data_nef_c17475_2y9t save_entry_information _nef_nmr_meta_data.sf_category nef_nmr_meta_data _nef_nmr_meta_data.sf_framecode entry_information _nef_nmr_meta_data.format_name nmr_exchange_format _nef_nmr_meta_data.format_version 1.1 save_ save_assembly _nef_molecular_system.sf_category nef_molecular_system _nef_molecular_system.sf_framecode assembly loop_ _nef_sequence.index _nef_sequence.chain_code _nef_sequence.sequence_code _nef_sequence.residue_name _nef_sequence.linking _nef_sequence.residue_variant _nef_sequence.cis_peptide 1 A 541 GLY start . false 2 A 542 SER middle . . 3 A 543 TYR middle . . 4 A 544 PRO middle . false 5 A 545 THR middle . . 6 A 546 ASP middle . . 7 A 547 CYS middle . . 8 A 548 SER middle . . 9 A 549 ILE middle . . 10 A 550 VAL middle . . 11 A 551 SER middle . . 12 A 552 PHE middle . . 13 A 553 LEU middle . . 14 A 554 ALA middle . . 15 A 555 ARG middle . . 16 A 556 LEU middle . . 17 A 557 GLY middle . false 18 A 558 CYS middle . . 19 A 559 SER middle . . 20 A 560 SER middle . . 21 A 561 CYS middle . . 22 A 562 LEU middle . . 23 A 563 ASP middle . . 24 A 564 TYR middle . . 25 A 565 PHE middle . . 26 A 566 THR middle . . 27 A 567 THR middle . . 28 A 568 GLN middle . . 29 A 569 GLY middle . false 30 A 570 LEU middle . . 31 A 571 THR middle . . 32 A 572 THR middle . . 33 A 573 ILE middle . . 34 A 574 TYR middle . . 35 A 575 GLN middle . . 36 A 576 ILE middle . . 37 A 577 GLU middle . . 38 A 578 HIS middle . . 39 A 579 TYR middle . . 40 A 580 SER middle . . 41 A 581 MET middle . . 42 A 582 ASP middle . . 43 A 583 ASP middle . . 44 A 584 LEU middle . . 45 A 585 ALA middle . . 46 A 586 SER middle . . 47 A 587 LEU middle . . 48 A 588 LYS middle . . 49 A 589 ILE middle . . 50 A 590 PRO middle . false 51 A 591 GLU middle . . 52 A 592 GLN middle . . 53 A 593 PHE middle . . 54 A 594 ARG middle . . 55 A 595 HIS middle . . 56 A 596 ALA middle . . 57 A 597 ILE middle . . 58 A 598 TRP middle . . 59 A 599 LYS middle . . 60 A 600 GLY middle . false 61 A 601 ILE middle . . 62 A 602 LEU middle . . 63 A 603 ASP middle . . 64 A 604 HIS middle . . 65 A 605 ARG middle . . 66 A 606 GLN middle . . 67 A 607 LEU middle . . 68 A 608 HIS middle . . 69 A 609 GLU middle . . 70 A 610 PHE middle . . 71 A 611 SER middle . . 72 A 612 SER middle . . 73 A 613 PRO middle . false 74 A 614 SER middle . . 75 A 615 HIS middle . . 76 A 616 LEU middle . . 77 A 617 LEU middle . . 78 A 618 ARG middle . . 79 A 619 THR middle . . 80 A 620 PRO middle . false 81 A 621 SER middle . . 82 A 622 SER end . . stop_ save_ save_assigned_chem_shift_list _nef_chemical_shift_list.sf_category nef_chemical_shift_list _nef_chemical_shift_list.sf_framecode assigned_chem_shift_list loop_ _nef_chemical_shift.chain_code _nef_chemical_shift.sequence_code _nef_chemical_shift.residue_name _nef_chemical_shift.atom_name _nef_chemical_shift.element _nef_chemical_shift.isotope_number _nef_chemical_shift.value _nef_chemical_shift.value_uncertainty A 542 SER H H 1 7.783 0.001 A 542 SER HA H 1 4.102 0.001 A 542 SER HBx H 1 3.889 0.001 A 542 SER HBy H 1 3.991 0.001 A 542 SER CA C 13 58.500 0.010 A 542 SER CB C 13 63.960 0.010 A 542 SER N N 15 126.720 0.010 A 543 TYR H H 1 8.275 0.001 A 543 TYR HA H 1 4.788 0.001 A 543 TYR HBy H 1 3.053 0.001 A 543 TYR HBx H 1 2.840 0.001 A 543 TYR CA C 13 56.190 0.010 A 543 TYR CB C 13 38.600 0.010 A 543 TYR N N 15 122.800 0.010 A 544 PRO HA H 1 4.491 0.001 A 544 PRO HDy H 1 3.727 0.001 A 544 PRO HDx H 1 3.458 0.001 A 544 PRO CA C 13 62.680 0.010 A 544 PRO CB C 13 32.240 0.010 A 545 THR H H 1 8.227 0.001 A 545 THR HA H 1 4.255 0.001 A 545 THR HB H 1 4.251 0.001 A 545 THR CA C 13 62.830 0.010 A 545 THR CB C 13 69.620 0.010 A 545 THR N N 15 114.030 0.010 A 546 ASP H H 1 8.219 0.001 A 546 ASP HA H 1 4.736 0.001 A 546 ASP HBx H 1 2.706 0.001 A 546 ASP HBy H 1 2.829 0.001 A 546 ASP CA C 13 54.130 0.010 A 546 ASP CB C 13 41.060 0.010 A 546 ASP N N 15 121.730 0.010 A 547 CYS H H 1 8.535 0.001 A 547 CYS HA H 1 4.560 0.001 A 547 CYS HBx H 1 2.860 0.001 A 547 CYS HBy H 1 3.001 0.001 A 547 CYS CA C 13 57.850 0.010 A 547 CYS CB C 13 28.400 0.010 A 547 CYS N N 15 120.300 0.010 A 548 SER H H 1 8.678 0.001 A 548 SER HA H 1 4.428 0.001 A 548 SER HBx H 1 4.149 0.001 A 548 SER HBy H 1 4.303 0.001 A 548 SER CA C 13 58.940 0.010 A 548 SER CB C 13 64.320 0.010 A 548 SER N N 15 119.210 0.010 A 549 ILE H H 1 8.093 0.001 A 549 ILE HA H 1 3.505 0.001 A 549 ILE HB H 1 1.322 0.001 A 549 ILE HG1y H 1 0.872 0.001 A 549 ILE HG1x H 1 0.842 0.001 A 549 ILE CA C 13 64.100 0.010 A 549 ILE CB C 13 37.370 0.010 A 549 ILE N N 15 124.170 0.010 A 550 VAL H H 1 8.122 0.001 A 550 VAL HA H 1 3.589 0.001 A 550 VAL HB H 1 1.984 0.001 A 550 VAL CA C 13 66.500 0.010 A 550 VAL CB C 13 31.890 0.010 A 550 VAL N N 15 119.800 0.010 A 551 SER H H 1 7.811 0.001 A 551 SER HA H 1 4.168 0.001 A 551 SER HBx H 1 3.779 0.001 A 551 SER HBy H 1 3.802 0.001 A 551 SER CA C 13 61.280 0.010 A 551 SER CB C 13 62.060 0.010 A 551 SER N N 15 117.070 0.010 A 552 PHE H H 1 7.542 0.001 A 552 PHE HA H 1 4.173 0.001 A 552 PHE HB2 H 1 2.884 0.001 A 552 PHE HB3 H 1 3.011 0.001 A 552 PHE HZ H 1 7.176 0.001 A 552 PHE CA C 13 59.990 0.010 A 552 PHE CB C 13 39.700 0.010 A 552 PHE N N 15 123.940 0.010 A 553 LEU H H 1 8.617 0.001 A 553 LEU HA H 1 3.468 0.001 A 553 LEU HB2 H 1 0.823 0.001 A 553 LEU HB3 H 1 1.741 0.001 A 553 LEU HG H 1 1.803 0.001 A 553 LEU CA C 13 57.090 0.010 A 553 LEU CB C 13 40.420 0.010 A 553 LEU N N 15 114.900 0.010 A 554 ALA H H 1 7.751 0.001 A 554 ALA HA H 1 4.114 0.001 A 554 ALA CA C 13 55.190 0.010 A 554 ALA CB C 13 17.880 0.010 A 554 ALA N N 15 121.640 0.010 A 555 ARG H H 1 7.745 0.001 A 555 ARG HA H 1 4.040 0.001 A 555 ARG HBy H 1 1.928 0.001 A 555 ARG HBx H 1 1.843 0.001 A 555 ARG HDy H 1 3.216 0.001 A 555 ARG HDx H 1 3.178 0.001 A 555 ARG HE H 1 7.183 0.001 A 555 ARG HGy H 1 1.740 0.001 A 555 ARG HGx H 1 1.644 0.001 A 555 ARG CA C 13 59.120 0.010 A 555 ARG CB C 13 30.020 0.010 A 555 ARG N N 15 118.470 0.010 A 556 LEU H H 1 6.936 0.001 A 556 LEU HA H 1 4.257 0.001 A 556 LEU HB2 H 1 1.510 0.001 A 556 LEU HB3 H 1 1.398 0.001 A 556 LEU HG H 1 1.477 0.001 A 556 LEU CA C 13 54.370 0.010 A 556 LEU CB C 13 43.380 0.010 A 556 LEU N N 15 115.530 0.010 A 557 GLY H H 1 7.702 0.001 A 557 GLY HA3 H 1 4.063 0.001 A 557 GLY CA C 13 46.510 0.010 A 557 GLY N N 15 107.800 0.010 A 558 CYS H H 1 8.167 0.001 A 558 CYS HA H 1 4.725 0.001 A 558 CYS HBx H 1 2.351 0.001 A 558 CYS HBy H 1 3.009 0.001 A 558 CYS CA C 13 57.770 0.010 A 558 CYS CB C 13 29.190 0.010 A 558 CYS N N 15 114.730 0.010 A 559 SER H H 1 8.544 0.001 A 559 SER HA H 1 3.933 0.001 A 559 SER CA C 13 63.510 0.010 A 559 SER CB C 13 62.290 0.010 A 559 SER N N 15 119.560 0.010 A 560 SER CA C 13 61.020 0.010 A 560 SER CB C 13 62.180 0.010 A 561 CYS H H 1 7.865 0.001 A 561 CYS HBy H 1 3.122 0.001 A 561 CYS HBx H 1 3.073 0.001 A 561 CYS CA C 13 59.690 0.010 A 561 CYS CB C 13 28.160 0.010 A 561 CYS N N 15 117.080 0.010 A 562 LEU H H 1 7.606 0.001 A 562 LEU HA H 1 3.994 0.001 A 562 LEU HB2 H 1 1.926 0.001 A 562 LEU HB3 H 1 1.706 0.001 A 562 LEU HG H 1 1.757 0.001 A 562 LEU CA C 13 59.470 0.010 A 562 LEU CB C 13 42.280 0.010 A 562 LEU N N 15 122.390 0.010 A 563 ASP H H 1 8.891 0.001 A 563 ASP HA H 1 4.561 0.001 A 563 ASP HBx H 1 2.347 0.001 A 563 ASP HBy H 1 2.398 0.001 A 563 ASP CA C 13 57.000 0.010 A 563 ASP CB C 13 39.960 0.010 A 563 ASP N N 15 116.550 0.010 A 564 TYR H H 1 7.331 0.001 A 564 TYR HA H 1 4.105 0.001 A 564 TYR HB2 H 1 2.836 0.001 A 564 TYR HB3 H 1 2.603 0.001 A 564 TYR CA C 13 61.190 0.010 A 564 TYR CB C 13 37.840 0.010 A 564 TYR N N 15 116.280 0.010 A 565 PHE H H 1 7.796 0.001 A 565 PHE HA H 1 4.430 0.001 A 565 PHE HB2 H 1 3.451 0.001 A 565 PHE HB3 H 1 3.279 0.001 A 565 PHE CA C 13 61.080 0.010 A 565 PHE CB C 13 38.840 0.010 A 565 PHE N N 15 112.930 0.010 A 566 THR H H 1 8.658 0.001 A 566 THR HA H 1 3.883 0.001 A 566 THR HB H 1 4.238 0.001 A 566 THR CA C 13 66.180 0.010 A 566 THR CB C 13 67.930 0.010 A 566 THR N N 15 114.940 0.010 A 567 THR H H 1 8.273 0.001 A 567 THR HA H 1 4.139 0.001 A 567 THR HB H 1 4.241 0.001 A 567 THR CA C 13 65.460 0.010 A 567 THR CB C 13 69.210 0.010 A 567 THR N N 15 115.290 0.010 A 568 GLN H H 1 7.059 0.001 A 568 GLN HA H 1 4.586 0.001 A 568 GLN HBy H 1 2.387 0.001 A 568 GLN HBx H 1 1.857 0.001 A 568 GLN HE21 H 1 7.577 0.001 A 568 GLN HE22 H 1 6.846 0.001 A 568 GLN HGy H 1 2.583 0.001 A 568 GLN HGx H 1 2.527 0.001 A 568 GLN CA C 13 54.270 0.010 A 568 GLN CB C 13 28.600 0.010 A 568 GLN N N 15 117.400 0.010 A 569 GLY H H 1 7.942 0.001 A 569 GLY HA3 H 1 4.102 0.001 A 569 GLY CA C 13 46.010 0.010 A 569 GLY N N 15 107.170 0.010 A 570 LEU H H 1 7.610 0.001 A 570 LEU HA H 1 4.527 0.001 A 570 LEU HB2 H 1 0.977 0.001 A 570 LEU HB3 H 1 2.126 0.001 A 570 LEU HG H 1 1.628 0.001 A 570 LEU CA C 13 53.850 0.010 A 570 LEU CB C 13 41.860 0.010 A 570 LEU N N 15 121.890 0.010 A 571 THR H H 1 9.415 0.001 A 571 THR HA H 1 4.505 0.001 A 571 THR HB H 1 4.304 0.001 A 571 THR CA C 13 61.860 0.010 A 571 THR CB C 13 71.300 0.010 A 571 THR N N 15 110.830 0.010 A 572 THR H H 1 8.497 0.001 A 572 THR HA H 1 5.123 0.001 A 572 THR HB H 1 4.197 0.001 A 572 THR CA C 13 59.710 0.010 A 572 THR CB C 13 72.580 0.010 A 572 THR N N 15 116.520 0.010 A 573 ILE H H 1 8.386 0.001 A 573 ILE HA H 1 3.193 0.001 A 573 ILE HB H 1 0.831 0.001 A 573 ILE HG1x H 1 0.017 0.001 A 573 ILE HG1y H 1 0.283 0.001 A 573 ILE CA C 13 61.610 0.010 A 573 ILE CB C 13 37.840 0.010 A 573 ILE N N 15 118.760 0.010 A 574 TYR H H 1 6.772 0.001 A 574 TYR HA H 1 4.771 0.001 A 574 TYR HBx H 1 2.707 0.001 A 574 TYR HBy H 1 3.161 0.001 A 574 TYR CA C 13 59.570 0.010 A 574 TYR CB C 13 37.470 0.010 A 574 TYR N N 15 117.620 0.010 A 575 GLN H H 1 7.328 0.001 A 575 GLN HA H 1 4.145 0.001 A 575 GLN HBx H 1 2.144 0.001 A 575 GLN HBy H 1 2.328 0.001 A 575 GLN HE21 H 1 7.417 0.001 A 575 GLN HE22 H 1 6.783 0.001 A 575 GLN CA C 13 57.970 0.010 A 575 GLN CB C 13 31.660 0.010 A 575 GLN N N 15 114.260 0.010 A 576 ILE H H 1 6.922 0.001 A 576 ILE HA H 1 3.952 0.001 A 576 ILE HB H 1 1.469 0.001 A 576 ILE HG1y H 1 0.781 0.001 A 576 ILE HG1x H 1 0.644 0.001 A 576 ILE CA C 13 60.000 0.010 A 576 ILE CB C 13 39.260 0.010 A 576 ILE N N 15 106.900 0.010 A 577 GLU H H 1 7.016 0.001 A 577 GLU HA H 1 3.794 0.001 A 577 GLU HBx H 1 1.864 0.001 A 577 GLU HBy H 1 2.081 0.001 A 577 GLU CA C 13 59.070 0.010 A 577 GLU CB C 13 29.550 0.010 A 577 GLU N N 15 120.030 0.010 A 578 HIS H H 1 8.449 0.001 A 578 HIS HA H 1 4.845 0.001 A 578 HIS HBy H 1 3.295 0.001 A 578 HIS HBx H 1 3.162 0.001 A 578 HIS HD2 H 1 7.175 0.001 A 578 HIS CA C 13 55.440 0.010 A 578 HIS CB C 13 29.940 0.010 A 578 HIS N N 15 115.230 0.010 A 579 TYR H H 1 7.960 0.001 A 579 TYR HA H 1 4.716 0.001 A 579 TYR HB2 H 1 3.018 0.001 A 579 TYR HB3 H 1 3.672 0.001 A 579 TYR HH H 1 8.054 0.001 A 579 TYR CA C 13 57.350 0.010 A 579 TYR CB C 13 38.000 0.010 A 579 TYR N N 15 124.160 0.010 A 580 SER H H 1 9.522 0.001 A 580 SER HA H 1 4.973 0.001 A 580 SER HBy H 1 4.283 0.001 A 580 SER HBx H 1 4.033 0.001 A 580 SER CA C 13 56.320 0.010 A 580 SER CB C 13 67.200 0.010 A 580 SER N N 15 116.540 0.010 A 581 MET H H 1 8.247 0.001 A 581 MET HA H 1 3.825 0.001 A 581 MET HBx H 1 1.382 0.001 A 581 MET HBy H 1 1.668 0.001 A 581 MET HGx H 1 1.599 0.001 A 581 MET HGy H 1 2.038 0.001 A 581 MET CA C 13 58.870 0.010 A 581 MET CB C 13 31.140 0.010 A 581 MET N N 15 119.180 0.010 A 582 ASP H H 1 7.929 0.001 A 582 ASP HA H 1 4.291 0.001 A 582 ASP HBy H 1 2.522 0.001 A 582 ASP HBx H 1 2.375 0.001 A 582 ASP CA C 13 57.200 0.010 A 582 ASP CB C 13 40.220 0.010 A 582 ASP N N 15 118.720 0.010 A 583 ASP H H 1 7.482 0.001 A 583 ASP HA H 1 4.143 0.001 A 583 ASP HBy H 1 2.489 0.001 A 583 ASP HBx H 1 2.456 0.001 A 583 ASP CA C 13 56.980 0.010 A 583 ASP CB C 13 40.490 0.010 A 583 ASP N N 15 120.890 0.010 A 584 LEU H H 1 7.588 0.001 A 584 LEU HA H 1 4.031 0.001 A 584 LEU HB2 H 1 2.181 0.001 A 584 LEU HB3 H 1 2.129 0.001 A 584 LEU HG H 1 1.460 0.001 A 584 LEU CA C 13 57.570 0.010 A 584 LEU CB C 13 41.260 0.010 A 584 LEU N N 15 118.320 0.010 A 585 ALA H H 1 8.048 0.001 A 585 ALA HA H 1 3.894 0.001 A 585 ALA CA C 13 55.500 0.010 A 585 ALA CB C 13 17.820 0.010 A 585 ALA N N 15 121.670 0.010 A 586 SER H H 1 8.082 0.001 A 586 SER HA H 1 4.210 0.001 A 586 SER HBx H 1 3.946 0.001 A 586 SER HBy H 1 3.995 0.001 A 586 SER CA C 13 61.390 0.010 A 586 SER CB C 13 62.510 0.010 A 586 SER N N 15 117.010 0.010 A 587 LEU H H 1 7.111 0.001 A 587 LEU HA H 1 4.216 0.001 A 587 LEU HB2 H 1 1.370 0.001 A 587 LEU HB3 H 1 1.761 0.001 A 587 LEU HG H 1 1.810 0.001 A 587 LEU CA C 13 54.930 0.010 A 587 LEU CB C 13 43.120 0.010 A 587 LEU N N 15 119.830 0.010 A 588 LYS H H 1 7.762 0.001 A 588 LYS HA H 1 3.566 0.001 A 588 LYS HBx H 1 1.920 0.001 A 588 LYS HBy H 1 2.361 0.001 A 588 LYS HDy H 1 1.729 0.001 A 588 LYS HDx H 1 1.659 0.001 A 588 LYS HGx H 1 1.280 0.001 A 588 LYS HGy H 1 1.330 0.001 A 588 LYS CA C 13 57.000 0.010 A 588 LYS CB C 13 28.140 0.010 A 588 LYS N N 15 109.820 0.010 A 589 ILE H H 1 6.710 0.001 A 589 ILE HA H 1 3.048 0.001 A 589 ILE HB H 1 1.335 0.001 A 589 ILE HG1y H 1 1.189 0.001 A 589 ILE HG1x H 1 1.164 0.001 A 589 ILE CA C 13 58.320 0.010 A 589 ILE CB C 13 38.160 0.010 A 589 ILE N N 15 117.770 0.010 A 590 PRO HA H 1 4.310 0.001 A 590 PRO HB2 H 1 2.558 0.001 A 590 PRO HB3 H 1 1.922 0.001 A 590 PRO HD2 H 1 3.743 0.001 A 590 PRO HD3 H 1 3.409 0.001 A 590 PRO HG2 H 1 2.130 0.001 A 590 PRO HG3 H 1 2.361 0.001 A 590 PRO CA C 13 63.710 0.010 A 590 PRO CB C 13 32.830 0.010 A 591 GLU H H 1 9.060 0.001 A 591 GLU HA H 1 3.508 0.001 A 591 GLU HBx H 1 1.980 0.001 A 591 GLU HBy H 1 2.017 0.001 A 591 GLU CA C 13 61.220 0.010 A 591 GLU CB C 13 30.010 0.010 A 591 GLU N N 15 124.370 0.010 A 592 GLN H H 1 9.222 0.001 A 592 GLN HA H 1 4.099 0.001 A 592 GLN HBy H 1 1.825 0.001 A 592 GLN HBx H 1 1.656 0.001 A 592 GLN HE21 H 1 7.232 0.001 A 592 GLN HE22 H 1 6.868 0.001 A 592 GLN HGy H 1 1.593 0.001 A 592 GLN HGx H 1 1.329 0.001 A 592 GLN CA C 13 58.480 0.010 A 592 GLN CB C 13 27.690 0.010 A 592 GLN N N 15 116.220 0.010 A 593 PHE H H 1 7.608 0.001 A 593 PHE HA H 1 4.940 0.001 A 593 PHE HB2 H 1 3.595 0.001 A 593 PHE HB3 H 1 2.549 0.001 A 593 PHE HZ H 1 7.339 0.001 A 593 PHE CA C 13 57.830 0.010 A 593 PHE CB C 13 41.770 0.010 A 593 PHE N N 15 116.460 0.010 A 594 ARG H H 1 7.639 0.001 A 594 ARG HA H 1 3.746 0.001 A 594 ARG HBy H 1 1.905 0.001 A 594 ARG HBx H 1 1.837 0.001 A 594 ARG HE H 1 6.997 0.001 A 594 ARG CA C 13 61.640 0.010 A 594 ARG CB C 13 30.930 0.010 A 594 ARG N N 15 118.050 0.010 A 595 HIS H H 1 8.662 0.001 A 595 HIS HA H 1 4.440 0.001 A 595 HIS HD2 H 1 7.184 0.001 A 595 HIS CA C 13 61.020 0.010 A 595 HIS CB C 13 29.750 0.010 A 595 HIS N N 15 117.170 0.010 A 596 ALA H H 1 8.245 0.001 A 596 ALA HA H 1 4.121 0.001 A 596 ALA CA C 13 55.090 0.010 A 596 ALA CB C 13 18.570 0.010 A 596 ALA N N 15 121.750 0.010 A 597 ILE H H 1 7.934 0.001 A 597 ILE HA H 1 3.677 0.001 A 597 