYS HBx 1.0 1.8 3.89 1689 1452 A 38 LYS H A 38 LYS HBy 1.0 1.8 3.89 1690 1453 A 38 LYS H A 38 LYS HGy 1.0 1.8 5.03 1691 1453 A 38 LYS H A 38 LYS HGx 1.0 1.8 5.03 1692 1454 A 38 LYS HA A 38 LYS HGy 1.0 1.8 3.99 1693 1454 A 38 LYS HA A 38 LYS HGx 1.0 1.8 3.99 1694 1455 A 38 LYS HA A 38 LYS HDy 1.0 1.8 4.65 1695 1455 A 38 LYS HA A 38 LYS HDx 1.0 1.8 4.65 1696 1456 A 38 LYS HBx A 38 LYS HDy 1.0 1.8 2.88 1697 1456 A 38 LYS HDx A 38 LYS HBx 1.0 1.8 2.88 1698 1456 A 38 LYS HBy A 38 LYS HDx 1.0 1.8 2.88 1699 1456 A 38 LYS HBy A 38 LYS HDy 1.0 1.8 2.88 1700 1457 A 38 LYS HBy A 38 LYS HEx 1.0 1.8 4.88 1701 1457 A 38 LYS HEy A 38 LYS HBx 1.0 1.8 4.88 1702 1457 A 38 LYS HBy A 38 LYS HEy 1.0 1.8 4.88 1703 1457 A 38 LYS HBx A 38 LYS HEx 1.0 1.8 4.88 1704 1458 A 39 LEU H A 38 LYS HBx 1.0 1.8 4.52 1705 1458 A 39 LEU H A 38 LYS HBy 1.0 1.8 4.52 1706 1459 A 39 LEU H A 38 LYS HGy 1.0 1.8 4.81 1707 1459 A 39 LEU H A 38 LYS HGx 1.0 1.8 4.81 1708 1460 A 39 LEU H A 39 LEU HBx 1.0 1.8 4.09 1709 1460 A 39 LEU H A 39 LEU HBy 1.0 1.8 4.09 1710 1461 A 39 LEU H A 39 LEU HDy% 1.0 1.8 4.73 1711 1461 A 39 LEU H A 39 LEU HDx% 1.0 1.8 4.73 1712 1462 A 40 ASP H A 39 LEU HBx 1.0 1.8 5.12 1713 1462 A 40 ASP H A 39 LEU HBy 1.0 1.8 5.12 1714 1463 A 40 ASP H A 39 LEU HDy% 1.0 1.8 4.36 1715 1463 A 40 ASP H A 39 LEU HDx% 1.0 1.8 4.36 1716 1464 A 50 MET H A 39 LEU HDy% 1.0 1.8 6.81 1717 1464 A 50 MET H A 39 LEU HDx% 1.0 1.8 6.81 1718 1465 A 39 LEU HDy% A 50 MET HBy 1.0 1.8 4.11 1719 1465 A 39 LEU HDx% A 50 MET HBy 1.0 1.8 4.11 1720 1465 A 50 MET HBx A 39 LEU HDy% 1.0 1.8 4.11 1721 1465 A 50 MET HBx A 39 LEU HDx% 1.0 1.8 4.11 1722 1466 A 39 LEU HDy% A 50 MET HGx 1.0 1.8 5.73 1723 1466 A 39 LEU HDx% A 50 MET HGx 1.0 1.8 5.73 1724 1466 A 50 MET HGy A 39 LEU HDy% 1.0 1.8 5.73 1725 1466 A 50 MET HGy A 39 LEU HDx% 1.0 1.8 5.73 1726 1467 A 50 MET HE% A 39 LEU HDy% 1.0 1.8 4.44 1727 1467 A 50 MET HE% A 39 LEU HDx% 1.0 1.8 4.44 1728 1468 A 40 ASP H A 40 ASP HBy 1.0 1.8 3.69 1729 1468 A 40 ASP H A 40 ASP HBx 1.0 1.8 3.69 1730 1469 A 41 ALA H A 40 ASP HBy 1.0 1.8 4.52 1731 1469 A 41 ALA H A 40 ASP HBx 1.0 1.8 4.52 1732 1470 A 41 ALA HB% A 46 GLU HBx 1.0 1.8 4.19 1733 1470 A 41 ALA HB% A 46 GLU HBy 1.0 1.8 4.19 1734 1471 A 41 ALA HB% A 46 GLU HGy 1.0 1.8 4.86 1735 1471 A 41 ALA HB% A 46 GLU HGx 1.0 1.8 4.86 1736 1472 A 42 GLN H A 42 GLN HBy 1.0 1.8 4.16 1737 1472 A 42 GLN H A 42 GLN HBx 1.0 1.8 4.16 1738 1473 A 43 THR HG2% A 42 GLN HBy 1.0 1.8 4.05 1739 1473 A 43 THR HG2% A 42 GLN HBx 1.0 1.8 4.05 1740 1474 A 43 THR HG2% A 42 GLN HGy 1.0 1.8 5.05 1741 1474 A 43 THR HG2% A 42 GLN HGx 1.0 1.8 5.05 1742 1475 A 43 THR H A 46 GLU HGy 1.0 1.8 5.64 1743 1475 A 43 THR H A 46 GLU HGx 1.0 1.8 5.64 1744 1476 A 45 LYS HA A 45 LYS HD3 1.0 1.8 5.01 1745 1476 A 45 LYS HA A 45 LYS HD2 1.0 1.8 5.01 1746 1477 A 45 LYS HA A 45 LYS HEx 1.0 1.8 5.91 1747 1477 A 45 LYS HA A 45 LYS HEy 1.0 1.8 5.91 1748 1478 A 45 LYS HA A 48 GLU HGy 1.0 1.8 4.77 1749 1478 A 45 LYS HA A 48 GLU HGx 1.0 1.8 4.77 1750 1479 A 45 LYS HBx A 45 LYS HD3 1.0 1.8 3.14 1751 1479 A 45 LYS HBy A 45 LYS HD3 1.0 1.8 3.14 1752 1479 A 45 LYS HD2 A 45 LYS HBx 1.0 1.8 3.14 1753 1479 A 45 LYS HD2 A 45 LYS HBy 1.0 1.8 3.14 1754 1480 A 45 