data_nef_c17132_2l2d 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 11 SER start . . 2 A 12 ALA middle . . 3 A 13 GLU middle . . 4 A 14 CYS middle . . 5 A 15 TRP middle . . 6 A 16 ALA middle . . 7 A 17 ALA middle . . 8 A 18 LEU middle . . 9 A 19 LEU middle . . 10 A 20 HIS middle . . 11 A 21 ASP middle . . 12 A 22 PRO middle . false 13 A 23 MET middle . . 14 A 24 THR middle . . 15 A 25 LEU middle . . 16 A 26 ASP middle . . 17 A 27 MET middle . . 18 A 28 ASP middle . . 19 A 29 ALA middle . . 20 A 30 VAL middle . . 21 A 31 LEU middle . . 22 A 32 SER middle . . 23 A 33 ASP middle . . 24 A 34 PHE middle . . 25 A 35 VAL middle . . 26 A 36 ARG middle . . 27 A 37 SER middle . . 28 A 38 THR middle . . 29 A 39 GLY middle . false 30 A 40 ALA middle . . 31 A 41 GLU middle . . 32 A 42 PRO middle . false 33 A 43 GLY middle . false 34 A 44 LEU middle . . 35 A 45 ALA middle . . 36 A 46 ARG middle . . 37 A 47 ASP middle . . 38 A 48 LEU middle . . 39 A 49 LEU middle . . 40 A 50 GLU middle . . 41 A 51 GLY middle . false 42 A 52 LYS middle . . 43 A 53 ASN middle . . 44 A 54 TRP middle . . 45 A 55 ASP middle . . 46 A 56 LEU middle . . 47 A 57 THR middle . . 48 A 58 ALA middle . . 49 A 59 ALA middle . . 50 A 60 LEU middle . . 51 A 61 SER middle . . 52 A 62 ASP middle . . 53 A 63 TYR middle . . 54 A 64 GLU middle . . 55 A 65 GLN middle . . 56 A 66 LEU middle . . 57 A 67 ARG middle . . 58 A 68 GLN middle . . 59 A 69 VAL middle . . 60 A 70 HIS middle . . 61 A 71 THR middle . . 62 A 72 ALA middle . . 63 A 73 ASN middle . . 64 A 74 LEU middle . . 65 A 75 PRO middle . false 66 A 76 HIS middle . . 67 A 77 VAL middle . . 68 A 78 PHE middle . . 69 A 79 ASN middle . . 70 A 80 GLU middle . . 71 A 81 GLY middle . false 72 A 82 ARG middle . . 73 A 83 GLY end . false stop_ save_ save_assigned_chem_shift_list_1 _nef_chemical_shift_list.sf_category nef_chemical_shift_list _nef_chemical_shift_list.sf_framecode assigned_chem_shift_list_1 loop_ _nef_chemical_shift.chain_code _nef_chemical_shift.sequence_code _nef_chemical_shift.residue_name _nef_chemical_shift.atom_name _nef_chemical_shift.element _nef_chemical_shift.isotope_number _nef_chemical_shift.value _nef_chemical_shift.value_uncertainty A 11 SER HA H 1 4.410 0.04 A 11 SER HBy H 1 3.842 0.04 A 11 SER HBx H 1 3.801 0.04 A 11 SER C C 13 174.520 0.4 A 11 SER CA C 13 58.430 0.40 A 11 SER CB C 13 63.740 0.40 A 12 ALA H H 1 8.470 0.04 A 12 ALA HA H 1 4.226 0.04 A 12 ALA HB% H 1 1.337 0.04 A 12 ALA C C 13 178.058 0.4 A 12 ALA CA C 13 52.810 0.40 A 12 ALA CB C 13 18.840 0.40 A 12 ALA N N 15 125.747 0.40 A 13 GLU H H 1 8.303 0.04 A 13 GLU HA H 1 4.124 0.04 A 13 GLU HBx H 1 1.827 0.04 A 13 GLU HBy H 1 1.827 0.04 A 13 GLU HGx H 1 2.176 0.04 A 13 GLU HGy H 1 2.176 0.04 A 13 GLU C C 13 176.856 0.4 A 13 GLU CA C 13 57.000 0.40 A 13 GLU CB C 13 29.540 0.40 A 13 GLU CG C 13 36.320 0.40 A 13 GLU N N 15 119.370 0.40 A 14 CYS H H 1 8.112 0.04 A 14 CYS HA H 1 4.352 0.04 A 14 CYS HBx H 1 2.810 0.04 A 14 CYS HBy H 1 2.810 0.04 A 14 CYS C C 13 174.785 0.4 A 14 CYS CA C 13 58.730 0.40 A 14 CYS CB C 13 27.510 0.40 A 14 CYS N N 15 119.552 0.40 A 15 TRP H H 1 8.024 0.04 A 15 TRP HA H 1 4.553 0.04 A 15 TRP HBy H 1 3.273 0.04 A 15 TRP HBx H 1 3.226 0.04 A 15 TRP HD1 H 1 7.225 0.04 A 15 TRP HE1 H 1 10.110 0.04 A 15 TRP HE3 H 1 7.523 0.04 A 15 TRP HH2 H 1 7.158 0.04 A 15 TRP HZ2 H 1 7.412 0.04 A 15 TRP HZ3 H 1 7.070 0.04 A 15 TRP C C 13 176.453 0.4 A 15 TRP CA C 13 57.760 0.40 A 15 TRP CB C 13 29.170 0.40 A 15 TRP CD1 C 13 127.164 0.40 A 15 TRP CE3 C 13 120.154 0.40 A 15 TRP CH2 C 13 124.245 0.40 A 15 TRP CZ2 C 13 114.397 0.40 A 15 TRP CZ3 C 13 121.594 0.40 A 15 TRP N N 15 123.030 0.40 A 15 TRP NE1 N 15 129.428 0.04 A 16 ALA H H 1 7.897 0.04 A 16 ALA HA H 1 4.065 0.04 A 16 ALA HB% H 1 1.214 0.04 A 16 ALA C C 13 177.620 0.4 A 16 ALA CA C 13 53.060 0.40 A 16 ALA CB C 13 19.020 0.40 A 16 ALA N N 15 124.340 0.40 A 17 ALA H H 1 7.809 0.04 A 17 ALA HA H 1 4.114 0.04 A 17 ALA HB% H 1 1.317 0.04 A 17 ALA C C 13 177.895 0.4 A 17 ALA CA C 13 52.700 0.40 A 17 ALA CB C 13 18.990 0.40 A 17 ALA N N 15 121.376 0.40 A 18 LEU H H 1 7.822 0.04 A 18 LEU HA H 1 4.208 0.04 A 18 LEU HBy H 1 1.590 0.04 A 18 LEU HBx H 1 1.478 0.04 A 18 LEU HD1% H 1 0.839 0.04 A 18 LEU HD2% H 1 0.798 0.04 A 18 LEU HG H 1 1.482 0.04 A 18 LEU C C 13 177.252 0.4 A 18 LEU CA C 13 55.160 0.40 A 18 LEU CB C 13 42.110 0.40 A 18 LEU CD1 C 13 24.930 0.40 A 18 LEU CD2 C 13 23.340 0.40 A 18 LEU CG C 13 26.840 0.40 A 18 LEU N N 15 119.633 0.40 A 19 LEU H H 1 7.860 0.04 A 19 LEU HA H 1 4.202 0.04 A 19 LEU HBy H 1 1.533 0.04 A 19 LEU HBx H 1 1.422 0.04 A 19 LEU HD1% H 1 0.839 0.04 A 19 LEU HD2% H 1 0.766 0.04 A 19 LEU HG H 1 1.569 0.04 A 19 LEU C C 13 176.863 0.4 A 19 LEU CA C 13 55.340 0.40 A 19 LEU CB C 13 41.970 0.40 A 19 LEU CD1 C 13 25.110 0.40 A 19 LEU CD2 C 13 23.340 0.40 A 19 LEU CG C 13 26.790 0.40 A 19 LEU N N 15 121.232 