ILE HB H 1 1.942 0.001 A 597 ILE HG1x H 1 0.719 0.001 A 597 ILE HG1y H 1 2.359 0.001 A 597 ILE CA C 13 65.540 0.010 A 597 ILE CB C 13 38.420 0.010 A 597 ILE N N 15 117.720 0.010 A 598 TRP H H 1 8.760 0.001 A 598 TRP HA H 1 4.403 0.001 A 598 TRP HB2 H 1 3.451 0.001 A 598 TRP HB3 H 1 3.267 0.001 A 598 TRP HD1 H 1 7.126 0.001 A 598 TRP HE1 H 1 10.255 0.001 A 598 TRP HE3 H 1 7.440 0.001 A 598 TRP HH2 H 1 7.286 0.001 A 598 TRP HZ2 H 1 7.544 0.001 A 598 TRP HZ3 H 1 7.236 0.001 A 598 TRP CA C 13 61.360 0.010 A 598 TRP CB C 13 29.710 0.010 A 598 TRP N N 15 121.640 0.010 A 599 LYS H H 1 8.587 0.001 A 599 LYS HA H 1 3.535 0.001 A 599 LYS HBx H 1 1.771 0.001 A 599 LYS HBy H 1 1.843 0.001 A 599 LYS HGy H 1 1.422 0.001 A 599 LYS HGx H 1 1.361 0.001 A 599 LYS CA C 13 59.190 0.010 A 599 LYS CB C 13 31.720 0.010 A 599 LYS N N 15 117.230 0.010 A 600 GLY H H 1 7.867 0.001 A 600 GLY HA3 H 1 4.043 0.001 A 600 GLY CA C 13 47.830 0.010 A 600 GLY N N 15 105.980 0.010 A 601 ILE H H 1 8.625 0.001 A 601 ILE HA H 1 3.506 0.001 A 601 ILE HB H 1 2.147 0.001 A 601 ILE HG1y H 1 2.082 0.001 A 601 ILE HG1x H 1 1.017 0.001 A 601 ILE CA C 13 66.250 0.010 A 601 ILE CB C 13 37.910 0.010 A 601 ILE N N 15 126.620 0.010 A 602 LEU H H 1 8.222 0.001 A 602 LEU HA H 1 3.692 0.001 A 602 LEU HB2 H 1 1.233 0.001 A 602 LEU HB3 H 1 1.374 0.001 A 602 LEU HG H 1 0.909 0.001 A 602 LEU CA C 13 58.230 0.010 A 602 LEU CB C 13 41.030 0.010 A 602 LEU N N 15 121.350 0.010 A 603 ASP H H 1 8.486 0.001 A 603 ASP HA H 1 4.318 0.001 A 603 ASP HBx H 1 2.625 0.001 A 603 ASP HBy H 1 2.770 0.001 A 603 ASP CA C 13 57.060 0.010 A 603 ASP CB C 13 40.440 0.010 A 603 ASP N N 15 119.500 0.010 A 604 HIS H H 1 7.883 0.001 A 604 HIS HA H 1 4.233 0.001 A 604 HIS HB2 H 1 3.331 0.001 A 604 HIS HB3 H 1 3.086 0.001 A 604 HIS HD2 H 1 6.708 0.001 A 604 HIS CA C 13 60.130 0.010 A 604 HIS CB C 13 30.090 0.010 A 604 HIS N N 15 120.540 0.010 A 605 ARG H H 1 8.434 0.001 A 605 ARG HA H 1 3.891 0.001 A 605 ARG HBy H 1 1.974 0.001 A 605 ARG HBx H 1 1.877 0.001 A 605 ARG HDy H 1 3.209 0.001 A 605 ARG HDx H 1 3.164 0.001 A 605 ARG CA C 13 59.220 0.010 A 605 ARG CB C 13 30.800 0.010 A 605 ARG N N 15 118.950 0.010 A 606 GLN H H 1 7.918 0.001 A 606 GLN HA H 1 4.081 0.001 A 606 GLN HE21 H 1 7.108 0.001 A 606 GLN HE22 H 1 7.880 0.001 A 606 GLN HGx H 1 2.358 0.001 A 606 GLN HGy H 1 2.452 0.001 A 606 GLN CA C 13 57.690 0.010 A 606 GLN CB C 13 28.730 0.010 A 606 GLN N N 15 117.150 0.010 A 607 LEU H H 1 7.646 0.001 A 607 LEU HA H 1 4.116 0.001 A 607 LEU HBx H 1 1.340 0.001 A 607 LEU HBy H 1 1.578 0.001 A 607 LEU HG H 1 1.526 0.001 A 607 LEU CA C 13 56.450 0.010 A 607 LEU CB C 13 42.310 0.010 A 607 LEU N N 15 119.310 0.010 A 608 HIS H H 1 7.816 0.001 A 608 HIS HA H 1 4.515 0.001 A 608 HIS HBx H 1 2.872 0.001 A 608 HIS HBy H 1 3.154 0.001 A 608 HIS HD2 H 1 6.967 0.001 A 608 HIS HE1 H 1 8.093 0.001 A 608 HIS CA C 13 56.400 0.010 A 608 HIS CB C 13 29.700 0.010 A 608 HIS N N 15 116.740 0.010 A 609 GLU H H 1 8.037 0.001 A 609 GLU HA H 1 4.108 0.001 A 609 GLU HBy H 1 1.999 0.001 A 609 GLU HBx H 1 1.869 0.001 A 609 GLU CA C 13 57.210 0.010 A 609 GLU CB C 13 30.030 0.010 A 609 GLU N N 15 120.690 0.010 A 610 PHE H H 1 8.172 0.001 A 610 PHE HA H 1 4.598 0.001 A 610 PHE HBx H 1 3.010 0.001 A 610 PHE HBy H 1 3.173 0.001 A 610 PHE HZ H 1 7.235 0.001 A 610 PHE CA C 13 57.780 0.010 A 610 PHE CB C 13 39.400 0.010 A 610 PHE N N 15 119.710 0.010 A 611 SER H H 1 8.084 0.001 A 611 SER HA H 1 4.429 0.001 A 611 SER CA C 13 58.190 0.010 A 611 SER CB C 13 63.990 0.010 A 611 SER N N 15 116.450 0.010 A 612 SER H H 1 8.177 0.001 A 612 SER HA H 1 4.730 0.001 A 612 SER HBy H 1 3.819 0.001 A 612 SER HBx H 1 3.811 0.001 A 612 SER CA C 13 56.800 0.010 A 612 SER CB C 13 63.490 0.010 A 612 SER N N 15 118.480 0.010 A 613 PRO HA H 1 4.426 0.001 A 613 PRO HBx H 1 1.988 0.001 A 613 PRO HBy H 1 2.282 0.001 A 613 PRO HDx H 1 3.704 0.001 A 613 PRO HDy H 1 3.795 0.001 A 614 SER CA C 13 57.770 0.010 A 614 SER CB C 13 64.320 0.010 A 615 HIS H H 1 8.535 0.001 A 615 HIS HD2 H 1 7.041 0.001 A 615 HIS CA C 13 56.650 0.010 A 615 HIS CB C 13 30.120 0.010 A 615 HIS N N 15 124.890 0.010 A 616 LEU H H 1 7.898 0.001 A 616 LEU HA H 1 4.253 0.001 A 616 LEU HG H 1 1.371 0.001 A 616 LEU CA C 13 55.220 0.010 A 616 LEU CB C 13 42.450 0.010 A 616 LEU N N 15 122.000 0.010 A 617 LEU H H 1 8.021 0.001 A 617 LEU HA H 1 4.321 0.001 A 617 LEU HBy H 1 1.624 0.001 A 617 LEU HBx H 1 1.578 0.001 A 617 LEU HG H 1 1.586 0.001 A 617 LEU CA C 13 55.160 0.010 A 617 LEU CB C 13 42.330 0.010 A 617 LEU N N 15 122.240 0.010 A 618 ARG H H 1 8.179 0.001 A 618 ARG HA H 1 4.382 0.001 A 618 ARG HBx H 1 1.726 0.001 A 618 ARG HBy H 1 1.802 0.001 A 618 ARG CA C 13 55.710 0.010 A 618 ARG CB C 13 30.960 0.010 A 618 ARG N N 15 121.800 0.010 A 619 THR H H 1 8.219 0.001 A 619 THR HA H 1 4.571 0.001 A 619 THR HB H 1 4.131 0.001 A 619 THR CA C 13 59.690 0.010 A 619 THR CB C 13 69.810 0.010 A 619 THR N N 15 118.120 0.010 A 620 PRO CA C 13 63.250 0.010 A 620 PRO CB C 13 32.490 0.010 A 621 SER H H 1 8.438 0.001 A 621 SER HA H 1 4.460 0.001 A 621 SER CA C 13 58.570 0.010 A 621 SER CB C 13 63.910 0.010 A 621 SER N N 15 116.460 0.010 A 622 SER H H 1 7.967 0.001 A 622 SER HA H 1 4.272 0.001 A 622 SER CA C 13 59.930 0.010 A 622 SER CB C 13 64.750 0.010 A 622 SER N N 15 123.020 0.010 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 542 SER H A 542 SER HA 1.0 1.8 4.75 2 2 A 542 SER H A 542 SER HBx 1.0 1.8 6.00 3 2 A 542 SER H A 542 SER HBy 1.0 1.8 6.00 4 3 A 542 SER HA A 542 SER HBx 1.0 1.8 3.50 5 3 A 542 SER HA A 542 SER HBy 1.0 1.8 3.50 6 4 A 543 TYR H A 543 TYR HA 1.0 1.8 3.50 7 5 A 543 TYR H A 543 TYR HBy 1.0 1.8 4.75 8 5 A 543 TYR H A 543 TYR HBx 1.0 1.8 4.75 9 6 A 543 TYR H A 543 TYR HD% 1.0 1.8 6.00 10 7 A 543 TYR H A 543 TYR HE% 1.0 1.8 6.00 11 8 A 543 TYR HA A 543 TYR HBy 1.0 1.8 3.50 12 8 A 543 TYR HA A 543 TYR HBx 1.0 1.8 3.50 13 9 A 543 TYR HA A 543 TYR HD% 1.0 1.8 4.75 14 10 A 543 TYR HA A 543 TYR HE% 1.0 1.8 6.00 15 11 A 543 TYR HD% A 543 TYR HBy 1.0 1.8 3.50 16 11 A 543 TYR HBx A 543 TYR HD% 1.0 1.8 3.50 17 12 A 543 TYR HE% A 543 TYR HBy 1.0 1.8 6.00 18 12 A 543 TYR HBx A 543 TYR HE% 1.0 1.8 6.00 19 13 A 545 THR H A 545 THR HA 1.0 1.8 3.50 20 14 A 545 THR H A 545 THR HB 1.0 1.8 4.75 21 15 A 545 THR H A 545 THR HG21 1.0 1.8 4.75 22 16 A 545 THR HA A 545 THR HB 1.0 1.8 3.50 23 17 A 545 THR HA A 545 THR HG21 1.0 1.8 4.75 24 18 A 545 THR HB A 545 THR HG21 1.0 1.8 4.75 25 19 A 546 ASP H A 546 ASP HA 1.0 1.8 3.50 26 20 A 546 ASP H A 546 ASP HBx 1.0 1.8 4.75 27 20 A 546 ASP H A 546 ASP HBy 1.0 1.8 4.75 28 21 A 546 ASP HA A 546 ASP HBx 1.0 1.8 4.75 29 21 A 546 ASP HA A 546 ASP HBy 1.0 1.8 4.75 30 22 A 547 CYS H A 547 CYS HA 1.0 1.8 6.00 31 23 A 547 CYS H A 547 CYS HBx 1.0 1.8 6.00 32 23 A 547 CYS H A 547 CYS HBy 1.0 1.8 6.00 33 24 A 547 CYS HA A 547 CYS HBx 1.0 1.8 4.75 34 24 A 547 CYS HA A 547 CYS HBy 1.0 1.8 4.75 35 25 A 548 SER H A 548 SER HA 1.0 1.8 4.75 36 26 A 548 SER H A 548 SER HBx 1.0 1.8 4.75 37 26 A 548 SER H A 548 SER HBy 1.0 1.8 4.75 38 27 A 548 SER HA A 548 SER HBx 1.0 1.8 4.75 39 27 A 548 SER HA A 548 SER HBy 1.0 1.8 4.75 40 28 A 549 ILE H A 549 ILE HA 1.0 1.8 4.75 41 29 A 549 ILE H A 549 ILE HB 1.0 1.8 3.50 42 30 A 549 ILE H A 549 ILE HG21 1.0 1.8 6.00 43 31 A 549 ILE H A 549 ILE HD11 1.0 1.8 6.00 44 32 A 549 ILE H A 549 ILE HG1y 1.0 1.8 3.50 45 32 A 549 ILE H A 549 ILE HG1x 1.0 1.8 3.50 46 33 A 549 ILE HA A 549 ILE HB 1.0 1.8 3.50 47 34 A 549 ILE HA A 549 ILE HG21 1.0 1.8 4.75 48 35 A 549 ILE HA A 549 ILE HD11 1.0 1.8 4.75 49 36 A 549 ILE HA A 549 ILE HG1y 1.0 1.8 3.50 50 36 A 549 ILE HA A 549 ILE HG1x 1.0 1.8 3.50 51 37 A 549 ILE HB A 549 ILE HG21 1.0 1.8 4.75 52 38 A 549 ILE HB A 549 ILE HD11 1.0 1.8 4.75 53 39 A 549 ILE HB A 549 ILE HG1y 1.0 1.8 3.50 54 39 A 549 ILE HB A 549 ILE HG1x 1.0 1.8 3.50 55 40 A 549 ILE HG21 A 549 ILE HD11 1.0 1.8 4.75 56 41 A 549 ILE HG21 A 549 ILE HG1y 1.0 1.8 4.75 57 41 A 549 ILE HG21 A 549 ILE HG1x 1.0 1.8 4.75 58 42 A 549 ILE HD11 A 549 ILE HG1y 1.0 1.8 3.50 59 42 A 549 ILE HD11 A 549 ILE HG1x 1.0 1.8 3.50 60 43 A 550 VAL H A 550 VAL HA 1.0 1.8 3.50 61 44 A 550 VAL H A 550 VAL HB 1.0 1.8 3.50 62 45 A 550 VAL H A 550 VAL HG11 1.0 1.8 6.00 63 46 A 550 VAL H A 550 VAL HG21 1.0 1.8 4.75 64 47 A 550 VAL HA A 550 VAL HB 1.0 1.8 3.50 65 48 A 550 VAL HA A 550 VAL HG11 1.0 1.8 3.50 66 49 A 550 VAL HA A 550 VAL HG21 1.0 1.8 3.50 67 50 A 550 VAL HB A 550 VAL HG11 1.0 1.8 3.50 68 51 A 550 VAL HB A 550 VAL HG21 1.0 1.8 3.50 69 52 A 551 SER H A 551 SER HA 1.0 1.8 4.75 70 53 A 551 SER H A 551 SER HBx 1.0 1.8 4.75 71 53 A 551 SER H A 551 SER HBy 1.0 1.8 4.75 72 54 A 551 SER HA A 551 SER HBx 1.0 1.8 3.50 73 54 A 551 SER HA A 551 SER HBy 1.0 1.8 3.50 74 55 A 552 PHE H A 552 PHE HA 1.0 1.8 4.75 75 56 A 552 PHE H A 552 PHE HB3 1.0 1.8 3.50 76 57 A 552 PHE H A 552 PHE HB2 1.0 1.8 3.50 77 58 A 552 PHE HA A 552 PHE HB3 1.0 1.8 4.75 78 59 A 552 PHE HA A 552 PHE HB2 1.0 1.8 4.75 79 60 A 552 PHE HA A 552 PHE HD% 1.0 1.8 3.50 80 61 A 552 PHE HA A 552 PHE HE% 1.0 1.8 6.00 81 62 A 552 PHE HB3 A 552 PHE HD% 1.0 1.8 3.50 82 63 A 552 PHE HB3 A 552 PHE HE% 1.0 1.8 6.00 83 64 A 552 PHE HB2 A 552 PHE HD% 1.0 1.8 3.50 84 65 A 552 PHE HB2 A 552 PHE HE% 1.0 1.8 6.00 85 66 A 553 LEU H A 553 LEU HA 1.0 1.8 3.50 86 67 A 553 LEU H A 553 LEU HB3 1.0 1.8 4.75 87 68 A 553 LEU H A 553 LEU HB2 1.0 1.8 3.50 88 69 A 553 LEU H A 553 LEU HG 1.0 1.8 3.50 89 70 A 553 LEU H A 553 LEU HD11 1.0 1.8 6.00 90 71 A 553 LEU H A 553 LEU HD21 1.0 1.8 6.00 91 72 A 553 LEU HA A 553 LEU HB3 1.0 1.8 3.50 92 73 A 553 LEU HA A 553 LEU HB2 1.0 1.8 3.50 93 74 A 553 LEU HA A 553 LEU HG 1.0 1.8 4.75 94 75 A 553 LEU HA A 553 LEU HD11 1.0 1.8 6.00 95 76 A 553 LEU HA A 553 LEU HD21 1.0 1.8 3.50 96 77 A 553 LEU HB3 A 553 LEU HG 1.0 1.8 3.50 97 78 A 553 LEU HB3 A 553 LEU HD11 1.0 1.8 4.75 98 79 A 553 LEU HB3 A 553 LEU HD21 1.0 1.8 4.75 99 80 A 553 LEU HB2 A 553 LEU HG 1.0 1.8 2.80 100 81 A 553 LEU HB2 A 553 LEU HD11 1.0 1.8 3.50 101 82 A 553 LEU HB2 A 553 LEU HD21 1.0 1.8 4.75 102 83 A 553 LEU HG A 553 LEU HD11 1.0 1.8 4.75 103 84 A 553 LEU HG A 553 LEU HD21 1.0 1.8 4.75 104 85 A 554 ALA H A 554 ALA HA 1.0 1.8 3.50 105 86 A 554 ALA H A 554 ALA HB1 1.0 1.8 3.50 106 87 A 554 ALA HA A 554 ALA HB1 1.0 1.8 3.50 107 88 A 555 ARG H A 555 ARG HA 1.0 1.8 3.50 108 89 A 555 ARG H A 555 ARG HBy 1.0 1.8 3.50 109 89 A 555 ARG H A 555 ARG HBx 1.0 1.8 3.50 110 90 A 555 ARG H A 555 ARG HGy 1.0 1.8 4.75 111 90 A 555 ARG H A 555 ARG HGx 1.0 1.8 4.75 112 91 A 555 ARG HA A 555 ARG HBy 1.0 1.8 3.50 113 91 A 555 ARG HA A 555 ARG HBx 1.0 1.8 3.50 114 92 A 555 ARG HA A 555 ARG HGy 1.0 1.8 3.50 115 92 A 555 ARG HA A 555 ARG HGx 1.0 1.8 3.50 116 93 A 555 ARG HA A 555 ARG HDy 1.0 1.8 6.00 117 93 A 555 ARG HA A 555 ARG HDx 1.0 1.8 6.00 118 94 A 555 ARG HE A 555 ARG HBy 1.0 1.8 6.00 119 94 A 555 ARG HBx A 555 ARG HE 1.0 1.8 6.00 120 95 A 555 ARG HE A 555 ARG HDy 1.0 1.8 3.50 121 95 A 555 ARG HDx A 555 ARG HE 1.0 1.8 3.50 122 96 A 555 ARG HBy A 555 ARG HGy 1.0 1.8 2.80 123 96 A 555 ARG HBx A 555 ARG HGy 1.0 1.8 2.80 124 96 A 555 ARG HGx A 555 ARG HBy 1.0 1.8 2.80 125 96 A 555 ARG HBx A 555 ARG HGx 1.0 1.8 2.80 126 97 A 555 ARG HBy A 555 ARG HDy 1.0 1.8 3.50 127 97 A 555 ARG HBx A 555 ARG HDy 1.0 1.8 3.50 128 97 A 555 ARG HDx A 555 ARG HBy 1.0 1.8 3.50 129 97 A 555 ARG HBx A 555 ARG HDx 1.0 1.8 3.50 130 98 A 555 ARG HDy A 555 ARG HGy 1.0 1.8 3.50 131 98 A 555 ARG HDx A 555 ARG HGy 1.0 1.8 3.50 132 98 A 555 ARG HGx A 555 ARG HDy 1.0 1.8 3.50 133 98 A 555 ARG HGx A 555 ARG HDx 1.0 1.8 3.50 134 99 A 556 LEU H A 556 LEU HA 1.0 1.8 4.75 135 100 A 556 LEU H A 556 LEU HB3 1.0 1.8 4.75 136 101 A 556 LEU H A 556 LEU HB2 1.0 1.8 3.50 137 102 A 556 LEU H A 556 LEU HG 1.0 1.8 3.50 138 103 A 556 LEU H A 556 LEU HD11 1.0 1.8 6.00 139 104 A 556 LEU H A 556 LEU HD21 1.0 1.8 6.00 140 105 A 556 LEU HA A 556 LEU HB3 1.0 1.8 3.50 141 106 A 556 LEU HA A 556 LEU HB2 1.0 1.8 4.75 142 107 A 556 LEU HA A 556 LEU HG 1.0 1.8 3.50 143 108 A 556 LEU HA A 556 LEU HD11 1.0 1.8 6.00 144 109 A 556 LEU HA A 556 LEU HD21 1.0 1.8 4.75 145 110 A 556 LEU HB3 A 556 LEU HG 1.0 1.8 3.50 146 111 A 556 LEU HB3 A 556 LEU HD11 1.0 1.8 4.75 147 112 A 556 LEU HB3 A 556 LEU HD21 1.0 1.8 4.75 148 113 A 556 LEU HB2 A 556 LEU HG 1.0 1.8 3.50 149 114 A 556 LEU HB2 A 556 LEU HD11 1.0 1.8 4.75 150 115 A 556 LEU HB2 A 556 LEU HD21 1.0 1.8 4.75 151 116 A 556 LEU HG A 556 LEU HD11 1.0 1.8 3.50 152 117 A 556 LEU HG A 556 LEU HD21 1.0 1.8 3.50 153 118 A 557 GLY H A 557 GLY HAx 1.0 1.8 3.50 154 118 A 557 GLY H A 557 GLY HA3 1.0 1.8 3.50 155 119 A 558 CYS H A 558 CYS HA 1.0 1.8 3.50 156 120 A 558 CYS H A 558 CYS HBx 1.0 1.8 3.50 157 120 A 558 CYS H A 558 CYS HBy 1.0 1.8 3.50 158 121 A 558 CYS HA A 558 CYS HBx 1.0 1.8 3.50 159 121 A 558 CYS HA A 558 CYS HBy 1.0 1.8 3.50 160 122 A 559 SER H A 559 SER HA 1.0 1.8 4.75 161 123 A 559 SER H A 559 SER HBx 1.0 1.8 4.75 162 123 A 559 SER H A 559 SER HBy 1.0 1.8 4.75 163 124 A 559 SER HA A 559 SER HBx 1.0 1.8 3.50 164 124 A 559 SER HA A 559 SER HBy 1.0 1.8 3.50 165 125 A 561 CYS H A 561 CYS HBy 1.0 1.8 3.50 166 125 A 561 CYS H A 561 CYS HBx 1.0 1.8 3.50 167 126 A 562 LEU H A 562 LEU HA 1.0 1.8 3.50 168 127 A 562 LEU H A 562 LEU HB3 1.0 1.8 3.50 169 128 A 562 LEU H A 562 LEU HB2 1.0 1.8 3.50 170 129 A 562 LEU H A 562 LEU HG 1.0 1.8 6.00 171 130 A 562 LEU H A 562 LEU HD11 1.0 1.8 6.00 172 131 A 562 LEU H A 562 LEU HD21 1.0 1.8 6.00 173 132 A 562 LEU HA A 562 LEU HB3 1.0 1.8 4.75 174 133 A 562 LEU HA A 562 LEU HB2 1.0 1.8 3.50 175 134 A 562 LEU HA A 562 LEU HG 1.0 1.8 4.75 176 135 A 562 LEU HA A 562 LEU HD11 1.0 1.8 3.50 177 136 A 562 LEU HA A 562 LEU HD21 1.0 1.8 6.00 178 137 A 562 LEU HB3 A 562 LEU HG 1.0 1.8 3.50 179 138 A 562 LEU HB3 A 562 LEU HD11 1.0 1.8 4.75 180 139 A 562 LEU HB3 A 562 LEU HD21 1.0 1.8 3.50 181 140 A 562 LEU HB2 A 562 LEU HG 1.0 1.8 4.75 182 141 A 562 LEU HB2 A 562 LEU HD11 1.0 1.8 3.50 183 142 A 562 LEU HB2 A 562 LEU HD21 1.0 1.8 3.50 184 143 A 562 LEU HG A 562 LEU HD11 1.0 1.8 3.50 185 144 A 562 LEU HG A 562 LEU HD21 1.0 1.8 3.50 186 145 A 563 ASP H A 563 ASP HA 1.0 1.8 4.75 187 146 A 563 ASP H A 563 ASP HBx 1.0 1.8 3.50 188 146 A 563 ASP H A 563 ASP HBy 1.0 1.8 3.50 189 147 A 563 ASP HA A 563 ASP HBx 1.0 1.8 3.50 190 147 A 563 ASP HA A 563 ASP HBy 1.0 1.8 3.50 191 148 A 564 TYR H A 564 TYR HA 1.0 1.8 3.50 192 149 A 564 TYR H A 564 TYR HB3 1.0 1.8 3.50 193 150 A 564 TYR H A 564 TYR HB2 1.0 1.8 3.50 194 151 A 564 TYR H A 564 TYR HD% 1.0 1.8 3.50 195 152 A 564 TYR HA A 564 TYR HB3 1.0 1.8 3.50 196 153 A 564 TYR HA A 564 TYR HB2 1.0 1.8 4.75 197 154 A 564 TYR HA A 564 TYR HD% 1.0 1.8 3.50 198 155 A 564 TYR HB3 A 564 TYR HD% 1.0 1.8 3.50 199 156 A 564 TYR HB3 A 564 TYR HE% 1.0 1.8 6.00 200 157 A 564 TYR HB2 A 564 TYR HD% 1.0 1.8 3.50 201 158 A 564 TYR HB2 A 564 TYR HE% 1.0 1.8 6.00 202 159 A 565 PHE H A 565 PHE HA 1.0 1.8 4.75 203 160 A 565 PHE H A 565 PHE HB3 1.0 1.8 4.75 204 161 A 565 PHE H A 565 