data_nef_c17634_2lcv save_entry_information _nef_nmr_meta_data.sf_category nef_nmr_meta_data _nef_nmr_meta_data.sf_framecode entry_information _nef_nmr_meta_data.format_name nmr_exchange_format _nef_nmr_meta_data.format_version 1.1 loop_ _nef_related_entries.database_name _nef_related_entries.database_accession_code BMRB 17419 PDB 2L8N 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 LYS middle . . 3 A 3 ALA middle . . 4 A 4 LYS middle . . 5 A 5 LYS middle . . 6 A 6 GLN middle . . 7 A 7 GLU middle . . 8 A 8 THR middle . . 9 A 9 ALA middle . . 10 A 10 ALA middle . . 11 A 11 THR middle . . 12 A 12 MET middle . . 13 A 13 LYS middle . . 14 A 14 ASP middle . . 15 A 15 VAL middle . . 16 A 16 ALA middle . . 17 A 17 LEU middle . . 18 A 18 LYS middle . . 19 A 19 ALA middle . . 20 A 20 LYS middle . . 21 A 21 VAL middle . . 22 A 22 SER middle . . 23 A 23 THR middle . . 24 A 24 ALA middle . . 25 A 25 THR middle . . 26 A 26 VAL middle . . 27 A 27 SER middle . . 28 A 28 ARG middle . . 29 A 29 ALA middle . . 30 A 30 LEU middle . . 31 A 31 MET middle . . 32 A 32 ASN middle . . 33 A 33 PRO middle . false 34 A 34 ASP middle . . 35 A 35 LYS middle . . 36 A 36 VAL middle . . 37 A 37 SER middle . . 38 A 38 GLN middle . . 39 A 39 ALA middle . . 40 A 40 THR middle . . 41 A 41 ARG middle . . 42 A 42 ASN middle . . 43 A 43 ARG middle . . 44 A 44 VAL middle . . 45 A 45 GLU middle . . 46 A 46 LYS middle . . 47 A 47 ALA middle . . 48 A 48 ALA middle . . 49 A 49 ARG middle . . 50 A 50 GLU middle . . 51 A 51 VAL middle . . 52 A 52 GLY middle . false 53 A 53 TYR middle . . 54 A 54 LEU middle . . 55 A 55 PRO middle . false 56 A 56 GLN middle . . 57 A 57 PRO middle . false 58 A 58 MET middle . . 59 A 59 GLY middle . false 60 A 60 ARG middle . . 61 A 61 ASN middle . . 62 A 62 VAL middle . . 63 A 63 LYS middle . . 64 A 64 ARG middle . . 65 A 65 ASN middle . . 66 A 66 GLU middle . . 67 A 67 SER 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 LYS CA C 13 56.4808 . A 2 LYS CB C 13 33.2612 . A 3 ALA H H 1 8.3759 . A 3 ALA HA H 1 4.3780 . A 3 ALA HB% H 1 1.4162 . A 3 ALA CA C 13 52.3460 . A 3 ALA CB C 13 19.6097 . A 3 ALA N N 15 126.1333 . A 4 LYS H H 1 8.2816 . A 4 LYS CA C 13 56.2606 . A 4 LYS CB C 13 33.3463 . A 4 LYS N N 15 121.3200 . A 5 LYS H H 1 8.3559 . A 5 LYS CA C 13 56.4255 . A 5 LYS CB C 13 33.2387 . A 5 LYS N N 15 123.2627 . A 6 GLN H H 1 8.4244 . A 6 GLN HA H 1 4.3464 . A 6 GLN HBx H 1 2.0634 . A 6 GLN HBy H 1 2.1344 . A 6 GLN HGx H 1 2.4230 . A 6 GLN HGy H 1 2.4230 . A 6 GLN CA C 13 56.0064 . A 6 GLN CB C 13 29.7147 . A 6 GLN CG C 13 33.7464 . A 6 GLN N N 15 122.0811 . A 7 GLU H H 1 8.5469 . A 7 GLU HA H 1 4.4033 . A 7 GLU HBx H 1 2.0076 . A 7 GLU HBy H 1 2.1444 . A 7 GLU HGx H 1 2.3270 . A 7 GLU HGy H 1 2.3270 . A 7 GLU CA C 13 56.8527 . A 7 GLU CB C 13 30.4222 . A 7 GLU CG C 13 36.3866 . A 7 GLU N N 15 122.5524 . A 8 THR H H 1 8.0900 . A 8 THR HA H 1 4.4082 . A 8 THR HB H 1 4.2943 . A 8 THR HG2% H 1 1.2598 . A 8 THR CA C 13 61.3682 . A 8 THR CB C 13 70.2225 . A 8 THR CG2 C 13 21.7074 . A 8 THR N N 15 114.8640 . A 9 ALA H H 1 8.3167 . A 9 ALA HA H 1 4.4488 . A 9 ALA HB% H 1 1.4863 . A 9 ALA CA C 13 52.3081 . A 9 ALA CB C 13 19.8345 . A 9 ALA N N 15 126.8345 . A 10 ALA H H 1 8.2520 . A 10 ALA HA H 1 4.7033 . A 10 ALA HB% H 1 1.4895 . A 10 ALA CA C 13 52.1822 . A 10 ALA CB C 13 20.2123 . A 10 ALA N N 15 123.1169 . A 11 THR H H 1 9.1673 . A 11 THR HA H 1 4.9864 . A 11 THR HB H 1 4.7002 . A 11 THR HG2% H 1 1.5044 . A 11 THR CA C 13 60.1933 . A 11 THR CB C 13 72.5288 . A 11 THR CG2 C 13 21.5880 . A 11 THR N N 15 111.9912 . A 12 MET H H 1 9.9749 . A 12 MET HA H 1 4.9865 . A 12 MET CA C 13 61.5527 . A 12 MET CB C 13 31.4117 . A 12 MET N N 15 120.4865 . A 13 LYS H H 1 8.2488 . A 13 LYS HA H 1 4.0142 . A 13 LYS HBx H 1 1.8558 . A 13 LYS HBy H 1 1.8878 . A 13 LYS HEx H 1 2.6871 . A 13 LYS HEy H 1 2.6871 . A 13 LYS HGx H 1 1.1482 . A 13 LYS HGy H 1 1.1482 . A 13 LYS CA C 13 59.5029 . A 13 LYS CB C 13 31.7587 . A 13 LYS N N 15 120.5217 . A 14 ASP H H 1 7.4681 . A 14 ASP HA H 1 4.4364 . A 14 ASP HBx H 1 2.6989 . A 14 ASP HBy H 1 3.1303 . A 14 ASP CA C 13 57.9174 . A 14 ASP CB C 13 41.3124 . A 14 ASP N N 15 119.0483 . A 15 VAL H H 1 7.3484 . A 15 VAL HA H 1 3.2829 . A 15 VAL HB H 1 2.2218 . A 15 VAL HGx% H 1 0.7830 . A 15 VAL HGy% H 1 0.8130 . A 15 VAL CA C 13 66.1897 . A 15 VAL CB C 13 31.1959 . A 15 VAL CGx C 13 22.7154 . A 15 VAL CGy C 13 23.7436 . A 15 VAL N N 15 119.2148 . A 16 ALA H H 1 8.6131 . A 16 ALA HA H 1 3.5221 . A 16 ALA HB% H 1 1.5182 . A 16 ALA CA C 13 55.7216 . A 16 ALA CB C 13 18.1930 . A 16 ALA N N 15 123.5193 . A 17 LEU H H 1 7.9833 . A 17 LEU HA H 1 4.2291 . A 17 LEU HBx H 1 1.6630 . A 17 LEU HBy H 1 1.8808 . A 17 LEU HDx% H 1 0.9866 . A 17 LEU HDy% H 1 1.0083 . A 17 LEU HG H 1 1.8715 . A 17 LEU CA C 13 57.6228 . A 17 LEU CB C 13 42.2250 . A 17 LEU CDx C 13 23.8155 . A 17 LEU CDy C 13 25.3061 . A 17 LEU CG C 13 27.4273 . A 17 LEU N N 15 116.8208 . A 18 LYS H H 1 7.2834 . A 18 LYS HA H 1 4.2306 . A 18 LYS HBx H 1 1.9166 . A 18 LYS HBy H 1 2.0605 . A 18 LYS HEx H 1 3.2992 . A 18 LYS HEy H 1 3.2992 . A 18 LYS HGx H 1 1.5718 . A 18 LYS HGy H 1 1.6655 . A 18 LYS CA C 13 57.7520 . A 18 LYS CB C 13 32.3708 . A 18 LYS CG C 13 24.6145 . A 18 LYS N N 15 118.7360 . A 19 ALA H H 1 8.4871 . A 19 ALA HA H 1 4.2516 . A 19 ALA HB% H 1 1.2955 . A 19 ALA CA C 13 52.3613 . A 19 ALA CB C 13 19.4631 . A 19 ALA N N 15 119.0152 . A 20 LYS H H 1 8.0822 . A 20 LYS HA H 1 4.0164 . A 20 LYS HBx H 1 1.9482 . A 20 LYS HBy H 1 2.1649 . A 20 LYS HDx H 1 1.7426 . A 20 LYS HDy H 1 1.7426 . A 20 LYS HEx H 1 3.0774 . A 20 LYS HEy H 1 3.0774 . A 20 LYS HGx H 1 1.4434 . A 20 LYS HGy H 1 1.4434 . A 20 LYS CA C 13 57.2426 . A 20 LYS CB C 13 28.9161 . A 20 LYS N N 15 116.3420 . A 21 VAL H H 1 7.8828 . A 21 VAL HA H 1 4.9577 . A 21 VAL HB H 1 2.3849 . A 21 VAL HGx% H 1 0.6741 . A 21 VAL HGy% H 1 0.9176 . A 21 VAL CA C 13 58.6585 . A 21 VAL CB C 13 35.5556 . A 21 VAL CGx C 13 18.9413 . A 21 VAL CGy C 13 22.0457 . A 21 VAL N N 15 110.1425 . A 22 SER H H 1 8.5949 . A 22 SER HA H 1 4.8106 . A 22 SER HBx H 1 4.1186 . A 22 SER HBy H 1 4.4591 . A 22 SER CA C 13 58.2312 . A 22 SER CB C 13 66.7893 . A 22 SER N N 15 113.9064 . A 23 THR H H 1 9.0893 . A 23 THR HA H 1 3.6062 . A 23 THR HB H 1 4.1236 . A 23 THR HG2% H 1 1.1435 . A 23 THR CA C 13 66.3203 . A 23 THR CB C 13 67.3357 . A 23 THR CG2 C 13 23.4717 . A 23 THR N N 15 115.6759 . A 24 ALA H H 1 8.1288 . A 24 ALA HA H 1 4.0137 . A 24 ALA HB% H 1 1.2850 . A 24 ALA CA C 13 55.2653 . A 24 ALA CB C 