0.40 A 20 HIS H H 1 8.076 0.04 A 20 HIS HA H 1 4.562 0.04 A 20 HIS HBy H 1 3.103 0.04 A 20 HIS HBx H 1 3.010 0.04 A 20 HIS HD2 H 1 7.049 0.04 A 20 HIS C C 13 174.071 0.4 A 20 HIS CA C 13 55.410 0.40 A 20 HIS CB C 13 30.220 0.40 A 20 HIS CD2 C 13 120.014 0.40 A 20 HIS N N 15 118.562 0.40 A 21 ASP H H 1 8.259 0.04 A 21 ASP HA H 1 4.790 0.04 A 21 ASP HBy H 1 2.719 0.04 A 21 ASP HBx H 1 2.463 0.04 A 21 ASP CA C 13 51.920 0.40 A 21 ASP CB C 13 41.240 0.40 A 21 ASP N N 15 123.062 0.40 A 22 PRO HA H 1 4.327 0.04 A 22 PRO HBy H 1 2.245 0.04 A 22 PRO HBx H 1 1.880 0.04 A 22 PRO HDx H 1 3.745 0.04 A 22 PRO HDy H 1 3.745 0.04 A 22 PRO HGx H 1 1.958 0.04 A 22 PRO HGy H 1 1.958 0.04 A 22 PRO C C 13 177.167 0.4 A 22 PRO CA C 13 63.760 0.40 A 22 PRO CB C 13 32.210 0.40 A 22 PRO CD C 13 50.480 0.40 A 22 PRO CG C 13 27.240 0.40 A 23 MET H H 1 8.408 0.04 A 23 MET HA H 1 4.392 0.04 A 23 MET HBx H 1 2.027 0.04 A 23 MET HBy H 1 2.027 0.04 A 23 MET HE% H 1 2.031 0.04 A 23 MET HGy H 1 2.582 0.04 A 23 MET HGx H 1 2.456 0.04 A 23 MET C C 13 176.800 0.4 A 23 MET CA C 13 55.740 0.40 A 23 MET CB C 13 32.500 0.40 A 23 MET CE C 13 16.990 0.40 A 23 MET CG C 13 32.210 0.40 A 23 MET N N 15 118.614 0.40 A 24 THR H H 1 7.856 0.04 A 24 THR HA H 1 4.241 0.04 A 24 THR HB H 1 4.219 0.04 A 24 THR HG2% H 1 1.114 0.04 A 24 THR C C 13 174.205 0.4 A 24 THR CA C 13 61.710 0.40 A 24 THR CB C 13 69.720 0.40 A 24 THR CG2 C 13 21.650 0.40 A 24 THR N N 15 114.315 0.40 A 25 LEU H H 1 7.944 0.04 A 25 LEU HA H 1 4.170 0.04 A 25 LEU HBx H 1 1.481 0.04 A 25 LEU HBy H 1 1.481 0.04 A 25 LEU HD1% H 1 0.825 0.04 A 25 LEU HD2% H 1 0.677 0.04 A 25 LEU HG H 1 1.363 0.04 A 25 LEU C C 13 176.277 0.4 A 25 LEU CA C 13 55.630 0.40 A 25 LEU CB C 13 42.760 0.40 A 25 LEU CD1 C 13 24.440 0.40 A 25 LEU CD2 C 13 24.440 0.40 A 25 LEU CG C 13 26.970 0.40 A 25 LEU N N 15 124.340 0.40 A 26 ASP H H 1 8.350 0.04 A 26 ASP HA H 1 4.563 0.04 A 26 ASP HBy H 1 2.848 0.04 A 26 ASP HBx H 1 2.435 0.04 A 26 ASP C C 13 176.326 0.4 A 26 ASP CA C 13 53.350 0.40 A 26 ASP CB C 13 40.300 0.40 A 26 ASP N N 15 123.596 0.40 A 27 MET H H 1 8.035 0.04 A 27 MET HA H 1 3.421 0.04 A 27 MET HBy H 1 1.440 0.04 A 27 MET HBx H 1 1.100 0.04 A 27 MET HE% H 1 1.592 0.04 A 27 MET HGy H 1 1.723 0.04 A 27 MET HGx H 1 0.759 0.04 A 27 MET C C 13 177.443 0.4 A 27 MET CA C 13 59.570 0.40 A 27 MET CB C 13 32.640 0.40 A 27 MET CE C 13 16.790 0.40 A 27 MET CG C 13 32.350 0.40 A 27 MET N N 15 122.573 0.40 A 28 ASP H H 1 7.957 0.04 A 28 ASP HA H 1 4.310 0.04 A 28 ASP HBy H 1 2.656 0.04 A 28 ASP HBx H 1 2.586 0.04 A 28 ASP C C 13 178.744 0.4 A 28 ASP CA C 13 57.580 0.40 A 28 ASP CB C 13 40.410 0.40 A 28 ASP N N 15 118.032 0.40 A 29 ALA H H 1 7.694 0.04 A 29 ALA HA H 1 4.097 0.04 A 29 ALA HB% H 1 1.446 0.04 A 29 ALA C C 13 180.108 0.4 A 29 ALA CA C 13 54.940 0.40 A 29 ALA CB C 13 18.340 0.40 A 29 ALA N N 15 124.000 0.40 A 30 VAL H H 1 7.940 0.04 A 30 VAL HA H 1 3.892 0.04 A 30 VAL HB H 1 2.357 0.04 A 30 VAL HG1% H 1 1.282 0.04 A 30 VAL HG2% H 1 1.249 0.04 A 30 VAL C C 13 178.235 0.4 A 30 VAL CA C 13 66.580 0.40 A 30 VAL CB C 13 32.100 0.40 A 30 VAL CG1 C 13 23.560 0.40 A 30 VAL CG2 C 13 22.980 0.40 A 30 VAL N N 15 119.649 0.40 A 31 LEU H H 1 8.486 0.04 A 31 LEU HA H 1 3.952 0.04 A 31 LEU HBy H 1 2.071 0.04 A 31 LEU HBx H 1 1.751 0.04 A 31 LEU HD1% H 1 0.863 0.04 A 31 LEU HD2% H 1 0.927 0.04 A 31 LEU HG H 1 1.642 0.04 A 31 LEU C C 13 178.567 0.4 A 31 LEU CA C 13 58.440 0.40 A 31 LEU CB C 13 41.970 0.40 A 31 LEU CD1 C 13 25.660 0.40 A 31 LEU CD2 C 13 26.240 0.40 A 31 LEU CG C 13 27.480 0.40 A 31 LEU N N 15 120.765 0.40 A 32 SER H H 1 8.109 0.04 A 32 SER HA H 1 4.114 0.04 A 32 SER HBy H 1 4.010 0.04 A 32 SER HBx H 1 3.959 0.04 A 32 SER C C 13 177.238 0.4 A 32 SER CA C 13 61.620 0.40 A 32 SER CB C 13 62.490 0.40 A 32 SER N N 15 113.114 0.40 A 33 ASP H H 1 8.221 0.04 A 33 ASP HA H 1 4.422 0.04 A 33 ASP HBy H 1 2.914 0.04 A 33 ASP HBx H 1 2.700 0.04 A 33 ASP C C 13 178.822 0.4 A 33 ASP CA C 13 57.510 0.40 A 33 ASP CB C 13 40.520 0.40 A 33 ASP N N 15 122.949 0.40 A 34 PHE H H 1 8.688 0.04 A 34 PHE HA H 1 3.827 0.04 A 34 PHE HBy H 1 3.345 0.04 A 34 PHE HBx H 1 2.946 0.04 A 34 PHE HDx H 1 6.749 0.04 A 34 PHE HDy H 1 6.749 0.04 A 34 PHE HEx H 1 6.639 0.04 A 34 PHE HEy H 1 6.639 0.04 A 34 PHE HZ H 1 6.821 0.04 A 34 PHE C C 13 179.620 0.4 A 34 PHE CA C 13 62.060 0.40 A 34 PHE CB C 13 40.090 0.40 A 34 PHE CD1 C 13 131.221 0.40 A 34 PHE CE1 C 13 130.973 0.40 A 34 PHE CZ C 13 129.373 0.40 A 34 PHE N N 15 122.480 0.40 A 35 VAL H H 1 8.970 0.04 A 35 VAL HA H 1 3.367 0.04 A 35 VAL HB H 1 2.168 0.04 A 35 VAL HG1% H 1 0.944 0.04 A 35 VAL HG2% H 1 0.970 0.04 A 35 VAL C C 13 178.963 0.4 A 35 VAL CA C 13 67.230 0.40 A 35 VAL CB C 13 32.070 0.40 A 35 VAL CG1 C 13 20.760 0.40 A 35 VAL CG2 C 13 22.360 0.40 A 35 VAL N N 15 122.411 0.40 A 36 ARG H H 1 8.570 0.04 A 36 ARG HA H 1 3.980 0.04 A 36 ARG HBy H 1 1.969 