PHE HB2 1.0 1.8 3.50 205 162 A 565 PHE H A 565 PHE HD% 1.0 1.8 3.50 206 163 A 565 PHE H A 565 PHE HE% 1.0 1.8 6.00 207 164 A 565 PHE HA A 565 PHE HB3 1.0 1.8 3.50 208 165 A 565 PHE HA A 565 PHE HB2 1.0 1.8 3.50 209 166 A 565 PHE HA A 565 PHE HD% 1.0 1.8 3.50 210 167 A 565 PHE HA A 565 PHE HE% 1.0 1.8 6.00 211 168 A 565 PHE HB3 A 565 PHE HD% 1.0 1.8 3.50 212 169 A 565 PHE HB3 A 565 PHE HE% 1.0 1.8 6.00 213 170 A 565 PHE HB2 A 565 PHE HD% 1.0 1.8 3.50 214 171 A 565 PHE HB2 A 565 PHE HE% 1.0 1.8 6.00 215 172 A 566 THR H A 566 THR HA 1.0 1.8 3.50 216 173 A 566 THR H A 566 THR HB 1.0 1.8 4.75 217 174 A 566 THR H A 566 THR HG21 1.0 1.8 4.75 218 175 A 566 THR HA A 566 THR HB 1.0 1.8 3.50 219 176 A 566 THR HA A 566 THR HG21 1.0 1.8 3.50 220 177 A 566 THR HB A 566 THR HG21 1.0 1.8 3.50 221 178 A 567 THR H A 567 THR HA 1.0 1.8 3.50 222 179 A 567 THR H A 567 THR HB 1.0 1.8 4.75 223 180 A 567 THR H A 567 THR HG21 1.0 1.8 4.75 224 181 A 567 THR HA A 567 THR HB 1.0 1.8 3.50 225 182 A 567 THR HA A 567 THR HG21 1.0 1.8 3.50 226 183 A 567 THR HB A 567 THR HG21 1.0 1.8 3.50 227 184 A 568 GLN H A 568 GLN HA 1.0 1.8 4.75 228 185 A 568 GLN H A 568 GLN HBy 1.0 1.8 3.50 229 185 A 568 GLN H A 568 GLN HBx 1.0 1.8 3.50 230 186 A 568 GLN H A 568 GLN HGy 1.0 1.8 4.75 231 186 A 568 GLN H A 568 GLN HGx 1.0 1.8 4.75 232 187 A 568 GLN HA A 568 GLN HBy 1.0 1.8 3.50 233 187 A 568 GLN HA A 568 GLN HBx 1.0 1.8 3.50 234 188 A 568 GLN HA A 568 GLN HGy 1.0 1.8 4.75 235 188 A 568 GLN HA A 568 GLN HGx 1.0 1.8 4.75 236 189 A 568 GLN HBy A 568 GLN HGy 1.0 1.8 3.50 237 189 A 568 GLN HBx A 568 GLN HGy 1.0 1.8 3.50 238 189 A 568 GLN HGx A 568 GLN HBy 1.0 1.8 3.50 239 189 A 568 GLN HBx A 568 GLN HGx 1.0 1.8 3.50 240 190 A 568 GLN HBx A 568 GLN HE22 1.0 1.8 3.50 241 190 A 568 GLN HBy A 568 GLN HE22 1.0 1.8 3.50 242 190 A 568 GLN HE21 A 568 GLN HBy 1.0 1.8 3.50 243 190 A 568 GLN HBx A 568 GLN HE21 1.0 1.8 3.50 244 191 A 568 GLN HE22 A 568 GLN HGy 1.0 1.8 4.75 245 191 A 568 GLN HGx A 568 GLN HE22 1.0 1.8 4.75 246 191 A 568 GLN HGx A 568 GLN HE21 1.0 1.8 4.75 247 191 A 568 GLN HE21 A 568 GLN HGy 1.0 1.8 4.75 248 192 A 569 GLY H A 569 GLY HAx 1.0 1.8 3.50 249 192 A 569 GLY H A 569 GLY HA3 1.0 1.8 3.50 250 193 A 570 LEU H A 570 LEU HA 1.0 1.8 4.75 251 194 A 570 LEU H A 570 LEU HB3 1.0 1.8 4.75 252 195 A 570 LEU H A 570 LEU HB2 1.0 1.8 3.50 253 196 A 570 LEU H A 570 LEU HG 1.0 1.8 3.50 254 197 A 570 LEU H A 570 LEU HD11 1.0 1.8 6.00 255 198 A 570 LEU H A 570 LEU HD21 1.0 1.8 6.00 256 199 A 570 LEU HA A 570 LEU HB3 1.0 1.8 4.75 257 200 A 570 LEU HA A 570 LEU HB2 1.0 1.8 4.75 258 201 A 570 LEU HA A 570 LEU HG 1.0 1.8 6.00 259 202 A 570 LEU HA A 570 LEU HD11 1.0 1.8 6.00 260 203 A 570 LEU HA A 570 LEU HD21 1.0 1.8 4.75 261 204 A 570 LEU HB3 A 570 LEU HG 1.0 1.8 4.75 262 205 A 570 LEU HB3 A 570 LEU HD11 1.0 1.8 3.50 263 206 A 570 LEU HB3 A 570 LEU HD21 1.0 1.8 4.75 264 207 A 570 LEU HB2 A 570 LEU HG 1.0 1.8 3.50 265 208 A 570 LEU HB2 A 570 LEU HD11 1.0 1.8 4.75 266 209 A 570 LEU HB2 A 570 LEU HD21 1.0 1.8 4.75 267 210 A 570 LEU HG A 570 LEU HD11 1.0 1.8 4.75 268 211 A 570 LEU HG A 570 LEU HD21 1.0 1.8 3.50 269 212 A 571 THR H A 571 THR HA 1.0 1.8 3.50 270 213 A 571 THR H A 571 THR HB 1.0 1.8 6.00 271 214 A 571 THR H A 571 THR HG21 1.0 1.8 6.00 272 215 A 571 THR HA A 571 THR HB 1.0 1.8 6.00 273 216 A 571 THR HA A 571 THR HG21 1.0 1.8 4.75 274 217 A 571 THR HB A 571 THR HG21 1.0 1.8 3.50 275 218 A 572 THR H A 572 THR HA 1.0 1.8 4.75 276 219 A 572 THR H A 572 THR HB 1.0 1.8 6.00 277 220 A 572 THR H A 572 THR HG21 1.0 1.8 6.00 278 221 A 572 THR HA A 572 THR HB 1.0 1.8 4.75 279 222 A 572 THR HA A 572 THR HG21 1.0 1.8 6.00 280 223 A 572 THR HB A 572 THR HG21 1.0 1.8 4.75 281 224 A 573 ILE H A 573 ILE HA 1.0 1.8 4.75 282 225 A 573 ILE H A 573 ILE HB 1.0 1.8 3.50 283 226 A 573 ILE H A 573 ILE HG21 1.0 1.8 4.75 284 227 A 573 ILE H A 573 ILE HD11 1.0 1.8 6.00 285 228 A 573 ILE H A 573 ILE HG1x 1.0 1.8 4.75 286 228 A 573 ILE H A 573 ILE HG1y 1.0 1.8 4.75 287 229 A 573 ILE HA A 573 ILE HB 1.0 1.8 3.50 288 230 A 573 ILE HA A 573 ILE HG21 1.0 1.8 4.75 289 231 A 573 ILE HA A 573 ILE HD11 1.0 1.8 6.00 290 232 A 573 ILE HA A 573 ILE HG1x 1.0 1.8 4.75 291 232 A 573 ILE HA A 573 ILE HG1y 1.0 1.8 4.75 292 233 A 573 ILE HB A 573 ILE HG21 1.0 1.8 4.75 293 234 A 573 ILE HB A 573 ILE HD11 1.0 1.8 6.00 294 235 A 573 ILE HB A 573 ILE HG1x 1.0 1.8 4.75 295 235 A 573 ILE HB A 573 ILE HG1y 1.0 1.8 4.75 296 236 A 573 ILE HG21 A 573 ILE HD11 1.0 1.8 6.00 297 237 A 573 ILE HG21 A 573 ILE HG1x 1.0 1.8 4.75 298 237 A 573 ILE HG21 A 573 ILE HG1y 1.0 1.8 4.75 299 238 A 573 ILE HD11 A 573 ILE HG1x 1.0 1.8 4.75 300 238 A 573 ILE HD11 A 573 ILE HG1y 1.0 1.8 4.75 301 239 A 574 TYR H A 574 TYR HBx 1.0 1.8 4.75 302 239 A 574 TYR H A 574 TYR HBy 1.0 1.8 4.75 303 240 A 574 TYR HA A 574 TYR HBx 1.0 1.8 3.50 304 240 A 574 TYR HBy A 574 TYR HA 1.0 1.8 3.50 305 241 A 574 TYR HD% A 574 TYR HBx 1.0 1.8 3.50 306 241 A 574 TYR HBy A 574 TYR HD% 1.0 1.8 3.50 307 242 A 574 TYR HE% A 574 TYR HBx 1.0 1.8 6.00 308 242 A 574 TYR HBy A 574 TYR HE% 1.0 1.8 6.00 309 243 A 575 GLN H A 575 GLN HA 1.0 1.8 3.50 310 244 A 575 GLN H A 575 GLN HBx 1.0 1.8 4.75 311 244 A 575 GLN H A 575 GLN HBy 1.0 1.8 4.75 312 245 A 575 GLN HA A 575 GLN HBx 1.0 1.8 3.50 313 245 A 575 GLN HA A 575 GLN HBy 1.0 1.8 3.50 314 246 A 576 ILE H A 576 ILE HA 1.0 1.8 4.75 315 247 A 576 ILE H A 576 ILE HB 1.0 1.8 4.75 316 248 A 576 ILE H A 576 ILE HG21 1.0 1.8 6.00 317 249 A 576 ILE H A 576 ILE HD11 1.0 1.8 6.00 318 250 A 576 ILE H A 576 ILE HG1y 1.0 1.8 3.50 319 250 A 576 ILE H A 576 ILE HG1x 1.0 1.8 3.50 320 251 A 576 ILE HA A 576 ILE HB 1.0 1.8 3.50 321 252 A 576 ILE HA A 576 ILE HG21 1.0 1.8 4.75 322 253 A 576 ILE HA A 576 ILE HD11 1.0 1.8 6.00 323 254 A 576 ILE HA A 576 ILE HG1y 1.0 1.8 4.75 324 254 A 576 ILE HA A 576 ILE HG1x 1.0 1.8 4.75 325 255 A 576 ILE HB A 576 ILE HG21 1.0 1.8 4.75 326 256 A 576 ILE HB A 576 ILE HD11 1.0 1.8 3.50 327 257 A 576 ILE HB A 576 ILE HG1y 1.0 1.8 3.50 328 257 A 576 ILE HB A 576 ILE HG1x 1.0 1.8 3.50 329 258 A 576 ILE HG21 A 576 ILE HD11 1.0 1.8 4.75 330 259 A 576 ILE HG21 A 576 ILE HG1y 1.0 1.8 4.75 331 259 A 576 ILE HG21 A 576 ILE HG1x 1.0 1.8 4.75 332 260 A 576 ILE HD11 A 576 ILE HG1y 1.0 1.8 4.75 333 260 A 576 ILE HD11 A 576 ILE HG1x 1.0 1.8 4.75 334 261 A 577 GLU H A 577 GLU HA 1.0 1.8 3.50 335 262 A 577 GLU H A 577 GLU HBx 1.0 1.8 3.50 336 262 A 577 GLU H A 577 GLU HBy 1.0 1.8 3.50 337 263 A 577 GLU H A 577 GLU HGx 1.0 1.8 4.75 338 263 A 577 GLU H A 577 GLU HGy 1.0 1.8 4.75 339 264 A 577 GLU HA A 577 GLU HBx 1.0 1.8 3.50 340 264 A 577 GLU HA A 577 GLU HBy 1.0 1.8 3.50 341 265 A 577 GLU HA A 577 GLU HGx 1.0 1.8 4.75 342 265 A 577 GLU HA A 577 GLU HGy 1.0 1.8 4.75 343 266 A 577 GLU HBx A 577 GLU HGx 1.0 1.8 3.50 344 266 A 577 GLU HBy A 577 GLU HGx 1.0 1.8 3.50 345 266 A 577 GLU HGy A 577 GLU HBx 1.0 1.8 3.50 346 266 A 577 GLU HBy A 577 GLU HGy 1.0 1.8 3.50 347 267 A 578 HIS H A 578 HIS HA 1.0 1.8 4.75 348 268 A 578 HIS H A 578 HIS HBy 1.0 1.8 4.75 349 268 A 578 HIS H A 578 HIS HBx 1.0 1.8 4.75 350 269 A 578 HIS HA A 578 HIS HD2 1.0 1.8 4.75 351 270 A 578 HIS HA A 578 HIS HBy 1.0 1.8 3.50 352 270 A 578 HIS HA A 578 HIS HBx 1.0 1.8 3.50 353 271 A 578 HIS HD2 A 578 HIS HBy 1.0 1.8 3.50 354 271 A 578 HIS HBx A 578 HIS HD2 1.0 1.8 3.50 355 272 A 579 TYR H A 579 TYR HA 1.0 1.8 4.75 356 273 A 579 TYR H A 579 TYR HB3 1.0 1.8 4.75 357 274 A 579 TYR H A 579 TYR HB2 1.0 1.8 3.50 358 275 A 579 TYR H A 579 TYR HD% 1.0 1.8 3.50 359 276 A 579 TYR H A 579 TYR HE% 1.0 1.8 6.00 360 277 A 579 TYR HA A 579 TYR HB3 1.0 1.8 4.75 361 278 A 579 TYR HA A 579 TYR HB2 1.0 1.8 4.75 362 279 A 579 TYR HA A 579 TYR HD% 1.0 1.8 4.75 363 280 A 579 TYR HA A 579 TYR HE% 1.0 1.8 6.00 364 281 A 579 TYR HB3 A 579 TYR HD% 1.0 1.8 3.50 365 282 A 579 TYR HB3 A 579 TYR HE% 1.0 1.8 6.00 366 283 A 579 TYR HB2 A 579 TYR HD% 1.0 1.8 3.50 367 284 A 579 TYR HB2 A 579 TYR HE% 1.0 1.8 6.00 368 285 A 580 SER H A 580 SER HA 1.0 1.8 4.75 369 286 A 580 SER H A 580 SER HBy 1.0 1.8 4.75 370 286 A 580 SER H A 580 SER HBx 1.0 1.8 4.75 371 287 A 580 SER HA A 580 SER HBy 1.0 1.8 4.75 372 287 A 580 SER HA A 580 SER HBx 1.0 1.8 4.75 373 288 A 581 MET H A 581 MET HA 1.0 1.8 4.75 374 289 A 581 MET H A 581 MET HBx 1.0 1.8 3.50 375 289 A 581 MET H A 581 MET HBy 1.0 1.8 3.50 376 290 A 581 MET H A 581 MET HGx 1.0 1.8 4.75 377 290 A 581 MET H A 581 MET HGy 1.0 1.8 4.75 378 291 A 581 MET HA A 581 MET HE1 1.0 1.8 6.00 379 292 A 581 MET HA A 581 MET HBx 1.0 1.8 3.50 380 292 A 581 MET HA A 581 MET HBy 1.0 1.8 3.50 381 293 A 581 MET HA A 581 MET HGx 1.0 1.8 4.75 382 293 A 581 MET HA A 581 MET HGy 1.0 1.8 4.75 383 294 A 581 MET HE1 A 581 MET HBx 1.0 1.8 4.75 384 294 A 581 MET HBy A 581 MET HE1 1.0 1.8 4.75 385 295 A 581 MET HE1 A 581 MET HGx 1.0 1.8 3.50 386 295 A 581 MET HGy A 581 MET HE1 1.0 1.8 3.50 387 296 A 581 MET HBy A 581 MET HGx 1.0 1.8 3.50 388 296 A 581 MET HBx A 581 MET HGx 1.0 1.8 3.50 389 296 A 581 MET HGy A 581 MET HBx 1.0 1.8 3.50 390 296 A 581 MET HBy A 581 MET HGy 1.0 1.8 3.50 391 297 A 582 ASP H A 582 ASP HA 1.0 1.8 3.50 392 298 A 582 ASP H A 582 ASP HBy 1.0 1.8 3.50 393 298 A 582 ASP H A 582 ASP HBx 1.0 1.8 3.50 394 299 A 582 ASP HA A 582 ASP HBy 1.0 1.8 3.50 395 299 A 582 ASP HA A 582 ASP HBx 1.0 1.8 3.50 396 300 A 583 ASP H A 583 ASP HA 1.0 1.8 4.75 397 301 A 583 ASP H A 583 ASP HBy 1.0 1.8 3.50 398 301 A 583 ASP H A 583 ASP HBx 1.0 1.8 3.50 399 302 A 583 ASP HA A 583 ASP HBy 1.0 1.8 3.50 400 302 A 583 ASP HA A 583 ASP HBx 1.0 1.8 3.50 401 303 A 584 LEU H A 584 LEU HA 1.0 1.8 3.50 402 304 A 584 LEU H A 584 LEU HB3 1.0 1.8 4.75 403 305 A 584 LEU H A 584 LEU HB2 1.0 1.8 3.50 404 306 A 584 LEU H A 584 LEU HG 1.0 1.8 4.75 405 307 A 584 LEU H A 584 LEU HD11 1.0 1.8 6.00 406 308 A 584 LEU H A 584 LEU HD21 1.0 1.8 6.00 407 309 A 584 LEU HA A 584 LEU HB3 1.0 1.8 4.75 408 310 A 584 LEU HA A 584 LEU HB2 1.0 1.8 4.75 409 311 A 584 LEU HA A 584 LEU HG 1.0 1.8 4.75 410 312 A 584 LEU HA A 584 LEU HD11 1.0 1.8 4.75 411 313 A 584 LEU HA A 584 LEU HD21 1.0 1.8 3.50 412 314 A 584 LEU HB3 A 584 LEU HG 1.0 1.8 6.00 413 315 A 584 LEU HB3 A 584 LEU HD11 1.0 1.8 3.50 414 316 A 584 LEU HB3 A 584 LEU HD21 1.0 1.8 4.75 415 317 A 584 LEU HB2 A 584 LEU HG 1.0 1.8 6.00 416 318 A 584 LEU HB2 A 584 LEU HD11 1.0 1.8 3.50 417 319 A 584 LEU HB2 A 584 LEU HD21 1.0 1.8 4.75 418 320 A 584 LEU HG A 584 LEU HD11 1.0 1.8 4.75 419 321 A 584 LEU HG A 584 LEU HD21 1.0 1.8 6.00 420 322 A 585 ALA H A 585 ALA HA 1.0 1.8 3.50 421 323 A 585 ALA H A 585 ALA HB1 1.0 1.8 3.50 422 324 A 585 ALA HA A 585 ALA HB1 1.0 1.8 3.50 423 325 A 586 SER H A 586 SER HA 1.0 1.8 3.50 424 326 A 586 SER H A 586 SER HBx 1.0 1.8 3.50 425 326 A 586 SER H A 586 SER HBy 1.0 1.8 3.50 426 327 A 586 SER HA A 586 SER HBx 1.0 1.8 3.50 427 327 A 586 SER HA A 586 SER HBy 1.0 1.8 3.50 428 328 A 587 LEU H A 587 LEU HA 1.0 1.8 3.50 429 329 A 587 LEU H A 587 LEU HB3 1.0 1.8 4.75 430 330 A 587 LEU H A 587 LEU HB2 1.0 1.8 3.50 431 331 A 587 LEU H A 587 LEU HG 1.0 1.8 3.50 432 332 A 587 LEU H A 587 LEU HD11 1.0 1.8 6.00 433 333 A 587 LEU H A 587 LEU HD21 1.0 1.8 6.00 434 334 A 587 LEU HA A 587 LEU HB3 1.0 1.8 3.50 435 335 A 587 LEU HA A 587 LEU HB2 1.0 1.8 4.75 436 336 A 587 LEU HA A 587 LEU HG 1.0 1.8 4.75 437 337 A 587 LEU HA A 587 LEU HD11 1.0 1.8 6.00 438 338 A 587 LEU HA A 587 LEU HD21 1.0 1.8 3.50 439 339 A 587 LEU HB3 A 587 LEU HG 1.0 1.8 4.75 440 340 A 587 LEU HB3 A 587 LEU HD11 1.0 1.8 4.75 441 341 A 587 LEU HB3 A 587 LEU HD21 1.0 1.8 4.75 442 342 A 587 LEU HB2 A 587 LEU HG 1.0 1.8 3.50 443 343 A 587 LEU HB2 A 587 LEU HD11 1.0 1.8 4.75 444 344 A 587 LEU HB2 A 587 LEU HD21 1.0 1.8 4.75 445 345 A 587 LEU HG A 587 LEU HD11 1.0 1.8 4.75 446 346 A 587 LEU HG A 587 LEU HD21 1.0 1.8 4.75 447 347 A 588 LYS H A 588 LYS HA 1.0 1.8 3.50 448 348 A 588 LYS H A 588 LYS HBx 1.0 1.8 3.50 449 348 A 588 LYS H A 588 LYS HBy 1.0 1.8 3.50 450 349 A 588 LYS H A 588 LYS HGx 1.0 1.8 4.75 451 349 A 588 LYS H A 588 LYS HGy 1.0 1.8 4.75 452 350 A 588 LYS HA A 588 LYS HBx 1.0 1.8 3.50 453 350 A 588 LYS HA A 588 LYS HBy 1.0 1.8 3.50 454 351 A 588 LYS HA A 588 LYS HGx 1.0 1.8 3.50 455 351 A 588 LYS HA A 588 LYS HGy 1.0 1.8 3.50 456 352 A 588 LYS HBx A 588 LYS HGx 1.0 1.8 3.50 457 352 A 588 LYS HBy A 588 LYS HGx 1.0 1.8 3.50 458 352 A 588 LYS HGy A 588 LYS HBx 1.0 1.8 3.50 459 352 A 588 LYS HBy A 588 LYS HGy 1.0 1.8 3.50 460 353 A 588 LYS HBx A 588 LYS HDy 1.0 1.8 3.50 461 353 A 588 LYS HDx A 588 LYS HBx 1.0 1.8 3.50 462 353 A 588 LYS HBy A 588 LYS HDx 1.0 1.8 3.50 463 353 A 588 LYS HBy A 588 LYS HDy 1.0 1.8 3.50 464 354 A 588 LYS HBx A 588 LYS HEx 1.0 1.8 4.75 465 354 A 588 LYS HBy A 588 LYS HEx 1.0 1.8 4.75 466 354 A 588 LYS HEy A 588 LYS HBx 1.0 1.8 4.75 467 354 A 588 LYS HBy A 588 LYS HEy 1.0 1.8 4.75 468 355 A 588 LYS HDy A 588 LYS HGx 1.0 1.8 3.50 469 355 A 588 LYS HDx A 588 LYS HGx 1.0 1.8 3.50 470 355 A 588 LYS HGy A 588 LYS HDy 1.0 1.8 3.50 471 355 A 588 LYS HGy A 588 LYS HDx 1.0 1.8 3.50 472 356 A 588 LYS HEy A 588 LYS HGx 1.0 1.8 4.75 473 356 A 588 LYS HEx A 588 LYS HGx 1.0 1.8 4.75 474 356 A 588 LYS HGy A 588 LYS HEx 1.0 1.8 4.75 475 356 A 588 LYS HGy A 588 LYS HEy 1.0 1.8 4.75 476 357 A 588 LYS HDy A 588 LYS HEx 1.0 1.8 4.75 477 357 A 588 LYS HDx A 588 LYS HEx 1.0 1.8 4.75 478 357 A 588 LYS HEy A 588 LYS HDy 1.0 1.8 4.75 479 357 A 588 LYS HDx A 588 LYS HEy 1.0 1.8 4.75 480 358 A 589 ILE H A 589 ILE HA 1.0 1.8 3.50 481 359 A 589 ILE H A 589 ILE HB 1.0 1.8 3.50 482 360 A 589 ILE H A 589 ILE HG21 1.0 1.8 4.75 483 361 A 589 ILE H A 589 ILE HD11 1.0 1.8 6.00 484 362 A 589 ILE H A 589 ILE HG1y 1.0 1.8 3.50 485 362 A 589 ILE H A 589 ILE HG1x 1.0 1.8 3.50 486 363 A 589 ILE HA A 589 ILE HB 1.0 1.8 4.75 487 364 A 589 ILE HA A 589 ILE HG21 1.0 1.8 4.75 488 365 A 589 ILE HA A 589 ILE HD11 1.0 1.8 4.75 489 366 A 589 ILE HA A 589 ILE HG1y 1.0 1.8 4.75 490 366 A 589 ILE HA A 589 ILE HG1x 1.0 1.8 4.75 491 367 A 589 ILE HB A 589 ILE HG21 1.0 1.8 3.50 492 368 A 589 ILE HB A 589 ILE HD11 1.0 1.8 4.75 493 369 A 589 ILE HB A 589 ILE HG1y 1.0 1.8 3.50 494 369 A 589 ILE HB A 589 ILE HG1x 1.0 1.8 3.50 495 370 A 589 ILE HG21 A 589 ILE HD11 1.0 1.8 4.75 496 371 A 589 ILE HG21 A 589 ILE HG1y 1.0 1.8 3.50 497 371 A 589 ILE HG21 A 589 ILE HG1x 1.0 1.8 3.50 498 372 A 589 ILE HD11 A 589 ILE HG1y 1.0 1.8 4.75 499 372 A 589 ILE HD11 A 589 ILE HG1x 1.0 1.8 4.75 500 373 A 591 GLU H A 591 GLU HA 1.0 1.8 4.75 501 374 A 591 GLU H A 591 GLU HBx 1.0 1.8 3.50 502 374 A 591 GLU H A 591 GLU HBy 1.0 1.8 3.50 503 375 A 591 GLU H A 591 GLU HGx 1.0 1.8 4.75 504 375 A 591 GLU H A 591 GLU HGy 1.0 1.8 4.75 505 376 A 591 GLU HA A 591 GLU HBx 1.0 1.8 3.50 506 376 A 591 GLU HA A 591 GLU HBy 1.0 1.8 3.50 507 377 A 591 GLU HA A 591 GLU HGx 1.0 1.8 3.50 508 377 A 591 GLU HA A 591 GLU HGy 1.0 1.8 3.50 509 378 A 591 GLU HBx A 591 GLU HGx 1.0 1.8 3.50 510 378 A 591 GLU HBy A 591 GLU HGx 1.0 1.8 3.50 511 378 A 591 GLU HGy A 591 GLU HBx 1.0 1.8 3.50 512 378 A 