13 20.0943 . A 24 ALA N N 15 123.1024 . A 25 THR H H 1 7.3901 . A 25 THR HA H 1 4.0392 . A 25 THR HB H 1 4.3224 . A 25 THR HG2% H 1 1.1731 . A 25 THR CA C 13 65.3486 . A 25 THR CB C 13 67.2451 . A 25 THR CG2 C 13 24.3009 . A 25 THR N N 15 116.3212 . A 26 VAL H H 1 7.6145 . A 26 VAL HA H 1 3.5093 . A 26 VAL HB H 1 2.2664 . A 26 VAL HGx% H 1 0.8215 . A 26 VAL HGy% H 1 0.8872 . A 26 VAL CA C 13 67.3357 . A 26 VAL CB C 13 31.1976 . A 26 VAL CGx C 13 21.0666 . A 26 VAL CGy C 13 21.9289 . A 26 VAL N N 15 122.7596 . A 27 SER H H 1 7.8949 . A 27 SER HA H 1 4.0647 . A 27 SER HBx H 1 3.9881 . A 27 SER HBy H 1 3.9881 . A 27 SER CA C 13 61.3495 . A 27 SER CB C 13 63.6238 . A 27 SER N N 15 112.1578 . A 28 ARG H H 1 8.3190 . A 28 ARG HA H 1 4.0130 . A 28 ARG HBx H 1 1.8647 . A 28 ARG HBy H 1 1.9002 . A 28 ARG HDx H 1 2.6978 . A 28 ARG HDy H 1 2.6978 . A 28 ARG HGx H 1 1.5662 . A 28 ARG HGy H 1 1.6723 . A 28 ARG CA C 13 59.4268 . A 28 ARG CB C 13 30.9959 . A 28 ARG N N 15 116.7792 . A 29 ALA H H 1 8.9019 . A 29 ALA HA H 1 3.7460 . A 29 ALA HB% H 1 1.5501 . A 29 ALA CA C 13 55.4934 . A 29 ALA CB C 13 19.0295 . A 29 ALA N N 15 119.5479 . A 30 LEU H H 1 7.7005 . A 30 LEU HA H 1 4.4244 . A 30 LEU HBx H 1 1.9141 . A 30 LEU HBy H 1 1.9141 . A 30 LEU HDx% H 1 0.9042 . A 30 LEU CA C 13 56.2083 . A 30 LEU CB C 13 42.1268 . A 30 LEU N N 15 111.3066 . A 31 MET H H 1 8.4595 . A 31 MET HA H 1 4.8245 . A 31 MET HBx H 1 2.1267 . A 31 MET HBy H 1 2.3396 . A 31 MET HE% H 1 2.1957 . A 31 MET HGx H 1 2.6686 . A 31 MET HGy H 1 3.2773 . A 31 MET CA C 13 55.2997 . A 31 MET CB C 13 33.2510 . A 31 MET CE C 13 17.3979 . A 31 MET CG C 13 32.2836 . A 31 MET N N 15 115.4677 . A 32 ASN H H 1 9.1335 . A 32 ASN HA H 1 5.1686 . A 32 ASN HBx H 1 2.6277 . A 32 ASN HBy H 1 2.9831 . A 32 ASN HD2y H 1 6.9287 . A 32 ASN CA C 13 51.6688 . A 32 ASN CB C 13 39.5395 . A 32 ASN N N 15 119.5687 . A 33 PRO CA C 13 65.6752 . A 33 PRO CB C 13 31.7805 . A 34 ASP H H 1 8.4335 . A 34 ASP HA H 1 4.5703 . A 34 ASP HBx H 1 2.6964 . A 34 ASP HBy H 1 2.7833 . A 34 ASP CA C 13 56.2357 . A 34 ASP CB C 13 40.2197 . A 34 ASP N N 15 117.1747 . A 35 LYS H H 1 8.2488 . A 35 LYS HA H 1 4.4424 . A 35 LYS HBx H 1 1.8476 . A 35 LYS CA C 13 55.7120 . A 35 LYS CB C 13 33.2443 . A 35 LYS N N 15 116.0090 . A 36 VAL H H 1 7.6997 . A 36 VAL HA H 1 4.7004 . A 36 VAL HB H 1 2.0769 . A 36 VAL HGx% H 1 0.9278 . A 36 VAL HGy% H 1 1.1557 . A 36 VAL CA C 13 59.5017 . A 36 VAL CB C 13 34.6644 . A 36 VAL CGx C 13 21.0677 . A 36 VAL CGy C 13 22.2175 . A 36 VAL N N 15 117.5078 . A 37 SER H H 1 9.3963 . A 37 SER HA H 1 4.5695 . A 37 SER HBx H 1 4.3797 . A 37 SER HBy H 1 4.3797 . A 37 SER CA C 13 58.7716 . A 37 SER CB C 13 64.4765 . A 37 SER N N 15 122.1084 . A 38 GLN H H 1 9.0919 . A 38 GLN HA H 1 3.9282 . A 38 GLN HBx H 1 2.1751 . A 38 GLN HBy H 1 2.2622 . A 38 GLN HE2y H 1 7.6658 . A 38 GLN HE2x H 1 7.0362 . A 38 GLN HGx H 1 2.4759 . A 38 GLN HGy H 1 2.4759 . A 38 GLN CA C 13 60.1101 . A 38 GLN CB C 13 28.5503 . A 38 GLN CG C 13 33.9222 . A 38 GLN N N 15 123.9403 . A 39 ALA H H 1 8.7510 . A 39 ALA HA H 1 4.2124 . A 39 ALA HB% H 1 1.5258 . A 39 ALA CA C 13 55.3904 . A 39 ALA CB C 13 18.2655 . A 39 ALA N N 15 120.4014 . A 40 THR H H 1 7.7335 . A 40 THR HA H 1 3.8523 . A 40 THR HB H 1 4.3710 . A 40 THR HG2% H 1 1.1438 . A 40 THR CA C 13 66.0354 . A 40 THR CB C 13 67.0882 . A 40 THR CG2 C 13 24.0865 . A 40 THR N N 15 118.6111 . A 41 ARG H H 1 9.0008 . A 41 ARG HA H 1 3.7102 . A 41 ARG HBx H 1 2.0116 . A 41 ARG HBy H 1 2.0116 . A 41 ARG HDx H 1 3.3948 . A 41 ARG HDy H 1 3.3948 . A 41 ARG CA C 13 61.0756 . A 41 ARG CB C 13 30.0000 . A 41 ARG N N 15 123.8570 . A 42 ASN H H 1 8.2462 . A 42 ASN HA H 1 4.5434 . A 42 ASN HBx H 1 2.9076 . A 42 ASN HBy H 1 3.0056 . A 42 ASN CA C 13 56.5074 . A 42 ASN CB C 13 38.4385 . A 42 ASN N N 15 116.5710 . A 43 ARG H H 1 7.7679 . A 43 ARG HA H 1 4.1630 . A 43 ARG HBx H 1 2.0193 . A 43 ARG HBy H 1 2.1286 . A 43 ARG CA C 13 59.9901 . A 43 ARG CB C 13 31.0133 . A 43 ARG N N 15 120.2498 . A 44 VAL H H 1 8.4910 . A 44 VAL HA H 1 3.3831 . A 44 VAL HB H 1 2.1278 . A 44 VAL HGx% H 1 0.8741 . A 44 VAL HGy% H 1 0.9552 . A 44 VAL CA C 13 67.3638 . A 44 VAL CB C 13 31.3495 . A 44 VAL CGy C 13 24.0117 . A 44 VAL CGx C 13 22.8044 . A 44 VAL N N 15 120.6505 . A 45 GLU H H 1 8.7354 . A 45 GLU HA H 1 3.8770 . A 45 GLU HBx H 1 2.1150 . A 45 GLU HBy H 1 2.2279 . A 45 GLU HGx H 1 2.2335 . A 45 GLU HGy H 1 2.5250 . A 45 GLU CA C 13 60.6734 . A 45 GLU CB C 13 29.5741 . A 45 GLU CG C 13 36.8615 . A 45 GLU N N 15 120.0475 . A 46 LYS H H 1 7.8715 . A 46 LYS HA H 1 4.0650 . A 46 LYS HBx H 1 1.9777 . A 46 LYS HBy H 1 1.9777 . A 46 LYS HGx H 1 1.4846 . A 46 LYS HGy H 1 1.6001 . A 46 LYS CA C 13 59.8193 . A 46 LYS CB C 13 32.7769 . A 46 LYS N N 15 118.6944 . A 47 ALA H H 1 7.7833 . A 47 ALA HA H 1 4.2527 . A 47 ALA HB% H 1 1.5853 . A 47 ALA CA C 13 54.9795 . A 47 ALA CB C 13 19.9655 . A 47 ALA N N 15 121.6207 . A 48 ALA H H 1 9.0762 . A 48 ALA HA H 1 4.1159 . A 48 ALA HB% H 1 1.6934 . A 48 ALA CA C 13 55.6218 . A 48 ALA CB C 13 17.4744 . A 48 ALA N N 15 119.3605 . A 49 ARG H H 1 7.8923 . A 49 ARG HA H 1 4.3235 . A 49 ARG HBx H 1 1.9817 . A 49 ARG HBy H 1 2.0974 . A 49 ARG HDx H 1 3.3143 . A 49 ARG HDy H 1 3.3143 . A 49 ARG HGx H 1 1.6909 . A 49 ARG HGy H 1 1.6909 . A 49 ARG CA C 13 59.1814 . A 49 ARG CB C 13 30.2145 . A 49 ARG N N 15 118.1739 . A 50 GLU H H 1 8.1390 . A 50 GLU HA H 1 4.1062 . A 50 GLU HBx H 1 2.1124 . A 50 GLU HBy H 1 2.3436 . A 50 GLU HGx H 1 2.3100 . A 50 GLU HGy H 1 2.5924 . A 50 GLU CA C 13 59.7499 . A 50 GLU CB C 13 30.0011 . A 50 GLU CG C 13 36.7366 . A 50 GLU N N 15 120.2438 . A 51 VAL H H 1 8.0088 . A 51 VAL HA H 1 4.4585 . A 51 VAL HB H 1 2.5166 . A 51 VAL HGx% H 1 1.0329 . A 51 VAL CA C 13 61.3869 . A 51 VAL CB C 13 32.0652 . A 51 VAL CGx C 13 20.9012 . A 51 VAL CGy C 13 20.9012 . A 51 VAL N N 15 110.0364 . A 52 GLY H H 1 7.6674 . A 52 GLY HAx H 1 3.8588 . A 52 GLY HAy H 1 4.1235 . A 52 GLY CA C 13 46.2102 . A 52 GLY N N 15 109.5060 . A 53 TYR H H 1 8.4068 . A 53 TYR HA H 1 4.1875 . A 53 TYR HBx H 1 2.5165 . A 53 TYR HBy H 1 2.6852 . A 53 TYR HEx H 1 6.6573 . A 53 TYR HEy H 1 6.6573 . A 53 TYR CA C 13 59.6622 . A 53 TYR CB C 13 40.2542 . A 53 TYR N N 15 121.5832 . A 54 LEU H H 1 7.3843 . A 54 LEU HA H 1 4.6790 . A 54 LEU HBx H 1 1.4022 . A 54 LEU HBy H 1 1.4839 . A 54 LEU HDx% H 1 0.8938 . A 54 LEU HDy% H 1 0.9388 . A 54 LEU HG H 1 1.5433 . A 54 LEU CA C 13 51.4771 . A 54 LEU CB C 13 43.4570 . A 54 LEU CDx C 13 23.8600 . A 54 LEU CDy C 13 25.1293 . A 54 LEU CG C 