0.04 A 36 ARG HBx H 1 1.915 0.04 A 36 ARG HDx H 1 3.186 0.04 A 36 ARG HDy H 1 3.186 0.04 A 36 ARG HGy H 1 1.712 0.04 A 36 ARG HGx H 1 1.573 0.04 A 36 ARG C C 13 178.518 0.4 A 36 ARG CA C 13 59.600 0.40 A 36 ARG CB C 13 30.040 0.40 A 36 ARG CD C 13 43.240 0.40 A 36 ARG CG C 13 27.640 0.40 A 36 ARG N N 15 121.979 0.40 A 37 SER H H 1 7.713 0.04 A 37 SER HA H 1 4.212 0.04 A 37 SER HBy H 1 3.795 0.04 A 37 SER HBx H 1 3.742 0.04 A 37 SER C C 13 175.223 0.4 A 37 SER CA C 13 61.120 0.40 A 37 SER CB C 13 63.720 0.40 A 37 SER N N 15 111.169 0.40 A 38 THR H H 1 7.346 0.04 A 38 THR HA H 1 4.205 0.04 A 38 THR HB H 1 3.364 0.04 A 38 THR HG2% H 1 0.185 0.04 A 38 THR C C 13 176.234 0.4 A 38 THR CA C 13 62.670 0.40 A 38 THR CB C 13 72.210 0.40 A 38 THR CG2 C 13 20.980 0.40 A 38 THR N N 15 106.644 0.40 A 39 GLY H H 1 8.715 0.04 A 39 GLY HAy H 1 4.079 0.04 A 39 GLY HAx H 1 3.724 0.04 A 39 GLY C C 13 173.880 0.4 A 39 GLY CA C 13 45.690 0.40 A 39 GLY N N 15 112.419 0.40 A 40 ALA H H 1 7.765 0.04 A 40 ALA HA H 1 4.129 0.04 A 40 ALA HB% H 1 1.086 0.04 A 40 ALA C C 13 176.312 0.4 A 40 ALA CA C 13 52.010 0.40 A 40 ALA CB C 13 20.110 0.40 A 40 ALA N N 15 121.623 0.40 A 41 GLU H H 1 8.280 0.04 A 41 GLU HA H 1 4.412 0.04 A 41 GLU HBy H 1 2.218 0.04 A 41 GLU HBx H 1 2.014 0.04 A 41 GLU HGy H 1 2.488 0.04 A 41 GLU HGx H 1 2.390 0.04 A 41 GLU CA C 13 54.860 0.40 A 41 GLU CB C 13 29.650 0.40 A 41 GLU CG C 13 36.550 0.40 A 41 GLU N N 15 121.574 0.40 A 42 PRO HA H 1 3.934 0.04 A 42 PRO HBy H 1 2.238 0.04 A 42 PRO HBx H 1 1.920 0.04 A 42 PRO HDy H 1 3.886 0.04 A 42 PRO HDx H 1 3.815 0.04 A 42 PRO HGy H 1 2.116 0.04 A 42 PRO HGx H 1 1.966 0.04 A 42 PRO C C 13 178.546 0.4 A 42 PRO CA C 13 65.910 0.40 A 42 PRO CB C 13 32.010 0.40 A 42 PRO CD C 13 50.750 0.40 A 42 PRO CG C 13 27.790 0.40 A 43 GLY H H 1 8.694 0.04 A 43 GLY HAy H 1 3.802 0.04 A 43 GLY HAx H 1 3.669 0.04 A 43 GLY C C 13 175.725 0.4 A 43 GLY CA C 13 47.370 0.40 A 43 GLY N N 15 107.695 0.40 A 44 LEU H H 1 7.214 0.04 A 44 LEU HA H 1 4.145 0.04 A 44 LEU HBy H 1 1.814 0.04 A 44 LEU HBx H 1 1.685 0.04 A 44 LEU HD1% H 1 0.968 0.04 A 44 LEU HD2% H 1 1.046 0.04 A 44 LEU HG H 1 1.561 0.04 A 44 LEU C C 13 178.454 0.4 A 44 LEU CA C 13 57.380 0.40 A 44 LEU CB C 13 41.910 0.40 A 44 LEU CD1 C 13 23.930 0.40 A 44 LEU CD2 C 13 25.710 0.40 A 44 LEU CG C 13 27.300 0.40 A 44 LEU N N 15 124.486 0.40 A 45 ALA H H 1 8.061 0.04 A 45 ALA HA H 1 3.135 0.04 A 45 ALA HB% H 1 0.993 0.04 A 45 ALA C C 13 177.797 0.4 A 45 ALA CA C 13 54.780 0.40 A 45 ALA CB C 13 20.120 0.40 A 45 ALA N N 15 119.257 0.40 A 46 ARG H H 1 8.042 0.04 A 46 ARG HA H 1 3.389 0.04 A 46 ARG HBy H 1 1.891 0.04 A 46 ARG HBx H 1 1.824 0.04 A 46 ARG HDy H 1 3.266 0.04 A 46 ARG HDx H 1 3.192 0.04 A 46 ARG HGy H 1 1.708 0.04 A 46 ARG HGx H 1 1.642 0.04 A 46 ARG C C 13 177.125 0.4 A 46 ARG CA C 13 59.660 0.40 A 46 ARG CB C 13 29.630 0.40 A 46 ARG CD C 13 43.350 0.40 A 46 ARG CG C 13 27.840 0.40 A 46 ARG N N 15 116.592 0.40 A 47 ASP H H 1 7.503 0.04 A 47 ASP HA H 1 4.180 0.04 A 47 ASP HBy H 1 2.746 0.04 A 47 ASP HBx H 1 2.554 0.04 A 47 ASP C C 13 179.783 0.4 A 47 ASP CA C 13 57.780 0.40 A 47 ASP CB C 13 40.430 0.40 A 47 ASP N N 15 119.067 0.40 A 48 LEU H H 1 8.101 0.04 A 48 LEU HA H 1 3.988 0.04 A 48 LEU HBy H 1 1.530 0.04 A 48 LEU HBx H 1 1.194 0.04 A 48 LEU HD1% H 1 0.951 0.04 A 48 LEU HD2% H 1 0.842 0.04 A 48 LEU HG H 1 1.731 0.04 A 48 LEU C C 13 180.045 0.4 A 48 LEU CA C 13 57.230 0.40 A 48 LEU CB C 13 41.550 0.40 A 48 LEU CD1 C 13 26.510 0.40 A 48 LEU CD2 C 13 23.360 0.40 A 48 LEU CG C 13 27.090 0.40 A 48 LEU N N 15 120.778 0.40 A 49 LEU H H 1 7.895 0.04 A 49 LEU HA H 1 3.058 0.04 A 49 LEU HBy H 1 0.753 0.04 A 49 LEU HBx H 1 -0.464 0.04 A 49 LEU HD1% H 1 0.391 0.04 A 49 LEU HD2% H 1 0.318 0.04 A 49 LEU HG H 1 0.608 0.04 A 49 LEU C C 13 179.599 0.4 A 49 LEU CA C 13 57.850 0.40 A 49 LEU CB C 13 39.960 0.40 A 49 LEU CD1 C 13 25.310 0.40 A 49 LEU CD2 C 13 23.580 0.40 A 49 LEU CG C 13 27.660 0.40 A 49 LEU N N 15 119.989 0.40 A 50 GLU H H 1 8.463 0.04 A 50 GLU HA H 1 3.347 0.04 A 50 GLU HBy H 1 2.020 0.04 A 50 GLU HBx H 1 1.906 0.04 A 50 GLU HGy H 1 2.357 0.04 A 50 GLU HGx H 1 2.305 0.04 A 50 GLU C C 13 180.886 0.4 A 50 GLU CA C 13 59.800 0.40 A 50 GLU CB C 13 29.370 0.40 A 50 GLU CG C 13 36.740 0.40 A 50 GLU N N 15 121.202 0.40 A 51 GLY H H 1 7.672 0.04 A 51 GLY HAy H 1 3.890 0.04 A 51 GLY HAx H 1 3.813 0.04 A 51 GLY C C 13 174.750 0.4 A 51 GLY CA C 13 46.470 0.40 A 51 GLY N N 15 106.110 0.40 A 52 LYS H H 1 6.952 0.04 A 52 LYS HA H 1 4.574 0.04 A 52 LYS HBy H 1 2.193 0.04 A 52 LYS HBx H 1 1.436 0.04 A 52 LYS HDy H 1 1.668 0.04 A 52 LYS HDx H 1 1.401 0.04 A 52 LYS HEy H 1 2.874 0.04 A 52 LYS HEx H 1 2.800 0.04 A 52 LYS HGy H 1 1.499 0.04 A 52 LYS HGx H 1 0.968 0.04 A 52 LYS C C 13 176.680 0.4 A 52 LYS CA C 13 52.360 0.40 A 52 LYS CB C 13 31.870 0.40 A 52 LYS CD C 13 27.680 0.40 A 52 LYS CE C 13 42.290 0.40 A 52 