591 GLU HBy A 591 GLU HGy 1.0 1.8 3.50 513 379 A 592 GLN H A 592 GLN HA 1.0 1.8 4.75 514 380 A 592 GLN H A 592 GLN HBy 1.0 1.8 4.75 515 380 A 592 GLN H A 592 GLN HBx 1.0 1.8 4.75 516 381 A 592 GLN H A 592 GLN HGy 1.0 1.8 4.75 517 381 A 592 GLN H A 592 GLN HGx 1.0 1.8 4.75 518 382 A 592 GLN HA A 592 GLN HBy 1.0 1.8 3.50 519 382 A 592 GLN HA A 592 GLN HBx 1.0 1.8 3.50 520 383 A 592 GLN HA A 592 GLN HGy 1.0 1.8 3.50 521 383 A 592 GLN HA A 592 GLN HGx 1.0 1.8 3.50 522 384 A 592 GLN HBx A 592 GLN HGy 1.0 1.8 3.50 523 384 A 592 GLN HBy A 592 GLN HGy 1.0 1.8 3.50 524 384 A 592 GLN HGx A 592 GLN HBy 1.0 1.8 3.50 525 384 A 592 GLN HBx A 592 GLN HGx 1.0 1.8 3.50 526 385 A 592 GLN HBx A 592 GLN HE22 1.0 1.8 4.75 527 385 A 592 GLN HBy A 592 GLN HE22 1.0 1.8 4.75 528 385 A 592 GLN HE21 A 592 GLN HBy 1.0 1.8 4.75 529 385 A 592 GLN HBx A 592 GLN HE21 1.0 1.8 4.75 530 386 A 592 GLN HE22 A 592 GLN HGy 1.0 1.8 4.75 531 386 A 592 GLN HGx A 592 GLN HE22 1.0 1.8 4.75 532 386 A 592 GLN HGx A 592 GLN HE21 1.0 1.8 4.75 533 386 A 592 GLN HE21 A 592 GLN HGy 1.0 1.8 4.75 534 387 A 593 PHE H A 593 PHE HA 1.0 1.8 4.75 535 388 A 593 PHE H A 593 PHE HB3 1.0 1.8 4.75 536 389 A 593 PHE H A 593 PHE HB2 1.0 1.8 3.50 537 390 A 593 PHE H A 593 PHE HD% 1.0 1.8 4.75 538 391 A 593 PHE HA A 593 PHE HB3 1.0 1.8 3.50 539 392 A 593 PHE HA A 593 PHE HB2 1.0 1.8 4.75 540 393 A 593 PHE HA A 593 PHE HD% 1.0 1.8 3.50 541 394 A 593 PHE HA A 593 PHE HE% 1.0 1.8 6.00 542 395 A 593 PHE HB3 A 593 PHE HD% 1.0 1.8 3.50 543 396 A 593 PHE HB3 A 593 PHE HE% 1.0 1.8 6.00 544 397 A 593 PHE HB2 A 593 PHE HD% 1.0 1.8 3.50 545 398 A 593 PHE HB2 A 593 PHE HE% 1.0 1.8 6.00 546 399 A 594 ARG H A 594 ARG HA 1.0 1.8 3.50 547 400 A 594 ARG H A 594 ARG HBy 1.0 1.8 3.50 548 400 A 594 ARG H A 594 ARG HBx 1.0 1.8 3.50 549 401 A 594 ARG H A 594 ARG HGx 1.0 1.8 4.75 550 401 A 594 ARG H A 594 ARG HGy 1.0 1.8 4.75 551 402 A 594 ARG H A 594 ARG HDx 1.0 1.8 6.00 552 402 A 594 ARG H A 594 ARG HDy 1.0 1.8 6.00 553 403 A 594 ARG HA A 594 ARG HBy 1.0 1.8 3.50 554 403 A 594 ARG HA A 594 ARG HBx 1.0 1.8 3.50 555 404 A 594 ARG HA A 594 ARG HGx 1.0 1.8 4.75 556 404 A 594 ARG HA A 594 ARG HGy 1.0 1.8 4.75 557 405 A 594 ARG HA A 594 ARG HDx 1.0 1.8 6.00 558 405 A 594 ARG HA A 594 ARG HDy 1.0 1.8 6.00 559 406 A 594 ARG HE A 594 ARG HBy 1.0 1.8 3.50 560 406 A 594 ARG HBx A 594 ARG HE 1.0 1.8 3.50 561 407 A 594 ARG HE A 594 ARG HGx 1.0 1.8 4.75 562 407 A 594 ARG HGy A 594 ARG HE 1.0 1.8 4.75 563 408 A 594 ARG HE A 594 ARG HDx 1.0 1.8 4.75 564 408 A 594 ARG HDy A 594 ARG HE 1.0 1.8 4.75 565 409 A 594 ARG HBx A 594 ARG HGx 1.0 1.8 3.50 566 409 A 594 ARG HBy A 594 ARG HGx 1.0 1.8 3.50 567 409 A 594 ARG HGy A 594 ARG HBy 1.0 1.8 3.50 568 409 A 594 ARG HBx A 594 ARG HGy 1.0 1.8 3.50 569 410 A 594 ARG HBy A 594 ARG HDx 1.0 1.8 3.50 570 410 A 594 ARG HBx A 594 ARG HDx 1.0 1.8 3.50 571 410 A 594 ARG HDy A 594 ARG HBy 1.0 1.8 3.50 572 410 A 594 ARG HBx A 594 ARG HDy 1.0 1.8 3.50 573 411 A 594 ARG HDy A 594 ARG HGx 1.0 1.8 3.50 574 411 A 594 ARG HDx A 594 ARG HGx 1.0 1.8 3.50 575 411 A 594 ARG HGy A 594 ARG HDx 1.0 1.8 3.50 576 411 A 594 ARG HGy A 594 ARG HDy 1.0 1.8 3.50 577 412 A 595 HIS H A 595 HIS HA 1.0 1.8 4.75 578 413 A 595 HIS H A 595 HIS HBx 1.0 1.8 3.50 579 413 A 595 HIS H A 595 HIS HBy 1.0 1.8 3.50 580 414 A 595 HIS HA A 595 HIS HD2 1.0 1.8 6.00 581 415 A 595 HIS HA A 595 HIS HBx 1.0 1.8 3.50 582 415 A 595 HIS HA A 595 HIS HBy 1.0 1.8 3.50 583 416 A 595 HIS HD2 A 595 HIS HBx 1.0 1.8 3.50 584 416 A 595 HIS HBy A 595 HIS HD2 1.0 1.8 3.50 585 417 A 596 ALA H A 596 ALA HA 1.0 1.8 3.50 586 418 A 596 ALA H A 596 ALA HB1 1.0 1.8 3.50 587 419 A 596 ALA HA A 596 ALA HB1 1.0 1.8 3.50 588 420 A 597 ILE H A 597 ILE HA 1.0 1.8 3.50 589 421 A 597 ILE H A 597 ILE HB 1.0 1.8 3.50 590 422 A 597 ILE H A 597 ILE HG21 1.0 1.8 6.00 591 423 A 597 ILE H A 597 ILE HD11 1.0 1.8 6.00 592 424 A 597 ILE H A 597 ILE HG1x 1.0 1.8 3.50 593 424 A 597 ILE H A 597 ILE HG1y 1.0 1.8 3.50 594 425 A 597 ILE HA A 597 ILE HB 1.0 1.8 3.50 595 426 A 597 ILE HA A 597 ILE HG21 1.0 1.8 4.75 596 427 A 597 ILE HA A 597 ILE HD11 1.0 1.8 4.75 597 428 A 597 ILE HA A 597 ILE HG1x 1.0 1.8 3.50 598 428 A 597 ILE HA A 597 ILE HG1y 1.0 1.8 3.50 599 429 A 597 ILE HB A 597 ILE HG21 1.0 1.8 3.50 600 430 A 597 ILE HB A 597 ILE HD11 1.0 1.8 3.50 601 431 A 597 ILE HB A 597 ILE HG1x 1.0 1.8 3.50 602 431 A 597 ILE HB A 597 ILE HG1y 1.0 1.8 3.50 603 432 A 597 ILE HG21 A 597 ILE HD11 1.0 1.8 3.50 604 433 A 597 ILE HG21 A 597 ILE HG1x 1.0 1.8 4.75 605 433 A 597 ILE HG21 A 597 ILE HG1y 1.0 1.8 4.75 606 434 A 597 ILE HD11 A 597 ILE HG1x 1.0 1.8 4.75 607 434 A 597 ILE HD11 A 597 ILE HG1y 1.0 1.8 4.75 608 435 A 598 TRP H A 598 TRP HA 1.0 1.8 4.75 609 436 A 598 TRP H A 598 TRP HB3 1.0 1.8 3.50 610 437 A 598 TRP H A 598 TRP HB2 1.0 1.8 3.50 611 438 A 598 TRP H A 598 TRP HE3 1.0 1.8 6.00 612 439 A 598 TRP HA A 598 TRP HB3 1.0 1.8 3.50 613 440 A 598 TRP HA A 598 TRP HB2 1.0 1.8 3.50 614 441 A 598 TRP HA A 598 TRP HD1 1.0 1.8 4.75 615 442 A 598 TRP HA A 598 TRP HE3 1.0 1.8 6.00 616 443 A 598 TRP HB3 A 598 TRP HD1 1.0 1.8 4.75 617 444 A 598 TRP HB3 A 598 TRP HE3 1.0 1.8 3.50 618 445 A 598 TRP HB2 A 598 TRP HD1 1.0 1.8 4.75 619 446 A 598 TRP HB2 A 598 TRP HE3 1.0 1.8 4.75 620 447 A 599 LYS H A 599 LYS HA 1.0 1.8 4.75 621 448 A 599 LYS H A 599 LYS HBx 1.0 1.8 3.50 622 448 A 599 LYS H A 599 LYS HBy 1.0 1.8 3.50 623 449 A 599 LYS H A 599 LYS HGy 1.0 1.8 6.00 624 449 A 599 LYS H A 599 LYS HGx 1.0 1.8 6.00 625 450 A 599 LYS HA A 599 LYS HBx 1.0 1.8 3.50 626 450 A 599 LYS HA A 599 LYS HBy 1.0 1.8 3.50 627 451 A 599 LYS HA A 599 LYS HGy 1.0 1.8 3.50 628 451 A 599 LYS HA A 599 LYS HGx 1.0 1.8 3.50 629 452 A 599 LYS HA A 599 LYS HDx 1.0 1.8 4.75 630 452 A 599 LYS HA A 599 LYS HDy 1.0 1.8 4.75 631 453 A 599 LYS HBy A 599 LYS HGy 1.0 1.8 3.50 632 453 A 599 LYS HBx A 599 LYS HGy 1.0 1.8 3.50 633 453 A 599 LYS HGx A 599 LYS HBx 1.0 1.8 3.50 634 453 A 599 LYS HBy A 599 LYS HGx 1.0 1.8 3.50 635 454 A 599 LYS HBx A 599 LYS HDx 1.0 1.8 3.50 636 454 A 599 LYS HBy A 599 LYS HDx 1.0 1.8 3.50 637 454 A 599 LYS HDy A 599 LYS HBx 1.0 1.8 3.50 638 454 A 599 LYS HBy A 599 LYS HDy 1.0 1.8 3.50 639 455 A 599 LYS HBy A 599 LYS HEx 1.0 1.8 6.00 640 455 A 599 LYS HBx A 599 LYS HEx 1.0 1.8 6.00 641 455 A 599 LYS HEy A 599 LYS HBx 1.0 1.8 6.00 642 455 A 599 LYS HBy A 599 LYS HEy 1.0 1.8 6.00 643 456 A 599 LYS HDy A 599 LYS HGy 1.0 1.8 3.50 644 456 A 599 LYS HDx A 599 LYS HGy 1.0 1.8 3.50 645 456 A 599 LYS HGx A 599 LYS HDx 1.0 1.8 3.50 646 456 A 599 LYS HGx A 599 LYS HDy 1.0 1.8 3.50 647 457 A 599 LYS HEx A 599 LYS HGy 1.0 1.8 4.75 648 457 A 599 LYS HEy A 599 LYS HGy 1.0 1.8 4.75 649 457 A 599 LYS HGx A 599 LYS HEx 1.0 1.8 4.75 650 457 A 599 LYS HGx A 599 LYS HEy 1.0 1.8 4.75 651 458 A 599 LYS HDy A 599 LYS HEx 1.0 1.8 3.50 652 458 A 599 LYS HDx A 599 LYS HEx 1.0 1.8 3.50 653 458 A 599 LYS HEy A 599 LYS HDx 1.0 1.8 3.50 654 458 A 599 LYS HDy A 599 LYS HEy 1.0 1.8 3.50 655 459 A 600 GLY H A 600 GLY HAx 1.0 1.8 3.50 656 459 A 600 GLY H A 600 GLY HA3 1.0 1.8 3.50 657 460 A 601 ILE H A 601 ILE HA 1.0 1.8 3.50 658 461 A 601 ILE H A 601 ILE HB 1.0 1.8 3.50 659 462 A 601 ILE H A 601 ILE HG21 1.0 1.8 6.00 660 463 A 601 ILE H A 601 ILE HD11 1.0 1.8 6.00 661 464 A 601 ILE H A 601 ILE HG1y 1.0 1.8 3.50 662 464 A 601 ILE H A 601 ILE HG1x 1.0 1.8 3.50 663 465 A 601 ILE HA A 601 ILE HB 1.0 1.8 4.75 664 466 A 601 ILE HA A 601 ILE HG21 1.0 1.8 4.75 665 467 A 601 ILE HA A 601 ILE HD11 1.0 1.8 4.75 666 468 A 601 ILE HA A 601 ILE HG1y 1.0 1.8 3.50 667 468 A 601 ILE HA A 601 ILE HG1x 1.0 1.8 3.50 668 469 A 601 ILE HB A 601 ILE HG21 1.0 1.8 4.75 669 470 A 601 ILE HB A 601 ILE HD11 1.0 1.8 6.00 670 471 A 601 ILE HB A 601 ILE HG1y 1.0 1.8 3.50 671 471 A 601 ILE HB A 601 ILE HG1x 1.0 1.8 3.50 672 472 A 601 ILE HG21 A 601 ILE HD11 1.0 1.8 6.00 673 473 A 601 ILE HG21 A 601 ILE HG1y 1.0 1.8 3.50 674 473 A 601 ILE HG21 A 601 ILE HG1x 1.0 1.8 3.50 675 474 A 601 ILE HD11 A 601 ILE HG1y 1.0 1.8 3.50 676 474 A 601 ILE HD11 A 601 ILE HG1x 1.0 1.8 3.50 677 475 A 602 LEU H A 602 LEU HA 1.0 1.8 3.50 678 476 A 602 LEU H A 602 LEU HB3 1.0 1.8 3.50 679 477 A 602 LEU H A 602 LEU HB2 1.0 1.8 3.50 680 478 A 602 LEU H A 602 LEU HG 1.0 1.8 6.00 681 479 A 602 LEU H A 602 LEU HD11 1.0 1.8 6.00 682 480 A 602 LEU H A 602 LEU HD21 1.0 1.8 6.00 683 481 A 602 LEU HA A 602 LEU HB3 1.0 1.8 3.50 684 482 A 602 LEU HA A 602 LEU HB2 1.0 1.8 4.75 685 483 A 602 LEU HA A 602 LEU HG 1.0 1.8 4.75 686 484 A 602 LEU HA A 602 LEU HD11 1.0 1.8 6.00 687 485 A 602 LEU HA A 602 LEU HD21 1.0 1.8 4.75 688 486 A 602 LEU HB3 A 602 LEU HG 1.0 1.8 4.75 689 487 A 602 LEU HB3 A 602 LEU HD11 1.0 1.8 6.00 690 488 A 602 LEU HB3 A 602 LEU HD21 1.0 1.8 4.75 691 489 A 602 LEU HB2 A 602 LEU HG 1.0 1.8 4.75 692 490 A 602 LEU HB2 A 602 LEU HD11 1.0 1.8 4.75 693 491 A 602 LEU HB2 A 602 LEU HD21 1.0 1.8 4.75 694 492 A 602 LEU HG A 602 LEU HD11 1.0 1.8 4.75 695 493 A 602 LEU HG A 602 LEU HD21 1.0 1.8 4.75 696 494 A 603 ASP H A 603 ASP HA 1.0 1.8 4.75 697 495 A 603 ASP H A 603 ASP HBx 1.0 1.8 3.50 698 495 A 603 ASP H A 603 ASP HBy 1.0 1.8 3.50 699 496 A 603 ASP HA A 603 ASP HBx 1.0 1.8 3.50 700 496 A 603 ASP HA A 603 ASP HBy 1.0 1.8 3.50 701 497 A 604 HIS H A 604 HIS HA 1.0 1.8 4.75 702 498 A 604 HIS H A 604 HIS HB3 1.0 1.8 3.50 703 499 A 604 HIS H A 604 HIS HB2 1.0 1.8 3.50 704 500 A 604 HIS HA A 604 HIS HB3 1.0 1.8 4.75 705 501 A 604 HIS HA A 604 HIS HB2 1.0 1.8 3.50 706 502 A 604 HIS HA A 604 HIS HD2 1.0 1.8 6.00 707 503 A 604 HIS HB3 A 604 HIS HD2 1.0 1.8 4.75 708 504 A 604 HIS HB2 A 604 HIS HD2 1.0 1.8 4.75 709 505 A 605 ARG H A 605 ARG HA 1.0 1.8 4.75 710 506 A 605 ARG H A 605 ARG HBy 1.0 1.8 3.50 711 506 A 605 ARG H A 605 ARG HBx 1.0 1.8 3.50 712 507 A 605 ARG H A 605 ARG HGx 1.0 1.8 4.75 713 507 A 605 ARG H A 605 ARG HGy 1.0 1.8 4.75 714 508 A 605 ARG HA A 605 ARG HBy 1.0 1.8 3.50 715 508 A 605 ARG HA A 605 ARG HBx 1.0 1.8 3.50 716 509 A 605 ARG HA A 605 ARG HGx 1.0 1.8 4.75 717 509 A 605 ARG HA A 605 ARG HGy 1.0 1.8 4.75 718 510 A 605 ARG HA A 605 ARG HDy 1.0 1.8 4.75 719 510 A 605 ARG HA A 605 ARG HDx 1.0 1.8 4.75 720 511 A 605 ARG HBx A 605 ARG HGx 1.0 1.8 2.80 721 511 A 605 ARG HBy A 605 ARG HGx 1.0 1.8 2.80 722 511 A 605 ARG HGy A 605 ARG HBy 1.0 1.8 2.80 723 511 A 605 ARG HBx A 605 ARG HGy 1.0 1.8 2.80 724 512 A 605 ARG HBy A 605 ARG HDy 1.0 1.8 3.50 725 512 A 605 ARG HBx A 605 ARG HDy 1.0 1.8 3.50 726 512 A 605 ARG HDx A 605 ARG HBy 1.0 1.8 3.50 727 512 A 605 ARG HBx A 605 ARG HDx 1.0 1.8 3.50 728 513 A 605 ARG HDx A 605 ARG HGx 1.0 1.8 3.50 729 513 A 605 ARG HDy A 605 ARG HGx 1.0 1.8 3.50 730 513 A 605 ARG HGy A 605 ARG HDy 1.0 1.8 3.50 731 513 A 605 ARG HGy A 605 ARG HDx 1.0 1.8 3.50 732 514 A 606 GLN H A 606 GLN HA 1.0 1.8 3.50 733 515 A 606 GLN H A 606 GLN HBx 1.0 1.8 3.50 734 515 A 606 GLN H A 606 GLN HBy 1.0 1.8 3.50 735 516 A 606 GLN H A 606 GLN HGx 1.0 1.8 3.50 736 516 A 606 GLN H A 606 GLN HGy 1.0 1.8 3.50 737 517 A 606 GLN HA A 606 GLN HBx 1.0 1.8 3.50 738 517 A 606 GLN HA A 606 GLN HBy 1.0 1.8 3.50 739 518 A 606 GLN HA A 606 GLN HGx 1.0 1.8 4.75 740 518 A 606 GLN HA A 606 GLN HGy 1.0 1.8 4.75 741 519 A 606 GLN HBy A 606 GLN HGx 1.0 1.8 2.80 742 519 A 606 GLN HBx A 606 GLN HGx 1.0 1.8 2.80 743 519 A 606 GLN HGy A 606 GLN HBx 1.0 1.8 2.80 744 519 A 606 GLN HBy A 606 GLN HGy 1.0 1.8 2.80 745 520 A 606 GLN HBx A 606 GLN HE22 1.0 1.8 3.50 746 520 A 606 GLN HBy A 606 GLN HE22 1.0 1.8 3.50 747 520 A 606 GLN HE21 A 606 GLN HBx 1.0 1.8 3.50 748 520 A 606 GLN HBy A 606 GLN HE21 1.0 1.8 3.50 749 521 A 606 GLN HE21 A 606 GLN HGx 1.0 1.8 3.50 750 521 A 606 GLN HE22 A 606 GLN HGx 1.0 1.8 3.50 751 521 A 606 GLN HGy A 606 GLN HE22 1.0 1.8 3.50 752 521 A 606 GLN HGy A 606 GLN HE21 1.0 1.8 3.50 753 522 A 607 LEU H A 607 LEU HA 1.0 1.8 3.50 754 523 A 607 LEU H A 607 LEU HG 1.0 1.8 3.50 755 524 A 607 LEU H A 607 LEU HD11 1.0 1.8 6.00 756 525 A 607 LEU H A 607 LEU HD21 1.0 1.8 6.00 757 526 A 607 LEU H A 607 LEU HBx 1.0 1.8 3.50 758 526 A 607 LEU H A 607 LEU HBy 1.0 1.8 3.50 759 527 A 607 LEU HA A 607 LEU HG 1.0 1.8 3.50 760 528 A 607 LEU HA A 607 LEU HD11 1.0 1.8 4.75 761 529 A 607 LEU HA A 607 LEU HD21 1.0 1.8 4.75 762 530 A 607 LEU HA A 607 LEU HBx 1.0 1.8 3.50 763 530 A 607 LEU HA A 607 LEU HBy 1.0 1.8 3.50 764 531 A 607 LEU HG A 607 LEU HD11 1.0 1.8 3.50 765 532 A 607 LEU HG A 607 LEU HD21 1.0 1.8 3.50 766 533 A 607 LEU HG A 607 LEU HBx 1.0 1.8 2.80 767 533 A 607 LEU HG A 607 LEU HBy 1.0 1.8 2.80 768 534 A 607 LEU HD11 A 607 LEU HBx 1.0 1.8 4.75 769 534 A 607 LEU HD11 A 607 LEU HBy 1.0 1.8 4.75 770 535 A 607 LEU HD21 A 607 LEU HBx 1.0 1.8 4.75 771 535 A 607 LEU HD21 A 607 LEU HBy 1.0 1.8 4.75 772 536 A 608 HIS H A 608 HIS HA 1.0 1.8 6.00 773 537 A 608 HIS H A 608 HIS HBx 1.0 1.8 4.75 774 537 A 608 HIS H A 608 HIS HBy 1.0 1.8 4.75 775 538 A 608 HIS HA A 608 HIS HD2 1.0 1.8 6.00 776 539 A 608 HIS HA A 608 HIS HBx 1.0 1.8 4.75 777 539 A 608 HIS HA A 608 HIS HBy 1.0 1.8 4.75 778 540 A 608 HIS HD2 A 608 HIS HBx 1.0 1.8 6.00 779 540 A 608 HIS HBy A 608 HIS HD2 1.0 1.8 6.00 780 541 A 609 GLU H A 609 GLU HA 1.0 1.8 4.75 781 542 A 609 GLU H A 609 GLU HBy 1.0 1.8 3.50 782 542 A 609 GLU H A 609 GLU HBx 1.0 1.8 3.50 783 543 A 609 GLU H A 609 GLU HGx 1.0 1.8 4.75 784 543 A 609 GLU H A 609 GLU HGy 1.0 1.8 4.75 785 544 A 609 GLU HA A 609 GLU HBy 1.0 1.8 3.50 786 544 A 609 GLU HA A 609 GLU HBx 1.0 1.8 3.50 787 545 A 609 GLU HA A 609 GLU HGx 1.0 1.8 3.50 788 545 A 609 GLU HA A 609 GLU HGy 1.0 1.8 3.50 789 546 A 609 GLU HBy A 609 GLU HGx 1.0 1.8 2.80 790 546 A 609 GLU HBx A 609 GLU HGx 1.0 1.8 2.80 791 546 A 609 GLU HGy A 609 GLU HBy 1.0 1.8 2.80 792 546 A 609 GLU HBx A 609 GLU HGy 1.0 1.8 2.80 793 547 A 610 PHE H A 610 PHE HA 1.0 1.8 4.75 794 548 A 610 PHE H A 610 PHE HBx 1.0 1.8 3.50 795 548 A 610 PHE H A 610 PHE HBy 1.0 1.8 3.50 796 549 A 610 PHE H A 610 PHE HD% 1.0 1.8 6.00 797 550 A 610 PHE HA A 610 PHE HBx 1.0 1.8 4.75 798 550 A 610 PHE HA A 610 PHE HBy 1.0 1.8 4.75 799 551 A 610 PHE HA A 610 PHE HD% 1.0 1.8 4.75 800 552 A 610 PHE HD% A 610 PHE HBx 1.0 1.8 3.50 801 552 A 610 PHE HBy A 610 PHE HD% 1.0 1.8 3.50 802 553 A 610 PHE HE% A 610 PHE HBx 1.0 1.8 6.00 803 553 A 610 PHE HBy A 610 PHE HE% 1.0 1.8 6.00 804 554 A 611 SER H A 611 SER HA 1.0 1.8 3.50 805 555 A 611 SER H A 611 SER HBx 1.0 1.8 4.75 806 555 A 611 SER H A 611 SER HBy 1.0 1.8 4.75 807 556 A 611 SER HA A 611 SER HBx 1.0 1.8 4.75 808 556 A 611 SER HA A 611 SER HBy 1.0 1.8 4.75 809 557 A 612 SER H A 612 SER HA 1.0 1.8 3.50 810 558 A 612 SER H A 612 SER HBy 1.0 1.8 4.75 811 558 A 612 SER H A 612 SER HBx 1.0 1.8 4.75 812 559 A 612 SER HA A 612 SER HBy 1.0 1.8 3.50 813 559 A 612 SER HA A 612 SER HBx 1.0 1.8 3.50 814 560 A 615 HIS HD2 A 615 HIS HBx 1.0 1.8 3.50 815 560 A 615 HIS HD2 A 615 HIS HBy 1.0 1.8 3.50 816 561 A 616 LEU H A 616 LEU HA 1.0 1.8 4.75 817 562 A 616 LEU H A 616 LEU HG 1.0 1.8 6.00 818 563 A 616 LEU H A 616 LEU HBx 1.0 1.8 4.75 819 563 A 616 LEU H A 616 LEU HBy 