13 26.7763 . A 54 LEU N N 15 127.2489 . A 55 PRO HA H 1 4.3678 . A 55 PRO HBx H 1 1.9920 . A 55 PRO HBy H 1 2.2804 . A 55 PRO HDx H 1 3.6469 . A 55 PRO HDy H 1 3.6469 . A 55 PRO HGx H 1 1.9918 . A 55 PRO HGy H 1 2.1024 . A 55 PRO CA C 13 62.7862 . A 55 PRO CB C 13 32.2347 . A 55 PRO CD C 13 50.2928 . A 55 PRO CG C 13 27.4338 . A 56 GLN H H 1 8.5063 . A 56 GLN HA H 1 4.6181 . A 56 GLN HBx H 1 1.9717 . A 56 GLN HBy H 1 2.1396 . A 56 GLN HE2x H 1 6.8594 . A 56 GLN HGx H 1 2.4437 . A 56 GLN HGy H 1 2.4437 . A 56 GLN CA C 13 53.6697 . A 56 GLN CB C 13 29.1753 . A 56 GLN CG C 13 33.2954 . A 56 GLN N N 15 121.5230 . A 57 PRO HA H 1 4.4680 . A 57 PRO HBx H 1 1.9608 . A 57 PRO HBy H 1 2.3392 . A 57 PRO HDx H 1 3.6999 . A 57 PRO HDy H 1 3.7281 . A 57 PRO HGx H 1 2.0595 . A 57 PRO HGy H 1 2.0829 . A 57 PRO CA C 13 63.4954 . A 57 PRO CB C 13 31.9620 . A 57 PRO CD C 13 50.5656 . A 57 PRO CG C 13 28.0885 . A 58 MET H H 1 8.4291 . A 58 MET HA H 1 4.5254 . A 58 MET HBx H 1 2.0995 . A 58 MET HBy H 1 2.1668 . A 58 MET HE% H 1 0.9553 . A 58 MET HGx H 1 2.6377 . A 58 MET HGy H 1 2.6966 . A 58 MET CA C 13 55.7476 . A 58 MET CB C 13 33.2079 . A 58 MET CG C 13 32.0467 . A 58 MET N N 15 120.2457 . A 59 GLY H H 1 8.3868 . A 59 GLY HAx H 1 4.0029 . A 59 GLY HAy H 1 4.0029 . A 59 GLY CA C 13 45.5484 . A 59 GLY N N 15 109.8508 . A 60 ARG H H 1 8.1936 . A 60 ARG HA H 1 4.3597 . A 60 ARG HBx H 1 1.7982 . A 60 ARG HBy H 1 1.8819 . A 60 ARG HDx H 1 3.2585 . A 60 ARG HDy H 1 3.2585 . A 60 ARG HGx H 1 1.6575 . A 60 ARG HGy H 1 1.6865 . A 60 ARG CA C 13 56.3717 . A 60 ARG CB C 13 30.8592 . A 60 ARG N N 15 120.2487 . A 61 ASN H H 1 8.5094 . A 61 ASN HA H 1 4.7591 . A 61 ASN HBx H 1 2.8013 . A 61 ASN HBy H 1 2.8851 . A 61 ASN CA C 13 53.4535 . A 61 ASN CB C 13 38.9730 . A 61 ASN N N 15 119.5324 . A 62 VAL H H 1 7.9053 . A 62 VAL HA H 1 4.1399 . A 62 VAL HB H 1 2.1196 . A 62 VAL HGx% H 1 0.9320 . A 62 VAL CA C 13 62.3503 . A 62 VAL CB C 13 32.8521 . A 62 VAL CGx C 13 21.5386 . A 62 VAL CGy C 13 21.5386 . A 62 VAL N N 15 120.0893 . A 63 LYS H H 1 8.3311 . A 63 LYS HA H 1 4.3714 . A 63 LYS HBx H 1 1.7884 . A 63 LYS HBy H 1 1.8695 . A 63 LYS HDx H 1 1.7508 . A 63 LYS HDy H 1 1.7508 . A 63 LYS HGx H 1 1.4693 . A 63 LYS HGy H 1 1.5101 . A 63 LYS CA C 13 56.3005 . A 63 LYS CB C 13 32.9944 . A 63 LYS N N 15 125.1308 . A 64 ARG H H 1 8.3473 . A 64 ARG HA H 1 4.3759 . A 64 ARG CA C 13 56.1167 . A 64 ARG CB C 13 31.0832 . A 64 ARG N N 15 122.7721 . A 65 ASN H H 1 8.4899 . A 65 ASN CA C 13 53.4787 . A 65 ASN CB C 13 39.0579 . A 65 ASN N N 15 120.1232 . A 66 GLU H H 1 8.3461 . A 66 GLU HA H 1 4.4157 . A 66 GLU CA C 13 56.6788 . A 66 GLU CB C 13 30.5799 . A 66 GLU N N 15 121.6790 . A 67 SER H H 1 7.9331 . A 67 SER HA H 1 4.3055 . A 67 SER HBx H 1 3.8635 . A 67 SER HBy H 1 3.8842 . A 67 SER CA C 13 60.1037 . A 67 SER CB C 13 65.0112 . A 67 SER N N 15 122.1271 . 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 10 ALA H A 15 VAL HGy% 1.0 2.00 6.00 2 1 A 10 ALA H A 15 VAL HGx% 1.0 2.00 6.00 3 2 A 10 ALA H A 51 VAL HGx% 1.0 1.00 5.00 4 2 A 10 ALA H A 51 VAL HG21 1.0 1.00 5.00 5 3 A 10 ALA HB% A 51 VAL HGx% 1.0 2.00 5.10 6 3 A 51 VAL HG21 A 10 ALA HB% 1.0 2.00 5.10 7 4 A 10 ALA HB% A 53 TYR HBx 1.0 2.00 5.10 8 4 A 10 ALA HB% A 53 TYR HBy 1.0 2.00 5.10 9 5 A 10 ALA HB% A 52 GLY HAy 1.0 3.00 6.10 10 5 A 10 ALA HB% A 52 GLY HAx 1.0 3.00 6.10 11 6 A 11 THR H A 15 VAL HGy% 1.0 2.00 5.10 12 6 A 15 VAL HGx% A 11 THR H 1.0 2.00 5.10 13 7 A 11 THR H A 51 VAL HGx% 1.0 1.00 5.00 14 7 A 51 VAL HG21 A 11 THR H 1.0 1.00 5.00 15 8 A 53 TYR HE% A 11 THR HG2% 1.0 2.00 5.10 16 8 A 11 THR HG1 A 53 TYR HE% 1.0 2.00 5.10 17 9 A 14 ASP HA A 51 VAL HGx% 1.0 2.00 6.10 18 9 A 51 VAL HG21 A 14 ASP HA 1.0 2.00 6.10 19 10 A 14 ASP HBy A 51 VAL HGx% 1.0 2.00 5.10 20 10 A 14 ASP HBx A 51 VAL HGx% 1.0 2.00 5.10 21 10 A 51 VAL HG21 A 14 ASP HBx 1.0 2.00 5.10 22 10 A 51 VAL HG21 A 14 ASP HBy 1.0 2.00 5.10 23 11 A 14 ASP HA A 26 VAL HGy% 1.0 2.90 6.10 24 11 A 14 ASP HA A 26 VAL HGx% 1.0 2.90 6.10 25 12 A 15 VAL HA A 47 ALA HB% 1.0 2.00 5.10 26 13 A 48 ALA HA A 15 VAL HGy% 1.0 2.00 5.10 27 13 A 15 VAL HGx% A 48 ALA HA 1.0 2.00 5.10 28 14 A 15 VAL H A 51 VAL HGx% 1.0 2.50 5.50 29 14 A 51 VAL HG21 A 15 VAL H 1.0 2.50 5.50 30 15 A 15 VAL H A 51 VAL HB 1.0 2.00 6.00 31 16 A 15 VAL HA A 51 VAL HGx% 1.0 2.00 5.10 32 16 A 51 VAL HG21 A 15 VAL HA 1.0 2.00 5.10 33 17 A 15 VAL HGx% A 51 VAL HGx% 1.0 2.00 6.00 34 17 A 15 VAL HGy% A 51 VAL HGx% 1.0 2.00 6.00 35 17 A 51 VAL HG21 A 15 VAL HGy% 1.0 2.00 6.00 36 17 A 15 VAL HGx% A 51 VAL HG21 1.0 2.00 6.00 37 18 A 15 VAL HGx% A 53 TYR HBx 1.0 2.00 5.10 38 18 A 15 VAL HGy% A 53 TYR HBx 1.0 2.00 5.10 39 18 A 53 TYR HBy A 15 VAL HGy% 1.0 2.00 5.10 40 18 A 15 VAL HGx% A 53 TYR HBy 1.0 2.00 5.10 41 19 A 19 ALA HB% A 26 VAL HGy% 1.0 2.00 6.00 42 19 A 26 VAL HGx% A 19 ALA HB% 1.0 2.00 6.00 43 20 A 19 ALA HB% A 43 ARG HA 1.0 2.00 6.00 44 21 A 19 ALA HB% A 43 ARG HBx 1.0 2.00 5.10 45 21 A 19 ALA HB% A 43 ARG HBy 1.0 2.00 5.10 46 22 A 19 ALA HB% A 44 VAL HGy% 1.0 2.00 5.10 47 22 A 19 ALA HB% A 44 VAL HGx% 1.0 2.00 5.10 48 23 A 19 ALA HB% A 44 VAL HA 1.0 2.00 5.10 49 24 A 25 THR HA A 36 VAL HGy% 1.0 2.00 5.10 50 24 A 25 THR HA A 36 VAL HGx% 1.0 2.00 5.10 51 25 A 25 THR HG2% A 36 VAL HGy% 1.0 2.00 5.10 52 25 A 25 THR HG1 A 36 VAL HGy% 1.0 2.00 5.10 53 25 A 36 VAL HGx% A 25 THR HG2% 1.0 2.00 5.10 54 25 A 36 VAL HGx% A 25 THR HG1 1.0 2.00 5.10 55 26 A 36 VAL HB A 25 THR HG2% 1.0 2.00 5.10 56 26 A 25 THR HG1 A 36 VAL HB 1.0 2.00 5.10 57 27 A 25 THR HA A 36 VAL HA 1.0 2.00 5.60 58 28 A 36 VAL HA A 25 THR HB 1.0 2.00 5.10 59 29 A 36 VAL HA A 25 THR HG2% 1.0 2.00 5.10 60 29 A 25 THR HG1 A 36 VAL HA 1.0 2.00 5.10 61 30 A 26 VAL HA A 36 VAL HGy% 1.0 2.00 5.10 62 30 A 36 VAL HGx% A 26 VAL HA 1.0 2.00 5.10 63 31 A 26 VAL HB A 36 VAL HGy% 1.0 2.00 5.60 64 31 A 36 VAL HGx% A 26 VAL HB 1.0 2.00 5.60 65 32 A 26 VAL HGx% A 36 VAL HGy% 1.0 2.00 5.10 66 32 A 26 VAL HGy% A 36 VAL HGy% 1.0 2.00 5.10 67 32 A 36 VAL HGx% A 26 VAL HGy% 1.0 2.00 5.10 68 32 A 26 VAL HGx% A 36 VAL HGx% 1.0 2.00 5.10 69 33 A 28 ARG HA A 32 ASN HBx 1.0 2.00 5.10 70 33 A 28 ARG HA A 32 ASN HBy 1.0 2.00 5.10 71 34 A 28 ARG HBy A 32 ASN HBx 1.0 2.00 5.10 72 34 A 28 ARG HBx A 32 ASN HBx 1.0 2.00 5.10 73 34 A 32 ASN HBy A 28 ARG HBx 1.0 2.00 5.10 74 34 A 32 ASN HBy A 28 ARG HBy 1.0 2.00 5.10 75 35 A 28 ARG HA A 32 ASN HBx 1.0 2.00 5.10 76 35 A 28 ARG HA A 32 ASN HBy 1.0 2.00 5.10 77 36 A 29 ALA HA A 36 VAL HGy% 1.0 1.50 5.10 78 36 A 36 VAL HGx% A 29 ALA HA 1.0 1.50 5.10 79 37 A 29 ALA HB% A 36 VAL HGy% 