LYS HBx A 45 LYS HEx 1.0 1.8 3.92 1755 1480 A 45 LYS HEy A 45 LYS HBx 1.0 1.8 3.92 1756 1480 A 45 LYS HEy A 45 LYS HBy 1.0 1.8 3.92 1757 1480 A 45 LYS HBy A 45 LYS HEx 1.0 1.8 3.92 1758 1481 A 46 GLU H A 45 LYS HGx 1.0 1.8 5.52 1759 1481 A 46 GLU H A 45 LYS HGy 1.0 1.8 5.52 1760 1482 A 45 LYS HD3 A 48 GLU HGy 1.0 1.8 5.96 1761 1482 A 45 LYS HD2 A 48 GLU HGy 1.0 1.8 5.96 1762 1482 A 48 GLU HGx A 45 LYS HD3 1.0 1.8 5.96 1763 1482 A 45 LYS HD2 A 48 GLU HGx 1.0 1.8 5.96 1764 1483 A 46 GLU H A 46 GLU HBx 1.0 1.8 3.39 1765 1483 A 46 GLU H A 46 GLU HBy 1.0 1.8 3.39 1766 1484 A 46 GLU HA A 46 GLU HGy 1.0 1.8 3.37 1767 1484 A 46 GLU HA A 46 GLU HGx 1.0 1.8 3.37 1768 1485 A 46 GLU HA A 49 LYS HGx 1.0 1.8 5.13 1769 1485 A 46 GLU HA A 49 LYS HGy 1.0 1.8 5.13 1770 1486 A 46 GLU HA A 49 LYS HD3 1.0 1.8 4.16 1771 1486 A 46 GLU HA A 49 LYS HD2 1.0 1.8 4.16 1772 1487 A 47 ALA HA A 46 GLU HBx 1.0 1.8 6.52 1773 1487 A 47 ALA HA A 46 GLU HBy 1.0 1.8 6.52 1774 1488 A 50 MET HE% A 46 GLU HBx 1.0 1.8 4.15 1775 1488 A 50 MET HE% A 46 GLU HBy 1.0 1.8 4.15 1776 1489 A 47 ALA H A 46 GLU HGy 1.0 1.8 5.14 1777 1489 A 47 ALA H A 46 GLU HGx 1.0 1.8 5.14 1778 1490 A 46 GLU HGx A 49 LYS HD3 1.0 1.8 5.30 1779 1490 A 46 GLU HGy A 49 LYS HD3 1.0 1.8 5.30 1780 1490 A 49 LYS HD2 A 46 GLU HGy 1.0 1.8 5.30 1781 1490 A 46 GLU HGx A 49 LYS HD2 1.0 1.8 5.30 1782 1491 A 46 GLU HGy A 50 MET HGx 1.0 1.8 5.16 1783 1491 A 46 GLU HGx A 50 MET HGx 1.0 1.8 5.16 1784 1491 A 50 MET HGy A 46 GLU HGy 1.0 1.8 5.16 1785 1491 A 50 MET HGy A 46 GLU HGx 1.0 1.8 5.16 1786 1492 A 50 MET HE% A 46 GLU HGy 1.0 1.8 4.46 1787 1492 A 50 MET HE% A 46 GLU HGx 1.0 1.8 4.46 1788 1493 A 47 ALA HA A 50 MET HBy 1.0 1.8 4.35 1789 1493 A 47 ALA HA A 50 MET HBx 1.0 1.8 4.35 1790 1494 A 47 ALA HB% A 48 GLU HGy 1.0 1.8 6.19 1791 1494 A 47 ALA HB% A 48 GLU HGx 1.0 1.8 6.19 1792 1495 A 47 ALA HB% A 65 LYS HE3 1.0 1.8 5.55 1793 1495 A 47 ALA HB% A 65 LYS HE2 1.0 1.8 5.55 1794 1496 A 48 GLU H A 48 GLU HGy 1.0 1.8 3.65 1795 1496 A 48 GLU H A 48 GLU HGx 1.0 1.8 3.65 1796 1497 A 48 GLU H A 49 LYS HGx 1.0 1.8 5.44 1797 1497 A 48 GLU H A 49 LYS HGy 1.0 1.8 5.44 1798 1498 A 48 GLU HA A 48 GLU HGy 1.0 1.8 4.14 1799 1498 A 48 GLU HA A 48 GLU HGx 1.0 1.8 4.14 1800 1499 A 49 LYS H A 48 GLU HGy 1.0 1.8 5.38 1801 1499 A 49 LYS H A 48 GLU HGx 1.0 1.8 5.38 1802 1500 A 48 GLU HGy A 65 LYS HE3 1.0 1.8 6.41 1803 1500 A 48 GLU HGx A 65 LYS HE3 1.0 1.8 6.41 1804 1500 A 65 LYS HE2 A 48 GLU HGy 1.0 1.8 6.41 1805 1500 A 65 LYS HE2 A 48 GLU HGx 1.0 1.8 6.41 1806 1501 A 49 LYS H A 49 LYS HGx 1.0 1.8 3.67 1807 1501 A 49 LYS H A 49 LYS HGy 1.0 1.8 3.67 1808 1502 A 49 LYS H A 49 LYS HD3 1.0 1.8 4.83 1809 1502 A 49 LYS H A 49 LYS HD2 1.0 1.8 4.83 1810 1503 A 49 LYS HA A 49 LYS HGx 1.0 1.8 3.57 1811 1503 A 49 LYS HA A 49 LYS HGy 1.0 1.8 3.57 1812 1504 A 49 LYS HA A 49 LYS HEy 1.0 1.8 6.68 1813 1504 A 49 LYS HA A 49 LYS HEx 1.0 1.8 6.68 1814 1505 A 49 LYS HB2 A 49 LYS HD3 1.0 1.8 4.04 1815 1505 A 49 LYS HB2 A 49 LYS HD2 1.0 1.8 4.04 1816 1506 A 49 LYS HB3 A 49 LYS HEy 1.0 1.8 5.49 1817 1506 A 49 LYS HB3 A 49 LYS HEx 1.0 1.8 5.49 1818 1507 A 50 MET H A 49 LYS HGx 1.0 1.8 5.53 1819 1507 A 50 MET H A 49 LYS HGy 1.0 1.8 5.53 1820 1508 A 50 