LYS CG C 13 23.670 0.40 A 52 LYS N N 15 117.514 0.40 A 53 ASN H H 1 7.980 0.04 A 53 ASN HA H 1 4.426 0.04 A 53 ASN HBy H 1 3.094 0.04 A 53 ASN HBx H 1 2.698 0.04 A 53 ASN HD21 H 1 7.560 0.04 A 53 ASN HD2y H 1 7.560 0.04 A 53 ASN HD2x H 1 6.822 0.04 A 53 ASN C C 13 174.078 0.4 A 53 ASN CA C 13 55.100 0.40 A 53 ASN CB C 13 37.180 0.40 A 53 ASN N N 15 118.323 0.40 A 53 ASN ND2 N 15 112.300 0.04 A 54 TRP H H 1 8.660 0.04 A 54 TRP HA H 1 2.978 0.04 A 54 TRP HBy H 1 3.518 0.04 A 54 TRP HBx H 1 3.196 0.04 A 54 TRP HD1 H 1 7.014 0.04 A 54 TRP HE1 H 1 10.294 0.04 A 54 TRP HE3 H 1 7.286 0.04 A 54 TRP HH2 H 1 6.903 0.04 A 54 TRP HZ2 H 1 7.434 0.04 A 54 TRP HZ3 H 1 7.032 0.04 A 54 TRP C C 13 172.827 0.4 A 54 TRP CA C 13 59.580 0.40 A 54 TRP CB C 13 24.100 0.40 A 54 TRP CD1 C 13 126.923 0.40 A 54 TRP CE3 C 13 118.969 0.40 A 54 TRP CH2 C 13 123.462 0.40 A 54 TRP CZ2 C 13 115.120 0.40 A 54 TRP CZ3 C 13 123.254 0.40 A 54 TRP N N 15 108.937 0.40 A 54 TRP NE1 N 15 129.898 0.04 A 55 ASP H H 1 7.010 0.04 A 55 ASP HA H 1 4.609 0.04 A 55 ASP HBy H 1 3.021 0.04 A 55 ASP HBx H 1 2.562 0.04 A 55 ASP C C 13 175.244 0.4 A 55 ASP CA C 13 53.080 0.40 A 55 ASP CB C 13 41.230 0.40 A 55 ASP N N 15 117.886 0.40 A 56 LEU H H 1 8.321 0.04 A 56 LEU HA H 1 3.813 0.04 A 56 LEU HBy H 1 1.891 0.04 A 56 LEU HBx H 1 1.618 0.04 A 56 LEU HD1% H 1 1.064 0.04 A 56 LEU HD2% H 1 0.989 0.04 A 56 LEU HG H 1 1.635 0.04 A 56 LEU C C 13 177.542 0.4 A 56 LEU CA C 13 58.790 0.40 A 56 LEU CB C 13 42.350 0.40 A 56 LEU CD1 C 13 24.330 0.40 A 56 LEU CD2 C 13 25.880 0.40 A 56 LEU CG C 13 27.040 0.40 A 56 LEU N N 15 128.530 0.40 A 57 THR H H 1 8.035 0.04 A 57 THR HA H 1 3.768 0.04 A 57 THR HB H 1 4.220 0.04 A 57 THR HG2% H 1 1.191 0.04 A 57 THR C C 13 177.090 0.4 A 57 THR CA C 13 66.700 0.40 A 57 THR CB C 13 68.290 0.40 A 57 THR CG2 C 13 21.760 0.40 A 57 THR N N 15 113.680 0.40 A 58 ALA H H 1 8.001 0.04 A 58 ALA HA H 1 4.135 0.04 A 58 ALA HB% H 1 1.365 0.04 A 58 ALA C C 13 180.137 0.4 A 58 ALA CA C 13 54.420 0.40 A 58 ALA CB C 13 18.680 0.40 A 58 ALA N N 15 125.052 0.40 A 59 ALA H H 1 8.357 0.04 A 59 ALA HA H 1 3.897 0.04 A 59 ALA HB% H 1 1.168 0.04 A 59 ALA C C 13 179.656 0.4 A 59 ALA CA C 13 55.460 0.40 A 59 ALA CB C 13 18.790 0.40 A 59 ALA N N 15 121.222 0.40 A 60 LEU HA H 1 3.992 0.04 A 60 LEU HBy H 1 1.911 0.04 A 60 LEU HBx H 1 1.390 0.04 A 60 LEU HD1% H 1 0.727 0.04 A 60 LEU HD2% H 1 0.311 0.04 A 60 LEU HG H 1 1.699 0.04 A 60 LEU C C 13 179.741 0.4 A 60 LEU CA C 13 58.290 0.40 A 60 LEU CB C 13 41.840 0.40 A 60 LEU CD1 C 13 26.040 0.40 A 60 LEU CD2 C 13 23.470 0.40 A 60 LEU CG C 13 26.800 0.40 A 61 SER H H 1 7.730 0.04 A 61 SER HA H 1 4.271 0.04 A 61 SER HBy H 1 4.010 0.04 A 61 SER HBx H 1 3.983 0.04 A 61 SER C C 13 177.429 0.4 A 61 SER CA C 13 61.430 0.40 A 61 SER CB C 13 62.730 0.40 A 61 SER N N 15 114.861 0.40 A 62 ASP H H 1 7.875 0.04 A 62 ASP HA H 1 4.423 0.04 A 62 ASP HBy H 1 2.814 0.04 A 62 ASP HBx H 1 2.586 0.04 A 62 ASP C C 13 178.793 0.4 A 62 ASP CA C 13 57.130 0.40 A 62 ASP CB C 13 40.290 0.40 A 62 ASP N N 15 122.027 0.40 A 63 TYR H H 1 8.444 0.04 A 63 TYR HA H 1 4.026 0.04 A 63 TYR HBy H 1 3.238 0.04 A 63 TYR HBx H 1 3.184 0.04 A 63 TYR HDx H 1 6.978 0.04 A 63 TYR HDy H 1 6.978 0.04 A 63 TYR HEx H 1 6.713 0.04 A 63 TYR HEy H 1 6.713 0.04 A 63 TYR C C 13 176.892 0.4 A 63 TYR CA C 13 62.080 0.40 A 63 TYR CB C 13 38.550 0.40 A 63 TYR CD1 C 13 132.908 0.40 A 63 TYR CE1 C 13 117.885 0.40 A 63 TYR N N 15 121.437 0.40 A 64 GLU H H 1 8.075 0.04 A 64 GLU HA H 1 3.893 0.04 A 64 GLU HBy H 1 2.144 0.04 A 64 GLU HBx H 1 2.080 0.04 A 64 GLU HGy H 1 2.361 0.04 A 64 GLU HGx H 1 2.326 0.04 A 64 GLU C C 13 178.779 0.4 A 64 GLU CA C 13 58.750 0.40 A 64 GLU CB C 13 29.190 0.40 A 64 GLU CG C 13 35.660 0.40 A 64 GLU N N 15 117.866 0.40 A 65 GLN H H 1 7.613 0.04 A 65 GLN HA H 1 4.045 0.04 A 65 GLN HBy H 1 2.136 0.04 A 65 GLN HBx H 1 2.085 0.04 A 65 GLN HE21 H 1 7.404 0.04 A 65 GLN HE2y H 1 7.404 0.04 A 65 GLN HE2x H 1 6.748 0.04 A 65 GLN HGy H 1 2.458 0.04 A 65 GLN HGx H 1 2.378 0.04 A 65 GLN C C 13 177.938 0.4 A 65 GLN CA C 13 57.960 0.40 A 65 GLN CB C 13 28.510 0.40 A 65 GLN CG C 13 33.950 0.40 A 65 GLN N N 15 116.754 0.40 A 65 GLN NE2 N 15 112.417 0.04 A 66 LEU H H 1 7.735 0.04 A 66 LEU HA H 1 4.064 0.04 A 66 LEU HBy H 1 1.636 0.04 A 66 LEU HBx H 1 1.466 0.04 A 66 LEU HD1% H 1 0.846 0.04 A 66 LEU HD2% H 1 0.807 0.04 A 66 LEU HG H 1 1.649 0.04 A 66 LEU C C 13 178.617 0.4 A 66 LEU CA C 13 56.690 0.40 A 66 LEU CB C 13 42.200 0.40 A 66 LEU CD1 C 13 25.130 0.40 A 66 LEU CD2 C 13 23.710 0.40 A 66 LEU CG C 13 26.840 0.40 A 66 LEU N N 15 120.312 0.40 A 67 ARG H H 1 7.743 0.04 A 67 ARG HA H 1 3.966 0.04 A 67 ARG HBy H 1 1.624 0.04 A 67 ARG HBx H 1 1.586 0.04 A 67 ARG HDx H 1 3.005 0.04 A 67 ARG HDy H 1 3.005 0.04 A 67 ARG HGy H 1 1.389 0.04 A 67 ARG HGx H 1 1.362 0.04 A 67 ARG C C 13 177.125 0.4 A 67 ARG CA C 13 57.200 0.40 A 67 ARG CB C 