1.0 1.50 5.10 80 37 A 36 VAL HGx% A 29 ALA HB% 1.0 1.50 5.10 81 38 A 41 ARG HA A 36 VAL HGy% 1.0 2.00 5.10 82 38 A 36 VAL HGx% A 41 ARG HA 1.0 2.00 5.10 83 39 A 36 VAL HGx% A 41 ARG HBx 1.0 2.00 5.10 84 39 A 36 VAL HGy% A 41 ARG HBx 1.0 2.00 5.10 85 39 A 41 ARG HBy A 36 VAL HGy% 1.0 2.00 5.10 86 39 A 36 VAL HGx% A 41 ARG HBy 1.0 2.00 5.10 87 40 A 36 VAL HB A 41 ARG HA 1.0 2.00 5.10 88 41 A 44 VAL HA A 36 VAL HGy% 1.0 2.00 5.20 89 41 A 44 VAL HA A 36 VAL HGx% 1.0 2.00 5.20 90 42 A 11 THR HA A 12 MET H 1.0 2.20 3.70 91 43 A 11 THR H A 12 MET H 1.0 0.80 4.80 92 44 A 11 THR HA A 13 LYS H 1.0 3.90 4.90 93 45 A 11 THR HA A 14 ASP H 1.0 2.60 4.60 94 46 A 15 VAL H A 11 THR HA 1.0 2.80 5.60 95 47 A 13 LYS H A 12 MET HA 1.0 3.30 3.70 96 48 A 12 MET H A 13 LYS H 1.0 2.50 3.10 97 49 A 14 ASP H A 12 MET HA 1.0 4.10 4.70 98 50 A 12 MET H A 14 ASP H 1.0 3.90 4.50 99 51 A 15 VAL H A 12 MET HA 1.0 2.60 4.20 100 52 A 12 MET HA A 16 ALA H 1.0 3.70 4.70 101 53 A 13 LYS H A 14 ASP H 1.0 2.60 3.00 102 54 A 14 ASP H A 13 LYS HA 1.0 3.30 3.70 103 55 A 15 VAL H A 13 LYS HA 1.0 4.20 4.60 104 56 A 15 VAL H A 13 LYS H 1.0 3.70 4.70 105 57 A 16 ALA H A 13 LYS HA 1.0 3.20 3.60 106 58 A 13 LYS HA A 17 LEU H 1.0 3.50 4.90 107 59 A 15 VAL H A 14 ASP H 1.0 2.60 3.00 108 60 A 14 ASP HA A 15 VAL H 1.0 3.30 3.70 109 61 A 14 ASP H A 16 ALA H 1.0 4.00 4.40 110 62 A 14 ASP HA A 16 ALA H 1.0 3.90 4.90 111 63 A 14 ASP HA A 17 LEU H 1.0 3.20 3.60 112 64 A 14 ASP HA A 17 LEU HDy% 1.0 3.00 6.10 113 64 A 14 ASP HA A 17 LEU HDx% 1.0 3.00 6.10 114 65 A 14 ASP HA A 18 LYS H 1.0 3.40 5.00 115 66 A 15 VAL H A 16 ALA H 1.0 2.60 3.00 116 67 A 15 VAL HA A 16 ALA H 1.0 3.00 4.00 117 68 A 15 VAL HA A 17 LEU H 1.0 3.10 4.20 118 69 A 15 VAL H A 17 LEU H 1.0 3.70 4.70 119 70 A 15 VAL HA A 18 LYS HBx 1.0 2.00 6.10 120 70 A 15 VAL HA A 18 LYS HBy 1.0 2.00 6.10 121 71 A 15 VAL HA A 18 LYS HGx 1.0 3.00 6.10 122 71 A 15 VAL HA A 18 LYS HGy 1.0 3.00 6.10 123 72 A 15 VAL HA A 19 ALA H 1.0 3.70 4.70 124 73 A 16 ALA H A 17 LEU H 1.0 2.50 3.10 125 74 A 17 LEU H A 16 ALA HA 1.0 3.00 4.00 126 75 A 16 ALA H A 18 LYS H 1.0 3.70 4.70 127 76 A 18 LYS H A 16 ALA HA 1.0 3.90 4.90 128 77 A 19 ALA H A 16 ALA HA 1.0 2.90 3.90 129 78 A 19 ALA HB% A 16 ALA HA 1.0 2.70 5.80 130 79 A 16 ALA HA A 20 LYS H 1.0 3.70 4.70 131 80 A 16 ALA HA A 21 VAL HGy% 1.0 2.00 6.10 132 80 A 16 ALA HA A 21 VAL HGx% 1.0 2.00 6.10 133 81 A 17 LEU H A 18 LYS H 1.0 2.60 3.00 134 82 A 17 LEU H A 19 ALA H 1.0 3.70 4.70 135 83 A 20 LYS H A 17 LEU HA 1.0 2.90 3.90 136 84 A 18 LYS H A 19 ALA H 1.0 2.60 3.00 137 85 A 19 ALA H A 18 LYS HA 1.0 3.00 4.00 138 86 A 18 LYS H A 20 LYS H 1.0 3.70 4.70 139 87 A 20 LYS H A 18 LYS HA 1.0 3.00 4.00 140 88 A 19 ALA H A 20 LYS H 1.0 2.40 3.00 141 89 A 19 ALA H A 21 VAL H 1.0 3.30 4.30 142 90 A 23 THR H A 24 ALA H 1.0 2.30 3.30 143 91 A 24 ALA H A 23 THR HA 1.0 3.00 4.00 144 92 A 23 THR H A 25 THR H 1.0 3.00 5.00 145 93 A 23 THR HA A 25 THR H 1.0 3.00 5.00 146 94 A 23 THR HA A 26 VAL H 1.0 2.70 4.30 147 95 A 23 THR HA A 27 SER H 1.0 3.70 4.70 148 96 A 26 VAL HA A 29 ALA HB% 1.0 2.30 5.60 149 97 A 34 ASP H A 35 LYS H 1.0 2.00 3.60 150 98 A 35 LYS H A 34 ASP HA 1.0 2.70 4.30 151 99 A 34 ASP H A 36 VAL H 1.0 3.20 5.20 152 100 A 34 ASP HA A 36 VAL H 1.0 2.50 4.50 153 101 A 35 LYS H A 36 VAL H 1.0 1.80 3.80 154 102 A 36 VAL H A 35 LYS HA 1.0 2.50 4.50 155 103 A 35 LYS HA A 37 SER H 1.0 2.40 6.10 156 104 A 36 VAL HA A 37 SER H 1.0 2.00 4.00 157 105 A 36 VAL H A 37 SER H 1.0 2.50 4.50 158 106 A 37 SER HA A 38 GLN H 1.0 2.30 4.30 159 107 A 37 SER H A 38 GLN H 1.0 2.50 4.50 160 108 A 37 SER HA A 39 ALA H 1.0 3.90 4.90 161 109 A 37 SER HA A 40 THR H 1.0 2.60 4.70 162 110 A 37 SER HA A 41 ARG H 1.0 3.60 4.80 163 111 A 39 ALA H A 38 GLN HA 1.0 3.30 3.70 164 112 A 38 GLN H A 39 ALA H 1.0 2.50 3.10 165 113 A 40 THR H A 38 GLN HA 1.0 4.00 4.80 166 114 A 38 GLN H A 40 THR H 1.0 3.70 4.70 167 115 A 41 ARG H A 38 GLN HA 1.0 3.20 3.60 168 116 A 38 GLN HA A 42 ASN H 1.0 4.00 4.40 169 117 A 39 ALA H A 40 THR H 1.0 2.60 3.00 170 118 A 40 THR H A 39 ALA HA 1.0 3.30 3.70 171 119 A 41 ARG H A 39 ALA HA 1.0 4.00 4.40 172 120 A 39 ALA H A 41 ARG H 1.0 3.80 4.60 173 121 A 42 ASN H A 39 ALA HA 1.0 3.20 3.60 174 122 A 39 ALA HA A 43 ARG H 1.0 3.70 4.70 175 123 A 40 THR H A 41 ARG H 1.0 2.60 3.00 176 124 A 41 ARG H A 40 THR HA 1.0 3.00 3.70 177 125 A 40 THR H A 42 ASN H 1.0 3.70 4.70 178 126 A 42 ASN H A 40 THR HA 1.0 3.90 4.90 179 127 A 43 ARG H A 40 THR HA 1.0 3.50 5.50 180 128 A 40 THR HA A 44 VAL H 1.0 3.20 5.20 181 129 A 41 ARG H A 42 ASN H 1.0 2.60 3.00 182 130 A 41 ARG HA A 42 ASN H 1.0 3.20 3.80 183 131 A 41 ARG H A 43 ARG H 1.0 3.90 4.50 184 132 A 41 ARG HA A 43 ARG H 1.0 4.10 4.70 185 133 A 41 ARG HA A 44 VAL H 1.0 3.00 3.90 186 134 A 41 ARG HA A 45 GLU H 1.0 3.70 4.70 187 135 A 42 ASN H A 43 ARG H 1.0 2.60 3.00 188 136 A 43 ARG H A 42 ASN HA 1.0 3.30 3.70 189 137 A 44 VAL H A 42 ASN HA 1.0 4.20 4.60 190 138 A 42 ASN H A 44 VAL H 1.0 3.70 4.70 191 139 A 45 GLU H A 42 ASN HA 1.0 3.20 3.60 192 140 A 42 ASN H A 45 GLU H 1.0 3.50 5.50 193 141 A 42 ASN HA A 46 LYS H 1.0 4.00 4.40 194 142 A 43 ARG H A 44 VAL H 1.0 2.60 3.00 195 143 A 43 ARG HA A 44 VAL H 1.0 3.20 3.80 196 144 A 43 ARG H A 45 GLU H 1.0 4.00 4.40 197 145 A 43 ARG HA A 45 GLU H 1.0 4.10 4.70 198 146 A 43 ARG HA A 46 LYS H 1.0 3.10 3.70 199 147 A 43 ARG HA A 47 ALA H 1.0 3.90 4.50 200 148 A 44 VAL H A 45 GLU H 1.0 2.50 3.10 201 149 A 44 VAL HA A 45 GLU H 1.0 3.00 4.00 202 150 A 44 VAL H A 46 LYS H 1.0 4.00 4.40 203 151 A 44 VAL HA A 46 LYS H 1.0 3.90 4.90 204 152 A 45 GLU H A 46 LYS H 1.0 2.50 3.10 205 153 A 46 LYS H A 45 GLU HA 1.0 3.10 3.90 206 154 A 45 GLU H A 47 ALA H 1.0 3.90 4.50 207 155 A 47 ALA H A 45 GLU HA 1.0 4.00 4.80 208 156 A 45 GLU HA A 48 ALA H 1.0 3.00 3.80 209 157 A 46 LYS H A 47 ALA H 1.0 2.60 3.00 210 158 A 47 ALA H A 46 LYS HA 1.0 3.20 3.80 211 159 A 48 ALA H A 46 LYS HA 1.0 3.70 4.30 212 160 A 46 LYS H A 48 ALA H 1.0 3.40 5.00 213 161 A 46 LYS HA A 49 ARG H 1.0 3.10 3.70 214 162 A 46 LYS HA A 50 GLU H 1.0 3.80 4.60 215 163 A 47 ALA H A 48 ALA H 1.0 2.50 3.10 216 164 A 48 ALA H A 47 ALA HA 1.0 3.20 3.80 217 165 A 47 ALA H A 49 ARG H 1.0 3.90 4.50 218 166 A 49 ARG H A 47 ALA HA 1.0 4.10 4.70 219 167 A 50 GLU H A 47 ALA HA 1.0 3.10 3.70 220 168 A 47 ALA HA A 51 VAL H 1.0 3.40 5.00 221 169 A 48 ALA H A 49 ARG H 1.0 2.60 3.00 222 170 A 48 ALA HA A 49 ARG H 1.0 3.00 4.00 223 171 A 48 ALA H A 50 GLU H 1.0 3.70 4.70 224 172 A 48 ALA HA A 50 GLU H 1.0 3.90 4.90 225 173 A 51 VAL HB A 48 ALA HB% 1.0 2.90 6.10 226 174 