1.0 1.8 4.75 820 564 A 616 LEU H A 616 LEU HD11 1.0 1.8 6.00 821 564 A 616 LEU H A 616 LEU HD21 1.0 1.8 6.00 822 565 A 616 LEU HA A 616 LEU HG 1.0 1.8 3.50 823 566 A 616 LEU HA A 616 LEU HBx 1.0 1.8 3.50 824 566 A 616 LEU HA A 616 LEU HBy 1.0 1.8 3.50 825 567 A 616 LEU HA A 616 LEU HD11 1.0 1.8 6.00 826 567 A 616 LEU HA A 616 LEU HD21 1.0 1.8 6.00 827 568 A 616 LEU HG A 616 LEU HBx 1.0 1.8 3.50 828 568 A 616 LEU HG A 616 LEU HBy 1.0 1.8 3.50 829 569 A 616 LEU HG A 616 LEU HD11 1.0 1.8 6.00 830 569 A 616 LEU HG A 616 LEU HD21 1.0 1.8 6.00 831 570 A 616 LEU HBx A 616 LEU HD11 1.0 1.8 4.75 832 570 A 616 LEU HBy A 616 LEU HD11 1.0 1.8 4.75 833 570 A 616 LEU HD21 A 616 LEU HBx 1.0 1.8 4.75 834 570 A 616 LEU HBy A 616 LEU HD21 1.0 1.8 4.75 835 571 A 617 LEU H A 617 LEU HA 1.0 1.8 6.00 836 572 A 617 LEU H A 617 LEU HG 1.0 1.8 4.75 837 573 A 617 LEU H A 617 LEU HD11 1.0 1.8 6.00 838 574 A 617 LEU H A 617 LEU HD21 1.0 1.8 6.00 839 575 A 617 LEU H A 617 LEU HBy 1.0 1.8 4.75 840 575 A 617 LEU H A 617 LEU HBx 1.0 1.8 4.75 841 576 A 617 LEU HA A 617 LEU HG 1.0 1.8 4.75 842 577 A 617 LEU HA A 617 LEU HD11 1.0 1.8 6.00 843 578 A 617 LEU HA A 617 LEU HD21 1.0 1.8 6.00 844 579 A 617 LEU HA A 617 LEU HBy 1.0 1.8 4.75 845 579 A 617 LEU HA A 617 LEU HBx 1.0 1.8 4.75 846 580 A 617 LEU HG A 617 LEU HD11 1.0 1.8 4.75 847 581 A 617 LEU HG A 617 LEU HD21 1.0 1.8 3.50 848 582 A 617 LEU HG A 617 LEU HBy 1.0 1.8 2.80 849 582 A 617 LEU HG A 617 LEU HBx 1.0 1.8 2.80 850 583 A 617 LEU HD11 A 617 LEU HBy 1.0 1.8 4.75 851 583 A 617 LEU HD11 A 617 LEU HBx 1.0 1.8 4.75 852 584 A 617 LEU HD21 A 617 LEU HBy 1.0 1.8 3.50 853 584 A 617 LEU HD21 A 617 LEU HBx 1.0 1.8 3.50 854 585 A 618 ARG H A 618 ARG HA 1.0 1.8 6.00 855 586 A 618 ARG H A 618 ARG HBx 1.0 1.8 6.00 856 586 A 618 ARG H A 618 ARG HBy 1.0 1.8 6.00 857 587 A 618 ARG H A 618 ARG HGx 1.0 1.8 6.00 858 587 A 618 ARG H A 618 ARG HGy 1.0 1.8 6.00 859 588 A 618 ARG HA A 618 ARG HBx 1.0 1.8 6.00 860 588 A 618 ARG HA A 618 ARG HBy 1.0 1.8 6.00 861 589 A 618 ARG HA A 618 ARG HDx 1.0 1.8 6.00 862 589 A 618 ARG HA A 618 ARG HDy 1.0 1.8 6.00 863 590 A 618 ARG HBy A 618 ARG HGx 1.0 1.8 3.50 864 590 A 618 ARG HBx A 618 ARG HGx 1.0 1.8 3.50 865 590 A 618 ARG HGy A 618 ARG HBx 1.0 1.8 3.50 866 590 A 618 ARG HBy A 618 ARG HGy 1.0 1.8 3.50 867 591 A 618 ARG HBx A 618 ARG HDx 1.0 1.8 4.75 868 591 A 618 ARG HBy A 618 ARG HDx 1.0 1.8 4.75 869 591 A 618 ARG HDy A 618 ARG HBx 1.0 1.8 4.75 870 591 A 618 ARG HBy A 618 ARG HDy 1.0 1.8 4.75 871 592 A 618 ARG HDy A 618 ARG HGx 1.0 1.8 3.50 872 592 A 618 ARG HDx A 618 ARG HGx 1.0 1.8 3.50 873 592 A 618 ARG HGy A 618 ARG HDx 1.0 1.8 3.50 874 592 A 618 ARG HGy A 618 ARG HDy 1.0 1.8 3.50 875 593 A 619 THR H A 619 THR HA 1.0 1.8 6.00 876 594 A 619 THR H A 619 THR HB 1.0 1.8 4.75 877 595 A 619 THR H A 619 THR HG21 1.0 1.8 4.75 878 596 A 619 THR HA A 619 THR HB 1.0 1.8 6.00 879 597 A 619 THR HA A 619 THR HG21 1.0 1.8 6.00 880 598 A 619 THR HB A 619 THR HG21 1.0 1.8 6.00 881 599 A 621 SER H A 621 SER HA 1.0 1.8 6.00 882 600 A 621 SER H A 621 SER HBx 1.0 1.8 4.75 883 600 A 621 SER H A 621 SER HBy 1.0 1.8 4.75 884 601 A 621 SER HA A 621 SER HBx 1.0 1.8 6.00 885 601 A 621 SER HA A 621 SER HBy 1.0 1.8 6.00 886 602 A 622 SER H A 622 SER HA 1.0 1.8 6.00 887 603 A 622 SER H A 622 SER HBx 1.0 1.8 4.75 888 603 A 622 SER H A 622 SER HBy 1.0 1.8 4.75 889 604 A 622 SER HA A 622 SER HBx 1.0 1.8 3.50 890 604 A 622 SER HA A 622 SER HBy 1.0 1.8 3.50 891 605 A 542 SER H A 543 TYR H 1.0 1.8 6.00 892 606 A 542 SER HA A 543 TYR H 1.0 1.8 4.75 893 607 A 543 TYR H A 542 SER HBx 1.0 1.8 4.75 894 607 A 542 SER HBy A 543 TYR H 1.0 1.8 4.75 895 608 A 543 TYR HA A 544 PRO HDy 1.0 1.8 4.75 896 608 A 543 TYR HA A 544 PRO HDx 1.0 1.8 4.75 897 609 A 543 TYR HBy A 544 PRO HDy 1.0 1.8 3.50 898 609 A 543 TYR HBx A 544 PRO HDy 1.0 1.8 3.50 899 609 A 544 PRO HDx A 543 TYR HBy 1.0 1.8 3.50 900 609 A 543 TYR HBx A 544 PRO HDx 1.0 1.8 3.50 901 610 A 543 TYR HD% A 544 PRO HDy 1.0 1.8 6.00 902 610 A 543 TYR HD% A 544 PRO HDx 1.0 1.8 6.00 903 611 A 545 THR H A 544 PRO HA 1.0 1.8 4.75 904 612 A 545 THR H A 544 PRO HBx 1.0 1.8 6.00 905 612 A 545 THR H A 544 PRO HBy 1.0 1.8 6.00 906 613 A 545 THR H A 544 PRO HGx 1.0 1.8 6.00 907 613 A 545 THR H A 544 PRO HGy 1.0 1.8 6.00 908 614 A 545 THR HA A 546 ASP H 1.0 1.8 3.50 909 615 A 545 THR HB A 546 ASP H 1.0 1.8 3.50 910 616 A 546 ASP HA A 547 CYS H 1.0 1.8 3.50 911 617 A 547 CYS H A 546 ASP HBx 1.0 1.8 6.00 912 617 A 546 ASP HBy A 547 CYS H 1.0 1.8 6.00 913 618 A 547 CYS H A 548 SER H 1.0 1.8 4.75 914 619 A 547 CYS HA A 548 SER H 1.0 1.8 4.75 915 620 A 548 SER H A 547 CYS HBx 1.0 1.8 4.75 916 620 A 547 CYS HBy A 548 SER H 1.0 1.8 4.75 917 621 A 548 SER HA A 549 ILE H 1.0 1.8 3.50 918 622 A 549 ILE H A 548 SER HBx 1.0 1.8 3.50 919 622 A 548 SER HBy A 549 ILE H 1.0 1.8 3.50 920 623 A 549 ILE HA A 550 VAL H 1.0 1.8 4.75 921 624 A 549 ILE HB A 550 VAL H 1.0 1.8 3.50 922 625 A 549 ILE HG21 A 550 VAL H 1.0 1.8 6.00 923 626 A 549 ILE HG21 A 550 VAL HA 1.0 1.8 6.00 924 627 A 549 ILE HG21 A 550 VAL HG21 1.0 1.8 6.00 925 628 A 550 VAL H A 549 ILE HG1y 1.0 1.8 4.75 926 628 A 549 ILE HG1x A 550 VAL H 1.0 1.8 4.75 927 629 A 550 VAL H A 551 SER H 1.0 1.8 4.75 928 630 A 550 VAL HA A 551 SER H 1.0 1.8 4.75 929 631 A 550 VAL HB A 551 SER H 1.0 1.8 3.50 930 632 A 550 VAL HG11 A 551 SER H 1.0 1.8 4.75 931 633 A 550 VAL HG11 A 551 SER HA 1.0 1.8 6.00 932 634 A 550 VAL HG21 A 551 SER H 1.0 1.8 6.00 933 635 A 551 SER H A 552 PHE H 1.0 1.8 3.50 934 636 A 551 SER HA A 552 PHE H 1.0 1.8 4.75 935 637 A 552 PHE H A 551 SER HBx 1.0 1.8 4.75 936 637 A 551 SER HBy A 552 PHE H 1.0 1.8 4.75 937 638 A 552 PHE H A 553 LEU H 1.0 1.8 4.75 938 639 A 552 PHE HA A 553 LEU H 1.0 1.8 6.00 939 640 A 552 PHE HB3 A 553 LEU H 1.0 1.8 4.75 940 641 A 552 PHE HB2 A 553 LEU H 1.0 1.8 4.75 941 642 A 552 PHE HD% A 553 LEU H 1.0 1.8 6.00 942 643 A 552 PHE HD% A 553 LEU HG 1.0 1.8 4.75 943 644 A 552 PHE HD% A 553 LEU HD11 1.0 1.8 6.00 944 645 A 552 PHE HD% A 553 LEU HD21 1.0 1.8 6.00 945 646 A 552 PHE HE% A 553 LEU H 1.0 1.8 6.00 946 647 A 552 PHE HE% A 553 LEU HG 1.0 1.8 4.75 947 648 A 552 PHE HE% A 553 LEU HD21 1.0 1.8 4.75 948 649 A 553 LEU H A 554 ALA H 1.0 1.8 3.50 949 650 A 553 LEU HA A 554 ALA H 1.0 1.8 4.75 950 651 A 553 LEU HB3 A 554 ALA H 1.0 1.8 6.00 951 652 A 553 LEU HB2 A 554 ALA H 1.0 1.8 3.50 952 653 A 553 LEU HD11 A 554 ALA H 1.0 1.8 6.00 953 654 A 553 LEU HD21 A 554 ALA H 1.0 1.8 6.00 954 655 A 554 ALA HA A 555 ARG H 1.0 1.8 3.50 955 656 A 554 ALA HB1 A 555 ARG H 1.0 1.8 3.50 956 657 A 555 ARG H A 556 LEU H 1.0 1.8 3.50 957 658 A 555 ARG HA A 556 LEU H 1.0 1.8 4.75 958 659 A 556 LEU H A 555 ARG HBy 1.0 1.8 4.75 959 659 A 555 ARG HBx A 556 LEU H 1.0 1.8 4.75 960 660 A 556 LEU H A 555 ARG HGy 1.0 1.8 6.00 961 660 A 555 ARG HGx A 556 LEU H 1.0 1.8 6.00 962 661 A 556 LEU H A 557 GLY H 1.0 1.8 3.50 963 662 A 556 LEU HA A 557 GLY H 1.0 1.8 4.75 964 663 A 556 LEU HB3 A 557 GLY H 1.0 1.8 4.75 965 664 A 556 LEU HB2 A 557 GLY H 1.0 1.8 4.75 966 665 A 556 LEU HG A 557 GLY H 1.0 1.8 4.75 967 666 A 557 GLY H A 558 CYS H 1.0 1.8 3.50 968 667 A 558 CYS H A 557 GLY HAx 1.0 1.8 4.75 969 667 A 557 GLY HA3 A 558 CYS H 1.0 1.8 4.75 970 668 A 558 CYS H A 559 SER H 1.0 1.8 4.75 971 669 A 558 CYS HA A 559 SER H 1.0 1.8 3.50 972 670 A 559 SER H A 558 CYS HBx 1.0 1.8 6.00 973 670 A 558 CYS HBy A 559 SER H 1.0 1.8 6.00 974 671 A 561 CYS H A 562 LEU H 1.0 1.8 3.50 975 672 A 562 LEU H A 563 ASP H 1.0 1.8 4.75 976 673 A 562 LEU HA A 563 ASP H 1.0 1.8 6.00 977 674 A 562 LEU HB3 A 563 ASP H 1.0 1.8 3.50 978 675 A 562 LEU HB2 A 563 ASP H 1.0 1.8 4.75 979 676 A 562 LEU HG A 563 ASP H 1.0 1.8 4.75 980 677 A 562 LEU HG A 563 ASP HA 1.0 1.8 6.00 981 678 A 562 LEU HD11 A 563 ASP H 1.0 1.8 6.00 982 679 A 562 LEU HD21 A 563 ASP H 1.0 1.8 6.00 983 680 A 563 ASP H A 564 TYR H 1.0 1.8 4.75 984 681 A 563 ASP HA A 564 TYR H 1.0 1.8 6.00 985 682 A 564 TYR H A 563 ASP HBx 1.0 1.8 3.50 986 682 A 563 ASP HBy A 564 TYR H 1.0 1.8 3.50 987 683 A 564 TYR H A 565 PHE H 1.0 1.8 3.50 988 684 A 564 TYR HA A 565 PHE H 1.0 1.8 4.75 989 685 A 564 TYR HB3 A 565 PHE H 1.0 1.8 4.75 990 686 A 564 TYR HB2 A 565 PHE H 1.0 1.8 4.75 991 687 A 564 TYR HB2 A 565 PHE HD% 1.0 1.8 4.75 992 688 A 564 TYR HD% A 565 PHE H 1.0 1.8 4.75 993 689 A 565 PHE H A 566 THR H 1.0 1.8 3.50 994 690 A 565 PHE HA A 566 THR H 1.0 1.8 4.75 995 691 A 565 PHE HB3 A 566 THR H 1.0 1.8 3.50 996 692 A 565 PHE HB2 A 566 THR H 1.0 1.8 3.50 997 693 A 565 PHE HB2 A 566 THR HG21 1.0 1.8 6.00 998 694 A 565 PHE HD% A 566 THR H 1.0 1.8 4.75 999 695 A 566 THR H A 567 THR H 1.0 1.8 3.50 1000 696 A 566 THR HA A 567 THR H 1.0 1.8 4.75 1001 697 A 566 THR HB A 567 THR H 1.0 1.8 3.50 1002 698 A 566 THR HG21 A 567 THR H 1.0 1.8 6.00 1003 699 A 567 THR H A 568 GLN H 1.0 1.8 3.50 1004 700 A 567 THR HA A 568 GLN H 1.0 1.8 4.75 1005 701 A 567 THR HB A 568 GLN H 1.0 1.8 4.75 1006 702 A 567 THR HG21 A 568 GLN H 1.0 1.8 6.00 1007 703 A 568 GLN H A 569 GLY H 1.0 1.8 3.50 1008 704 A 568 GLN HA A 569 GLY H 1.0 1.8 4.75 1009 705 A 569 GLY H A 568 GLN HBy 1.0 1.8 3.50 1010 705 A 568 GLN HBx A 569 GLY H 1.0 1.8 3.50 1011 706 A 569 GLY H A 568 GLN HGy 1.0 1.8 4.75 1012 706 A 568 GLN HGx A 569 GLY H 1.0 1.8 4.75 1013 707 A 569 GLY H A 570 LEU H 1.0 1.8 3.50 1014 708 A 570 LEU H A 569 GLY HAx 1.0 1.8 3.50 1015 708 A 569 GLY HA3 A 570 LEU H 1.0 1.8 3.50 1016 709 A 570 LEU H A 571 THR H 1.0 1.8 6.00 1017 710 A 570 LEU HA A 571 THR H 1.0 1.8 3.50 1018 711 A 570 LEU HB3 A 571 THR H 1.0 1.8 6.00 1019 712 A 570 LEU HB2 A 571 THR H 1.0 1.8 6.00 1020 713 A 570 LEU HG A 571 THR H 1.0 1.8 6.00 1021 714 A 570 LEU HD21 A 571 THR H 1.0 1.8 6.00 1022 715 A 571 THR H A 572 THR H 1.0 1.8 3.50 1023 716 A 571 THR HA A 572 THR H 1.0 1.8 4.75 1024 717 A 571 THR HB A 572 THR H 1.0 1.8 4.75 1025 718 A 571 THR HG21 A 572 THR H 1.0 1.8 6.00 1026 719 A 572 THR H A 573 ILE H 1.0 1.8 4.75 1027 720 A 572 THR HA A 573 ILE H 1.0 1.8 3.50 1028 721 A 572 THR HA A 573 ILE HA 1.0 1.8 6.00 1029 722 A 572 THR HA A 573 ILE HG21 1.0 1.8 6.00 1030 723 A 572 THR HB A 573 ILE H 1.0 1.8 4.75 1031 724 A 572 THR HG21 A 573 ILE H 1.0 1.8 6.00 1032 725 A 573 ILE H A 574 TYR H 1.0 1.8 4.75 1033 726 A 573 ILE HA A 574 TYR H 1.0 1.8 4.75 1034 727 A 573 ILE HG21 A 574 TYR H 1.0 1.8 6.00 1035 728 A 573 ILE HG21 A 574 TYR HA 1.0 1.8 6.00 1036 729 A 573 ILE HG21 A 574 TYR HD% 1.0 1.8 6.00 1037 730 A 573 ILE HG21 A 574 TYR HE% 1.0 1.8 6.00 1038 731 A 573 ILE HD11 A 574 TYR HA 1.0 1.8 6.00 1039 732 A 574 TYR H A 575 GLN H 1.0 1.8 3.50 1040 733 A 574 TYR HA A 575 GLN H 1.0 1.8 3.50 1041 734 A 575 GLN H A 574 TYR HBx 1.0 1.8 4.75 1042 734 A 574 TYR HBy A 575 GLN H 1.0 1.8 4.75 1043 735 A 574 TYR HD% A 575 GLN H 1.0 1.8 6.00 1044 736 A 575 GLN H A 576 ILE H 1.0 1.8 3.50 1045 737 A 575 GLN HA A 576 ILE H 1.0 1.8 4.75 1046 738 A 576 ILE H A 575 GLN HBx 1.0 1.8 4.75 1047 738 A 575 GLN HBy A 576 ILE H 1.0 1.8 4.75 1048 739 A 576 ILE HG21 A 575 GLN HBx 1.0 1.8 6.00 1049 739 A 575 GLN HBy A 576 ILE HG21 1.0 1.8 6.00 1050 740 A 576 ILE H A 577 GLU H 1.0 1.8 3.50 1051 741 A 576 ILE H A 577 GLU HA 1.0 1.8 6.00 1052 742 A 576 ILE HA A 577 GLU H 1.0 1.8 4.75 1053 743 A 576 ILE HB A 577 GLU H 1.0 1.8 6.00 1054 744 A 576 ILE HG21 A 577 GLU H 1.0 1.8 6.00 1055 745 A 577 GLU HA A 576 ILE HG1y 1.0 1.8 6.00 1056 745 A 576 ILE HG1x A 577 GLU HA 1.0 1.8 6.00 1057 746 A 577 GLU H A 578 HIS H 1.0 1.8 4.75 1058 747 A 577 GLU HA A 578 HIS H 1.0 1.8 6.00 1059 748 A 578 HIS H A 577 GLU HBx 1.0 1.8 3.50 1060 748 A 577 GLU HBy A 578 HIS H 1.0 1.8 3.50 1061 749 A 578 HIS HD2 A 577 GLU HBx 1.0 1.8 4.75 1062 749 A 577 GLU HBy A 578 HIS HD2 1.0 1.8 4.75 1063 750 A 578 HIS H A 577 GLU HGx 1.0 1.8 6.00 1064 750 A 577 GLU HGy A 578 HIS H 1.0 1.8 6.00 1065 751 A 578 HIS H A 579 TYR H 1.0 1.8 3.50 1066 752 A 578 HIS H A 579 TYR HA 1.0 1.8 6.00 1067 753 A 578 HIS H A 579 TYR HD% 1.0 1.8 6.00 1068 754 A 578 HIS HA A 579 TYR H 1.0 1.8 4.75 1069 755 A 579 TYR H A 578 HIS HBy 1.0 1.8 6.00 1070 755 A 578 HIS HBx A 579 TYR H 1.0 1.8 6.00 1071 756 A 579 TYR H A 580 SER H 1.0 1.8 6.00 1072 757 A 579 TYR HA A 580 SER H 1.0 1.8 3.50 1073 758 A 579 TYR HB3 A 580 SER H 1.0 1.8 4.75 1074 759 A 579 TYR HB2 A 580 SER H 1.0 1.8 6.00 1075 760 A 579 TYR HD% A 580 SER H 1.0 1.8 4.75 1076 761 A 580 SER H A 581 MET H 1.0 1.8 6.00 1077 762 A 580 SER HA A 581 MET H 1.0 1.8 4.75 1078 763 A 581 MET H A 580 SER HBy 1.0 1.8 3.50 1079 763 A 580 SER HBx A 581 MET H 1.0 1.8 3.50 1080 764 A 581 MET H A 582 ASP H 1.0 1.8 3.50 1081 765 A 581 MET HA A 582 ASP H 1.0 1.8 3.50 1082 766 A 582 ASP H A 581 MET HBx 1.0 1.8 4.75 1083 766 A 581 MET HBy A 582 ASP H 1.0 1.8 4.75 1084 767 A 582 ASP H A 581 MET HGx 1.0 1.8 6.00 1085 767 A 581 MET HGy A 582 ASP H 1.0 1.8 6.00 1086 768 A 582 ASP H A 583 ASP H 1.0 1.8 4.75 1087 769 A 582 ASP HA A 583 ASP H 1.0 1.8 4.75 1088 770 A 583 ASP H A 582 ASP HBy 1.0 1.8 4.75 1089 770 A 582 ASP HBx A 583 ASP H 1.0 1.8 4.75 1090 771 A 583 ASP H A 584 LEU H 1.0 1.8 3.50 1091 772 A 583 ASP HA A 584 LEU H 1.0 1.8 6.00 1092 773 A 584 LEU H A 583 ASP HBy 1.0 1.8 4.75 1093 773 A 583 ASP HBx A 584 LEU H 1.0 1.8 4.75 1094 774 A 584 LEU HG A 583 ASP HBy 1.0 1.8 6.00 1095 774 A 583 ASP HBx A 584 LEU HG 1.0 1.8 6.00 1096 775 A 584 LEU H A 585 ALA H 1.0 1.8 3.50 1097 776 A 584 LEU HA A 585 ALA H 1.0 1.8 4.75 1098 777 A 584 LEU HB3 A 585 ALA H 1.0 1.8 4.75 1099 778 A 584 LEU HB2 A 585 ALA H 1.0 1.8 4.75 1100 779 A 584 LEU HG A 585 ALA H 1.0 1.8 6.00 1101 780 A 584 LEU HD11 A 585 ALA H 1.0 1.8 6.00 1102 781 A 584 LEU HD21 A 585 ALA H 1.0 1.8 6.00 1103 782 A 585 ALA H A 586 SER H 1.0 1.8 3.50 1104 783 A 585 ALA HA A 586 SER H 1.0 1.8 3.50 1105 784 A 585 ALA HB1 A 586 SER H 1.0 1.8 4.75 1106 785 A 586 SER H A 587 LEU H 1.0 1.8 3.50 1107 786 A 586 SER HA A 587 LEU H 1.0 1.8 3.50 1108 787 A 587 LEU H A 586 SER HBx 1.0 1.8 4.75 1109 787 A 586 SER HBy A 587 LEU H 1.0 1.8 4.75 1110 788 A 587 LEU H A 588 LYS H 1.0 1.8 3.50 1111 789 A 587 LEU H A 588 LYS HA 1.0 1.8 6.00 1112 790 A 587 LEU HA A 588 LYS H 1.0 1.8 4.75 1113 791 A 587 LEU HA A 588 LYS HA 1.0 1.8 6.00 1114 792 A 587 LEU HB3 A 588 LYS H 1.0 1.8 6.00 1115 793 A 587 LEU HB2 A 588 LYS H 1.0 1.8 3.50 1116 794 A 587 LEU HG A 588 LYS H 1.0 1.8 4.75 1117 795 A 587 LEU HD11 A 588 LYS H 1.0 1.8 6.00 1118 796 A 587 LEU HD21 A 588 LYS H 1.0 1.8 6.00 1119 797 A 588 LYS H A 589 ILE H 1.0 1.8 3.50 1120 798 A 588 LYS HA A 589 ILE H 1.0 1.8 3.50 1121 799 A 589 ILE H A 588 LYS HBx 1.0 1.8 6.00 1122 799 A 588 LYS HBy A 589 ILE H 1.0 1.8 6.00 1123 800 A 589 ILE H A 590 PRO HD3 1.0 1.8 6.00 1124 801 A 589 ILE HA A 590 PRO HD3 1.0 1.8 3.50 1125 802 A 589 ILE HA A 590 PRO HD2 1.0 1.8 3.50 1126 803 A 589 ILE HB A 590 PRO HD3 1.0 1.8 4.75 1127 804 A 589 ILE HB A 590 PRO HD2 1.0 1.8 6.00 1128 805 A 589 ILE HG21 A 590 PRO HD3 1.0 1.8 4.75 1129 806 A 589 ILE HG21 A 590 PRO HD2 1.0 1.8 4.75 1130 807 A 589 ILE HD11 A 590 PRO HD3 1.0 1.8 6.00 1131 808 A 591 GLU H A 