MET H A 49 LYS HD3 1.0 1.8 6.12 1821 1508 A 50 MET H A 49 LYS HD2 1.0 1.8 6.12 1822 1509 A 50 MET H A 50 MET HBy 1.0 1.8 3.69 1823 1509 A 50 MET H A 50 MET HBx 1.0 1.8 3.69 1824 1510 A 50 MET H A 50 MET HGx 1.0 1.8 4.17 1825 1510 A 50 MET H A 50 MET HGy 1.0 1.8 4.17 1826 1511 A 50 MET HE% A 50 MET HBy 1.0 1.8 5.44 1827 1511 A 50 MET HE% A 50 MET HBx 1.0 1.8 5.44 1828 1512 A 51 GLU H A 50 MET HBy 1.0 1.8 3.83 1829 1512 A 51 GLU H A 50 MET HBx 1.0 1.8 3.83 1830 1513 A 51 GLU HA A 50 MET HBy 1.0 1.8 5.74 1831 1513 A 51 GLU HA A 50 MET HBx 1.0 1.8 5.74 1832 1514 A 51 GLU HBx A 50 MET HBy 1.0 1.8 5.05 1833 1514 A 51 GLU HBx A 50 MET HBx 1.0 1.8 5.05 1834 1515 A 51 GLU HGy A 50 MET HBy 1.0 1.8 5.95 1835 1515 A 51 GLU HGy A 50 MET HBx 1.0 1.8 5.95 1836 1516 A 54 VAL HGy% A 50 MET HBy 1.0 1.8 5.59 1837 1516 A 54 VAL HGy% A 50 MET HBx 1.0 1.8 5.59 1838 1517 A 51 GLU H A 50 MET HGx 1.0 1.8 6.03 1839 1517 A 51 GLU H A 50 MET HGy 1.0 1.8 6.03 1840 1518 A 53 ALA HB% A 50 MET HGx 1.0 1.8 6.06 1841 1518 A 53 ALA HB% A 50 MET HGy 1.0 1.8 6.06 1842 1519 A 51 GLU HGy A 52 LYS HGx 1.0 1.8 6.68 1843 1519 A 51 GLU HGy A 52 LYS HGy 1.0 1.8 6.68 1844 1520 A 51 GLU HGx A 52 LYS HGx 1.0 1.8 6.68 1845 1520 A 51 GLU HGx A 52 LYS HGy 1.0 1.8 6.68 1846 1521 A 52 LYS HA A 52 LYS HGx 1.0 1.8 4.06 1847 1521 A 52 LYS HA A 52 LYS HGy 1.0 1.8 4.06 1848 1522 A 52 LYS HA A 52 LYS HD3 1.0 1.8 5.80 1849 1522 A 52 LYS HA A 52 LYS HD2 1.0 1.8 5.80 1850 1523 A 52 LYS HA A 52 LYS HE3 1.0 1.8 6.07 1851 1523 A 52 LYS HA A 52 LYS HE2 1.0 1.8 6.07 1852 1524 A 52 LYS HA A 55 LYS HEx 1.0 1.8 6.68 1853 1524 A 52 LYS HA A 55 LYS HEy 1.0 1.8 6.68 1854 1525 A 52 LYS HBy A 52 LYS HD3 1.0 1.8 4.19 1855 1525 A 52 LYS HBy A 52 LYS HD2 1.0 1.8 4.19 1856 1526 A 52 LYS HBy A 52 LYS HE3 1.0 1.8 6.43 1857 1526 A 52 LYS HBy A 52 LYS HE2 1.0 1.8 6.43 1858 1527 A 52 LYS HBx A 52 LYS HD3 1.0 1.8 4.21 1859 1527 A 52 LYS HBx A 52 LYS HD2 1.0 1.8 4.21 1860 1528 A 52 LYS HBx A 52 LYS HE3 1.0 1.8 5.96 1861 1528 A 52 LYS HBx A 52 LYS HE2 1.0 1.8 5.96 1862 1529 A 53 ALA H A 52 LYS HGx 1.0 1.8 5.27 1863 1529 A 53 ALA H A 52 LYS HGy 1.0 1.8 5.27 1864 1530 A 53 ALA H A 52 LYS HD3 1.0 1.8 6.68 1865 1530 A 53 ALA H A 52 LYS HD2 1.0 1.8 6.68 1866 1531 A 53 ALA HA A 56 LYS HBy 1.0 1.8 4.57 1867 1531 A 53 ALA HA A 56 LYS HBx 1.0 1.8 4.57 1868 1532 A 53 ALA HA A 56 LYS HGx 1.0 1.8 5.32 1869 1532 A 53 ALA HA A 56 LYS HGy 1.0 1.8 5.32 1870 1533 A 53 ALA HB% A 56 LYS HGx 1.0 1.8 4.91 1871 1533 A 53 ALA HB% A 56 LYS HGy 1.0 1.8 4.91 1872 1534 A 54 VAL HGx% A 58 LYS HDx 1.0 1.8 4.80 1873 1534 A 54 VAL HGx% A 58 LYS HDy 1.0 1.8 4.80 1874 1535 A 55 LYS H A 56 LYS HBy 1.0 1.8 5.85 1875 1535 A 55 LYS H A 56 LYS HBx 1.0 1.8 5.85 1876 1536 A 55 LYS HA A 55 LYS HEx 1.0 1.8 5.51 1877 1536 A 55 LYS HA A 55 LYS HEy 1.0 1.8 5.51 1878 1537 A 55 LYS HBy A 55 LYS HEx 1.0 1.8 5.14 1879 1537 A 55 LYS HBy A 55 LYS HEy 1.0 1.8 5.14 1880 1538 A 55 LYS HGx A 55 LYS HEx 1.0 1.8 3.85 1881 1538 A 55 LYS HGx A 55 LYS HEy 1.0 1.8 3.85 1882 1539 A 63 ILE HD1% A 55 LYS HEx 1.0 1.8 4.51 1883 1539 A 63 ILE HD1% A 55 LYS HEy 1.0 1.8 4.51 1884 1540 A 56 LYS H A 56 LYS HBy 1.0 1.8 3.43 1885 1540 A 56 LYS H A 56 LYS HBx 1.0 1.8 3.43 1886 1541 