A 48 ALA HB% A 53 TYR HBx 1.0 3.00 6.10 227 174 A 53 TYR HBy A 48 ALA HB% 1.0 3.00 6.10 228 175 A 49 ARG H A 50 GLU H 1.0 2.60 3.00 229 176 A 50 GLU H A 49 ARG HA 1.0 3.00 4.00 230 177 A 49 ARG H A 51 VAL H 1.0 3.70 4.40 231 178 A 51 VAL H A 49 ARG HA 1.0 3.90 4.90 232 179 A 49 ARG HA A 52 GLY H 1.0 2.90 3.90 233 180 A 50 GLU H A 51 VAL H 1.0 2.60 3.00 234 181 A 51 VAL H A 50 GLU HA 1.0 3.00 3.70 235 182 A 50 GLU H A 52 GLY H 1.0 3.70 4.70 236 183 A 51 VAL H A 52 GLY H 1.0 2.50 3.00 237 184 A 52 GLY H A 51 VAL HA 1.0 2.70 4.30 238 185 A 51 VAL H A 53 TYR H 1.0 3.70 4.70 239 186 A 51 VAL HA A 53 TYR H 1.0 3.60 5.20 240 187 A 51 VAL HGx% A 53 TYR HBx 1.0 2.00 6.00 241 187 A 51 VAL HG21 A 53 TYR HBx 1.0 2.00 6.00 242 187 A 53 TYR HBy A 51 VAL HGx% 1.0 2.00 6.00 243 187 A 51 VAL HG21 A 53 TYR HBy 1.0 2.00 6.00 244 188 A 52 GLY H A 53 TYR H 1.0 2.30 3.30 245 189 A 53 TYR HA A 54 LEU H 1.0 2.00 4.00 246 190 A 10 ALA H A 9 ALA HA 1.0 1.72 2.86 247 191 A 14 ASP HA A 13 LYS H 1.0 2.11 5.12 248 192 A 14 ASP H A 13 LYS HA 1.0 1.87 4.49 249 193 A 15 VAL HA A 14 ASP H 1.0 1.89 5.20 250 194 A 14 ASP H A 15 VAL HB 1.0 1.77 5.04 251 195 A 15 VAL HGx% A 14 ASP H 1.0 2.40 5.75 252 196 A 14 ASP HA A 15 VAL H 1.0 1.76 4.22 253 197 A 15 VAL H A 14 ASP HBx 1.0 1.72 3.85 254 197 A 14 ASP HBy A 15 VAL H 1.0 1.72 3.85 255 198 A 15 VAL H A 16 ALA HB% 1.0 1.90 4.55 256 199 A 15 VAL HA A 16 ALA H 1.0 1.95 4.67 257 200 A 16 ALA H A 15 VAL HB 1.0 1.72 3.97 258 201 A 16 ALA H A 15 VAL HGy% 1.0 1.76 4.22 259 202 A 15 VAL HGx% A 16 ALA H 1.0 1.92 4.62 260 203 A 17 LEU H A 16 ALA HA 1.0 2.00 4.79 261 204 A 17 LEU H A 16 ALA HB% 1.0 1.83 4.40 262 205 A 17 LEU H A 18 LYS HBx 1.0 2.28 5.47 263 205 A 17 LEU H A 18 LYS HBy 1.0 2.28 5.47 264 206 A 18 LYS H A 17 LEU HDy% 1.0 2.29 5.51 265 206 A 17 LEU HDx% A 18 LYS H 1.0 2.29 5.51 266 207 A 19 ALA HB% A 18 LYS H 1.0 2.45 5.87 267 208 A 19 ALA HB% A 18 LYS HGx 1.0 3.00 6.10 268 208 A 19 ALA HB% A 18 LYS HGy 1.0 3.00 6.10 269 209 A 19 ALA H A 18 LYS HBx 1.0 1.75 4.19 270 209 A 18 LYS HBy A 19 ALA H 1.0 1.75 4.19 271 210 A 19 ALA H A 18 LYS HGx 1.0 1.62 4.07 272 210 A 18 LYS HGy A 19 ALA H 1.0 1.62 4.07 273 211 A 19 ALA H A 20 LYS HA 1.0 1.92 5.78 274 212 A 19 ALA HB% A 20 LYS H 1.0 2.42 5.81 275 213 A 20 LYS H A 21 VAL H 1.0 1.72 3.64 276 214 A 20 LYS H A 21 VAL HA 1.0 2.66 6.00 277 215 A 20 LYS H A 21 VAL HGx% 1.0 2.77 6.00 278 216 A 20 LYS H A 21 VAL HGy% 1.0 2.86 6.00 279 217 A 21 VAL H A 20 LYS HBx 1.0 1.87 4.48 280 217 A 21 VAL H A 20 LYS HBy 1.0 1.87 4.48 281 218 A 21 VAL H A 20 LYS HA 1.0 1.71 3.53 282 219 A 21 VAL H A 20 LYS HGx 1.0 1.84 4.42 283 219 A 21 VAL H A 20 LYS HGy 1.0 1.84 4.42 284 220 A 21 VAL H A 20 LYS HDx 1.0 2.10 5.72 285 220 A 21 VAL H A 20 LYS HDy 1.0 2.10 5.72 286 221 A 21 VAL H A 22 SER H 1.0 1.89 4.55 287 222 A 21 VAL HA A 22 SER H 1.0 1.72 3.40 288 223 A 22 SER H A 21 VAL HB 1.0 1.72 3.94 289 224 A 21 VAL HGx% A 22 SER H 1.0 1.75 4.21 290 225 A 22 SER H A 21 VAL HGy% 1.0 1.86 4.48 291 226 A 23 THR H A 22 SER H 1.0 1.90 4.56 292 227 A 23 THR H A 22 SER HBx 1.0 1.71 3.72 293 227 A 23 THR H A 22 SER HBy 1.0 1.71 3.72 294 228 A 23 THR H A 22 SER HA 1.0 1.72 3.32 295 229 A 23 THR H A 24 ALA HB% 1.0 2.18 5.23 296 230 A 24 ALA H A 23 THR HA 1.0 1.72 3.80 297 231 A 24 ALA H A 25 THR HG2% 1.0 1.73 4.15 298 232 A 24 ALA H A 25 THR H 1.0 1.72 3.34 299 233 A 25 THR H A 24 ALA HB% 1.0 1.89 4.52 300 234 A 25 THR H A 26 VAL H 1.0 1.72 3.89 301 235 A 26 VAL HB A 25 THR H 1.0 2.12 5.09 302 236 A 25 THR HB A 26 VAL H 1.0 1.74 4.18 303 237 A 25 THR HA A 26 VAL H 1.0 1.72 4.13 304 238 A 26 VAL H A 27 SER H 1.0 1.72 4.03 305 239 A 26 VAL HA A 27 SER H 1.0 2.29 5.48 306 240 A 26 VAL HGx% A 27 SER H 1.0 2.02 5.96 307 241 A 27 SER H A 26 VAL HGy% 1.0 2.30 5.51 308 242 A 26 VAL HB A 27 SER H 1.0 1.86 4.45 309 243 A 27 SER H A 28 ARG HGx 1.0 2.04 4.90 310 243 A 27 SER H A 28 ARG HGy 1.0 2.04 4.90 311 244 A 27 SER H A 28 ARG H 1.0 2.00 4.80 312 245 A 28 ARG H A 29 ALA H 1.0 1.82 4.38 313 246 A 29 ALA H A 28 ARG HGx 1.0 1.73 4.15 314 246 A 28 ARG HGy A 29 ALA H 1.0 1.73 4.15 315 247 A 29 ALA H A 28 ARG HDx 1.0 2.07 5.31 316 247 A 29 ALA H A 28 ARG HDy 1.0 2.07 5.31 317 248 A 29 ALA H A 30 LEU H 1.0 1.72 4.04 318 249 A 29 ALA H A 30 LEU HD21 1.0 1.71 4.79 319 249 A 29 ALA H A 30 LEU HDx% 1.0 1.71 4.79 320 250 A 29 ALA H A 30 LEU HA 1.0 1.96 5.38 321 251 A 29 ALA HA A 30 LEU H 1.0 1.97 4.73 322 252 A 30 LEU H A 31 MET H 1.0 1.71 3.83 323 253 A 30 LEU H A 31 MET HGx 1.0 2.05 4.91 324 253 A 30 LEU H A 31 MET HGy 1.0 2.05 4.91 325 254 A 31 MET H A 30 LEU HD21 1.0 1.97 4.73 326 254 A 30 LEU HDx% A 31 MET H 1.0 1.97 4.73 327 255 A 31 MET H A 30 LEU HBx 1.0 1.72 4.01 328 255 A 31 MET H A 30 LEU HBy 1.0 1.72 4.01 329 256 A 30 LEU HA A 31 MET H 1.0 1.79 4.31 330 257 A 31 MET H A 32 ASN H 1.0 1.72 3.40 331 258 A 32 ASN H A 31 MET HBx 1.0 1.73 4.15 332 258 A 32 ASN H A 31 MET HBy 1.0 1.73 4.15 333 259 A 32 ASN H A 31 MET HA 1.0 1.81 4.34 334 260 A 34 ASP H A 33 PRO HDx 1.0 1.70 4.97 335 260 A 34 ASP H A 33 PRO HDy 1.0 1.70 4.97 336 261 A 34 ASP H A 33 PRO HA 1.0 1.98 4.74 337 262 A 34 ASP H A 35 LYS HBx 1.0 2.16 5.17 338 262 A 34 ASP H A 35 LYS HBy 1.0 2.16 5.17 339 263 A 35 LYS H A 34 ASP HA 1.0 1.88 4.50 340 264 A 35 LYS H A 34 ASP HBx 1.0 1.88 4.51 341 264 A 35 LYS H A 34 ASP HBy 1.0 1.88 4.51 342 265 A 36 VAL HGx% A 35 LYS H 1.0 2.59 6.00 343 266 A 35 LYS H A 36 VAL HGy% 1.0 2.25 5.41 344 267 A 36 VAL H A 35 LYS HBx 1.0 1.73 4.16 345 267 A 36 VAL H A 35 LYS HBy 1.0 1.73 4.16 346 268 A 36 VAL H A 35 LYS HA 1.0 1.72 3.59 347 269 A 36 VAL HA A 37 SER H 1.0 1.72 3.76 348 270 A 36 VAL HB A 37 SER H 1.0 1.62 3.98 349 271 A 36 VAL HGx% A 37 SER H 1.0 1.78 4.27 350 272 A 37 SER H A 36 VAL HGy% 1.0 2.16 5.18 351 273 A 37 SER HA A 38 GLN H 1.0 1.73 3.57 352 274 A 38 GLN H A 37 SER HBx 1.0 1.72 4.12 353 274 A 38 GLN H A 37 SER HBy 1.0 1.72 4.12 354 275 A 38 GLN H A 39 ALA HA 1.0 2.28 5.47 355 276 A 38 GLN H A 39 ALA HB% 1.0 2.52 6.00 356 277 A 39 ALA H A 38 GLN HA 1.0 1.95 4.69 357 278 A 39 ALA H A 38 GLN HGx 1.0 1.90 4.90 358 278 A 39 ALA H A 38 GLN HGy 1.0 1.90 4.90 359 279 A 39 ALA H A 38 GLN HBx 1.0 1.72 4.04 360 279 A 39 ALA H A 38 GLN HBy 1.0 1.72 4.04 361 280 A 39 ALA H A 40 THR HB 1.0 2.02 4.85 362 281 A 40 THR H A 39 ALA HA 1.0 1.81 4.34 363 282 A 40 THR H A 39 ALA HB% 1.0 1.81 4.33 364 283 A 41 ARG HA A 40 THR H 1.0 2.28 5.19 365 284 A 40 THR H A 41 ARG HBx 1.0 1.85 4.43 366 284 A 41 ARG HBy A 40 THR H 1.0 1.85 4.43 367 285 A 41 ARG H A 40 THR HB 1.0 1.80 4.31 368 286 A 41 ARG H A 40 THR HG2% 