590 PRO HA 1.0 1.8 3.50 1132 809 A 591 GLU H A 590 PRO HB3 1.0 1.8 4.75 1133 810 A 591 GLU H A 590 PRO HB2 1.0 1.8 6.00 1134 811 A 591 GLU H A 590 PRO HG3 1.0 1.8 6.00 1135 812 A 591 GLU H A 590 PRO HG2 1.0 1.8 6.00 1136 813 A 591 GLU H A 592 GLN H 1.0 1.8 6.00 1137 814 A 591 GLU HA A 592 GLN H 1.0 1.8 6.00 1138 815 A 592 GLN H A 591 GLU HBx 1.0 1.8 4.75 1139 815 A 591 GLU HBy A 592 GLN H 1.0 1.8 4.75 1140 816 A 592 GLN H A 591 GLU HGx 1.0 1.8 6.00 1141 816 A 591 GLU HGy A 592 GLN H 1.0 1.8 6.00 1142 817 A 592 GLN H A 593 PHE H 1.0 1.8 4.75 1143 818 A 592 GLN HA A 593 PHE H 1.0 1.8 3.50 1144 819 A 593 PHE H A 592 GLN HBy 1.0 1.8 3.50 1145 819 A 592 GLN HBx A 593 PHE H 1.0 1.8 3.50 1146 820 A 593 PHE HE% A 592 GLN HGy 1.0 1.8 6.00 1147 820 A 592 GLN HGx A 593 PHE HE% 1.0 1.8 6.00 1148 821 A 593 PHE H A 594 ARG H 1.0 1.8 3.50 1149 822 A 593 PHE HA A 594 ARG H 1.0 1.8 6.00 1150 823 A 593 PHE HB2 A 594 ARG H 1.0 1.8 4.75 1151 824 A 593 PHE HD% A 594 ARG H 1.0 1.8 4.75 1152 825 A 594 ARG H A 595 HIS H 1.0 1.8 4.75 1153 826 A 594 ARG HA A 595 HIS H 1.0 1.8 6.00 1154 827 A 595 HIS H A 594 ARG HBy 1.0 1.8 4.75 1155 827 A 594 ARG HBx A 595 HIS H 1.0 1.8 4.75 1156 828 A 595 HIS H A 594 ARG HGx 1.0 1.8 3.50 1157 828 A 594 ARG HGy A 595 HIS H 1.0 1.8 3.50 1158 829 A 595 HIS H A 596 ALA H 1.0 1.8 3.50 1159 830 A 595 HIS HA A 596 ALA H 1.0 1.8 6.00 1160 831 A 596 ALA H A 595 HIS HBx 1.0 1.8 4.75 1161 831 A 595 HIS HBy A 596 ALA H 1.0 1.8 4.75 1162 832 A 596 ALA HB1 A 595 HIS HBx 1.0 1.8 6.00 1163 832 A 595 HIS HBy A 596 ALA HB1 1.0 1.8 6.00 1164 833 A 596 ALA H A 597 ILE H 1.0 1.8 3.50 1165 834 A 596 ALA HA A 597 ILE H 1.0 1.8 3.50 1166 835 A 596 ALA HB1 A 597 ILE H 1.0 1.8 4.75 1167 836 A 596 ALA HB1 A 597 ILE HA 1.0 1.8 6.00 1168 837 A 596 ALA HB1 A 597 ILE HG1x 1.0 1.8 6.00 1169 837 A 596 ALA HB1 A 597 ILE HG1y 1.0 1.8 6.00 1170 838 A 597 ILE H A 598 TRP H 1.0 1.8 3.50 1171 839 A 597 ILE HA A 598 TRP H 1.0 1.8 4.75 1172 840 A 597 ILE HB A 598 TRP H 1.0 1.8 3.50 1173 841 A 597 ILE HG21 A 598 TRP H 1.0 1.8 6.00 1174 842 A 597 ILE HD11 A 598 TRP H 1.0 1.8 6.00 1175 843 A 598 TRP H A 597 ILE HG1x 1.0 1.8 6.00 1176 843 A 597 ILE HG1y A 598 TRP H 1.0 1.8 6.00 1177 844 A 598 TRP H A 599 LYS H 1.0 1.8 4.75 1178 845 A 598 TRP HA A 599 LYS H 1.0 1.8 6.00 1179 846 A 598 TRP HB3 A 599 LYS H 1.0 1.8 4.75 1180 847 A 598 TRP HB2 A 599 LYS H 1.0 1.8 6.00 1181 848 A 598 TRP HE3 A 599 LYS H 1.0 1.8 6.00 1182 849 A 598 TRP HE3 A 599 LYS HA 1.0 1.8 6.00 1183 850 A 599 LYS H A 600 GLY H 1.0 1.8 4.75 1184 851 A 599 LYS HA A 600 GLY H 1.0 1.8 4.75 1185 852 A 600 GLY H A 599 LYS HBx 1.0 1.8 4.75 1186 852 A 599 LYS HBy A 600 GLY H 1.0 1.8 4.75 1187 853 A 600 GLY H A 601 ILE H 1.0 1.8 3.50 1188 854 A 601 ILE H A 600 GLY HAx 1.0 1.8 4.75 1189 854 A 600 GLY HA3 A 601 ILE H 1.0 1.8 4.75 1190 855 A 601 ILE H A 602 LEU H 1.0 1.8 3.50 1191 856 A 601 ILE HA A 602 LEU H 1.0 1.8 4.75 1192 857 A 601 ILE HB A 602 LEU H 1.0 1.8 3.50 1193 858 A 601 ILE HG21 A 602 LEU H 1.0 1.8 4.75 1194 859 A 602 LEU H A 601 ILE HG1y 1.0 1.8 6.00 1195 859 A 601 ILE HG1x A 602 LEU H 1.0 1.8 6.00 1196 860 A 602 LEU H A 603 ASP H 1.0 1.8 3.50 1197 861 A 602 LEU HA A 603 ASP H 1.0 1.8 4.75 1198 862 A 602 LEU HB3 A 603 ASP H 1.0 1.8 4.75 1199 863 A 602 LEU HB2 A 603 ASP H 1.0 1.8 4.75 1200 864 A 602 LEU HG A 603 ASP H 1.0 1.8 6.00 1201 865 A 602 LEU HD11 A 603 ASP H 1.0 1.8 6.00 1202 866 A 602 LEU HD21 A 603 ASP H 1.0 1.8 6.00 1203 867 A 603 ASP H A 604 HIS H 1.0 1.8 3.50 1204 868 A 603 ASP HA A 604 HIS H 1.0 1.8 4.75 1205 869 A 604 HIS H A 603 ASP HBx 1.0 1.8 4.75 1206 869 A 603 ASP HBy A 604 HIS H 1.0 1.8 4.75 1207 870 A 604 HIS H A 605 ARG H 1.0 1.8 3.50 1208 871 A 604 HIS HA A 605 ARG H 1.0 1.8 6.00 1209 872 A 604 HIS HB3 A 605 ARG H 1.0 1.8 3.50 1210 873 A 604 HIS HB2 A 605 ARG H 1.0 1.8 4.75 1211 874 A 605 ARG H A 606 GLN H 1.0 1.8 3.50 1212 875 A 605 ARG HA A 606 GLN H 1.0 1.8 4.75 1213 876 A 606 GLN H A 605 ARG HBy 1.0 1.8 3.50 1214 876 A 605 ARG HBx A 606 GLN H 1.0 1.8 3.50 1215 877 A 606 GLN H A 605 ARG HGx 1.0 1.8 6.00 1216 877 A 605 ARG HGy A 606 GLN H 1.0 1.8 6.00 1217 878 A 606 GLN H A 607 LEU H 1.0 1.8 3.50 1218 879 A 606 GLN HA A 607 LEU H 1.0 1.8 3.50 1219 880 A 607 LEU H A 606 GLN HBx 1.0 1.8 3.50 1220 880 A 606 GLN HBy A 607 LEU H 1.0 1.8 3.50 1221 881 A 607 LEU H A 608 HIS H 1.0 1.8 4.75 1222 882 A 607 LEU HA A 608 HIS H 1.0 1.8 4.75 1223 883 A 607 LEU HG A 608 HIS H 1.0 1.8 6.00 1224 884 A 607 LEU HD11 A 608 HIS H 1.0 1.8 6.00 1225 885 A 607 LEU HD21 A 608 HIS H 1.0 1.8 6.00 1226 886 A 608 HIS H A 607 LEU HBx 1.0 1.8 6.00 1227 886 A 607 LEU HBy A 608 HIS H 1.0 1.8 6.00 1228 887 A 608 HIS H A 609 GLU H 1.0 1.8 6.00 1229 888 A 608 HIS HA A 609 GLU H 1.0 1.8 4.75 1230 889 A 609 GLU H A 608 HIS HBx 1.0 1.8 4.75 1231 889 A 608 HIS HBy A 609 GLU H 1.0 1.8 4.75 1232 890 A 609 GLU H A 610 PHE H 1.0 1.8 4.75 1233 891 A 609 GLU HA A 610 PHE H 1.0 1.8 3.50 1234 892 A 609 GLU HA A 610 PHE HD% 1.0 1.8 6.00 1235 893 A 610 PHE H A 609 GLU HBy 1.0 1.8 4.75 1236 893 A 609 GLU HBx A 610 PHE H 1.0 1.8 4.75 1237 894 A 610 PHE H A 609 GLU HGx 1.0 1.8 6.00 1238 894 A 609 GLU HGy A 610 PHE H 1.0 1.8 6.00 1239 895 A 610 PHE H A 611 SER H 1.0 1.8 4.75 1240 896 A 610 PHE HA A 611 SER H 1.0 1.8 4.75 1241 897 A 611 SER H A 610 PHE HBx 1.0 1.8 6.00 1242 897 A 610 PHE HBy A 611 SER H 1.0 1.8 6.00 1243 898 A 610 PHE HD% A 611 SER H 1.0 1.8 6.00 1244 899 A 611 SER H A 612 SER H 1.0 1.8 4.75 1245 900 A 611 SER HA A 612 SER H 1.0 1.8 4.75 1246 901 A 612 SER H A 611 SER HBx 1.0 1.8 4.75 1247 901 A 611 SER HBy A 612 SER H 1.0 1.8 4.75 1248 902 A 612 SER HA A 613 PRO HDx 1.0 1.8 3.50 1249 902 A 612 SER HA A 613 PRO HDy 1.0 1.8 3.50 1250 903 A 616 LEU H A 617 LEU HD21 1.0 1.8 6.00 1251 904 A 616 LEU HA A 617 LEU H 1.0 1.8 4.75 1252 905 A 617 LEU HA A 618 ARG H 1.0 1.8 4.75 1253 906 A 618 ARG HA A 619 THR H 1.0 1.8 4.75 1254 907 A 621 SER HA A 622 SER H 1.0 1.8 6.00 1255 908 A 550 VAL H A 548 SER HBx 1.0 1.8 4.75 1256 908 A 548 SER HBy A 550 VAL H 1.0 1.8 4.75 1257 909 A 550 VAL HB A 548 SER HBx 1.0 1.8 4.75 1258 909 A 548 SER HBy A 550 VAL HB 1.0 1.8 4.75 1259 910 A 550 VAL HG11 A 548 SER HBx 1.0 1.8 6.00 1260 910 A 548 SER HBy A 550 VAL HG11 1.0 1.8 6.00 1261 911 A 551 SER H A 553 LEU H 1.0 1.8 4.75 1262 912 A 552 PHE H A 554 ALA H 1.0 1.8 4.75 1263 913 A 552 PHE HA A 554 ALA H 1.0 1.8 4.75 1264 914 A 554 ALA HA A 556 LEU H 1.0 1.8 6.00 1265 915 A 556 LEU H A 558 CYS H 1.0 1.8 6.00 1266 916 A 556 LEU HA A 558 CYS H 1.0 1.8 6.00 1267 917 A 556 LEU HB2 A 558 CYS HBx 1.0 1.8 4.75 1268 917 A 556 LEU HB2 A 558 CYS HBy 1.0 1.8 4.75 1269 918 A 556 LEU HD11 A 558 CYS HBx 1.0 1.8 6.00 1270 918 A 556 LEU HD11 A 558 CYS HBy 1.0 1.8 6.00 1271 919 A 564 TYR H A 566 THR H 1.0 1.8 6.00 1272 920 A 566 THR HA A 568 GLN H 1.0 1.8 6.00 1273 921 A 568 GLN H A 570 LEU H 1.0 1.8 4.75 1274 922 A 570 LEU HD11 A 568 GLN HBy 1.0 1.8 4.75 1275 922 A 568 GLN HBx A 570 LEU HD11 1.0 1.8 4.75 1276 923 A 570 LEU HG A 568 GLN HGy 1.0 1.8 4.75 1277 923 A 568 GLN HGx A 570 LEU HG 1.0 1.8 4.75 1278 924 A 570 LEU HD11 A 568 GLN HGy 1.0 1.8 6.00 1279 924 A 568 GLN HGx A 570 LEU HD11 1.0 1.8 6.00 1280 925 A 572 THR HA A 574 TYR H 1.0 1.8 6.00 1281 926 A 572 THR HB A 574 TYR H 1.0 1.8 4.75 1282 927 A 572 THR HB A 574 TYR HD% 1.0 1.8 4.75 1283 928 A 572 THR HG21 A 574 TYR HD% 1.0 1.8 6.00 1284 929 A 585 ALA HA A 587 LEU H 1.0 1.8 6.00 1285 930 A 587 LEU H A 589 ILE H 1.0 1.8 6.00 1286 931 A 587 LEU H A 589 ILE HD11 1.0 1.8 6.00 1287 932 A 587 LEU HB2 A 589 ILE H 1.0 1.8 4.75 1288 933 A 587 LEU HB2 A 589 ILE HG1y 1.0 1.8 4.75 1289 933 A 587 LEU HB2 A 589 ILE HG1x 1.0 1.8 4.75 1290 934 A 587 LEU HD11 A 589 ILE HD11 1.0 1.8 6.00 1291 935 A 593 PHE H A 595 HIS H 1.0 1.8 6.00 1292 936 A 595 HIS HA A 597 ILE H 1.0 1.8 6.00 1293 937 A 596 ALA HB1 A 598 TRP H 1.0 1.8 6.00 1294 938 A 608 HIS H A 610 PHE H 1.0 1.8 6.00 1295 939 A 610 PHE HD% A 612 SER HBy 1.0 1.8 6.00 1296 939 A 610 PHE HD% A 612 SER HBx 1.0 1.8 6.00 1297 940 A 549 ILE HA A 552 PHE H 1.0 1.8 4.75 1298 941 A 549 ILE HA A 552 PHE HB3 1.0 1.8 3.50 1299 942 A 549 ILE HA A 552 PHE HB2 1.0 1.8 3.50 1300 943 A 549 ILE HA A 552 PHE HD% 1.0 1.8 3.50 1301 944 A 549 ILE HA A 552 PHE HE% 1.0 1.8 4.75 1302 945 A 549 ILE HG21 A 552 PHE HD% 1.0 1.8 6.00 1303 946 A 549 ILE HG21 A 552 PHE HE% 1.0 1.8 6.00 1304 947 A 549 ILE HD11 A 552 PHE HB3 1.0 1.8 6.00 1305 948 A 550 VAL HA A 553 LEU H 1.0 1.8 6.00 1306 949 A 550 VAL HA A 553 LEU HB2 1.0 1.8 4.75 1307 950 A 550 VAL HA A 553 LEU HD11 1.0 1.8 6.00 1308 951 A 551 SER HA A 554 ALA H 1.0 1.8 4.75 1309 952 A 551 SER HA A 554 ALA HB1 1.0 1.8 4.75 1310 953 A 554 ALA HB1 A 551 SER HBx 1.0 1.8 6.00 1311 953 A 551 SER HBy A 554 ALA HB1 1.0 1.8 6.00 1312 954 A 552 PHE HA A 555 ARG H 1.0 1.8 4.75 1313 955 A 552 PHE HA A 555 ARG HBy 1.0 1.8 6.00 1314 955 A 552 PHE HA A 555 ARG HBx 1.0 1.8 6.00 1315 956 A 553 LEU HA A 556 LEU H 1.0 1.8 4.75 1316 957 A 553 LEU HA A 556 LEU HB2 1.0 1.8 4.75 1317 958 A 553 LEU HA A 556 LEU HD11 1.0 1.8 6.00 1318 959 A 554 ALA HA A 557 GLY H 1.0 1.8 4.75 1319 960 A 559 SER HA A 562 LEU H 1.0 1.8 4.75 1320 961 A 564 TYR HD% A 561 CYS HBy 1.0 1.8 3.50 1321 961 A 561 CYS HBx A 564 TYR HD% 1.0 1.8 3.50 1322 962 A 562 LEU HA A 565 PHE H 1.0 1.8 6.00 1323 963 A 562 LEU HA A 565 PHE HB2 1.0 1.8 4.75 1324 964 A 562 LEU HA A 565 PHE HD% 1.0 1.8 4.75 1325 965 A 562 LEU HA A 565 PHE HE% 1.0 1.8 6.00 1326 966 A 562 LEU HD11 A 565 PHE HB3 1.0 1.8 6.00 1327 967 A 562 LEU HD11 A 565 PHE HB2 1.0 1.8 6.00 1328 968 A 562 LEU HD11 A 565 PHE HD% 1.0 1.8 6.00 1329 969 A 562 LEU HD11 A 565 PHE HE% 1.0 1.8 6.00 1330 970 A 563 ASP HA A 566 THR H 1.0 1.8 4.75 1331 971 A 563 ASP HA A 566 THR HA 1.0 1.8 6.00 1332 972 A 563 ASP HA A 566 THR HB 1.0 1.8 6.00 1333 973 A 563 ASP HA A 566 THR HG21 1.0 1.8 6.00 1334 974 A 566 THR HA A 569 GLY H 1.0 1.8 4.75 1335 975 A 573 ILE HA A 576 ILE H 1.0 1.8 4.75 1336 976 A 573 ILE HA A 576 ILE HB 1.0 1.8 6.00 1337 977 A 573 ILE HA A 576 ILE HG21 1.0 1.8 6.00 1338 978 A 573 ILE HA A 576 ILE HG1y 1.0 1.8 3.50 1339 978 A 573 ILE HA A 576 ILE HG1x 1.0 1.8 3.50 1340 979 A 573 ILE HD11 A 576 ILE HG1y 1.0 1.8 6.00 1341 979 A 573 ILE HD11 A 576 ILE HG1x 1.0 1.8 6.00 1342 980 A 574 TYR HD% A 577 GLU HBx 1.0 1.8 4.75 1343 980 A 574 TYR HD% A 577 GLU HBy 1.0 1.8 4.75 1344 981 A 576 ILE HA A 579 TYR HD% 1.0 1.8 4.75 1345 982 A 576 ILE HA A 579 TYR HE% 1.0 1.8 4.75 1346 983 A 576 ILE HB A 579 TYR HD% 1.0 1.8 3.50 1347 984 A 576 ILE HB A 579 TYR HE% 1.0 1.8 4.75 1348 985 A 576 ILE HG21 A 579 TYR HD% 1.0 1.8 6.00 1349 986 A 576 ILE HG21 A 579 TYR HE% 1.0 1.8 6.00 1350 987 A 576 ILE HD11 A 579 TYR HE% 1.0 1.8 6.00 1351 988 A 580 SER H A 583 ASP H 1.0 1.8 4.75 1352 989 A 580 SER H A 583 ASP HBy 1.0 1.8 3.50 1353 989 A 580 SER H A 583 ASP HBx 1.0 1.8 3.50 1354 990 A 581 MET HA A 584 LEU HB3 1.0 1.8 4.75 1355 991 A 581 MET HA A 584 LEU HB2 1.0 1.8 4.75 1356 992 A 581 MET HA A 584 LEU HD11 1.0 1.8 4.75 1357 993 A 581 MET HA A 584 LEU HD21 1.0 1.8 6.00 1358 994 A 581 MET HE1 A 584 LEU HD11 1.0 1.8 6.00 1359 995 A 582 ASP HA A 585 ALA H 1.0 1.8 4.75 1360 996 A 582 ASP HA A 585 ALA HB1 1.0 1.8 4.75 1361 997 A 583 ASP HA A 586 SER HBx 1.0 1.8 3.50 1362 997 A 583 ASP HA A 586 SER HBy 1.0 1.8 3.50 1363 998 A 584 LEU HA A 587 LEU H 1.0 1.8 4.75 1364 999 A 584 LEU HA A 587 LEU HB3 1.0 1.8 6.00 1365 1000 A 584 LEU HA A 587 LEU HB2 1.0 1.8 4.75 1366 1001 A 584 LEU HA A 587 LEU HD11 1.0 1.8 6.00 1367 1002 A 584 LEU HD21 A 587 LEU HB2 1.0 1.8 6.00 1368 1003 A 584 LEU HD21 A 587 LEU HG 1.0 1.8 6.00 1369 1004 A 584 LEU HD21 A 587 LEU HD11 1.0 1.8 6.00 1370 1005 A 585 ALA HA A 588 LYS H 1.0 1.8 4.75 1371 1006 A 593 PHE HD% A 590 PRO HB2 1.0 1.8 3.50 1372 1007 A 593 PHE HE% A 590 PRO HB2 1.0 1.8 4.75 1373 1008 A 593 PHE HD% A 590 PRO HG3 1.0 1.8 6.00 1374 1009 A 593 PHE HD% A 590 PRO HG2 1.0 1.8 4.75 1375 1010 A 593 PHE HE% A 590 PRO HG2 1.0 1.8 4.75 1376 1011 A 593 PHE HD% A 590 PRO HD3 1.0 1.8 4.75 1377 1012 A 593 PHE HD% A 590 PRO HD2 1.0 1.8 3.50 1378 1013 A 593 PHE HE% A 590 PRO HD2 1.0 1.8 6.00 1379 1014 A 591 GLU HA A 594 ARG H 1.0 1.8 4.75 1380 1015 A 591 GLU HA A 594 ARG HE 1.0 1.8 4.75 1381 1016 A 591 GLU HA A 594 ARG HDx 1.0 1.8 3.50 1382 1016 A 591 GLU HA A 594 ARG HDy 1.0 1.8 3.50 1383 1017 A 593 PHE HA A 596 ALA HB1 1.0 1.8 6.00 1384 1018 A 593 PHE HD% A 596 ALA HB1 1.0 1.8 6.00 1385 1019 A 594 ARG HA A 597 ILE H 1.0 1.8 4.75 1386 1020 A 594 ARG HA A 597 ILE HB 1.0 1.8 3.50 1387 1021 A 594 ARG HA A 597 ILE HG21 1.0 1.8 6.00 1388 1022 A 595 HIS HA A 598 TRP H 1.0 1.8 4.75 1389 1023 A 595 HIS HA A 598 TRP HB3 1.0 1.8 3.50 1390 1024 A 595 HIS HA A 598 TRP HB2 1.0 1.8 3.50 1391 1025 A 595 HIS HA A 598 TRP HE3 1.0 1.8 4.75 1392 1026 A 598 TRP H A 595 HIS HBx 1.0 1.8 6.00 1393 1026 A 595 HIS HBy A 598 TRP H 1.0 1.8 6.00 1394 1027 A 596 ALA HA A 599 LYS HBx 1.0 1.8 4.75 1395 1027 A 596 ALA HA A 599 LYS HBy 1.0 1.8 4.75 1396 1028 A 597 ILE HA A 600 GLY H 1.0 1.8 4.75 1397 1029 A 597 ILE HA A 600 GLY HAx 1.0 1.8 4.75 1398 1029 A 597 ILE HA A 600 GLY HA3 1.0 1.8 4.75 1399 1030 A 598 TRP HA A 601 ILE H 1.0 1.8 4.75 1400 1031 A 598 TRP HA A 601 ILE HB 1.0 1.8 4.75 1401 1032 A 598 TRP HA A 601 ILE HG1y 1.0 1.8 4.75 1402 1032 A 598 TRP HA A 601 ILE HG1x 1.0 1.8 4.75 1403 1033 A 598 TRP HD1 A 601 ILE HB 1.0 1.8 6.00 1404 1034 A 598 TRP HD1 A 601 ILE HG21 1.0 1.8 6.00 1405 1035 A 598 TRP HD1 A 601 ILE HG1y 1.0 1.8 4.75 1406 1035 A 598 TRP HD1 A 601 ILE HG1x 1.0 1.8 4.75 1407 1036 A 599 LYS HA A 602 LEU H 1.0 1.8 4.75 1408 1037 A 599 LYS HA A 602 LEU HB3 1.0 1.8 4.75 1409 1038 A 599 LYS HA A 602 LEU HB2 1.0 1.8 3.50 1410 1039 A 599 LYS HA A 602 LEU HD11 1.0 1.8 4.75 1411 1040 A 603 ASP H A 600 GLY HAx 1.0 1.8 6.00 1412 1040 A 600 GLY HA3 A 603 ASP H 1.0 1.8 6.00 1413 1041 A 600 GLY HA3 A 603 ASP HBx 1.0 1.8 4.75 1414 1041 A 600 GLY HAx A 603 ASP HBx 1.0 1.8 4.75 1415 1041 A 603 ASP HBy A 600 GLY HAx 1.0 1.8 4.75 1416 1041 A 600 GLY HA3 A 603 ASP HBy 1.0 1.8 4.75 1417 1042 A 601 ILE HA A 604 HIS H 1.0 1.8 4.75 1418 1043 A 601 ILE HA A 604 HIS HB3 1.0 1.8 3.50 1419 1044 A 601 ILE HA A 604 HIS HB2 1.0 1.8 3.50 1420 1045 A 602 LEU HA A 605 ARG H 1.0 1.8 4.75 1421 1046 A 602 LEU HA A 605 ARG HBy 1.0 1.8 3.50 1422 1046 A 602 LEU HA A 605 ARG HBx 1.0 1.8 3.50 1423 1047 A 602 LEU HA A 605 ARG HDy 1.0 1.8 6.00 1424 1047 A 602 LEU HA A 605 ARG HDx 1.0 1.8 6.00 1425 1048 A 602 LEU HG A 605 ARG HDy 1.0 1.8 6.00 1426 1048 A 602 LEU HG A 605 ARG HDx 1.0 1.8 6.00 1427 1049 A 602 LEU HD21 A 605 ARG HDy 1.0 1.8 6.00 1428 1049 A 602 LEU HD21 A 605 ARG HDx 1.0 1.8 6.00 1429 1050 A 603 ASP HA A 606 GLN HBx 1.0 1.8 4.75 1430 1050 A 603 ASP HA A 606 GLN HBy 1.0 1.8 4.75 1431 1051 A 603 ASP HA A 606 GLN HGx 1.0 1.8 6.00 1432 1051 A 603 ASP HA A 606 GLN HGy 1.0 1.8 6.00 1433 1052 A 604 HIS HA A 607 LEU HD11 1.0 1.8 6.00 1434 1053 A 549 ILE HG21 A 553 LEU H 1.0 1.8 6.00 1435 1054 A 549 ILE HG21 A 553 LEU HB2 1.0 1.8 