13 29.990 0.40 A 67 ARG CD C 13 43.170 0.40 A 67 ARG CG C 13 26.800 0.40 A 67 ARG N N 15 118.210 0.40 A 68 GLN H H 1 7.756 0.04 A 68 GLN HA H 1 4.145 0.04 A 68 GLN HBy H 1 2.055 0.04 A 68 GLN HBx H 1 1.973 0.04 A 68 GLN HE21 H 1 7.461 0.04 A 68 GLN HE2y H 1 7.461 0.04 A 68 GLN HE2x H 1 6.750 0.04 A 68 GLN HGy H 1 2.367 0.04 A 68 GLN HGx H 1 2.302 0.04 A 68 GLN C C 13 176.503 0.4 A 68 GLN CA C 13 56.660 0.40 A 68 GLN CB C 13 28.830 0.40 A 68 GLN CG C 13 33.730 0.40 A 68 GLN N N 15 118.646 0.40 A 68 GLN NE2 N 15 112.100 0.04 A 69 VAL H H 1 8.803 0.04 A 69 VAL HA H 1 3.936 0.04 A 69 VAL HB H 1 1.999 0.04 A 69 VAL HG1% H 1 0.791 0.04 A 69 VAL HG2% H 1 0.868 0.04 A 69 VAL C C 13 176.446 0.4 A 69 VAL CA C 13 63.050 0.40 A 69 VAL CB C 13 32.370 0.40 A 69 VAL CG1 C 13 20.920 0.40 A 69 VAL CG2 C 13 20.630 0.40 A 69 VAL N N 15 119.326 0.40 A 70 HIS H H 1 8.251 0.04 A 70 HIS HA H 1 4.651 0.04 A 70 HIS HBy H 1 3.171 0.04 A 70 HIS HBx H 1 3.062 0.04 A 70 HIS HD2 H 1 7.062 0.04 A 70 HIS C C 13 175.548 0.4 A 70 HIS CA C 13 56.150 0.40 A 70 HIS CB C 13 30.100 0.40 A 70 HIS CD2 C 13 120.014 0.40 A 70 HIS N N 15 121.691 0.40 A 71 THR H H 1 7.983 0.04 A 71 THR HA H 1 4.194 0.04 A 71 THR HB H 1 4.173 0.04 A 71 THR HG2% H 1 1.137 0.04 A 71 THR C C 13 174.368 0.4 A 71 THR CA C 13 62.340 0.40 A 71 THR CB C 13 69.590 0.40 A 71 THR CG2 C 13 21.690 0.40 A 71 THR N N 15 114.974 0.40 A 72 ALA H H 1 8.190 0.04 A 72 ALA HA H 1 4.241 0.04 A 72 ALA HB% H 1 1.340 0.04 A 72 ALA C C 13 177.287 0.4 A 72 ALA CA C 13 52.750 0.40 A 72 ALA CB C 13 19.330 0.40 A 72 ALA N N 15 125.618 0.40 A 73 ASN H H 1 8.219 0.04 A 73 ASN HA H 1 4.627 0.04 A 73 ASN HBy H 1 2.772 0.04 A 73 ASN HBx H 1 2.648 0.04 A 73 ASN C C 13 174.679 0.4 A 73 ASN CA C 13 53.010 0.40 A 73 ASN CB C 13 38.880 0.40 A 73 ASN N N 15 117.045 0.40 A 74 LEU H H 1 7.944 0.04 A 74 LEU HA H 1 4.516 0.04 A 74 LEU HBy H 1 1.530 0.04 A 74 LEU HBx H 1 1.450 0.04 A 74 LEU HD1% H 1 0.870 0.04 A 74 LEU HD2% H 1 0.830 0.04 A 74 LEU HG H 1 1.587 0.04 A 74 LEU CA C 13 53.060 0.40 A 74 LEU CB C 13 41.420 0.40 A 74 LEU CD1 C 13 25.220 0.40 A 74 LEU CD2 C 13 23.360 0.40 A 74 LEU CG C 13 26.770 0.40 A 74 LEU N N 15 123.289 0.40 A 75 PRO HA H 1 4.314 0.04 A 75 PRO HBy H 1 2.199 0.04 A 75 PRO HBx H 1 1.754 0.04 A 75 PRO HDy H 1 3.736 0.04 A 75 PRO HDx H 1 3.563 0.04 A 75 PRO HGx H 1 1.937 0.04 A 75 PRO HGy H 1 1.937 0.04 A 75 PRO C C 13 176.595 0.4 A 75 PRO CA C 13 63.200 0.40 A 75 PRO CB C 13 32.080 0.40 A 75 PRO CD C 13 50.440 0.40 A 75 PRO CG C 13 27.300 0.40 A 76 HIS H H 1 8.318 0.04 A 76 HIS HA H 1 4.539 0.04 A 76 HIS HBx H 1 3.016 0.04 A 76 HIS HBy H 1 3.016 0.04 A 76 HIS HD2 H 1 6.926 0.04 A 76 HIS C C 13 174.714 0.4 A 76 HIS CA C 13 55.610 0.40 A 76 HIS CB C 13 30.060 0.40 A 76 HIS CD2 C 13 119.853 0.40 A 76 HIS N N 15 118.986 0.40 A 77 VAL H H 1 7.880 0.04 A 77 VAL HA H 1 3.991 0.04 A 77 VAL HB H 1 1.887 0.04 A 77 VAL C C 13 175.541 0.4 A 77 VAL CA C 13 61.900 0.40 A 77 VAL CB C 13 32.950 0.40 A 77 VAL N N 15 121.365 0.40 A 78 PHE H H 1 8.360 0.04 A 78 PHE HA H 1 4.555 0.04 A 78 PHE HBy H 1 3.041 0.04 A 78 PHE HBx H 1 2.957 0.04 A 78 PHE HDx H 1 7.209 0.04 A 78 PHE HDy H 1 7.209 0.04 A 78 PHE HEx H 1 7.284 0.04 A 78 PHE HEy H 1 7.284 0.04 A 78 PHE HZ H 1 7.216 0.04 A 78 PHE C C 13 175.407 0.4 A 78 PHE CA C 13 57.670 0.40 A 78 PHE CB C 13 39.350 0.40 A 78 PHE CD1 C 13 132.252 0.40 A 78 PHE CE1 C 13 132.091 0.40 A 78 PHE CZ C 13 129.621 0.40 A 78 PHE N N 15 124.098 0.40 A 79 ASN H H 1 8.346 0.04 A 79 ASN HA H 1 4.574 0.04 A 79 ASN HBy H 1 2.722 0.04 A 79 ASN HBx H 1 2.592 0.04 A 79 ASN C C 13 174.834 0.4 A 79 ASN CA C 13 52.930 0.40 A 79 ASN CB C 13 38.770 0.40 A 79 ASN N N 15 121.457 0.40 A 80 GLU H H 1 8.290 0.04 A 80 GLU HA H 1 4.117 0.04 A 80 GLU HBy H 1 2.020 0.04 A 80 GLU HBx H 1 1.894 0.04 A 80 GLU HGx H 1 2.182 0.04 A 80 GLU HGy H 1 2.182 0.04 A 80 GLU C C 13 176.814 0.4 A 80 GLU CA C 13 57.240 0.40 A 80 GLU CB C 13 29.660 0.40 A 80 GLU CG C 13 36.300 0.40 A 80 GLU N N 15 121.060 0.40 A 81 GLY H H 1 8.334 0.04 A 81 GLY HAx H 1 3.889 0.04 A 81 GLY HAy H 1 3.889 0.04 A 81 GLY C C 13 174.205 0.4 A 81 GLY CA C 13 45.530 0.40 A 81 GLY N N 15 109.442 0.40 A 82 ARG H H 1 8.046 0.04 A 82 ARG HA H 1 4.322 0.04 A 82 ARG HBy H 1 1.857 0.04 A 82 ARG HBx H 1 1.703 0.04 A 82 ARG HDx H 1 3.118 0.04 A 82 ARG HDy H 1 3.118 0.04 A 82 ARG HGx H 1 1.565 0.04 A 82 ARG HGy H 1 1.565 0.04 A 82 ARG C C 13 175.845 0.4 A 82 ARG CA C 13 55.900 0.40 A 82 ARG CB C 13 30.860 0.40 A 82 ARG CD C 13 43.310 0.40 A 82 ARG CG C 13 27.040 0.40 A 82 ARG N N 15 120.309 0.40 A 83 GLY H H 1 8.019 0.04 A 83 GLY HAx H 1 3.686 0.04 A 83 GLY HAy H 1 3.686 0.04 A 83 GLY CA C 13 46.070 0.40 A 83 GLY N N 15 115.974 0.40 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 12 ALA HB% A 13 GLU H 1.0 1.8 5.0 2 2 A 13 GLU HA A 13 GLU HGx 1.0 1.8 5.0 3 2 A 13 GLU HA A 13 GLU HGy 1.0 1.8 5.0 4 3 A 13 GLU