A 56 LYS H A 56 LYS HGx 1.0 1.8 4.37 1887 1541 A 56 LYS H A 56 LYS HGy 1.0 1.8 4.37 1888 1542 A 56 LYS HA A 56 LYS HGx 1.0 1.8 4.08 1889 1542 A 56 LYS HA A 56 LYS HGy 1.0 1.8 4.08 1890 1543 A 56 LYS HA A 56 LYS HDy 1.0 1.8 4.50 1891 1543 A 56 LYS HA A 56 LYS HDx 1.0 1.8 4.50 1892 1544 A 56 LYS HA A 56 LYS HEx 1.0 1.8 5.93 1893 1544 A 56 LYS HA A 56 LYS HEy 1.0 1.8 5.93 1894 1545 A 56 LYS HBx A 56 LYS HDy 1.0 1.8 3.55 1895 1545 A 56 LYS HBy A 56 LYS HDy 1.0 1.8 3.55 1896 1545 A 56 LYS HDx A 56 LYS HBy 1.0 1.8 3.55 1897 1545 A 56 LYS HBx A 56 LYS HDx 1.0 1.8 3.55 1898 1546 A 56 LYS HBx A 56 LYS HEx 1.0 1.8 5.58 1899 1546 A 56 LYS HBy A 56 LYS HEx 1.0 1.8 5.58 1900 1546 A 56 LYS HEy A 56 LYS HBy 1.0 1.8 5.58 1901 1546 A 56 LYS HBx A 56 LYS HEy 1.0 1.8 5.58 1902 1547 A 57 VAL H A 56 LYS HBy 1.0 1.8 4.05 1903 1547 A 57 VAL H A 56 LYS HBx 1.0 1.8 4.05 1904 1548 A 57 VAL HGy% A 56 LYS HBy 1.0 1.8 5.21 1905 1548 A 57 VAL HGy% A 56 LYS HBx 1.0 1.8 5.21 1906 1549 A 58 LYS H A 56 LYS HBy 1.0 1.8 5.55 1907 1549 A 58 LYS H A 56 LYS HBx 1.0 1.8 5.55 1908 1550 A 57 VAL H A 56 LYS HGx 1.0 1.8 5.54 1909 1550 A 57 VAL H A 56 LYS HGy 1.0 1.8 5.54 1910 1551 A 57 VAL HB A 58 LYS HDx 1.0 1.8 6.68 1911 1551 A 57 VAL HB A 58 LYS HDy 1.0 1.8 6.68 1912 1552 A 57 VAL HGx% A 58 LYS HDx 1.0 1.8 6.11 1913 1552 A 57 VAL HGx% A 58 LYS HDy 1.0 1.8 6.11 1914 1553 A 58 LYS H A 58 LYS HDx 1.0 1.8 5.05 1915 1553 A 58 LYS H A 58 LYS HDy 1.0 1.8 5.05 1916 1554 A 58 LYS HA A 58 LYS HDx 1.0 1.8 5.70 1917 1554 A 58 LYS HA A 58 LYS HDy 1.0 1.8 5.70 1918 1555 A 58 LYS HA A 59 PRO HG2 1.0 1.8 5.46 1919 1555 A 58 LYS HA A 59 PRO HG3 1.0 1.8 5.46 1920 1556 A 58 LYS HBy A 58 LYS HDx 1.0 1.8 3.86 1921 1556 A 58 LYS HBy A 58 LYS HDy 1.0 1.8 3.86 1922 1557 A 58 LYS HBy A 58 LYS HEx 1.0 1.8 5.14 1923 1557 A 58 LYS HBy A 58 LYS HEy 1.0 1.8 5.14 1924 1558 A 58 LYS HBx A 58 LYS HDx 1.0 1.8 3.48 1925 1558 A 58 LYS HBx A 58 LYS HDy 1.0 1.8 3.48 1926 1559 A 58 LYS HBx A 58 LYS HEx 1.0 1.8 5.00 1927 1559 A 58 LYS HBx A 58 LYS HEy 1.0 1.8 5.00 1928 1560 A 61 ALA HA A 58 LYS HDx 1.0 1.8 6.68 1929 1560 A 61 ALA HA A 58 LYS HDy 1.0 1.8 6.68 1930 1561 A 61 ALA HB% A 58 LYS HDx 1.0 1.8 4.73 1931 1561 A 61 ALA HB% A 58 LYS HDy 1.0 1.8 4.73 1932 1562 A 61 ALA H A 58 LYS HEx 1.0 1.8 6.11 1933 1562 A 61 ALA H A 58 LYS HEy 1.0 1.8 6.11 1934 1563 A 61 ALA HA A 58 LYS HEx 1.0 1.8 4.32 1935 1563 A 61 ALA HA A 58 LYS HEy 1.0 1.8 4.32 1936 1564 A 61 ALA HB% A 58 LYS HEx 1.0 1.8 4.11 1937 1564 A 61 ALA HB% A 58 LYS HEy 1.0 1.8 4.11 1938 1565 A 60 ASN HA A 60 ASN HD2y 1.0 1.8 3.48 1939 1565 A 60 ASN HA A 60 ASN HD2x 1.0 1.8 3.48 1940 1566 A 62 THR HG2% A 64 ARG HGx 1.0 1.8 4.61 1941 1566 A 62 THR HG2% A 64 ARG HGy 1.0 1.8 4.61 1942 1567 A 62 THR HG2% A 64 ARG HDx 1.0 1.8 5.34 1943 1567 A 62 THR HG2% A 64 ARG HDy 1.0 1.8 5.34 1944 1568 A 63 ILE HG2% A 65 LYS HGx 1.0 1.8 5.34 1945 1568 A 63 ILE HG2% A 65 LYS HGy 1.0 1.8 5.34 1946 1569 A 63 ILE HG2% A 65 LYS HE3 1.0 1.8 5.49 1947 1569 A 63 ILE HG2% A 65 LYS HE2 1.0 1.8 5.49 1948 1570 A 64 ARG H A 64 ARG HBx 1.0 1.8 4.14 1949 1570 A 64 ARG H A 64 ARG HBy 1.0 1.8 4.14 1950 1571 A 64 ARG H A 64 ARG HGx 1.0 1.8 4.43 1951 1571 A 64 ARG H A 64 ARG HGy 1.0 1.8 