6.00 1436 1055 A 549 ILE HG21 A 553 LEU HG 1.0 1.8 4.75 1437 1056 A 549 ILE HG21 A 553 LEU HD11 1.0 1.8 6.00 1438 1057 A 549 ILE HG21 A 553 LEU HD21 1.0 1.8 6.00 1439 1058 A 550 VAL HG11 A 554 ALA HB1 1.0 1.8 6.00 1440 1059 A 552 PHE HA A 556 LEU H 1.0 1.8 6.00 1441 1060 A 556 LEU HD11 A 552 PHE HZ 1.0 1.8 6.00 1442 1061 A 552 PHE HD% A 556 LEU HD11 1.0 1.8 6.00 1443 1062 A 552 PHE HE% A 556 LEU HD11 1.0 1.8 4.75 1444 1063 A 552 PHE HE% A 556 LEU HD21 1.0 1.8 4.75 1445 1064 A 553 LEU HA A 557 GLY H 1.0 1.8 6.00 1446 1065 A 565 PHE HD% A 561 CYS HBy 1.0 1.8 6.00 1447 1065 A 561 CYS HBx A 565 PHE HD% 1.0 1.8 6.00 1448 1066 A 565 PHE HE% A 561 CYS HBy 1.0 1.8 3.50 1449 1066 A 561 CYS HBx A 565 PHE HE% 1.0 1.8 3.50 1450 1067 A 562 LEU HD11 A 566 THR HG21 1.0 1.8 6.00 1451 1068 A 562 LEU HD21 A 566 THR HG21 1.0 1.8 6.00 1452 1069 A 563 ASP HA A 567 THR H 1.0 1.8 6.00 1453 1070 A 563 ASP HA A 567 THR HG21 1.0 1.8 6.00 1454 1071 A 567 THR HG21 A 563 ASP HBx 1.0 1.8 4.75 1455 1071 A 563 ASP HBy A 567 THR HG21 1.0 1.8 4.75 1456 1072 A 566 THR HA A 570 LEU H 1.0 1.8 4.75 1457 1073 A 573 ILE HG21 A 577 GLU HBx 1.0 1.8 6.00 1458 1073 A 573 ILE HG21 A 577 GLU HBy 1.0 1.8 6.00 1459 1074 A 579 TYR HA A 583 ASP HBy 1.0 1.8 4.75 1460 1074 A 579 TYR HA A 583 ASP HBx 1.0 1.8 4.75 1461 1075 A 579 TYR HD% A 583 ASP HBy 1.0 1.8 4.75 1462 1075 A 579 TYR HD% A 583 ASP HBx 1.0 1.8 4.75 1463 1076 A 579 TYR HE% A 583 ASP HBy 1.0 1.8 6.00 1464 1076 A 579 TYR HE% A 583 ASP HBx 1.0 1.8 6.00 1465 1077 A 580 SER H A 584 LEU HG 1.0 1.8 6.00 1466 1078 A 582 ASP HA A 586 SER H 1.0 1.8 4.75 1467 1079 A 585 ALA HA A 589 ILE H 1.0 1.8 4.75 1468 1080 A 589 ILE HG21 A 593 PHE HB3 1.0 1.8 4.75 1469 1081 A 589 ILE HG21 A 593 PHE HB2 1.0 1.8 4.75 1470 1082 A 589 ILE HG21 A 593 PHE HD% 1.0 1.8 6.00 1471 1083 A 594 ARG H A 590 PRO HB3 1.0 1.8 6.00 1472 1084 A 593 PHE HA A 597 ILE H 1.0 1.8 6.00 1473 1085 A 593 PHE HB3 A 597 ILE HD11 1.0 1.8 3.50 1474 1086 A 593 PHE HB2 A 597 ILE HD11 1.0 1.8 6.00 1475 1087 A 593 PHE HD% A 597 ILE HD11 1.0 1.8 6.00 1476 1088 A 594 ARG HA A 598 TRP H 1.0 1.8 6.00 1477 1089 A 597 ILE HA A 601 ILE H 1.0 1.8 6.00 1478 1090 A 597 ILE HA A 601 ILE HG1y 1.0 1.8 4.75 1479 1090 A 597 ILE HA A 601 ILE HG1x 1.0 1.8 4.75 1480 1091 A 597 ILE HG21 A 601 ILE H 1.0 1.8 6.00 1481 1092 A 598 TRP HD1 A 602 LEU HD11 1.0 1.8 6.00 1482 1093 A 598 TRP HD1 A 602 LEU HD21 1.0 1.8 6.00 1483 1094 A 602 LEU HD11 A 598 TRP HE1 1.0 1.8 6.00 1484 1095 A 602 LEU HD21 A 598 TRP HE1 1.0 1.8 6.00 1485 1096 A 598 TRP HE3 A 602 LEU HG 1.0 1.8 6.00 1486 1097 A 598 TRP HE3 A 602 LEU HD11 1.0 1.8 6.00 1487 1098 A 602 LEU HD11 A 598 TRP HZ2 1.0 1.8 6.00 1488 1099 A 602 LEU HD21 A 598 TRP HZ2 1.0 1.8 6.00 1489 1100 A 602 LEU HD11 A 598 TRP HH2 1.0 1.8 6.00 1490 1101 A 602 LEU HD21 A 598 TRP HH2 1.0 1.8 6.00 1491 1102 A 602 LEU HA A 606 GLN HGx 1.0 1.8 6.00 1492 1102 A 602 LEU HA A 606 GLN HGy 1.0 1.8 6.00 1493 1103 A 573 ILE HG21 A 546 ASP HBx 1.0 1.8 6.00 1494 1103 A 546 ASP HBy A 573 ILE HG21 1.0 1.8 6.00 1495 1104 A 574 TYR HE% A 546 ASP HBx 1.0 1.8 4.75 1496 1104 A 546 ASP HBy A 574 TYR HE% 1.0 1.8 4.75 1497 1105 A 547 CYS HA A 573 ILE HG21 1.0 1.8 6.00 1498 1106 A 547 CYS HA A 573 ILE HD11 1.0 1.8 6.00 1499 1107 A 548 SER HA A 572 THR HA 1.0 1.8 6.00 1500 1108 A 548 SER HA A 572 THR HG21 1.0 1.8 6.00 1501 1109 A 572 THR HG21 A 548 SER HBx 1.0 1.8 6.00 1502 1109 A 548 SER HBy A 572 THR HG21 1.0 1.8 6.00 1503 1110 A 548 SER HA A 573 ILE H 1.0 1.8 6.00 1504 1111 A 548 SER H A 574 TYR H 1.0 1.8 6.00 1505 1112 A 549 ILE HG21 A 562 LEU HA 1.0 1.8 6.00 1506 1113 A 549 ILE HG21 A 562 LEU HD11 1.0 1.8 6.00 1507 1114 A 549 ILE HG21 A 562 LEU HD21 1.0 1.8 6.00 1508 1115 A 562 LEU HD21 A 549 ILE HG1y 1.0 1.8 6.00 1509 1115 A 549 ILE HG1x A 562 LEU HD21 1.0 1.8 6.00 1510 1116 A 549 ILE HG21 A 565 PHE HB3 1.0 1.8 6.00 1511 1117 A 549 ILE HG21 A 565 PHE HB2 1.0 1.8 6.00 1512 1118 A 549 ILE HG21 A 565 PHE HD% 1.0 1.8 6.00 1513 1119 A 549 ILE HG21 A 565 PHE HE% 1.0 1.8 6.00 1514 1120 A 549 ILE HD11 A 565 PHE HB3 1.0 1.8 4.75 1515 1121 A 549 ILE HD11 A 565 PHE HB2 1.0 1.8 6.00 1516 1122 A 549 ILE HD11 A 570 LEU HB2 1.0 1.8 6.00 1517 1123 A 549 ILE H A 571 THR HA 1.0 1.8 6.00 1518 1124 A 549 ILE HB A 571 THR HA 1.0 1.8 4.75 1519 1125 A 549 ILE HG21 A 571 THR HA 1.0 1.8 6.00 1520 1126 A 549 ILE HD11 A 571 THR HA 1.0 1.8 6.00 1521 1127 A 549 ILE H A 572 THR HA 1.0 1.8 4.75 1522 1128 A 549 ILE HD11 A 572 THR HA 1.0 1.8 6.00 1523 1129 A 572 THR HA A 549 ILE HG1y 1.0 1.8 4.75 1524 1129 A 549 ILE HG1x A 572 THR HA 1.0 1.8 4.75 1525 1130 A 549 ILE HA A 573 ILE HG21 1.0 1.8 6.00 1526 1131 A 549 ILE HA A 573 ILE HD11 1.0 1.8 6.00 1527 1132 A 549 ILE HD11 A 573 ILE HA 1.0 1.8 6.00 1528 1133 A 549 ILE HD11 A 573 ILE HG21 1.0 1.8 6.00 1529 1134 A 549 ILE HD11 A 573 ILE HD11 1.0 1.8 6.00 1530 1135 A 549 ILE HD11 A 575 GLN HBx 1.0 1.8 6.00 1531 1135 A 549 ILE HD11 A 575 GLN HBy 1.0 1.8 6.00 1532 1136 A 550 VAL HA A 562 LEU HD11 1.0 1.8 3.50 1533 1137 A 550 VAL HA A 562 LEU HD21 1.0 1.8 4.75 1534 1138 A 550 VAL HB A 562 LEU HD11 1.0 1.8 4.75 1535 1139 A 550 VAL HG21 A 562 LEU HG 1.0 1.8 6.00 1536 1140 A 550 VAL HG21 A 562 LEU HD11 1.0 1.8 4.75 1537 1141 A 550 VAL HG21 A 562 LEU HD21 1.0 1.8 4.75 1538 1142 A 552 PHE HB3 A 573 ILE HG21 1.0 1.8 6.00 1539 1143 A 552 PHE HB3 A 573 ILE HD11 1.0 1.8 6.00 1540 1144 A 552 PHE HB2 A 573 ILE HG21 1.0 1.8 6.00 1541 1145 A 552 PHE HB2 A 573 ILE HD11 1.0 1.8 6.00 1542 1146 A 552 PHE HD% A 573 ILE HG21 1.0 1.8 6.00 1543 1147 A 552 PHE HD% A 573 ILE HD11 1.0 1.8 6.00 1544 1148 A 552 PHE HE% A 573 ILE HD11 1.0 1.8 6.00 1545 1149 A 552 PHE HD% A 576 ILE HD11 1.0 1.8 4.75 1546 1150 A 552 PHE HE% A 576 ILE HD11 1.0 1.8 4.75 1547 1151 A 597 ILE HG21 A 552 PHE HZ 1.0 1.8 6.00 1548 1152 A 552 PHE HE% A 597 ILE HG21 1.0 1.8 4.75 1549 1153 A 552 PHE HZ A 600 GLY HAx 1.0 1.8 4.75 1550 1153 A 600 GLY HA3 A 552 PHE HZ 1.0 1.8 4.75 1551 1154 A 552 PHE HE% A 600 GLY HAx 1.0 1.8 4.75 1552 1154 A 552 PHE HE% A 600 GLY HA3 1.0 1.8 4.75 1553 1155 A 601 ILE H A 552 PHE HZ 1.0 1.8 4.75 1554 1156 A 601 ILE HA A 552 PHE HZ 1.0 1.8 4.75 1555 1157 A 601 ILE HD11 A 552 PHE HZ 1.0 1.8 6.00 1556 1158 A 553 LEU HD21 A 558 CYS HBx 1.0 1.8 4.75 1557 1158 A 553 LEU HD21 A 558 CYS HBy 1.0 1.8 4.75 1558 1159 A 553 LEU HB3 A 559 SER HA 1.0 1.8 3.50 1559 1160 A 553 LEU HB3 A 559 SER HBx 1.0 1.8 4.75 1560 1160 A 553 LEU HB3 A 559 SER HBy 1.0 1.8 4.75 1561 1161 A 553 LEU HB2 A 559 SER HA 1.0 1.8 3.50 1562 1162 A 553 LEU HD11 A 559 SER HA 1.0 1.8 4.75 1563 1163 A 553 LEU HD21 A 559 SER HA 1.0 1.8 6.00 1564 1164 A 553 LEU HD11 A 561 CYS H 1.0 1.8 6.00 1565 1165 A 553 LEU HD11 A 561 CYS HBy 1.0 1.8 6.00 1566 1165 A 553 LEU HD11 A 561 CYS HBx 1.0 1.8 6.00 1567 1166 A 553 LEU HD21 A 561 CYS H 1.0 1.8 6.00 1568 1167 A 553 LEU HD21 A 561 CYS HBy 1.0 1.8 6.00 1569 1167 A 553 LEU HD21 A 561 CYS HBx 1.0 1.8 6.00 1570 1168 A 553 LEU HD11 A 562 LEU HA 1.0 1.8 4.75 1571 1169 A 553 LEU HD11 A 562 LEU HB3 1.0 1.8 6.00 1572 1170 A 553 LEU HD11 A 562 LEU HD11 1.0 1.8 6.00 1573 1171 A 553 LEU HD11 A 562 LEU HD21 1.0 1.8 6.00 1574 1172 A 553 LEU HD11 A 565 PHE H 1.0 1.8 6.00 1575 1173 A 553 LEU HD11 A 565 PHE HD% 1.0 1.8 6.00 1576 1174 A 553 LEU HD11 A 565 PHE HE% 1.0 1.8 4.75 1577 1175 A 553 LEU HD21 A 565 PHE HE% 1.0 1.8 3.50 1578 1176 A 553 LEU HD21 A 597 ILE HA 1.0 1.8 6.00 1579 1177 A 553 LEU HD21 A 597 ILE HG21 1.0 1.8 6.00 1580 1178 A 553 LEU HD21 A 597 ILE HD11 1.0 1.8 6.00 1581 1179 A 554 ALA HB1 A 559 SER HBx 1.0 1.8 6.00 1582 1179 A 554 ALA HB1 A 559 SER HBy 1.0 1.8 6.00 1583 1180 A 556 LEU HB2 A 597 ILE HG1x 1.0 1.8 4.75 1584 1180 A 556 LEU HB2 A 597 ILE HG1y 1.0 1.8 4.75 1585 1181 A 556 LEU HD11 A 597 ILE HA 1.0 1.8 4.75 1586 1182 A 556 LEU HD11 A 597 ILE HG1x 1.0 1.8 6.00 1587 1182 A 556 LEU HD11 A 597 ILE HG1y 1.0 1.8 6.00 1588 1183 A 556 LEU HD21 A 597 ILE HA 1.0 1.8 6.00 1589 1184 A 556 LEU HD11 A 600 GLY H 1.0 1.8 6.00 1590 1185 A 556 LEU HD11 A 600 GLY HAx 1.0 1.8 4.75 1591 1185 A 556 LEU HD11 A 600 GLY HA3 1.0 1.8 4.75 1592 1186 A 556 LEU HD21 A 600 GLY H 1.0 1.8 6.00 1593 1187 A 556 LEU HD21 A 600 GLY HAx 1.0 1.8 4.75 1594 1187 A 556 LEU HD21 A 600 GLY HA3 1.0 1.8 4.75 1595 1188 A 597 ILE HD11 A 558 CYS HBx 1.0 1.8 6.00 1596 1188 A 558 CYS HBy A 597 ILE HD11 1.0 1.8 6.00 1597 1189 A 597 ILE HD11 A 561 CYS HBy 1.0 1.8 6.00 1598 1189 A 561 CYS HBx A 597 ILE HD11 1.0 1.8 6.00 1599 1190 A 564 TYR HB3 A 587 LEU HB3 1.0 1.8 4.75 1600 1191 A 564 TYR HD% A 588 LYS HBx 1.0 1.8 3.50 1601 1191 A 564 TYR HD% A 588 LYS HBy 1.0 1.8 3.50 1602 1192 A 564 TYR HE% A 588 LYS HBx 1.0 1.8 4.75 1603 1192 A 564 TYR HE% A 588 LYS HBy 1.0 1.8 4.75 1604 1193 A 564 TYR HB3 A 589 ILE HG21 1.0 1.8 6.00 1605 1194 A 564 TYR HB3 A 589 ILE HD11 1.0 1.8 6.00 1606 1195 A 564 TYR HB3 A 589 ILE HG1y 1.0 1.8 6.00 1607 1195 A 564 TYR HB3 A 589 ILE HG1x 1.0 1.8 6.00 1608 1196 A 564 TYR HB2 A 589 ILE HD11 1.0 1.8 6.00 1609 1197 A 564 TYR HD% A 589 ILE H 1.0 1.8 6.00 1610 1198 A 564 TYR HD% A 589 ILE HG21 1.0 1.8 6.00 1611 1199 A 564 TYR HD% A 589 ILE HD11 1.0 1.8 6.00 1612 1200 A 564 TYR HD% A 589 ILE HG1y 1.0 1.8 6.00 1613 1200 A 564 TYR HD% A 589 ILE HG1x 1.0 1.8 6.00 1614 1201 A 564 TYR HE% A 589 ILE HA 1.0 1.8 4.75 1615 1202 A 564 TYR HE% A 589 ILE HG21 1.0 1.8 6.00 1616 1203 A 564 TYR HE% A 590 PRO HG3 1.0 1.8 6.00 1617 1204 A 564 TYR HE% A 590 PRO HG2 1.0 1.8 4.75 1618 1205 A 564 TYR HE% A 590 PRO HD3 1.0 1.8 4.75 1619 1206 A 564 TYR HE% A 590 PRO HD2 1.0 1.8 4.75 1620 1207 A 565 PHE HA A 570 LEU HB2 1.0 1.8 4.75 1621 1208 A 565 PHE HA A 570 LEU HD11 1.0 1.8 4.75 1622 1209 A 565 PHE HA A 570 LEU HD21 1.0 1.8 6.00 1623 1210 A 565 PHE HB3 A 570 LEU HB2 1.0 1.8 3.50 1624 1211 A 565 PHE HB3 A 570 LEU HD11 1.0 1.8 6.00 1625 1212 A 565 PHE HB2 A 570 LEU HB2 1.0 1.8 4.75 1626 1213 A 565 PHE HB2 A 570 LEU HD11 1.0 1.8 6.00 1627 1214 A 565 PHE HD% A 570 LEU HB3 1.0 1.8 6.00 1628 1215 A 565 PHE HD% A 570 LEU HB2 1.0 1.8 4.75 1629 1216 A 565 PHE HD% A 570 LEU HD11 1.0 1.8 6.00 1630 1217 A 565 PHE HD% A 570 LEU HD21 1.0 1.8 6.00 1631 1218 A 565 PHE HE% A 570 LEU HB2 1.0 1.8 6.00 1632 1219 A 565 PHE HE% A 570 LEU HD21 1.0 1.8 6.00 1633 1220 A 565 PHE HD% A 576 ILE HG21 1.0 1.8 4.75 1634 1221 A 565 PHE HD% A 576 ILE HD11 1.0 1.8 4.75 1635 1222 A 565 PHE HE% A 576 ILE HB 1.0 1.8 4.75 1636 1223 A 565 PHE HE% A 576 ILE HG21 1.0 1.8 4.75 1637 1224 A 565 PHE HE% A 576 ILE HD11 1.0 1.8 4.75 1638 1225 A 565 PHE HE% A 579 TYR HD% 1.0 1.8 4.75 1639 1226 A 565 PHE HE% A 579 TYR HE% 1.0 1.8 4.75 1640 1227 A 565 PHE HD% A 584 LEU HD21 1.0 1.8 6.00 1641 1228 A 565 PHE HE% A 584 LEU HD11 1.0 1.8 6.00 1642 1229 A 565 PHE HE% A 584 LEU HD21 1.0 1.8 3.50 1643 1230 A 565 PHE HA A 587 LEU HD11 1.0 1.8 6.00 1644 1231 A 565 PHE HA A 587 LEU HD21 1.0 1.8 6.00 1645 1232 A 565 PHE HD% A 587 LEU HD11 1.0 1.8 6.00 1646 1233 A 565 PHE HE% A 587 LEU HG 1.0 1.8 4.75 1647 1234 A 565 PHE HE% A 587 LEU HD11 1.0 1.8 4.75 1648 1235 A 565 PHE HD% A 589 ILE HD11 1.0 1.8 6.00 1649 1236 A 565 PHE HE% A 589 ILE HG21 1.0 1.8 6.00 1650 1237 A 565 PHE HE% A 589 ILE HD11 1.0 1.8 3.50 1651 1238 A 565 PHE HE% A 597 ILE HG21 1.0 1.8 3.50 1652 1239 A 565 PHE HE% A 597 ILE HD11 1.0 1.8 3.50 1653 1240 A 566 THR HA A 571 THR HG21 1.0 1.8 6.00 1654 1241 A 566 THR HG21 A 571 THR HA 1.0 1.8 6.00 1655 1242 A 566 THR HG21 A 571 THR HG21 1.0 1.8 6.00 1656 1243 A 587 LEU HD21 A 568 GLN HBy 1.0 1.8 4.75 1657 1243 A 568 GLN HBx A 587 LEU HD21 1.0 1.8 4.75 1658 1244 A 587 LEU HD11 A 568 GLN HGy 1.0 1.8 6.00 1659 1244 A 568 GLN HGx A 587 LEU HD11 1.0 1.8 6.00 1660 1245 A 587 LEU HD21 A 568 GLN HGy 1.0 1.8 4.75 1661 1245 A 568 GLN HGx A 587 LEU HD21 1.0 1.8 4.75 1662 1246 A 570 LEU HD21 A 575 GLN H 1.0 1.8 6.00 1663 1247 A 570 LEU HD21 A 575 GLN HBx 1.0 1.8 4.75 1664 1247 A 570 LEU HD21 A 575 GLN HBy 1.0 1.8 4.75 1665 1248 A 570 LEU HB3 A 576 ILE HG21 1.0 1.8 6.00 1666 1249 A 570 LEU HB2 A 576 ILE HG21 1.0 1.8 6.00 1667 1250 A 570 LEU HD11 A 576 ILE HG21 1.0 1.8 6.00 1668 1251 A 570 LEU HD21 A 576 ILE HG21 1.0 1.8 6.00 1669 1252 A 570 LEU HD11 A 579 TYR HD% 1.0 1.8 6.00 1670 1253 A 570 LEU HD11 A 579 TYR HE% 1.0 1.8 4.75 1671 1254 A 570 LEU HD21 A 579 TYR HE% 1.0 1.8 6.00 1672 1255 A 570 LEU HD21 A 583 ASP HBy 1.0 1.8 6.00 1673 1255 A 570 LEU HD21 A 583 ASP HBx 1.0 1.8 6.00 1674 1256 A 570 LEU HD11 A 587 LEU HD11 1.0 1.8 6.00 1675 1257 A 570 LEU HD11 A 587 LEU HD21 1.0 1.8 6.00 1676 1258 A 573 ILE HD11 A 601 ILE HD11 1.0 1.8 6.00 1677 1259 A 573 ILE HG21 A 604 HIS HD2 1.0 1.8 6.00 1678 1260 A 573 ILE HD11 A 604 HIS HB2 1.0 1.8 6.00 1679 1261 A 573 ILE HD11 A 604 HIS HD2 1.0 1.8 6.00 1680 1262 A 576 ILE HB A 601 ILE HG1y 1.0 1.8 4.75 1681 1262 A 576 ILE HB A 601 ILE HG1x 1.0 1.8 4.75 1682 1263 A 576 ILE HD11 A 601 ILE HG1y 1.0 1.8 6.00 1683 1263 A 576 ILE HD11 A 601 ILE HG1x 1.0 1.8 6.00 1684 1264 A 601 ILE HG21 A 576 ILE HG1y 1.0 1.8 6.00 1685 1264 A 576 ILE HG1x A 601 ILE HG21 1.0 1.8 6.00 1686 1265 A 576 ILE HG1y A 601 ILE HG1y 1.0 1.8 3.50 1687 1265 A 576 ILE HG1x A 601 ILE HG1y 1.0 1.8 3.50 1688 1265 A 601 ILE HG1x A 576 ILE HG1y 1.0 1.8 3.50 1689 1265 A 576 ILE HG1x A 601 ILE HG1x 1.0 1.8 3.50 1690 1266 A 577 GLU HA A 601 ILE HG21 1.0 1.8 4.75 1691 1267 A 577 GLU HA A 601 ILE HG1y 1.0 1.8 6.00 1692 1267 A 577 GLU HA A 601 ILE HG1x 1.0 1.8 6.00 1693 1268 A 577 GLU HA A 604 HIS HD2 1.0 1.8 6.00 1694 1269 A 604 HIS HD2 A 577 GLU HBx 1.0 1.8 4.75 1695 1269 A 577 GLU HBy A 604 HIS HD2 1.0 1.8 4.75 1696 1270 A 579 TYR HD% A 584 LEU HA 1.0 1.8 6.00 1697 1271 A 579 TYR HD% A 584 LEU HB2 1.0 1.8 6.00 1698 1272 A 579 TYR HD% A 584 LEU HG 1.0 1.8 6.00 1699 1273 A 579 TYR HD% A 584 LEU HD11 1.0 1.8 6.00 1700 1274 A 579 TYR HD% A 584 LEU HD21 1.0 1.8 6.00 1701 1275 A 579 TYR HE% A 584 LEU HA 1.0 1.8 6.00 1702 1276 A 579 TYR HE% A 584 LEU HB2 1.0 1.8 6.00 1703 1277 A 579 TYR HE% A 584 LEU HD21 1.0 1.8 6.00 1704 1278 A 579 TYR HD% A 587 LEU HD11 1.0 1.8 6.00 1705 1279 A 579 TYR HD% A 587 LEU HD21 1.0 1.8 6.00 1706 1280 A 579 TYR HE% A 587 LEU HG 1.0 1.8 4.75 1707 1281 A 579 TYR HE% A 587 LEU HD11 1.0 1.8 4.75 1708 1282 A 579 TYR HE% A 587 LEU HD21 1.0 1.8 6.00 1709 1283 A 579 TYR H A 601 ILE HG21 1.0 1.8 6.00 1710 1284 A 579 TYR H A 601 ILE HG1y 1.0 1.8 6.00 1711 1284 A 579 TYR H A 601 ILE HG1x 1.0 1.8 6.00 1712 1285 A 580 SER HA A 598 TRP HD1 1.0 1.8 4.75 1713 1286 A 580 SER HA A 598 TRP HE1 1.0 1.8 6.00 1714 1287 A 580 SER HA A 598 TRP HZ2 1.0 1.8 6.00 1715 1288 A 581 MET HE1 A 594 ARG HDx 1.0 1.8 6.00 1716 1288 A 581 MET HE1 A 594 ARG HDy 1.0 1.8 6.00 1717 1289 A 581 MET HE1 A 595 HIS HA 1.0 1.8 6.00 1718 1290 A 581 MET HE1 A 595 HIS HBx 1.0 1.8 4.75 1719 1290 A 581 MET HE1 A 595 HIS HBy 1.0 1.8 4.75 1720 1291 A 595 HIS HD2 A 581 MET HBx 1.0 1.8 4.75 1721 1291 A 581 MET HBy A 595 HIS HD2 1.0 1.8 4.75 1722 1292 A 581 MET H A 598 TRP HD1 1.0 1.8 6.00 1723 1293 A 581 MET HE1 A 598 TRP HB3 1.0 1.8 6.00 1724 1294 A 581 MET HE1 A 598 TRP HE3 1.0 1.8 