H A 13 GLU HBx 1.0 1.8 5.0 5 3 A 13 GLU H A 13 GLU HBy 1.0 1.8 5.0 6 4 A 13 GLU H A 13 GLU HGx 1.0 1.8 5.0 7 4 A 13 GLU H A 13 GLU HGy 1.0 1.8 5.0 8 5 A 14 CYS H A 13 GLU HBx 1.0 1.8 5.0 9 5 A 13 GLU HBy A 14 CYS H 1.0 1.8 5.0 10 6 A 14 CYS H A 14 CYS HBx 1.0 1.8 5.0 11 6 A 14 CYS H A 14 CYS HBy 1.0 1.8 5.0 12 7 A 14 CYS HA A 15 TRP H 1.0 1.8 5.0 13 8 A 15 TRP H A 14 CYS HBx 1.0 1.8 5.0 14 8 A 14 CYS HBy A 15 TRP H 1.0 1.8 5.0 15 9 A 15 TRP HA A 15 TRP HE3 1.0 1.8 5.0 16 10 A 15 TRP H A 15 TRP HBx 1.0 1.8 5.0 17 11 A 15 TRP H A 15 TRP HBy 1.0 1.8 5.0 18 12 A 15 TRP H A 15 TRP HE1 1.0 1.8 6.0 19 13 A 15 TRP HA A 15 TRP HE1 1.0 1.8 6.0 20 14 A 15 TRP HD1 A 15 TRP HBx 1.0 1.8 3.5 21 14 A 15 TRP HBy A 15 TRP HD1 1.0 1.8 3.5 22 15 A 15 TRP HA A 16 ALA H 1.0 1.8 5.0 23 16 A 16 ALA H A 15 TRP HBx 1.0 1.8 5.0 24 17 A 15 TRP HBy A 16 ALA H 1.0 1.8 5.0 25 18 A 15 TRP HE3 A 16 ALA H 1.0 1.8 6.0 26 19 A 16 ALA H A 15 TRP HBx 1.0 1.8 5.0 27 19 A 15 TRP HBy A 16 ALA H 1.0 1.8 5.0 28 20 A 16 ALA H A 16 ALA HB% 1.0 1.8 3.5 29 21 A 16 ALA HA A 17 ALA H 1.0 1.8 5.0 30 22 A 16 ALA HB% A 17 ALA H 1.0 1.8 5.0 31 23 A 16 ALA H A 17 ALA H 1.0 1.8 3.5 32 24 A 17 ALA H A 17 ALA HB% 1.0 1.8 3.5 33 25 A 17 ALA HA A 18 LEU H 1.0 1.8 3.5 34 26 A 17 ALA HB% A 18 LEU H 1.0 1.8 5.0 35 27 A 18 LEU HA A 18 LEU HD1% 1.0 1.8 5.0 36 28 A 18 LEU HA A 18 LEU HG 1.0 1.8 5.0 37 29 A 18 LEU HA A 18 LEU HD2% 1.0 1.8 5.0 38 30 A 18 LEU H A 18 LEU HD1% 1.0 1.8 5.0 39 31 A 18 LEU H A 18 LEU HD2% 1.0 1.8 5.0 40 32 A 18 LEU H A 18 LEU HG 1.0 1.8 5.0 41 33 A 18 LEU H A 18 LEU HBy 1.0 1.8 3.5 42 33 A 18 LEU H A 18 LEU HBx 1.0 1.8 3.5 43 34 A 18 LEU HA A 18 LEU HD1% 1.0 1.8 3.5 44 34 A 18 LEU HA A 18 LEU HD2% 1.0 1.8 3.5 45 35 A 18 LEU HG A 19 LEU H 1.0 1.8 6.0 46 36 A 18 LEU HD2% A 19 LEU H 1.0 1.8 6.0 47 37 A 18 LEU HA A 19 LEU H 1.0 1.8 3.5 48 38 A 19 LEU H A 18 LEU HD1% 1.0 1.8 6.0 49 39 A 19 LEU H A 18 LEU HBy 1.0 1.8 5.0 50 39 A 18 LEU HBx A 19 LEU H 1.0 1.8 5.0 51 40 A 19 LEU H A 18 LEU HD1% 1.0 1.8 5.0 52 40 A 18 LEU HD2% A 19 LEU H 1.0 1.8 5.0 53 41 A 19 LEU HA A 19 LEU HG 1.0 1.8 5.0 54 42 A 19 LEU HA A 19 LEU HD1% 1.0 1.8 5.0 55 43 A 19 LEU HA A 19 LEU HD2% 1.0 1.8 5.0 56 44 A 19 LEU H A 19 LEU HG 1.0 1.8 5.0 57 45 A 19 LEU H A 19 LEU HD2% 1.0 1.8 6.0 58 46 A 19 LEU H A 19 LEU HD1% 1.0 1.8 6.0 59 47 A 19 LEU H A 19 LEU HBy 1.0 1.8 3.5 60 47 A 19 LEU H A 19 LEU HBx 1.0 1.8 3.5 61 48 A 19 LEU H A 19 LEU HD1% 1.0 1.8 5.0 62 48 A 19 LEU H A 19 LEU HD2% 1.0 1.8 5.0 63 49 A 19 LEU HA A 19 LEU HD1% 1.0 1.8 5.0 64 49 A 19 LEU HA A 19 LEU HD2% 1.0 1.8 5.0 65 50 A 20 HIS H A 19 LEU HD1% 1.0 1.8 6.0 66 51 A 19 LEU HD2% A 20 HIS H 1.0 1.8 6.0 67 52 A 19 LEU H A 20 HIS H 1.0 1.8 5.0 68 53 A 20 HIS H A 19 LEU HD1% 1.0 1.8 5.0 69 53 A 19 LEU HD2% A 20 HIS H 1.0 1.8 5.0 70 54 A 20 HIS H A 20 HIS HBx 1.0 1.8 5.0 71 54 A 20 HIS H A 20 HIS HBy 1.0 1.8 5.0 72 55 A 21 ASP H A 20 HIS HBx 1.0 1.8 6.0 73 56 A 20 HIS HBy A 21 ASP H 1.0 1.8 6.0 74 57 A 21 ASP H A 20 HIS HBx 1.0 1.8 5.0 75 57 A 20 HIS HBy A 21 ASP H 1.0 1.8 5.0 76 58 A 21 ASP H A 21 ASP HBx 1.0 1.8 5.0 77 59 A 21 ASP H A 21 ASP HBy 1.0 1.8 5.0 78 60 A 21 ASP H A 21 ASP HBx 1.0 1.8 5.0 79 60 A 21 ASP H A 21 ASP HBy 1.0 1.8 5.0 80 61 A 21 ASP HA A 22 PRO HDx 1.0 1.8 3.5 81 61 A 21 ASP HA A 22 PRO HDy 1.0 1.8 3.5 82 62 A 23 MET H A 21 ASP HBx 1.0 1.8 6.0 83 62 A 21 ASP HBy A 23 MET H 1.0 1.8 6.0 84 63 A 23 MET H A 22 PRO HDx 1.0 1.8 5.0 85 63 A 22 PRO HDy A 23 MET H 1.0 1.8 5.0 86 64 A 23 MET H A 22 PRO HGx 1.0 1.8 5.0 87 64 A 23 MET H A 22 PRO HGy 1.0 1.8 5.0 88 65 A 23 MET H A 22 PRO HBy 1.0 1.8 5.0 89 65 A 23 MET H A 22 PRO HBx 1.0 1.8 5.0 90 66 A 23 MET HA A 23 MET HGx 1.0 1.8 5.0 91 67 A 23 MET HA A 23 MET HE% 1.0 1.8 6.0 92 68 A 23 MET HA A 23 MET HGy 1.0 1.8 5.0 93 69 A 23 MET HE% A 23 MET HGx 1.0 1.8 5.0 94 70 A 23 MET HE% A 23 MET HGy 1.0 1.8 5.0 95 71 A 23 MET H A 23 MET HGx 1.0 1.8 5.0 96 72 A 23 MET H A 23 MET HBx 1.0 1.8 3.5 97 72 A 23 MET H A 23 MET HBy 1.0 1.8 3.5 98 73 A 23 MET H A 23 MET HGy 1.0 1.8 5.0 99 74 A 23 MET H A 23 MET HGx 1.0 1.8 5.0 100 74 A 23 MET H A 23 MET HGy 1.0 1.8 5.0 101 75 A 23 MET HA A 23 MET HGx 1.0 1.8 5.0 102 75 A 23 MET HA A 23 MET HGy 1.0 1.8 5.0 103 76 A 23 MET HE% A 23 MET HGx 1.0 1.8 3.5 104 76 A 23 MET HE% A 23 MET HGy 1.0 1.8 3.5 105 77 A 24 THR H A 23 MET HBx 1.0 1.8 5.0 106 77 A 23 MET HBy A 24 THR H 1.0 1.8 5.0 107 78 A 23 MET H A 24 THR H 1.0 1.8 5.0 108 79 A 23 MET H A 25 LEU H 1.0 1.8 6.0 109 80 A 24 THR HA A 24 THR HG2% 1.0 1.8 3.5 110 81 A 24 THR H A 24 THR HB 1.0 1.8 5.0 111 82 A 24 THR H A 24 THR HG2% 1.0 1.8 5.0 112 83 A 24 THR HG2% A 25 LEU HBx 1.0 1.8 5.0 113 83 A 24 THR HG2% A 25 LEU HBy 1.0 1.8 5.0 114 84 A 24 THR HG2% A 25 LEU HA 1.0 1.8 5.0 115 85 A 24 THR H A 25 LEU HBx 1.0 1.8 5.0 116 85 A 24 THR H A 25 LEU HBy 1.0 1.8 5.0 117 86 A 25 LEU H A 24 THR HB 1.0 1.8 5.0 118 87 A 25 LEU H A 24 THR HG2% 1.0 