1.0 2.02 4.86 369 287 A 41 ARG H A 40 THR HA 1.0 1.86 4.45 370 288 A 41 ARG H A 42 ASN HA 1.0 2.25 5.12 371 289 A 41 ARG H A 42 ASN HBx 1.0 2.34 5.62 372 289 A 41 ARG H A 42 ASN HBy 1.0 2.34 5.62 373 290 A 41 ARG HA A 42 ASN H 1.0 1.99 4.79 374 291 A 42 ASN H A 43 ARG HBx 1.0 1.72 4.63 375 291 A 43 ARG HBy A 42 ASN H 1.0 1.72 4.63 376 292 A 43 ARG H A 42 ASN HA 1.0 1.98 4.75 377 293 A 43 ARG H A 42 ASN HBx 1.0 1.77 4.25 378 293 A 43 ARG H A 42 ASN HBy 1.0 1.77 4.25 379 294 A 44 VAL HA A 43 ARG H 1.0 2.26 5.20 380 295 A 44 VAL HGx% A 43 ARG H 1.0 2.37 5.69 381 296 A 43 ARG HA A 44 VAL H 1.0 1.79 4.31 382 297 A 44 VAL H A 43 ARG HBx 1.0 1.72 4.00 383 297 A 43 ARG HBy A 44 VAL H 1.0 1.72 4.00 384 298 A 44 VAL HGx% A 45 GLU H 1.0 2.03 4.87 385 299 A 44 VAL HA A 45 GLU H 1.0 1.97 4.73 386 300 A 45 GLU H A 44 VAL HGy% 1.0 1.96 5.06 387 301 A 46 LYS H A 45 GLU HA 1.0 1.97 4.72 388 302 A 46 LYS H A 45 GLU HGx 1.0 2.16 5.18 389 302 A 46 LYS H A 45 GLU HGy 1.0 2.16 5.18 390 303 A 46 LYS H A 45 GLU HBx 1.0 1.79 4.31 391 303 A 46 LYS H A 45 GLU HBy 1.0 1.79 4.31 392 304 A 47 ALA H A 46 LYS HBx 1.0 1.72 3.71 393 304 A 47 ALA H A 46 LYS HBy 1.0 1.72 3.71 394 305 A 47 ALA H A 46 LYS HA 1.0 1.82 4.37 395 306 A 47 ALA HB% A 48 ALA H 1.0 1.89 4.52 396 307 A 48 ALA H A 47 ALA HA 1.0 1.86 4.46 397 308 A 49 ARG H A 50 GLU H 1.0 1.72 4.14 398 309 A 49 ARG H A 50 GLU HGx 1.0 1.93 6.05 399 309 A 49 ARG H A 50 GLU HGy 1.0 1.93 6.05 400 310 A 50 GLU H A 49 ARG HBx 1.0 1.85 4.43 401 310 A 50 GLU H A 49 ARG HBy 1.0 1.85 4.43 402 311 A 50 GLU H A 49 ARG HGx 1.0 2.01 4.81 403 311 A 50 GLU H A 49 ARG HGy 1.0 2.01 4.81 404 312 A 50 GLU H A 51 VAL HA 1.0 2.25 5.39 405 313 A 50 GLU H A 51 VAL HGx% 1.0 2.39 5.74 406 313 A 51 VAL HG21 A 50 GLU H 1.0 2.39 5.74 407 314 A 51 VAL H A 50 GLU HBx 1.0 1.72 4.09 408 314 A 51 VAL H A 50 GLU HBy 1.0 1.72 4.09 409 315 A 51 VAL H A 52 GLY HAy 1.0 2.01 4.81 410 315 A 52 GLY HAx A 51 VAL H 1.0 2.01 4.81 411 316 A 51 VAL HGx% A 52 GLY HAy 1.0 3.00 6.10 412 316 A 51 VAL HG21 A 52 GLY HAy 1.0 3.00 6.10 413 316 A 52 GLY HAx A 51 VAL HGx% 1.0 3.00 6.10 414 316 A 51 VAL HG21 A 52 GLY HAx 1.0 3.00 6.10 415 317 A 52 GLY H A 51 VAL HGx% 1.0 2.06 4.94 416 317 A 51 VAL HG21 A 52 GLY H 1.0 2.06 4.94 417 318 A 52 GLY H A 51 VAL HA 1.0 1.97 4.73 418 319 A 52 GLY H A 53 TYR HBx 1.0 1.86 4.79 419 319 A 53 TYR HBy A 52 GLY H 1.0 1.86 4.79 420 320 A 53 TYR H A 52 GLY HAy 1.0 1.78 4.26 421 321 A 53 TYR H A 54 LEU HG 1.0 1.57 4.54 422 322 A 54 LEU H A 53 TYR HBx 1.0 1.73 4.15 423 322 A 53 TYR HBy A 54 LEU H 1.0 1.73 4.15 424 323 A 53 TYR HA A 54 LEU H 1.0 1.72 3.18 425 324 A 10 ALA H A 10 ALA HB% 1.0 2.30 3.50 426 325 A 10 ALA H A 10 ALA HA 1.0 2.60 4.00 427 326 A 10 ALA HB% A 10 ALA HA 1.0 2.10 3.50 428 327 A 11 THR H A 11 THR HA 1.0 2.60 4.00 429 328 A 11 THR H A 11 THR HG2% 1.0 2.50 3.80 430 329 A 11 THR H A 11 THR HB 1.0 2.30 3.70 431 330 A 11 THR HA A 11 THR HB 1.0 2.60 4.10 432 331 A 11 THR HA A 11 THR HG2% 1.0 2.40 3.60 433 332 A 11 THR HB A 11 THR HG2% 1.0 1.90 4.20 434 333 A 12 MET H A 12 MET HA 1.0 2.60 4.00 435 334 A 13 LYS H A 13 LYS HA 1.0 2.50 3.70 436 335 A 13 LYS H A 13 LYS HBx 1.0 2.20 3.60 437 335 A 13 LYS H A 13 LYS HBy 1.0 2.20 3.60 438 336 A 13 LYS H A 13 LYS HEx 1.0 3.40 5.00 439 336 A 13 LYS H A 13 LYS HEy 1.0 3.40 5.00 440 337 A 13 LYS H A 13 LYS HGx 1.0 2.50 3.90 441 337 A 13 LYS H A 13 LYS HGy 1.0 2.50 3.90 442 338 A 13 LYS HA A 13 LYS HEx 1.0 2.20 4.70 443 338 A 13 LYS HA A 13 LYS HEy 1.0 2.20 4.70 444 339 A 13 LYS HA A 13 LYS HBx 1.0 2.30 3.50 445 339 A 13 LYS HA A 13 LYS HBy 1.0 2.30 3.50 446 340 A 13 LYS HA A 13 LYS HGx 1.0 2.30 3.50 447 340 A 13 LYS HA A 13 LYS HGy 1.0 2.30 3.50 448 341 A 13 LYS HBy A 13 LYS HGx 1.0 1.80 4.10 449 341 A 13 LYS HBx A 13 LYS HGx 1.0 1.80 4.10 450 341 A 13 LYS HGy A 13 LYS HBx 1.0 1.80 4.10 451 341 A 13 LYS HBy A 13 LYS HGy 1.0 1.80 4.10 452 342 A 14 ASP HA A 14 ASP H 1.0 2.60 4.00 453 343 A 14 ASP H A 14 ASP HBx 1.0 2.30 3.50 454 343 A 14 ASP HBy A 14 ASP H 1.0 2.30 3.50 455 344 A 14 ASP HA A 14 ASP HBx 1.0 2.40 3.60 456 344 A 14 ASP HA A 14 ASP HBy 1.0 2.40 3.60 457 345 A 15 VAL HA A 15 VAL H 1.0 2.60 4.00 458 346 A 15 VAL H A 15 VAL HB 1.0 2.10 3.30 459 347 A 15 VAL H A 15 VAL HGy% 1.0 2.30 3.90 460 348 A 15 VAL HGx% A 15 VAL HA 1.0 2.50 3.90 461 349 A 15 VAL HA A 15 VAL HGy% 1.0 1.90 4.30 462 350 A 15 VAL HA A 15 VAL HB 1.0 2.00 3.40 463 351 A 15 VAL HGx% A 15 VAL HB 1.0 1.90 4.10 464 352 A 15 VAL HB A 15 VAL HGy% 1.0 1.90 4.20 465 353 A 16 ALA H A 16 ALA HA 1.0 2.60 4.00 466 354 A 16 ALA H A 16 ALA HB% 1.0 2.30 3.70 467 355 A 16 ALA HA A 16 ALA HB% 1.0 2.10 3.30 468 356 A 17 LEU H A 17 LEU HA 1.0 2.60 4.00 469 357 A 17 LEU H A 17 LEU HBx 1.0 2.30 3.50 470 357 A 17 LEU H A 17 LEU HBy 1.0 2.30 3.50 471 358 A 17 LEU H A 17 LEU HDy% 1.0 3.80 5.80 472 359 A 17 LEU H A 17 LEU HDx% 1.0 3.30 4.90 473 360 A 17 LEU H A 17 LEU HG 1.0 2.40 4.40 474 361 A 17 LEU HA A 17 LEU HBx 1.0 2.10 3.10 475 361 A 17 LEU HA A 17 LEU HBy 1.0 2.10 3.10 476 362 A 17 LEU HDx% A 17 LEU HBy 1.0 2.20 3.40 477 362 A 17 LEU HDx% A 17 LEU HBx 1.0 2.20 3.40 478 363 A 17 LEU HG A 17 LEU HDy% 1.0 2.30 3.50 479 364 A 17 LEU HDx% A 17 LEU HG 1.0 2.20 3.40 480 365 A 17 LEU HA A 17 LEU HG 1.0 2.50 3.70 481 366 A 17 LEU HBy A 17 LEU HDy% 1.0 2.10 3.30 482 366 A 17 LEU HBx A 17 LEU HDy% 1.0 2.10 3.30 483 367 A 17 LEU HA A 17 LEU HDy% 1.0 2.10 3.70 484 368 A 17 LEU HDx% A 17 LEU HA 1.0 2.20 3.80 485 369 A 18 LYS H A 18 LYS HA 1.0 2.60 4.00 486 370 A 18 LYS H A 18 LYS HBx 1.0 1.90 3.10 487 370 A 18 LYS H A 18 LYS HBy 1.0 1.90 3.10 488 371 A 18 LYS H A 18 LYS HGx 1.0 2.20 4.20 489 371 A 18 LYS H A 18 LYS HGy 1.0 2.20 4.20 490 372 A 18 LYS HA A 18 LYS HBx 1.0 2.20 3.40 491 372 A 18 LYS HBy A 18 LYS HA 1.0 2.20 3.40 492 373 A 18 LYS HA A 18 LYS HGx 1.0 2.30 3.50 493 373 A 18 LYS HGy A 18 LYS HA 1.0 2.30 3.50 494 374 A 18 LYS HBx A 18 LYS HGx 1.0 2.20 3.40 495 374 A 18 LYS HBy A 18 LYS HGx 1.0 2.20 3.40 496 374 A 18 LYS HGy A 18 LYS HBx 1.0 2.20 3.40 497 374 A 18 LYS HBy A 18 LYS HGy 1.0 2.20 3.40 498 375 A 19 ALA H A 19 ALA HA 1.0 2.60 4.00 499 376 A 19 ALA HB% A 19 ALA H 1.0 1.90 4.30 500 377 A 19 ALA HB% A 19 ALA HA 1.0 2.00 3.20 501 378 A 20 LYS H A 20 LYS HA 1.0 2.30 3.70 502 379 A 20 LYS H A 20 LYS HBx 1.0 2.50 4.90 503 379 A 20 LYS H A 20 LYS HBy 1.0 2.50 4.90 504 380 A 20 LYS H A 20 LYS HGx 1.0 2.50 5.20 505 380 A 20 LYS H A 20 LYS HGy 1.0 2.50 5.20 506 381 A 20 LYS H A 20 LYS HDx 1.0 3.90 5.90 507 381 A 20 LYS H A 20 LYS HDy 1.0 3.90 5.90 508 382 A 20 LYS H A 20 LYS HEx 1.0 4.50 6.70 