6.00 1725 1295 A 598 TRP HD1 A 581 MET HBx 1.0 1.8 6.00 1726 1295 A 581 MET HBy A 598 TRP HD1 1.0 1.8 6.00 1727 1296 A 584 LEU HA A 589 ILE H 1.0 1.8 6.00 1728 1297 A 584 LEU HA A 589 ILE HD11 1.0 1.8 6.00 1729 1298 A 584 LEU HD11 A 589 ILE HD11 1.0 1.8 6.00 1730 1299 A 584 LEU HD21 A 589 ILE HB 1.0 1.8 4.75 1731 1300 A 584 LEU HD11 A 594 ARG HA 1.0 1.8 4.75 1732 1301 A 584 LEU HD11 A 594 ARG HBy 1.0 1.8 4.75 1733 1301 A 584 LEU HD11 A 594 ARG HBx 1.0 1.8 4.75 1734 1302 A 584 LEU HD11 A 594 ARG HDx 1.0 1.8 6.00 1735 1302 A 584 LEU HD11 A 594 ARG HDy 1.0 1.8 6.00 1736 1303 A 584 LEU HD21 A 594 ARG HA 1.0 1.8 6.00 1737 1304 A 584 LEU HD21 A 594 ARG HBy 1.0 1.8 6.00 1738 1304 A 584 LEU HD21 A 594 ARG HBx 1.0 1.8 6.00 1739 1305 A 584 LEU HD11 A 597 ILE H 1.0 1.8 6.00 1740 1306 A 584 LEU HD11 A 597 ILE HB 1.0 1.8 6.00 1741 1307 A 584 LEU HD11 A 598 TRP H 1.0 1.8 6.00 1742 1308 A 584 LEU HD11 A 598 TRP HA 1.0 1.8 6.00 1743 1309 A 584 LEU HD11 A 598 TRP HB3 1.0 1.8 6.00 1744 1310 A 584 LEU HD11 A 598 TRP HB2 1.0 1.8 4.75 1745 1311 A 584 LEU HD11 A 598 TRP HD1 1.0 1.8 6.00 1746 1312 A 584 LEU HG A 601 ILE HG1y 1.0 1.8 6.00 1747 1312 A 584 LEU HG A 601 ILE HG1x 1.0 1.8 6.00 1748 1313 A 584 LEU HD11 A 601 ILE HG1y 1.0 1.8 4.75 1749 1313 A 584 LEU HD11 A 601 ILE HG1x 1.0 1.8 4.75 1750 1314 A 585 ALA H A 594 ARG HDx 1.0 1.8 4.75 1751 1314 A 585 ALA H A 594 ARG HDy 1.0 1.8 4.75 1752 1315 A 585 ALA HA A 594 ARG HE 1.0 1.8 4.75 1753 1316 A 585 ALA HB1 A 594 ARG HDx 1.0 1.8 4.75 1754 1316 A 585 ALA HB1 A 594 ARG HDy 1.0 1.8 4.75 1755 1317 A 589 ILE HG21 A 594 ARG HE 1.0 1.8 6.00 1756 1318 A 589 ILE HG21 A 594 ARG HBy 1.0 1.8 4.75 1757 1318 A 589 ILE HG21 A 594 ARG HBx 1.0 1.8 4.75 1758 1319 A 589 ILE HG21 A 594 ARG HDx 1.0 1.8 6.00 1759 1319 A 589 ILE HG21 A 594 ARG HDy 1.0 1.8 6.00 1760 1320 A 589 ILE HG21 A 597 ILE HG1x 1.0 1.8 6.00 1761 1320 A 589 ILE HG21 A 597 ILE HG1y 1.0 1.8 6.00 1762 1321 A 589 ILE HD11 A 597 ILE HD11 1.0 1.8 6.00 stop_ save_ save_CNS/XPLOR_distance_constraints_4 _nef_distance_restraint_list.sf_category nef_distance_restraint_list _nef_distance_restraint_list.sf_framecode CNS/XPLOR_distance_constraints_4 _nef_distance_restraint_list.restraint_origin hbond _nef_distance_restraint_list.potential_type . 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 549 ILE H A 571 THR O 1.0 33.2 2.1 2 2 A 571 THR O A 549 ILE N 1.0 32.3 3.1 3 3 A 551 SER H A 548 SER OG 1.0 33.2 2.1 4 4 A 548 SER OG A 551 SER N 1.0 32.3 3.1 5 5 A 552 PHE H A 548 SER O 1.0 33.2 2.1 6 6 A 548 SER O A 552 PHE N 1.0 32.3 3.1 7 7 A 553 LEU H A 549 ILE O 1.0 33.2 2.1 8 8 A 549 ILE O A 553 LEU N 1.0 32.3 3.1 9 9 A 554 ALA H A 550 VAL O 1.0 33.2 2.1 10 10 A 550 VAL O A 554 ALA N 1.0 32.3 3.1 11 11 A 555 ARG H A 551 SER O 1.0 33.2 2.1 12 12 A 551 SER O A 555 ARG N 1.0 32.3 3.1 13 13 A 556 LEU H A 553 LEU O 1.0 33.2 2.1 14 14 A 553 LEU O A 556 LEU N 1.0 32.3 3.1 15 15 A 558 CYS H A 553 LEU O 1.0 33.2 2.1 16 16 A 553 LEU O A 558 CYS N 1.0 32.3 3.1 17 17 A 561 CYS H A 558 CYS O 1.0 33.2 2.1 18 18 A 558 CYS O A 561 CYS N 1.0 32.3 3.1 19 19 A 562 LEU H A 559 SER O 1.0 33.2 2.1 20 20 A 559 SER O A 562 LEU N 1.0 32.3 3.1 21 21 A 564 TYR H A 561 CYS O 1.0 33.2 2.1 22 22 A 561 CYS O A 564 TYR N 1.0 32.3 3.1 23 23 A 565 PHE H A 562 LEU O 1.0 33.2 2.1 24 24 A 562 LEU O A 565 PHE N 1.0 32.3 3.1 25 25 A 566 THR H A 562 LEU O 1.0 33.2 2.1 26 26 A 562 LEU O A 566 THR N 1.0 32.3 3.1 27 27 A 567 THR H A 563 ASP O 1.0 33.2 2.1 28 28 A 563 ASP O A 567 THR N 1.0 32.3 3.1 29 29 A 568 GLN H A 565 PHE O 1.0 33.2 2.1 30 30 A 565 PHE O A 568 GLN N 1.0 32.3 3.1 31 31 A 569 GLY H A 566 THR O 1.0 33.2 2.1 32 32 A 566 THR O A 569 GLY N 1.0 32.3 3.1 33 33 A 570 LEU H A 565 PHE O 1.0 33.2 2.1 34 34 A 565 PHE O A 570 LEU N 1.0 32.3 3.1 35 35 A 573 ILE H A 547 CYS O 1.0 33.2 2.1 36 36 A 547 CYS O A 573 ILE N 1.0 32.3 3.1 37 37 A 575 GLN H A 572 THR OG1 1.0 33.2 2.1 38 38 A 572 THR OG1 A 575 GLN N 1.0 32.3 3.1 39 39 A 576 ILE H A 573 ILE O 1.0 33.2 2.1 40 40 A 573 ILE O A 576 ILE N 1.0 32.3 3.1 41 41 A 577 GLU H A 574 TYR O 1.0 33.2 2.1 42 42 A 574 TYR O A 577 GLU N 1.0 32.3 3.1 43 43 A 579 TYR H A 576 ILE O 1.0 33.2 2.1 44 44 A 576 ILE O A 579 TYR N 1.0 32.3 3.1 45 45 A 580 SER H A 583 ASP OD2 1.0 33.2 2.1 46 46 A 583 ASP OD2 A 580 SER N 1.0 32.3 3.1 47 47 A 583 ASP H A 580 SER OG 1.0 33.2 2.1 48 48 A 580 SER OG A 583 ASP N 1.0 32.3 3.1 49 49 A 584 LEU H A 580 SER O 1.0 33.2 2.1 50 50 A 580 SER O A 584 LEU N 1.0 32.3 3.1 51 51 A 585 ALA H A 581 MET O 1.0 33.2 2.1 52 52 A 581 MET O A 585 ALA N 1.0 32.3 3.1 53 53 A 586 SER H A 582 ASP O 1.0 33.2 2.1 54 54 A 582 ASP O A 586 SER N 1.0 32.3 3.1 55 55 A 587 LEU H A 583 ASP O 1.0 33.2 2.1 56 56 A 583 ASP O A 587 LEU N 1.0 32.3 3.1 57 57 A 588 LYS H A 585 ALA O 1.0 33.2 2.1 58 58 A 585 ALA O A 588 LYS N 1.0 32.3 3.1 59 59 A 589 ILE H A 584 LEU O 1.0 33.2 2.1 60 60 A 584 LEU O A 589 ILE N 1.0 32.3 3.1 61 61 A 597 ILE H A 593 PHE O 1.0 33.2 2.1 62 62 A 593 PHE O A 597 ILE N 1.0 32.3 3.1 63 63 A 598 TRP H A 594 ARG O 1.0 33.2 2.1 64 64 A 594 ARG O A 598 TRP N 1.0 32.3 3.1 65 65 A 599 LYS H A 595 HIS O 1.0 33.2 2.1 66 66 A 595 HIS O A 599 LYS N 1.0 32.3 3.1 67 67 A 600 GLY H A 596 ALA O 1.0 33.2 2.1 68 68 A 596 ALA O A 600 GLY N 1.0 32.3 3.1 69 69 A 601 ILE H A 597 ILE O 1.0 33.2 2.1 70 70 A 597 ILE O A 601 ILE N 1.0 32.3 3.1 71 71 A 602 LEU H A 598 TRP O 1.0 33.2 2.1 72 72 A 598 TRP O A 602 LEU N 1.0 32.3 3.1 73 73 A 603 ASP H A 599 LYS O 1.0 33.2 2.1 74 74 A 599 LYS O A 603 ASP N 1.0 32.3 3.1 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 552 PHE N A 552 PHE CA A 552 PHE CB A 552 PHE CG 1.0 135.0 225.0 CHI1 2 2 A 553 LEU N A 553 LEU CA A 553 LEU CB A 553 LEU CG 1.0 -105.0 -15.0 CHI1 3 3 A 556 LEU N A 556 LEU CA A 556 LEU CB A 556 LEU CG 1.0 -105.0 -15.0 CHI1 4 4 A 562 LEU N A 562 LEU CA A 562 LEU CB A 562 LEU CG 1.0 135.0 225.0 CHI1 5 5 A 564 TYR N A 564 TYR CA A 564 TYR CB A 564 TYR CG 1.0 -105.0 -15.0 CHI1 6 6 A 565 PHE N A 565 PHE CA A 565 PHE CB A 565 PHE CG 1.0 -105.0 -15.0 CHI1 7 7 A 570 LEU N A 570 LEU CA A 570 LEU CB A 570 LEU CG 1.0 -105.0 -15.0 CHI1 8 8 A 574 TYR N A 574 TYR CA A 574 TYR CB A 574 TYR CG 1.0 -105.0 -15.0 CHI1 9 9 A 579 TYR N A 579 TYR CA A 579 TYR CB A 579 TYR CG 1.0 -105.0 -15.0 CHI1 10 10 A 584 LEU N A 584 LEU CA A 584 LEU CB A 584 LEU CG 1.0 135.0 225.0 CHI1 11 11 A 587 LEU N A 587 LEU CA A 587 LEU CB A 587 LEU CG 1.0 -105.0 -15.0 CHI1 12 12 A 593 PHE N A 593 PHE CA A 593 PHE CB A 593 PHE CG 1.0 -105.0 -15.0 CHI1 13 13 A 598 TRP N A 598 TRP CA A 598 TRP CB A 598 TRP CG 1.0 135.0 225.0 CHI1 14 14 A 602 LEU N A 602 LEU CA A 602 LEU CB A 602 LEU CG 1.0 -105.0 -15.0 CHI1 15 15 A 604 HIS N A 604 HIS CA A 604 HIS CB A 604 HIS CG 1.0 135.0 225.0 CHI1 16 16 A 543 TYR C A 544 PRO N A 544 PRO CA A 544 PRO C 1.0 -97.0 -41.0 PHI 17 17 A 546 ASP C A 547 CYS N A 547 CYS CA A 547 CYS C 1.0 -97.0 -59.0 PHI 18 18 A 547 CYS C A 548 SER N A 548 SER CA A 548 SER C 1.0 -105.0 -57.0 PHI 19 19 A 548 SER C A 549 ILE N A 549 ILE CA A 549 ILE C 1.0 -82.0 -52.0 PHI 20 20 A 549 ILE C A 550 VAL N A 550 VAL CA A 550 VAL C 1.0 -74.0 -56.0 PHI 21 21 A 550 VAL C A 551 SER N A 551 SER CA A 551 SER C 1.0 -78.0 -54.0 PHI 22 22 A 551 SER C A 552 PHE N A 552 PHE CA A 552 PHE C 1.0 -77.0 -59.0 PHI 23 23 A 552 PHE C A 553 LEU N A 553 LEU CA A 553 LEU C 1.0 -74.0 -52.0 PHI 24 24 A 553 LEU C A 554 ALA N A 554 ALA CA A 554 ALA C 1.0 -75.0 -55.0 PHI 25 25 A 554 ALA C A 555 ARG N A 555 ARG CA A 555 ARG C 1.0 -80.0 -52.0 PHI 26 26 A 555 ARG C A 556 LEU N A 556 LEU CA A 556 LEU C 1.0 -109.0 -77.0 PHI 27 27 A 556 LEU C A 557 GLY N A 557 GLY CA A 557 GLY C 1.0 39.0 95.0 PHI 28 28 A 558 CYS C A 559 SER N A 559 SER CA A 559 SER C 1.0 -75.0 -47.0 PHI 29 29 A 559 SER C A 560 SER N A 560 SER CA A 560 SER C 1.0 -87.0 -53.0 PHI 30 30 A 560 SER C A 561 CYS N A 561 CYS CA A 561 CYS C 1.0 -89.0 -49.0 PHI 31 31 A 561 CYS C A 562 LEU N A 562 LEU CA A 562 LEU C 1.0 -81.0 -51.0 PHI 32 32 A 562 LEU C A 563 ASP N A 563 ASP CA A 563 ASP C 1.0 -73.0 -53.0 PHI 33 33 A 563 ASP C A 564 TYR N A 564 TYR CA A 564 TYR C 1.0 -82.0 -54.0 PHI 34 34 A 564 TYR C A 565 PHE N A 565 PHE CA A 565 PHE C 1.0 -75.0 -53.0 PHI 35 35 A 565 PHE C A 566 THR N A 566 THR CA A 566 THR C 1.0 -75.0 -59.0 PHI 36 36 A 566 THR C A 567 THR N A 567 THR CA A 567 THR C 1.0 -80.0 -56.0 PHI 37 37 A 567 THR C A 568 GLN N A 568 GLN CA A 568 GLN C 1.0 -117.0 -77.0 PHI 38 38 A 568 GLN C A 569 GLY N A 569 GLY CA A 569 GLY C 1.0 67.0 111.0 PHI 39 39 A 569 GLY C A 570 LEU N A 570 LEU CA A 570 LEU C 1.0 -127.0 -73.0 PHI 40 40 A 571 THR C A 572 THR N A 572 THR CA A 572 THR C 1.0 -136.0 -80.0 PHI 41 41 A 573 ILE C A 574 TYR N A 574 TYR CA A 574 TYR C 1.0 -98.0 -52.0 PHI 42 42 A 574 TYR C A 575 GLN N A 575 GLN CA A 575 GLN C 1.0 -98.0 -58.0 PHI 43 43 A 575 GLN C A 576 ILE N A 576 ILE CA A 576 ILE C 1.0 -124.0 -84.0 PHI 44 44 A 578 HIS C A 579 TYR N A 579 TYR CA A 579 TYR C 1.0 -120.0 -54.0 PHI 45 45 A 579 TYR C A 580 SER N A 580 SER CA A 580 SER C 1.0 -100.0 -76.0 PHI 46 46 A 580 SER C A 581 MET N A 581 MET CA A 581 MET C 1.0 -73.0 -51.0 PHI 47 47 A 581 MET C A 582 ASP N A 582 ASP CA A 582 ASP C 1.0 -75.0 -53.0 PHI 48 48 A 582 ASP C A 583 ASP N A 583 ASP CA A 583 ASP C 1.0 -79.0 -53.0 PHI 49 49 A 583 ASP C A 584 LEU N A 584 LEU CA A 584 LEU C 1.0 -76.0 -52.0 PHI 50 50 A 584 LEU C A 585 ALA N A 585 ALA CA A 585 ALA C 1.0 -75.0 -51.0 PHI 51 51 A 585 ALA C A 586 SER N A 586 SER CA A 586 SER C 1.0 -83.0 -57.0 PHI 52 52 A 586 SER C A 587 LEU N A 587 LEU CA A 587 LEU C 1.0 -109.0 -59.0 PHI 53 53 A 590 PRO C A 591 GLU N A 591 GLU CA A 591 GLU C 1.0 -76.0 -50.0 PHI 54 54 A 591 GLU C A 592 GLN N A 592 GLN CA A 592 GLN C 1.0 -106.0 -58.0 PHI 55 55 A 593 PHE C A 594 ARG N A 594 ARG CA A 594 ARG C 1.0 -73.0 -55.0 PHI 56 56 A 594 ARG C A 595 HIS N A 595 HIS CA A 595 HIS C 1.0 -75.0 -55.0 PHI 57 57 A 595 HIS C A 596 ALA N A 596 ALA CA A 596 ALA C 1.0 -78.0 -58.0 PHI 58 58 A 596 ALA C A 597 ILE N A 597 ILE CA A 597 ILE C 1.0 -76.0 -52.0 PHI 59 59 A 597 ILE C A 598 TRP N A 598 TRP CA A 598 TRP C 1.0 -77.0 -53.0 PHI 60 60 A 598 TRP C A 599 LYS N A 599 LYS CA A 599 LYS C 1.0 -75.0 -53.0 PHI 61 61 A 599 LYS C A 600 GLY N A 600 GLY CA A 600 GLY C 1.0 -76.0 -54.0 PHI 62 62 A 600 GLY C A 601 ILE N A 601 ILE CA A 601 ILE C 1.0 -80.0 -54.0 PHI 63 63 A 601 ILE C A 602 LEU N A 602 LEU CA A 602 LEU C 1.0 -74.0 -56.0 PHI 64 64 A 602 LEU C A 603 ASP N A 603 ASP CA A 603 ASP C 1.0 -77.0 -51.0 PHI 65 65 A 603 ASP C A 604 HIS N A 604 HIS CA A 604 HIS C 1.0 -78.0 -56.0 PHI 66 66 A 604 HIS C A 605 ARG N A 605 ARG CA A 605 ARG C 1.0 -81.0 -53.0 PHI 67 67 A 605 ARG C A 606 GLN N A 606 GLN CA A 606 GLN C 1.0 -87.0 -51.0 PHI 68 68 A 606 GLN C A 607 LEU N A 607 LEU CA A 607 LEU C 1.0 -99.0 -53.0 PHI 69 69 A 607 LEU C A 608 HIS N A 608 HIS CA A 608 HIS C 1.0 -108.0 -74.0 PHI 70 70 A 544 PRO N A 544 PRO CA A 544 PRO C A 545 THR N 1.0 114.0 154.0 PSI 71 71 A 547 CYS N A 547 CYS CA A 547 CYS C A 548 SER N 1.0 112.0 158.0 PSI 72 72 A 548 SER N A 548 SER CA A 548 SER C A 549 ILE N 1.0 113.0 163.0 PSI 73 73 A 549 ILE N A 549 ILE CA A 549 ILE C A 550 VAL N 1.0 -57.0 -21.0 PSI 74 74 A 550 VAL N A 550 VAL CA A 550 VAL C A 551 SER N 1.0 -49.0 -29.0 PSI 75 75 A 551 SER N A 551 SER CA A 551 SER C A 552 PHE N 1.0 -50.0 -28.0 PSI 76 76 A 552 PHE N A 552 PHE CA A 552 PHE C A 553 LEU N 1.0 -54.0 -24.0 PSI 77 77 A 553 LEU N A 553 LEU CA A 553 LEU C A 554 ALA N 1.0 -57.0 -27.0 PSI 78 78 A 554 ALA N A 554 ALA CA A 554 ALA C A 555 ARG N 1.0 -46.0 -26.0 PSI 79 79 A 555 ARG N A 555 ARG CA A 555 ARG C A 556 LEU N 1.0 -48.0 -10.0 PSI 80 80 A 556 LEU N A 556 LEU CA A 556 LEU C A 557 GLY N 1.0 -18.0 26.0 PSI 81 81 A 557 GLY N A 557 GLY CA A 557 GLY C A 558 CYS N 1.0 9.0 51.0 PSI 82 82 A 559 SER N A 559 SER CA A 559 SER C A 560 SER N 1.0 -45.0 -21.0 PSI 83 83 A 560 SER N A 560 SER CA A 560 SER C A 561 CYS N 1.0 -47.0 -7.0 PSI 84 84 A 561 CYS N A 561 CYS CA A 561 CYS C A 562 LEU N 1.0 -54.0 -20.0 PSI 85 85 A 562 LEU N A 562 LEU CA A 562 LEU C A 563 ASP N 1.0 -50.0 -24.0 PSI 86 86 A 563 ASP N A 563 ASP CA A 563 ASP C A 564 TYR N 1.0 -50.0 -28.0 PSI 87 87 A 564 TYR N A 564 TYR CA A 564 TYR C A 565 PHE N 1.0 -54.0 -26.0 PSI 88 88 A 565 PHE N A 565 PHE CA A 565 PHE C A 566 THR N 1.0 -48.0 -28.0 PSI 89 89 A 566 THR N A 566 THR CA A 566 THR C A 567 THR N 1.0 -48.0 -28.0 PSI 90 90 A 567 THR N A 567 THR CA A 567 THR C A 568 GLN N 1.0 -44.0 -8.0 PSI 91 91 A 568 GLN N A 568 GLN CA A 568 GLN C A 569 GLY N 1.0 -13.0 25.0 PSI 92 92 A 569 GLY N A 569 GLY CA A 569 GLY C A 570 LEU N 1.0 4.0 28.0 PSI 93 93 A 570 LEU N A 570 LEU CA A 570 LEU C A 571 THR N 1.0 112.0 160.0 PSI 94 94 A 572 THR N A 572 THR CA A 572 THR C A 573 ILE N 1.0 134.0 204.0 PSI 95 95 A 574 TYR N A 574 TYR CA A 574 TYR C A 575 GLN N 1.0 -52.0 -8.0 PSI 96 96 A 575 GLN N A 575 GLN CA A 575 GLN C A 576 ILE N 1.0 -50.0 -6.0 PSI 97 97 A 576 ILE N A 576 ILE CA A 576 ILE C A 577 GLU N 1.0 -23.0 15.0 PSI 98 98 A 579 TYR N A 579 TYR CA A 579 TYR C A 580 SER N 1.0 106.0 152.0 PSI 99 99 A 580 SER N A 580 SER CA A 580 SER C A 581 MET N 1.0 158.0 180.0 PSI 100 100 A 581 MET N A 581 MET CA A 581 MET C A 582 ASP N 1.0 -47.0 -23.0 PSI 101 101 A 582 ASP N A 582 ASP CA A 582 ASP C A 583 ASP N 1.0 -54.0 -30.0 PSI 102 102 A 583 ASP N A 583 ASP CA A 583 ASP C A 584 LEU N 1.0 -52.0 -30.0 PSI 103 103 A 584 LEU N A 584 LEU CA A 584 LEU C A 585 ALA N 1.0 -53.0 -27.0 PSI 104 104 A 585 ALA N A 585 ALA CA A 585 ALA C A 586 SER N 1.0 -47.0 -29.0 PSI 105 105 A 586 SER N A 586 SER CA A 586 SER C A 587 LEU N 1.0 -43.0 -3.0 PSI 106 106 A 587 LEU N A 587 LEU CA A 587 LEU C A 588 LYS N 1.0 -22.0 18.0 PSI 107 107 A 591 GLU N A 591 GLU CA A 591 GLU C A 592 GLN N 1.0 -47.0 -23.0 PSI 108 108 A 592 GLN N A 592 GLN CA A 592 GLN C A 593 PHE N 1.0 -52.0 -4.0 PSI 109 109 A 594 ARG N A 594 ARG CA A 594 ARG C A 595 HIS N 1.0 -54.0 -26.0 PSI 110 110 A 595 HIS N A 595 HIS CA A 595 HIS C A 596 ALA N 1.0 -50.0 -26.0 PSI 111 111 A 596 ALA N A 596 ALA CA A 596 ALA C A 597 ILE N 1.0 -52.0 -28.0 PSI 112 112 A 597 ILE N A 597 ILE CA A 597 ILE C A 598 TRP N 1.0 -51.0 -31.0 PSI 113 113 A 598 TRP N A 598 TRP CA A 598 TRP C A 599 LYS N 1.0 -51.0 -29.0 PSI 114 114 A 599 LYS N A 599 LYS CA A 599 LYS C A 600 GLY N 1.0 -54.0 -26.0 PSI 115 115 A 600 GLY N A 600 GLY CA A 600 GLY C A 601 ILE N 1.0 -49.0 -29.0 PSI 116 116 A 601 ILE N A 601 ILE CA A 601 ILE C A 602 LEU N 1.0 -56.0 -30.0 PSI 117 117 A 602 LEU N A 602 LEU CA A 602 LEU C A 603 ASP N 1.0 -49.0 -27.0 PSI 118 118 A 603 ASP N A 603 ASP CA A 603 ASP C A 604 HIS N 1.0 -47.0 -31.0 PSI 119 119 A 604 HIS N A 604 HIS CA A 604 HIS C A 605 ARG N 1.0 -55.0 -29.0 PSI 120 120 A 605 ARG N A 605 ARG CA A 605 ARG C A 606 GLN N 1.0 -47.0 -25.0 PSI 121 121 A 606 GLN N A 606 GLN CA A 606 GLN C A 607 LEU N 1.0 -52.0 -6.0 PSI 122 122 A 607 LEU N A 607 LEU CA A 607 LEU C A 608 HIS N 1.0 -42.0 -8.0 PSI 123 123 A 608 HIS N A 608 HIS CA A 608 HIS C A 609 GLU N 1.0 -42.0 2.0 PSI stop_ save_