4.43 1952 1572 A 64 ARG H A 64 ARG HDx 1.0 1.8 5.96 1953 1572 A 64 ARG H A 64 ARG HDy 1.0 1.8 5.96 1954 1573 A 64 ARG HA A 64 ARG HGx 1.0 1.8 4.27 1955 1573 A 64 ARG HGy A 64 ARG HA 1.0 1.8 4.27 1956 1574 A 64 ARG HA A 64 ARG HDx 1.0 1.8 5.32 1957 1574 A 64 ARG HDy A 64 ARG HA 1.0 1.8 5.32 1958 1575 A 64 ARG HBx A 64 ARG HDx 1.0 1.8 3.76 1959 1575 A 64 ARG HBy A 64 ARG HDx 1.0 1.8 3.76 1960 1575 A 64 ARG HDy A 64 ARG HBx 1.0 1.8 3.76 1961 1575 A 64 ARG HBy A 64 ARG HDy 1.0 1.8 3.76 1962 1576 A 65 LYS H A 65 LYS HDx 1.0 1.8 5.57 1963 1576 A 65 LYS H A 65 LYS HDy 1.0 1.8 5.57 1964 1577 A 65 LYS HA A 65 LYS HDx 1.0 1.8 5.29 1965 1577 A 65 LYS HA A 65 LYS HDy 1.0 1.8 5.29 1966 1578 A 65 LYS HBx A 65 LYS HDx 1.0 1.8 3.01 1967 1578 A 65 LYS HBx A 65 LYS HDy 1.0 1.8 3.01 1968 1579 A 65 LYS HBx A 65 LYS HE3 1.0 1.8 5.36 1969 1579 A 65 LYS HBx A 65 LYS HE2 1.0 1.8 5.36 1970 1580 A 65 LYS HBy A 65 LYS HDx 1.0 1.8 3.65 1971 1580 A 65 LYS HBy A 65 LYS HDy 1.0 1.8 3.65 1972 1581 A 65 LYS HBy A 65 LYS HE3 1.0 1.8 5.23 1973 1581 A 65 LYS HBy A 65 LYS HE2 1.0 1.8 5.23 1974 1582 A 65 LYS HE2 A 65 LYS HGx 1.0 1.8 3.84 1975 1582 A 65 LYS HE3 A 65 LYS HGx 1.0 1.8 3.84 1976 1582 A 65 LYS HGy A 65 LYS HE3 1.0 1.8 3.84 1977 1582 A 65 LYS HGy A 65 LYS HE2 1.0 1.8 3.84 1978 1583 A 70 LEU HA A 70 LEU HDy% 1.0 1.8 3.90 1979 1583 A 70 LEU HA A 70 LEU HDx% 1.0 1.8 3.90 1980 1584 A 70 LEU HG A 70 LEU HBx 1.0 1.8 2.90 1981 1584 A 70 LEU HG A 70 LEU HBy 1.0 1.8 2.90 1982 1585 A 71 GLU H A 70 LEU HDy% 1.0 1.8 5.92 1983 1585 A 71 GLU H A 70 LEU HDx% 1.0 1.8 5.92 1984 1586 A 71 GLU H A 71 GLU HBy 1.0 1.8 4.13 1985 1586 A 71 GLU H A 71 GLU HBx 1.0 1.8 4.13 1986 1587 A 71 GLU H A 71 GLU HGx 1.0 1.8 4.80 1987 1587 A 71 GLU H A 71 GLU HGy 1.0 1.8 4.80 1988 1588 A 19 ARG H A 15 GLU O 1.0 1.8 2.18 1989 1589 A 15 GLU O A 19 ARG N 1.0 2.7 3.28 1990 1590 A 21 ILE H A 17 ILE O 1.0 1.8 2.18 1991 1591 A 17 ILE O A 21 ILE N 1.0 2.7 3.28 1992 1592 A 22 ARG H A 18 ILE O 1.0 1.8 2.18 1993 1593 A 18 ILE O A 22 ARG N 1.0 2.7 3.28 1994 1594 A 25 TRP H A 21 ILE O 1.0 1.8 2.18 1995 1595 A 21 ILE O A 25 TRP N 1.0 2.7 3.28 1996 1596 A 50 MET H A 46 GLU O 1.0 1.8 2.18 1997 1597 A 46 GLU O A 50 MET N 1.0 2.7 3.28 1998 1598 A 51 GLU H A 47 ALA O 1.0 1.8 2.18 1999 1599 A 47 ALA O A 51 GLU N 1.0 2.7 3.28 2000 1600 A 53 ALA H A 49 LYS O 1.0 1.8 2.18 2001 1601 A 49 LYS O A 53 ALA N 1.0 2.7 3.28 stop_ save_ save_CNS/XPLOR_dihedral_3 _nef_dihedral_restraint_list.sf_category nef_dihedral_restraint_list _nef_dihedral_restraint_list.sf_framecode CNS/XPLOR_dihedral_3 _nef_dihedral_restraint_list.potential_type square-well-parabolic _nef_dihedral_restraint_list.restraint_origin . loop_ _nef_dihedral_restraint.index _nef_dihedral_restraint.restraint_id _nef_dihedral_restraint.chain_code_1 _nef_dihedral_restraint.sequence_code_1 _nef_dihedral_restraint.residue_name_1 _nef_dihedral_restraint.atom_name_1 _nef_dihedral_restraint.chain_code_2 _nef_dihedral_restraint.sequence_code_2 _nef_dihedral_restraint.residue_name_2 _nef_dihedral_restraint.atom_name_2 _nef_dihedral_restraint.chain_code_3 _nef_dihedral_restraint.sequence_code_3 _nef_dihedral_restraint.residue_name_3 _nef_dihedral_restraint.atom_name_3 _nef_dihedral_restraint.chain_code_4 _nef_dihedral_restraint.sequence_code_4 _nef_dihedral_restraint.residue_name_4 _nef_dihedral_restraint.atom_name_4 _nef_dihedral_restraint.weight _nef_dihedral_restraint.lower_limit _nef_dihedral_restraint.upper_limit _nef_dihedral_restraint.name 1 1 A 1 MET C A 2 VAL N A 2 VAL CA A 2 VAL C 1.0 -116.2 -54.3 PHI 2 2 A 2 VAL N A 2 VAL CA A 2 VAL C A 3 ASP N 1.0 111.9 151.9 PSI 3 3 A 2 VAL C A 3 ASP N A 3 ASP CA A 3 ASP C 1.0 -109.2 -69.2 PHI 4 4 A 3 ASP N A 3 ASP CA A 3 ASP C A 4 LEU N 1.0 105.0 145.0 PSI 5 5 A 3 ASP C A 4 LEU N A 4 LEU CA A 4 LEU C 1.0 -136.0 -96.0 PHI 6 6 A 4 LEU N A 4 LEU CA A 4 LEU C A 5 LYS N 1.0 113.2 153.2 PSI 7 7 A 4 LEU C A 5 LYS N A 5 LYS CA A 5 LYS C 1.0 -136.3 -88.3 PHI 8 8 A 5 LYS N A 5 LYS CA A 5 LYS C A 6 ILE N 1.0 108.1 148.1 PSI 9 9 A 5 LYS C A 6 ILE N A 6 ILE CA A 6 ILE C 1.0 -142.3 -102.3 PHI 10 10 A 6 ILE N A 6 ILE CA A 6 ILE C A 7 ASP N 1.0 107.8 147.8 PSI 11 11 A 6 ILE C A 7 ASP N A 7 ASP CA A 7 ASP C 1.0 -98.6 -58.6 PHI 12 12 A 7 ASP N A 7 ASP CA A 7 ASP C A 8 VAL N 1.0 109.3 149.3 PSI 13 13 A 7 ASP C A 8 VAL N A 8 VAL CA A 8 VAL C 1.0 -145.8 -105.8 PHI 14 14 A 8 VAL N A 8 VAL CA A 8 VAL C A 9 SER N 1.0 125.1 173.2 PSI 15 15 A 8 VAL C A 9 SER N A 9 SER CA A 9 SER C 1.0 -110.9 -49.4 PHI 16 16 A 9 SER N A 9 SER CA A 9 SER C A 10 ASP N 1.0 -68.2 12.5 PSI 17 17 A 9 SER C A 10 ASP N A 10 ASP CA A 10 ASP C 1.0 -202.6 -68.2 PHI 18 18 A 10 ASP N A 10 ASP CA A 10 ASP C A 11 ASP N 1.0 84.0 203.1 PSI 19 19 A 10 ASP C A 11 ASP N A 11 ASP CA A 11 ASP C 1.0 -84.0 -44.0 PHI 20 20 A 11 ASP N A 11 ASP CA A 11 ASP C A 12 GLU N 1.0 -57.6 -17.6 PSI 21 21 A 11 ASP C A 12 GLU N A 12 GLU CA A 12 GLU C 1.0 -83.8 -43.8 PHI 22 22 A 12 GLU N A 12 GLU CA A 12 GLU C A 13 GLU N 1.0 -58.8 -18.8 PSI 23 23 A 12 GLU C A 13 GLU N A 13 GLU CA A 13 GLU C 1.0 -86.8 -46.8 PHI 24 24 A 13 GLU N A 13 GLU CA A 13 GLU C A 14 ALA N 1.0 -61.5 -21.5 PSI 25 25 A 13 GLU C A 14 ALA N A 14 ALA CA A 14 ALA C 1.0 -84.2 -44.2 PHI 26 26 A 14 ALA N A 14 ALA CA A 14 ALA C A 15 GLU N 1.0 -61.3 -21.3 PSI 27 27 A 14 ALA C A 15 GLU N A 15 GLU CA A 15 GLU C 1.0 -84.7 -44.7 PHI 28 28 A 15 GLU N A 15 GLU CA A 15 GLU C A 16 LYS N 1.0 -58.4 -18.4 PSI 29 29 A 15 GLU C A 16 LYS N A 16 LYS CA A 16 LYS C 1.0 -85.3 -45.3 PHI 30 30 A 16 LYS N A 16 LYS CA A 16 LYS C A 17 ILE N 1.0 -62.6 -22.6 PSI 31 31 A 16 LYS C A 17 ILE N A 17 ILE CA A 17 ILE C 1.0 -84.5 -44.5 PHI 32 32 A 17 ILE N A 17 ILE CA A 17 ILE C A 18 ILE N 1.0 -64.9 -24.9 PSI 33 33 A 17 ILE C A 18 ILE N A 18 ILE CA A 18 ILE C 1.0 -81.6 -41.6 PHI 34 34 A 18 ILE N A 18 ILE CA A 18 ILE C A 19 ARG N 1.0 -63.1 -23.1 PSI 35 35 A 18 ILE C A 19 ARG N A 19 ARG CA A 19 ARG C 1.0 -84.0 -44.0 PHI 36 36 A 19 ARG N A 19 ARG CA A 19 ARG C A 20 GLU N 1.0 -59.9 -19.9 PSI 37 37 A 19 ARG C A 20 GLU N A 20 GLU CA A 20 GLU C 1.0 -86.5 -46.5 PHI 38 38 A 20 GLU N A 20 GLU CA A 20 GLU C A 21 ILE N 1.0 -60.0 -20.0 PSI 39 39 A 20 GLU C A 21 ILE N A 21 ILE CA A 21 ILE C 1.0 -89.2 -49.2 PHI 40 40 A 21 ILE N A 21 ILE CA A 21 ILE C A 22 ARG N 1.0 -57.1 -17.1 PSI 41 41 A 21 ILE C A 22 ARG N A 22 ARG CA A 22 ARG C 1.0 -85.0 -45.0 PHI 42 42 A 22 ARG N A 22 ARG CA A 22 ARG C A 23 GLU N 1.0 -56.1 -16.1 PSI 43 43 A 22 ARG C A 23 GLU N A 23 GLU CA A 23 GLU C 1.0 -87.6 -47.6 PHI 44 44 A 23 GLU N A 23 GLU CA A 23 GLU C A 24 GLN N 1.0 -56.8 -16.8 PSI 45 45 A 23 GLU C A 24 GLN N A 24 GLN CA A 24 GLN C 1.0 -95.9 -52.1 PHI 46 46 A 24 GLN N A 24 GLN CA A 24 GLN C A 25 TRP N 1.0 -57.0 -11.7 PSI 47 47 A 26 PRO N A 26 PRO CA A 26 PRO C A 27 LYS N 1.0 -42.6 -2.6 PSI 48 48 A 26 PRO C A 27 LYS N A 27 LYS CA A 27 LYS C 1.0 -119.0 -78.5 PHI 49 49 A 27 LYS N A 27 LYS CA A 27 LYS C A 28 ALA N 1.0 -18.1 21.9 PSI 50 50 A 27 LYS C A 28 ALA N A 28 ALA CA A 28 ALA C 1.0 -102.0 -45.6 PHI 51 51 A 28 ALA N A 28 ALA CA A 28 ALA C A 29 THR N 1.0 112.6 152.6 PSI 52 52 A 28 ALA C A 29 THR N A 29 THR CA A 29 THR C 1.0 -100.0 -60.0 PHI 53 53 A 29 THR N A 29 THR CA A 29 THR C A 30 VAL N 1.0 106.3 146.3 PSI 54 54 A 29 THR C A 30 VAL N A 30 VAL CA A 30 VAL C 1.0 -134.2 -94.2 PHI 55 55 A 30 VAL N A 30 VAL CA A 30 VAL C A 31 THR N 1.0 107.1 147.1 PSI 56 56 A 30 VAL C A 31 THR N A 31 THR CA A 31 THR C 1.0 -138.0 -97.5 PHI 57 57 A 31 THR N A 31 THR CA A 31 THR C A 32 ARG N 1.0 106.6 148.0 PSI 58 58 A 31 THR C A 32 ARG N A 32 ARG CA A 32 ARG C 1.0 -126.2 -80.4 PHI 59 59 A 32 ARG N A 32 ARG CA A 32 ARG C A 33 THR N 1.0 104.2 144.2 PSI 60 60 A 32 ARG C A 33 THR N A 33 THR CA A 33 THR C 1.0 -132.7 -79.2 PHI 61 61 A 33 THR N A 33 THR CA A 33 THR C A 34 ASN N 1.0 100.2 150.0 PSI 62 62 A 33 THR C A 34 ASN N A 34 ASN CA A 34 ASN C 1.0 -153.3 -45.0 PHI 63 63 A 34 ASN N A 34 ASN CA A 34 ASN C A 35 GLY N 1.0 109.2 159.5 PSI 64 64 A 35 GLY C A 36 ASP N A 36 ASP CA A 36 ASP C 1.0 -142.2 -55.6 PHI 65 65 A 36 ASP N A 36 ASP CA A 36 ASP C A 37 ILE N 1.0 117.5 171.8 PSI 66 66 A 36 ASP C A 37 ILE N A 37 ILE CA A 37 ILE C 1.0 -140.9 -99.7 PHI 67 67 A 37 ILE N A 37 ILE CA A 37 ILE C A 38 LYS N 1.0 109.4 149.4 PSI 68 68 A 37 ILE C A 38 LYS N A 38 LYS CA A 38 LYS C 1.0 -128.0 -88.0 PHI 69 69 A 38 LYS N A 38 LYS CA A 38 LYS C A 39 LEU N 1.0 109.1 149.1 PSI 70 70 A 38 LYS C A 39 LEU N A 39 LEU CA A 39 LEU C 1.0 -140.2 -100.2 PHI 71 71 A 39 LEU N A 39 LEU CA A 39 LEU C A 40 ASP N 1.0 108.9 148.9 PSI 72 72 A 39 LEU C A 40 ASP N A 40 ASP CA A 40 ASP C 1.0 -127.5 -69.9 PHI 73 73 A 40 ASP N A 40 ASP CA A 40 ASP C A 41 ALA N 1.0 106.0 150.7 PSI 74 74 A 40 ASP C A 41 ALA N A 41 ALA CA A 41 ALA C 1.0 -149.7 -86.4 PHI 75 75 A 41 ALA N A 41 ALA CA A 41 ALA C A 42 GLN N 1.0 126.9 183.0 PSI 76 76 A 41 ALA C A 42 GLN N A 42 GLN CA A 42 GLN C 1.0 -89.3 -49.3 PHI 77 77 A 42 GLN N A 42 GLN CA A 42 GLN C A 43 THR N 1.0 -54.4 -12.6 PSI 78 78 A 42 GLN C A 43 THR N A 43 THR CA A 43 THR C 1.0 -155.4 -115.4 PHI 79 79 A 43 THR N A 43 THR CA A 43 THR C A 44 GLU N 1.0 140.7 180.7 PSI 80 80 A 44 GLU C A 45 LYS N A 45 LYS CA A 45 LYS C 1.0 -82.3 -42.3 PHI 81 81 A 45 LYS N A 45 LYS CA A 45 LYS C A 46 GLU N 1.0 -56.9 -16.9 PSI 82 82 A 45 LYS C A 46 GLU N A 46 GLU CA A 46 GLU C 1.0 -85.4 -45.4 PHI 83 83 A 46 GLU N A 46 GLU CA A 46 GLU C A 47 ALA N 1.0 -59.0 -19.0 PSI 84 84 A 46 GLU C A 47 ALA N A 47 ALA CA A 47 ALA C 1.0 -85.5 -45.5 PHI 85 85 A 47 ALA N A 47 ALA CA A 47 ALA C A 48 GLU N 1.0 -59.0 -19.0 PSI 86 86 A 47 ALA C A 48 GLU N A 48 GLU CA A 48 GLU C 1.0 -85.1 -45.1 PHI 87 87 A 48 GLU N A 48 GLU