509 382 A 20 LYS H A 20 LYS HEy 1.0 4.50 6.70 510 383 A 20 LYS HA A 20 LYS HBx 1.0 2.10 3.30 511 383 A 20 LYS HA A 20 LYS HBy 1.0 2.10 3.30 512 384 A 20 LYS HA A 20 LYS HGx 1.0 2.40 3.60 513 384 A 20 LYS HA A 20 LYS HGy 1.0 2.40 3.60 514 385 A 20 LYS HA A 20 LYS HDx 1.0 3.00 4.40 515 385 A 20 LYS HA A 20 LYS HDy 1.0 3.00 4.40 516 386 A 20 LYS HBy A 20 LYS HGx 1.0 2.30 3.50 517 386 A 20 LYS HBx A 20 LYS HGx 1.0 2.30 3.50 518 386 A 20 LYS HGy A 20 LYS HBx 1.0 2.30 3.50 519 386 A 20 LYS HBy A 20 LYS HGy 1.0 2.30 3.50 520 387 A 21 VAL H A 21 VAL HB 1.0 2.20 3.80 521 388 A 21 VAL HGx% A 21 VAL H 1.0 3.10 4.70 522 389 A 21 VAL H A 21 VAL HGy% 1.0 1.90 4.50 523 390 A 21 VAL H A 21 VAL HA 1.0 2.60 4.00 524 391 A 21 VAL HGx% A 21 VAL HA 1.0 1.80 3.20 525 392 A 21 VAL HA A 21 VAL HGy% 1.0 1.90 4.90 526 393 A 21 VAL HA A 21 VAL HB 1.0 2.60 4.00 527 394 A 21 VAL HGx% A 21 VAL HB 1.0 1.90 4.40 528 395 A 21 VAL HB A 21 VAL HGy% 1.0 1.90 4.40 529 396 A 21 VAL HGx% A 21 VAL HGy% 1.0 1.90 4.20 530 397 A 22 SER H A 22 SER HA 1.0 2.60 4.00 531 398 A 22 SER H A 22 SER HBx 1.0 2.70 4.10 532 398 A 22 SER H A 22 SER HBy 1.0 2.70 4.10 533 399 A 22 SER HA A 22 SER HBx 1.0 2.30 3.70 534 399 A 22 SER HBy A 22 SER HA 1.0 2.30 3.70 535 400 A 23 THR H A 23 THR HA 1.0 2.60 4.00 536 401 A 23 THR H A 23 THR HG2% 1.0 2.50 3.90 537 402 A 23 THR HA A 23 THR HB 1.0 2.60 3.80 538 403 A 23 THR HA A 23 THR HG2% 1.0 2.30 3.70 539 404 A 23 THR HG2% A 23 THR HB 1.0 2.10 3.50 540 405 A 24 ALA H A 24 ALA HB% 1.0 2.20 3.40 541 406 A 24 ALA H A 24 ALA HA 1.0 2.60 4.00 542 407 A 24 ALA HB% A 24 ALA HA 1.0 1.90 5.20 543 408 A 25 THR HA A 25 THR H 1.0 2.60 4.00 544 409 A 25 THR HB A 25 THR H 1.0 2.60 3.80 545 410 A 25 THR H A 25 THR HG2% 1.0 2.10 3.70 546 411 A 25 THR HA A 25 THR HG2% 1.0 2.30 3.70 547 412 A 25 THR HB A 25 THR HG2% 1.0 1.90 4.30 548 413 A 26 VAL HA A 26 VAL H 1.0 2.60 4.00 549 414 A 26 VAL HB A 26 VAL H 1.0 2.20 3.40 550 415 A 26 VAL HGx% A 26 VAL H 1.0 2.50 4.10 551 416 A 26 VAL H A 26 VAL HGy% 1.0 2.40 4.20 552 417 A 26 VAL HA A 26 VAL HB 1.0 2.50 3.90 553 418 A 26 VAL HGx% A 26 VAL HA 1.0 2.60 4.00 554 419 A 26 VAL HGx% A 26 VAL HB 1.0 2.10 3.50 555 420 A 26 VAL HA A 26 VAL HGy% 1.0 1.90 4.30 556 421 A 26 VAL HB A 26 VAL HGy% 1.0 1.90 4.10 557 422 A 27 SER H A 27 SER HA 1.0 2.60 4.00 558 423 A 27 SER H A 27 SER HBx 1.0 1.90 4.30 559 423 A 27 SER H A 27 SER HBy 1.0 1.90 4.30 560 424 A 27 SER HA A 27 SER HBx 1.0 2.25 4.20 561 424 A 27 SER HA A 27 SER HBy 1.0 2.25 4.20 562 425 A 28 ARG H A 28 ARG HBx 1.0 1.90 4.60 563 425 A 28 ARG HBy A 28 ARG H 1.0 1.90 4.60 564 426 A 28 ARG H A 28 ARG HDx 1.0 3.40 5.20 565 426 A 28 ARG H A 28 ARG HDy 1.0 3.40 5.20 566 427 A 28 ARG HA A 28 ARG H 1.0 2.60 4.00 567 428 A 28 ARG HA A 28 ARG HBx 1.0 2.30 3.50 568 428 A 28 ARG HA A 28 ARG HBy 1.0 2.30 3.50 569 429 A 29 ALA HB% A 29 ALA H 1.0 2.30 3.70 570 430 A 29 ALA HA A 29 ALA H 1.0 2.60 4.00 571 431 A 29 ALA HA A 29 ALA HB% 1.0 2.10 3.50 572 432 A 30 LEU H A 30 LEU HA 1.0 2.60 4.00 573 433 A 30 LEU H A 30 LEU HBx 1.0 2.30 3.50 574 433 A 30 LEU H A 30 LEU HBy 1.0 2.30 3.50 575 434 A 30 LEU H A 30 LEU HD21 1.0 2.20 3.60 576 434 A 30 LEU H A 30 LEU HDx% 1.0 2.20 3.60 577 435 A 30 LEU HA A 30 LEU HBx 1.0 2.30 3.50 578 435 A 30 LEU HA A 30 LEU HBy 1.0 2.30 3.50 579 436 A 30 LEU HDx% A 30 LEU HBy 1.0 2.30 3.70 580 436 A 30 LEU HDx% A 30 LEU HBx 1.0 2.30 3.70 581 437 A 30 LEU HDx% A 30 LEU HA 1.0 2.30 3.90 582 438 A 30 LEU HA A 30 LEU HD21 1.0 2.00 3.80 583 438 A 30 LEU HDx% A 30 LEU HA 1.0 2.00 3.80 584 439 A 31 MET H A 31 MET HA 1.0 2.60 4.00 585 440 A 31 MET H A 31 MET HBx 1.0 2.40 3.80 586 440 A 31 MET H A 31 MET HBy 1.0 2.40 3.80 587 441 A 31 MET H A 31 MET HGx 1.0 2.30 3.70 588 441 A 31 MET H A 31 MET HGy 1.0 2.30 3.70 589 442 A 31 MET HA A 31 MET HBx 1.0 2.30 3.50 590 442 A 31 MET HBy A 31 MET HA 1.0 2.30 3.50 591 443 A 31 MET HBy A 31 MET HGx 1.0 1.90 4.00 592 443 A 31 MET HBx A 31 MET HGx 1.0 1.90 4.00 593 443 A 31 MET HGy A 31 MET HBx 1.0 1.90 4.00 594 443 A 31 MET HGy A 31 MET HBy 1.0 1.90 4.00 595 444 A 31 MET HA A 31 MET HGx 1.0 2.10 3.70 596 444 A 31 MET HGy A 31 MET HA 1.0 2.10 3.70 597 445 A 31 MET HE% A 31 MET HGx 1.0 2.00 3.70 598 445 A 31 MET HGy A 31 MET HE% 1.0 2.00 3.70 599 446 A 31 MET HA A 31 MET HE% 1.0 3.10 4.70 600 447 A 32 ASN H A 32 ASN HA 1.0 2.60 4.00 601 448 A 32 ASN H A 32 ASN HBx 1.0 2.40 4.10 602 448 A 32 ASN HBy A 32 ASN H 1.0 2.40 4.10 603 449 A 32 ASN HA A 32 ASN HBx 1.0 2.30 3.50 604 449 A 32 ASN HBy A 32 ASN HA 1.0 2.30 3.50 605 450 A 33 PRO HA A 33 PRO HDx 1.0 2.50 3.70 606 450 A 33 PRO HDy A 33 PRO HA 1.0 2.50 3.70 607 451 A 34 ASP H A 34 ASP HA 1.0 2.50 4.10 608 452 A 34 ASP H A 34 ASP HBx 1.0 2.50 3.80 609 452 A 34 ASP H A 34 ASP HBy 1.0 2.50 3.80 610 453 A 34 ASP HA A 34 ASP HBx 1.0 2.20 3.20 611 453 A 34 ASP HA A 34 ASP HBy 1.0 2.20 3.20 612 454 A 35 LYS H A 35 LYS HA 1.0 2.60 4.00 613 455 A 35 LYS H A 35 LYS HBx 1.0 2.30 4.20 614 455 A 35 LYS H A 35 LYS HBy 1.0 2.30 4.20 615 456 A 37 SER H A 37 SER HA 1.0 2.60 4.00 616 457 A 37 SER H A 37 SER HBx 1.0 2.30 3.50 617 457 A 37 SER H A 37 SER HBy 1.0 2.30 3.50 618 458 A 37 SER HA A 37 SER HBx 1.0 2.30 3.50 619 458 A 37 SER HA A 37 SER HBy 1.0 2.30 3.50 620 459 A 38 GLN H A 38 GLN HA 1.0 2.60 4.00 621 460 A 38 GLN H A 38 GLN HGx 1.0 2.40 4.40 622 460 A 38 GLN H A 38 GLN HGy 1.0 2.40 4.40 623 461 A 38 GLN H A 38 GLN HBx 1.0 2.30 3.50 624 461 A 38 GLN H A 38 GLN HBy 1.0 2.30 3.50 625 462 A 38 GLN HA A 38 GLN HBx 1.0 2.30 3.70 626 462 A 38 GLN HA A 38 GLN HBy 1.0 2.30 3.70 627 463 A 38 GLN HA A 38 GLN HGx 1.0 2.40 3.60 628 463 A 38 GLN HA A 38 GLN HGy 1.0 2.40 3.60 629 464 A 38 GLN HBy A 38 GLN HGx 1.0 2.00 3.00 630 464 A 38 GLN HBx A 38 GLN HGx 1.0 2.00 3.00 631 464 A 38 GLN HGy A 38 GLN HBx 1.0 2.00 3.00 632 464 A 38 GLN HGy A 38 GLN HBy 1.0 2.00 3.00 633 465 A 39 ALA H A 39 ALA HA 1.0 2.60 4.00 634 466 A 39 ALA H A 39 ALA HB% 1.0 2.30 3.70 635 467 A 39 ALA HA A 39 ALA HB% 1.0 2.30 3.50 636 468 A 40 THR H A 40 THR HB 1.0 2.30 3.70 637 469 A 40 THR H A 40 THR HA 1.0 2.60 4.00 638 470 A 40 THR H A 40 THR HG2% 1.0 2.80 5.20 639 471 A 40 THR HA A 40 THR HG2% 1.0 2.40 4.00 640 472 A 40 THR HB A 40 THR HG2% 1.0 1.90 4.20 641 473 A 41 ARG HA A 41 ARG H 1.0 2.60 4.00 642 474 A 41 ARG H A 41 ARG HDx 1.0 3.30 4.90 643 474 A 41 ARG H A 41 ARG HDy 1.0 3.30 4.90 644 475 A 41 ARG H A 41 ARG HBx 1.0 2.30 3.50 645 475 A 41 ARG HBy A 41 ARG H 1.0 2.30 3.50 646 476 A 41 ARG HA A 41 ARG HBx 1.0 2.40 3.60 647 476 A 41 ARG HA A 41 ARG HBy 1.0 2.40 3.60 648 477 A 42 ASN H A 42 ASN