1.8 5.0 119 88 A 24 THR H A 25 LEU H 1.0 1.8 3.5 120 89 A 25 LEU HA A 25 LEU HD1% 1.0 1.8 5.0 121 90 A 25 LEU HA A 25 LEU HG 1.0 1.8 5.0 122 91 A 25 LEU HD1% A 25 LEU HBx 1.0 1.8 3.5 123 91 A 25 LEU HBy A 25 LEU HD1% 1.0 1.8 3.5 124 92 A 25 LEU H A 25 LEU HD1% 1.0 1.8 5.0 125 93 A 25 LEU HA A 25 LEU HD2% 1.0 1.8 5.0 126 94 A 25 LEU HD2% A 25 LEU HBx 1.0 1.8 3.5 127 94 A 25 LEU HBy A 25 LEU HD2% 1.0 1.8 3.5 128 95 A 25 LEU H A 25 LEU HG 1.0 1.8 6.0 129 96 A 25 LEU H A 25 LEU HBx 1.0 1.8 3.5 130 96 A 25 LEU H A 25 LEU HBy 1.0 1.8 3.5 131 97 A 25 LEU H A 25 LEU HD2% 1.0 1.8 5.0 132 98 A 26 ASP HA A 25 LEU HBx 1.0 1.8 6.0 133 98 A 25 LEU HBy A 26 ASP HA 1.0 1.8 6.0 134 99 A 25 LEU HA A 26 ASP HBy 1.0 1.8 5.0 135 100 A 25 LEU H A 26 ASP H 1.0 1.8 5.0 136 101 A 25 LEU HA A 26 ASP H 1.0 1.8 3.5 137 102 A 26 ASP H A 25 LEU HBx 1.0 1.8 5.0 138 102 A 25 LEU HBy A 26 ASP H 1.0 1.8 5.0 139 103 A 25 LEU HD1% A 26 ASP H 1.0 1.8 5.0 140 104 A 25 LEU HD2% A 26 ASP H 1.0 1.8 5.0 141 105 A 25 LEU HG A 26 ASP H 1.0 1.8 5.0 142 106 A 25 LEU HD2% A 27 MET HE% 1.0 1.8 5.0 143 107 A 25 LEU HD2% A 27 MET HA 1.0 1.8 5.0 144 108 A 25 LEU HD2% A 27 MET HBy 1.0 1.8 5.0 145 109 A 25 LEU HD2% A 27 MET HGy 1.0 1.8 5.0 146 110 A 25 LEU HD2% A 27 MET HGx 1.0 1.8 5.0 147 111 A 25 LEU HD2% A 27 MET HBx 1.0 1.8 5.0 148 112 A 25 LEU HD1% A 27 MET HE% 1.0 1.8 6.0 149 113 A 25 LEU HG A 27 MET H 1.0 1.8 6.0 150 114 A 25 LEU HD1% A 27 MET H 1.0 1.8 6.0 151 115 A 25 LEU HD2% A 27 MET H 1.0 1.8 6.0 152 116 A 25 LEU HA A 30 VAL HG2% 1.0 1.8 5.0 153 117 A 25 LEU HD1% A 30 VAL HG2% 1.0 1.8 3.5 154 118 A 25 LEU HD2% A 30 VAL HG2% 1.0 1.8 5.0 155 119 A 25 LEU HG A 30 VAL HG2% 1.0 1.8 5.0 156 120 A 30 VAL HG2% A 25 LEU HBx 1.0 1.8 5.0 157 120 A 25 LEU HBy A 30 VAL HG2% 1.0 1.8 5.0 158 121 A 25 LEU HD1% A 30 VAL HB 1.0 1.8 5.0 159 122 A 25 LEU HG A 30 VAL H 1.0 1.8 6.0 160 123 A 25 LEU H A 30 VAL HG2% 1.0 1.8 6.0 161 124 A 25 LEU HD1% A 49 LEU HD2% 1.0 1.8 5.0 162 125 A 25 LEU HD2% A 54 TRP HBy 1.0 1.8 5.0 163 126 A 25 LEU HD1% A 54 TRP HBy 1.0 1.8 5.0 164 127 A 25 LEU HD2% A 54 TRP HBx 1.0 1.8 5.0 165 128 A 25 LEU HD1% A 54 TRP HBx 1.0 1.8 5.0 166 129 A 25 LEU HD1% A 54 TRP HA 1.0 1.8 5.0 167 130 A 25 LEU HD1% A 54 TRP HE3 1.0 1.8 5.0 168 131 A 25 LEU HD1% A 54 TRP HD1 1.0 1.8 6.0 169 132 A 25 LEU HD1% A 55 ASP H 1.0 1.8 6.0 170 133 A 25 LEU HD1% A 56 LEU HBy 1.0 1.8 6.0 171 134 A 25 LEU HD1% A 56 LEU H 1.0 1.8 5.0 172 135 A 26 ASP HBy A 26 ASP H 1.0 1.8 5.0 173 136 A 26 ASP H A 26 ASP HBx 1.0 1.8 5.0 174 137 A 26 ASP HA A 27 MET HBy 1.0 1.8 6.0 175 138 A 26 ASP H A 27 MET H 1.0 1.8 5.0 176 139 A 26 ASP HA A 27 MET H 1.0 1.8 3.5 177 140 A 26 ASP HBy A 27 MET H 1.0 1.8 5.0 178 141 A 27 MET H A 26 ASP HBx 1.0 1.8 5.0 179 142 A 26 ASP HA A 28 ASP H 1.0 1.8 5.0 180 143 A 26 ASP H A 28 ASP H 1.0 1.8 6.0 181 144 A 26 ASP HA A 29 ALA H 1.0 1.8 5.0 182 145 A 26 ASP HBy A 29 ALA H 1.0 1.8 5.0 183 146 A 26 ASP HBy A 29 ALA HB% 1.0 1.8 5.0 184 147 A 26 ASP HBx A 29 ALA HB% 1.0 1.8 5.0 185 148 A 26 ASP HA A 29 ALA HB% 1.0 1.8 5.0 186 149 A 26 ASP HBx A 29 ALA H 1.0 1.8 5.0 187 150 A 26 ASP H A 29 ALA H 1.0 1.8 6.0 188 151 A 26 ASP H A 29 ALA HB% 1.0 1.8 5.0 189 152 A 26 ASP HBx A 30 VAL HA 1.0 1.8 6.0 190 153 A 30 VAL HG2% A 26 ASP HBx 1.0 1.8 5.0 191 154 A 30 VAL H A 26 ASP HBx 1.0 1.8 5.0 192 155 A 26 ASP H A 30 VAL HG2% 1.0 1.8 5.0 193 156 A 26 ASP H A 30 VAL H 1.0 1.8 6.0 194 157 A 27 MET HE% A 27 MET HBy 1.0 1.8 5.0 195 158 A 27 MET HE% A 27 MET HBx 1.0 1.8 5.0 196 159 A 27 MET HBx A 27 MET H 1.0 1.8 5.0 197 160 A 27 MET HBy A 27 MET H 1.0 1.8 3.5 198 161 A 27 MET HE% A 27 MET H 1.0 1.8 5.0 199 162 A 27 MET H A 27 MET HGx 1.0 1.8 3.5 200 162 A 27 MET H A 27 MET HGy 1.0 1.8 3.5 201 163 A 27 MET HA A 27 MET HGx 1.0 1.8 5.0 202 163 A 27 MET HA A 27 MET HGy 1.0 1.8 5.0 203 164 A 27 MET HE% A 27 MET HGx 1.0 1.8 3.5 204 164 A 27 MET HE% A 27 MET HGy 1.0 1.8 3.5 205 165 A 27 MET HBx A 28 ASP H 1.0 1.8 5.0 206 166 A 27 MET HBy A 28 ASP H 1.0 1.8 5.0 207 167 A 27 MET H A 28 ASP H 1.0 1.8 3.5 208 168 A 28 ASP H A 27 MET HGx 1.0 1.8 6.0 209 168 A 28 ASP H A 27 MET HGy 1.0 1.8 6.0 210 169 A 27 MET HA A 29 ALA H 1.0 1.8 6.0 211 170 A 27 MET H A 29 ALA H 1.0 1.8 5.0 212 171 A 27 MET H A 30 VAL HG2% 1.0 1.8 5.0 213 172 A 27 MET HA A 30 VAL HB 1.0 1.8 5.0 214 173 A 27 MET HA A 30 VAL HG2% 1.0 1.8 5.0 215 174 A 27 MET HA A 30 VAL H 1.0 1.8 5.0 216 175 A 30 VAL HG2% A 27 MET HGx 1.0 1.8 5.0 217 175 A 30 VAL HG2% A 27 MET HGy 1.0 1.8 5.0 218 176 A 27 MET HBx A 31 LEU H 1.0 1.8 6.0 219 177 A 27 MET HA A 31 LEU H 1.0 1.8 5.0 220 178 A 27 MET HE% A 54 TRP HZ2 1.0 1.8 5.0 221 179 A 27 MET HE% A 54 TRP HD1 1.0 1.8 5.0 222 180 A 27 MET HA A 54 TRP HZ3 1.0 1.8 5.0 223 181 A 54 TRP HE3 A 27 MET HGy 1.0 1.8 5.0 224 182 A 27 MET HA A 54 TRP HE3 1.0 1.8 5.0 225 183 A 54 TRP HE3 A 27 MET HGx 1.0 1.8 5.0 226 184 A 27 MET HE% A 54 TRP HE1 1.0 1.8 5.0 227 