CA A 48 GLU C A 49 LYS N 1.0 -61.3 -21.3 PSI 88 88 A 48 GLU C A 49 LYS N A 49 LYS CA A 49 LYS C 1.0 -85.9 -45.9 PHI 89 89 A 49 LYS N A 49 LYS CA A 49 LYS C A 50 MET N 1.0 -63.3 -23.3 PSI 90 90 A 49 LYS C A 50 MET N A 50 MET CA A 50 MET C 1.0 -84.2 -44.2 PHI 91 91 A 50 MET N A 50 MET CA A 50 MET C A 51 GLU N 1.0 -63.6 -23.6 PSI 92 92 A 50 MET C A 51 GLU N A 51 GLU CA A 51 GLU C 1.0 -81.7 -41.7 PHI 93 93 A 51 GLU N A 51 GLU CA A 51 GLU C A 52 LYS N 1.0 -59.6 -19.6 PSI 94 94 A 51 GLU C A 52 LYS N A 52 LYS CA A 52 LYS C 1.0 -84.5 -44.5 PHI 95 95 A 52 LYS N A 52 LYS CA A 52 LYS C A 53 ALA N 1.0 -62.0 -22.0 PSI 96 96 A 52 LYS C A 53 ALA N A 53 ALA CA A 53 ALA C 1.0 -87.0 -47.0 PHI 97 97 A 53 ALA N A 53 ALA CA A 53 ALA C A 54 VAL N 1.0 -59.4 -19.4 PSI 98 98 A 53 ALA C A 54 VAL N A 54 VAL CA A 54 VAL C 1.0 -84.7 -44.7 PHI 99 99 A 54 VAL N A 54 VAL CA A 54 VAL C A 55 LYS N 1.0 -62.1 -22.1 PSI 100 100 A 54 VAL C A 55 LYS N A 55 LYS CA A 55 LYS C 1.0 -86.8 -46.8 PHI 101 101 A 55 LYS N A 55 LYS CA A 55 LYS C A 56 LYS N 1.0 -50.6 -10.6 PSI 102 102 A 55 LYS C A 56 LYS N A 56 LYS CA A 56 LYS C 1.0 -92.2 -52.2 PHI 103 103 A 56 LYS N A 56 LYS CA A 56 LYS C A 57 VAL N 1.0 -48.7 -8.7 PSI 104 104 A 57 VAL C A 58 LYS N A 58 LYS CA A 58 LYS C 1.0 -149.2 -25.8 PHI 105 105 A 58 LYS N A 58 LYS CA A 58 LYS C A 59 PRO N 1.0 101.6 184.1 PSI 106 106 A 59 PRO N A 59 PRO CA A 59 PRO C A 60 ASN N 1.0 -44.4 -4.4 PSI 107 107 A 59 PRO C A 60 ASN N A 60 ASN CA A 60 ASN C 1.0 -118.6 -78.6 PHI 108 108 A 60 ASN N A 60 ASN CA A 60 ASN C A 61 ALA N 1.0 -17.1 31.1 PSI 109 109 A 60 ASN C A 61 ALA N A 61 ALA CA A 61 ALA C 1.0 -87.0 -47.0 PHI 110 110 A 61 ALA N A 61 ALA CA A 61 ALA C A 62 THR N 1.0 116.8 156.8 PSI 111 111 A 61 ALA C A 62 THR N A 62 THR CA A 62 THR C 1.0 -107.9 -66.7 PHI 112 112 A 62 THR N A 62 THR CA A 62 THR C A 63 ILE N 1.0 104.0 144.0 PSI 113 113 A 62 THR C A 63 ILE N A 63 ILE CA A 63 ILE C 1.0 -123.0 -83.0 PHI 114 114 A 63 ILE N A 63 ILE CA A 63 ILE C A 64 ARG N 1.0 103.7 143.7 PSI 115 115 A 63 ILE C A 64 ARG N A 64 ARG CA A 64 ARG C 1.0 -123.1 -65.9 PHI 116 116 A 64 ARG N A 64 ARG CA A 64 ARG C A 65 LYS N 1.0 103.5 143.5 PSI 117 117 A 64 ARG C A 65 LYS N A 65 LYS CA A 65 LYS C 1.0 -123.4 -83.4 PHI 118 118 A 65 LYS N A 65 LYS CA A 65 LYS C A 66 THR N 1.0 107.6 149.3 PSI 119 119 A 65 LYS C A 66 THR N A 66 THR CA A 66 THR C 1.0 -157.1 -61.4 PHI 120 120 A 66 THR N A 66 THR CA A 66 THR C A 67 GLY N 1.0 124.7 190.8 PSI stop_ save_ save_spectral_peak_list_1 _nef_nmr_spectrum.sf_category nef_nmr_spectrum _nef_nmr_spectrum.sf_framecode spectral_peak_list_1 _nef_nmr_spectrum.num_dimensions 3 loop_ _nef_spectrum_dimension.dimension_id _nef_spectrum_dimension.axis_unit _nef_spectrum_dimension.axis_code _nef_spectrum_dimension.spectral_width _nef_spectrum_dimension.folding 1 ppm 15N 31 . stop_ save_ save_spectral_peak_list_2 _nef_nmr_spectrum.sf_category nef_nmr_spectrum _nef_nmr_spectrum.sf_framecode spectral_peak_list_2 _nef_nmr_spectrum.num_dimensions 3 loop_ _nef_spectrum_dimension.dimension_id _nef_spectrum_dimension.axis_unit _nef_spectrum_dimension.axis_code _nef_spectrum_dimension.spectral_width _nef_spectrum_dimension.folding 1 ppm 13C 70 . stop_ save_