HA 1.0 2.60 4.00 649 478 A 42 ASN H A 42 ASN HBx 1.0 2.30 3.50 650 478 A 42 ASN H A 42 ASN HBy 1.0 2.30 3.50 651 479 A 42 ASN HA A 42 ASN HBx 1.0 2.20 3.40 652 479 A 42 ASN HA A 42 ASN HBy 1.0 2.20 3.40 653 480 A 43 ARG HA A 43 ARG H 1.0 2.60 4.00 654 481 A 43 ARG H A 43 ARG HBx 1.0 2.20 3.40 655 481 A 43 ARG HBy A 43 ARG H 1.0 2.20 3.40 656 482 A 43 ARG HA A 43 ARG HBx 1.0 2.20 3.40 657 482 A 43 ARG HA A 43 ARG HBy 1.0 2.20 3.40 658 483 A 44 VAL HA A 44 VAL H 1.0 2.60 4.00 659 484 A 44 VAL H A 44 VAL HGy% 1.0 2.00 3.90 660 485 A 44 VAL HGx% A 44 VAL H 1.0 2.10 4.50 661 486 A 44 VAL HA A 44 VAL HB 1.0 2.50 3.70 662 487 A 44 VAL HGx% A 44 VAL HA 1.0 2.50 3.90 663 488 A 44 VAL HA A 44 VAL HGy% 1.0 2.20 3.60 664 489 A 44 VAL HGx% A 44 VAL HB 1.0 1.90 4.20 665 490 A 44 VAL HB A 44 VAL HGy% 1.0 1.90 4.10 666 491 A 45 GLU H A 45 GLU HA 1.0 2.60 4.00 667 492 A 45 GLU H A 45 GLU HBx 1.0 2.40 3.60 668 492 A 45 GLU H A 45 GLU HBy 1.0 2.40 3.60 669 493 A 45 GLU H A 45 GLU HGx 1.0 2.40 4.40 670 493 A 45 GLU H A 45 GLU HGy 1.0 2.40 4.40 671 494 A 45 GLU HA A 45 GLU HBx 1.0 2.30 3.50 672 494 A 45 GLU HA A 45 GLU HBy 1.0 2.30 3.50 673 495 A 45 GLU HBx A 45 GLU HGx 1.0 2.00 3.20 674 495 A 45 GLU HBy A 45 GLU HGx 1.0 2.00 3.20 675 495 A 45 GLU HGy A 45 GLU HBx 1.0 2.00 3.20 676 495 A 45 GLU HGy A 45 GLU HBy 1.0 2.00 3.20 677 496 A 45 GLU HA A 45 GLU HGx 1.0 2.40 3.60 678 496 A 45 GLU HA A 45 GLU HGy 1.0 2.40 3.60 679 497 A 46 LYS H A 46 LYS HA 1.0 2.60 4.00 680 498 A 46 LYS H A 46 LYS HBx 1.0 2.30 3.50 681 498 A 46 LYS H A 46 LYS HBy 1.0 2.30 3.50 682 499 A 46 LYS H A 46 LYS HGx 1.0 2.50 4.10 683 499 A 46 LYS H A 46 LYS HGy 1.0 2.50 4.10 684 500 A 46 LYS HA A 46 LYS HBx 1.0 2.10 3.10 685 500 A 46 LYS HA A 46 LYS HBy 1.0 2.10 3.10 686 501 A 46 LYS HA A 46 LYS HGx 1.0 2.40 3.60 687 501 A 46 LYS HA A 46 LYS HGy 1.0 2.40 3.60 688 502 A 46 LYS HBy A 46 LYS HGx 1.0 2.20 3.20 689 502 A 46 LYS HBx A 46 LYS HGx 1.0 2.20 3.20 690 502 A 46 LYS HGy A 46 LYS HBx 1.0 2.20 3.20 691 502 A 46 LYS HBy A 46 LYS HGy 1.0 2.20 3.20 692 503 A 47 ALA H A 47 ALA HA 1.0 2.60 4.00 693 504 A 47 ALA HB% A 47 ALA H 1.0 2.20 4.20 694 505 A 47 ALA HB% A 47 ALA HA 1.0 2.10 3.30 695 506 A 48 ALA HA A 48 ALA H 1.0 2.60 4.00 696 507 A 48 ALA H A 48 ALA HB% 1.0 1.80 3.20 697 508 A 48 ALA HA A 48 ALA HB% 1.0 1.90 4.10 698 509 A 49 ARG H A 49 ARG HA 1.0 2.60 4.00 699 510 A 49 ARG H A 49 ARG HDx 1.0 3.40 5.20 700 510 A 49 ARG H A 49 ARG HDy 1.0 3.40 5.20 701 511 A 49 ARG H A 49 ARG HBx 1.0 2.20 3.40 702 511 A 49 ARG H A 49 ARG HBy 1.0 2.20 3.40 703 512 A 49 ARG H A 49 ARG HGx 1.0 2.50 4.10 704 512 A 49 ARG H A 49 ARG HGy 1.0 2.50 4.10 705 513 A 49 ARG HA A 49 ARG HBx 1.0 2.30 3.70 706 513 A 49 ARG HA A 49 ARG HBy 1.0 2.30 3.70 707 514 A 49 ARG HA A 49 ARG HGx 1.0 2.40 3.80 708 514 A 49 ARG HA A 49 ARG HGy 1.0 2.40 3.80 709 515 A 49 ARG HBx A 49 ARG HGx 1.0 2.20 3.40 710 515 A 49 ARG HBy A 49 ARG HGx 1.0 2.20 3.40 711 515 A 49 ARG HGy A 49 ARG HBx 1.0 2.20 3.40 712 515 A 49 ARG HBy A 49 ARG HGy 1.0 2.20 3.40 713 516 A 49 ARG HBy A 49 ARG HDx 1.0 1.80 3.20 714 516 A 49 ARG HBx A 49 ARG HDx 1.0 1.80 3.20 715 516 A 49 ARG HDy A 49 ARG HBx 1.0 1.80 3.20 716 516 A 49 ARG HBy A 49 ARG HDy 1.0 1.80 3.20 717 517 A 50 GLU H A 50 GLU HA 1.0 2.60 4.00 718 518 A 50 GLU H A 50 GLU HGx 1.0 2.40 3.80 719 518 A 50 GLU H A 50 GLU HGy 1.0 2.40 3.80 720 519 A 50 GLU H A 50 GLU HBx 1.0 2.30 3.70 721 519 A 50 GLU H A 50 GLU HBy 1.0 2.30 3.70 722 520 A 50 GLU HA A 50 GLU HBx 1.0 2.20 3.40 723 520 A 50 GLU HA A 50 GLU HBy 1.0 2.20 3.40 724 521 A 50 GLU HBx A 50 GLU HGx 1.0 2.20 3.40 725 521 A 50 GLU HBy A 50 GLU HGx 1.0 2.20 3.40 726 521 A 50 GLU HGy A 50 GLU HBx 1.0 2.20 3.40 727 521 A 50 GLU HGy A 50 GLU HBy 1.0 2.20 3.40 728 522 A 50 GLU HA A 50 GLU HGx 1.0 2.30 3.50 729 522 A 50 GLU HA A 50 GLU HGy 1.0 2.30 3.50 730 523 A 51 VAL H A 51 VAL HA 1.0 2.60 4.00 731 524 A 51 VAL HB A 51 VAL H 1.0 2.50 3.90 732 525 A 51 VAL H A 51 VAL HGx% 1.0 1.60 3.00 733 525 A 51 VAL HG21 A 51 VAL H 1.0 1.60 3.00 734 526 A 51 VAL HB A 51 VAL HA 1.0 2.20 3.40 735 527 A 51 VAL HA A 51 VAL HGx% 1.0 1.60 2.80 736 527 A 51 VAL HG21 A 51 VAL HA 1.0 1.60 2.80 737 528 A 51 VAL HB A 51 VAL HGx% 1.0 1.90 3.70 738 528 A 51 VAL HG21 A 51 VAL HB 1.0 1.90 3.70 739 529 A 52 GLY H A 52 GLY HAy 1.0 2.60 3.80 740 530 A 53 TYR H A 53 TYR HA 1.0 2.60 4.00 741 531 A 53 TYR H A 53 TYR HBx 1.0 2.40 3.80 742 531 A 53 TYR HBy A 53 TYR H 1.0 2.40 3.80 743 532 A 53 TYR HA A 53 TYR HBx 1.0 1.80 3.20 744 532 A 53 TYR HBy A 53 TYR HA 1.0 1.80 3.20 745 533 A 53 TYR HE% A 53 TYR HA 1.0 3.00 4.40 746 534 A 53 TYR HE% A 53 TYR HBx 1.0 3.20 4.80 747 534 A 53 TYR HBy A 53 TYR HE% 1.0 3.20 4.80 748 535 A 54 LEU H A 54 LEU HBx 1.0 2.40 3.60 749 535 A 54 LEU H A 54 LEU HBy 1.0 2.40 3.60 750 536 A 54 LEU H A 54 LEU HG 1.0 2.30 3.50 751 537 A 54 LEU H A 54 LEU HDy% 1.0 3.40 5.00 752 538 A 54 LEU H A 54 LEU HDx% 1.0 3.20 4.80 753 539 A 54 LEU H A 54 LEU HA 1.0 2.60 4.00 754 540 A 54 LEU HA A 54 LEU HBx 1.0 2.30 3.50 755 540 A 54 LEU HBy A 54 LEU HA 1.0 2.30 3.50 756 541 A 54 LEU HA A 54 LEU HDy% 1.0 2.40 4.40 757 541 A 54 LEU HA A 54 LEU HDx% 1.0 2.40 4.40 758 542 A 54 LEU HG A 54 LEU HA 1.0 2.40 3.80 759 543 A 54 LEU HG A 54 LEU HDy% 1.0 2.10 3.30 760 544 A 54 LEU HG A 54 LEU HDx% 1.0 2.10 3.30 761 545 A 54 LEU HBy A 54 LEU HDx% 1.0 1.90 4.10 762 545 A 54 LEU HDx% A 54 LEU HBx 1.0 1.90 4.10 763 546 A 54 LEU HBx A 54 LEU HDy% 1.0 1.90 4.10 764 546 A 54 LEU HBy A 54 LEU HDy% 1.0 1.90 4.10 765 547 A 54 LEU HG A 54 LEU HBx 1.0 1.70 2.50 766 547 A 54 LEU HG A 54 LEU HBy 1.0 1.70 2.50 767 548 A 54 LEU HA A 54 LEU HDy% 1.0 2.40 4.80 768 549 A 54 LEU HA A 54 LEU HDx% 1.0 2.60 3.80 769 550 A 55 PRO HA A 55 PRO HBx 1.0 2.20 3.40 770 550 A 55 PRO HA A 55 PRO HBy 1.0 2.20 3.40 771 551 A 55 PRO HA A 55 PRO HDx 1.0 3.00 4.60 772 551 A 55 PRO HA A 55 PRO HDy 1.0 3.00 4.60 773 552 A 55 PRO HDx A 55 PRO HGx 1.0 1.90 2.90 774 552 A 55 PRO HDy A 55 PRO HGx 1.0 1.90 2.90 775 552 A 55 PRO HGy A 55 PRO HDx 1.0 1.90 2.90 776 552 A 55 PRO HDy A 55 PRO HGy 1.0 1.90 2.90 777 553 A 55 PRO HBy A 55 PRO HGx 1.0 2.10 3.10 778 553 A 55 PRO HGy A 55 PRO HBx 1.0 2.10 3.10 779 553 A 55 PRO HBy A 55 PRO HGy 1.0 2.10 3.10 780 553 A 55 PRO HBx A 55 PRO HGx 1.0 2.10 3.10 781 554 A 55 PRO HBx A 55 PRO HDx 1.0 2.40 3.60 782 554 A 55 PRO HDy A 55 PRO HBx 1.0 2.40 3.60 783 554 A 55 PRO HBy A 55 PRO HDy 1.0 2.40 3.60 784 554 A 55 PRO HBy A 55 PRO HDx 1.0 2.40 3.60 785 555 A 55 PRO HA A 55 PRO HGx 1.0 2.60 4.00 786 555 A 55 PRO HA A 55 PRO HGy 1.0 2.60 4.00 stop_ save_