185 A 54 TRP HE3 A 27 MET HGx 1.0 1.8 5.0 228 185 A 54 TRP HE3 A 27 MET HGy 1.0 1.8 5.0 229 186 A 54 TRP HZ2 A 27 MET HGx 1.0 1.8 5.0 230 186 A 27 MET HGy A 54 TRP HZ2 1.0 1.8 5.0 231 187 A 54 TRP HH2 A 27 MET HGx 1.0 1.8 6.0 232 187 A 27 MET HGy A 54 TRP HH2 1.0 1.8 6.0 233 188 A 28 ASP H A 28 ASP HBx 1.0 1.8 3.5 234 189 A 28 ASP H A 28 ASP HBy 1.0 1.8 3.5 235 190 A 28 ASP H A 28 ASP HBx 1.0 1.8 3.5 236 190 A 28 ASP H A 28 ASP HBy 1.0 1.8 3.5 237 191 A 29 ALA H A 28 ASP HBx 1.0 1.8 5.0 238 192 A 29 ALA H A 28 ASP HBy 1.0 1.8 5.0 239 193 A 28 ASP H A 29 ALA H 1.0 1.8 3.5 240 194 A 29 ALA HB% A 28 ASP HBx 1.0 1.8 5.0 241 194 A 29 ALA HB% A 28 ASP HBy 1.0 1.8 5.0 242 195 A 30 VAL H A 28 ASP HA 1.0 1.8 5.0 243 196 A 28 ASP HA A 31 LEU HBy 1.0 1.8 5.0 244 197 A 28 ASP HA A 31 LEU HBx 1.0 1.8 5.0 245 198 A 28 ASP HA A 31 LEU HD2% 1.0 1.8 5.0 246 199 A 31 LEU H A 28 ASP HA 1.0 1.8 5.0 247 200 A 28 ASP HA A 32 SER H 1.0 1.8 5.0 248 201 A 29 ALA H A 29 ALA HB% 1.0 1.8 3.5 249 202 A 29 ALA HB% A 30 VAL HA 1.0 1.8 5.0 250 203 A 30 VAL HB A 29 ALA HB% 1.0 1.8 5.0 251 204 A 30 VAL HG2% A 29 ALA HB% 1.0 1.8 3.5 252 205 A 30 VAL HG2% A 29 ALA H 1.0 1.8 5.0 253 206 A 30 VAL H A 29 ALA HB% 1.0 1.8 3.5 254 207 A 30 VAL H A 29 ALA H 1.0 1.8 3.5 255 208 A 29 ALA HB% A 31 LEU H 1.0 1.8 5.0 256 209 A 31 LEU H A 29 ALA HA 1.0 1.8 6.0 257 210 A 29 ALA H A 31 LEU H 1.0 1.8 5.0 258 211 A 29 ALA HB% A 32 SER HBy 1.0 1.8 6.0 259 212 A 32 SER H A 29 ALA HA 1.0 1.8 5.0 260 213 A 29 ALA HA A 32 SER HBy 1.0 1.8 5.0 261 214 A 29 ALA HA A 32 SER HBx 1.0 1.8 3.5 262 215 A 29 ALA HB% A 32 SER HBx 1.0 1.8 5.0 263 216 A 29 ALA H A 32 SER H 1.0 1.8 5.0 264 217 A 29 ALA HB% A 32 SER H 1.0 1.8 5.0 265 218 A 29 ALA HB% A 33 ASP H 1.0 1.8 5.0 266 219 A 29 ALA HA A 33 ASP H 1.0 1.8 5.0 267 220 A 29 ALA HB% A 33 ASP HBx 1.0 1.8 5.0 268 220 A 29 ALA HB% A 33 ASP HBy 1.0 1.8 5.0 269 221 A 29 ALA HB% A 56 LEU HD2% 1.0 1.8 6.0 270 222 A 29 ALA HB% A 56 LEU HD1% 1.0 1.8 6.0 271 223 A 30 VAL HA A 30 VAL HG1% 1.0 1.8 3.5 272 224 A 30 VAL H A 30 VAL HG1% 1.0 1.8 5.0 273 225 A 30 VAL HG2% A 30 VAL HA 1.0 1.8 3.5 274 226 A 30 VAL HB A 30 VAL H 1.0 1.8 3.5 275 227 A 30 VAL HG2% A 30 VAL H 1.0 1.8 3.5 276 228 A 31 LEU HBy A 30 VAL HG1% 1.0 1.8 5.0 277 229 A 30 VAL HG1% A 31 LEU HA 1.0 1.8 5.0 278 230 A 30 VAL H A 31 LEU HBx 1.0 1.8 6.0 279 231 A 30 VAL H A 31 LEU H 1.0 1.8 3.5 280 232 A 30 VAL HB A 31 LEU H 1.0 1.8 3.5 281 233 A 31 LEU H A 30 VAL HG1% 1.0 1.8 5.0 282 234 A 30 VAL HG2% A 31 LEU H 1.0 1.8 5.0 283 235 A 30 VAL H A 32 SER H 1.0 1.8 5.0 284 236 A 33 ASP H A 30 VAL HG1% 1.0 1.8 6.0 285 237 A 30 VAL HG2% A 33 ASP H 1.0 1.8 6.0 286 238 A 30 VAL H A 33 ASP H 1.0 1.8 5.0 287 239 A 30 VAL HA A 33 ASP H 1.0 1.8 5.0 288 240 A 30 VAL H A 33 ASP HBx 1.0 1.8 5.0 289 240 A 30 VAL H A 33 ASP HBy 1.0 1.8 5.0 290 241 A 30 VAL HA A 33 ASP HBx 1.0 1.8 3.5 291 241 A 30 VAL HA A 33 ASP HBy 1.0 1.8 3.5 292 242 A 30 VAL HG1% A 33 ASP HBx 1.0 1.8 6.0 293 242 A 33 ASP HBy A 30 VAL HG1% 1.0 1.8 6.0 294 243 A 30 VAL HG2% A 33 ASP HBx 1.0 1.8 6.0 295 243 A 30 VAL HG2% A 33 ASP HBy 1.0 1.8 6.0 296 244 A 30 VAL HG1% A 34 PHE H 1.0 1.8 5.0 297 245 A 30 VAL HG1% A 34 PHE HD% 1.0 1.8 5.0 298 246 A 30 VAL HA A 34 PHE H 1.0 1.8 5.0 299 247 A 30 VAL HG1% A 34 PHE HBx 1.0 1.8 5.0 300 247 A 30 VAL HG1% A 34 PHE HBy 1.0 1.8 5.0 301 248 A 49 LEU HD2% A 30 VAL HG1% 1.0 1.8 3.5 302 249 A 30 VAL HG1% A 49 LEU HD1% 1.0 1.8 3.5 303 250 A 30 VAL HG2% A 49 LEU HD1% 1.0 1.8 5.0 304 251 A 30 VAL HG2% A 49 LEU HD2% 1.0 1.8 5.0 305 252 A 30 VAL HB A 49 LEU HD2% 1.0 1.8 5.0 306 253 A 30 VAL HG1% A 49 LEU HG 1.0 1.8 5.0 307 254 A 30 VAL HA A 49 LEU HD1% 1.0 1.8 5.0 308 255 A 30 VAL HB A 54 TRP HZ3 1.0 1.8 5.0 309 256 A 54 TRP HZ3 A 30 VAL HG1% 1.0 1.8 5.0 310 257 A 54 TRP HA A 30 VAL HG1% 1.0 1.8 5.0 311 258 A 30 VAL HG2% A 54 TRP HE3 1.0 1.8 5.0 312 259 A 30 VAL HG2% A 54 TRP HZ3 1.0 1.8 5.0 313 260 A 54 TRP HBx A 30 VAL HG1% 1.0 1.8 5.0 314 261 A 30 VAL HG2% A 54 TRP HBx 1.0 1.8 6.0 315 262 A 30 VAL HB A 54 TRP HE3 1.0 1.8 5.0 316 263 A 54 TRP HE3 A 30 VAL HG1% 1.0 1.8 3.5 317 264 A 30 VAL H A 54 TRP HE3 1.0 1.8 6.0 318 265 A 30 VAL H A 54 TRP HZ3 1.0 1.8 6.0 319 266 A 30 VAL HG2% A 55 ASP HA 1.0 1.8 6.0 320 267 A 30 VAL HA A 56 LEU HD1% 1.0 1.8 5.0 321 268 A 56 LEU HBy A 30 VAL HG1% 1.0 1.8 5.0 322 269 A 30 VAL HG1% A 56 LEU HBx 1.0 1.8 5.0 323 270 A 30 VAL HG1% A 56 LEU HA 1.0 1.8 5.0 324 271 A 30 VAL HG2% A 56 LEU HD1% 1.0 1.8 5.0 325 272 A 30 VAL HG2% A 56 LEU HBy 1.0 1.8 5.0 326 273 A 30 VAL HG2% A 56 LEU HBx 1.0 1.8 5.0 327 274 A 30 VAL HB A 56 LEU HD1% 1.0 1.8 6.0 328 275 A 56 LEU HD2% A 30 VAL HG1% 1.0 1.8 5.0 329 276 A 30 VAL HG2% A 56 LEU HD2% 1.0 1.8 5.0 330 277 A 30 VAL HA A 56 LEU HD2% 1.0 1.8 5.0 331 278 A 56 LEU HD1% A 30 VAL HG1% 1.0 1.8 3.5 332 279 A 30 VAL H A 56 LEU HD1% 1.0 1.8 6.0 333 280 A 30 VAL H A 56 LEU HBy 1.0 1.8 6.0 334 281 A 56 LEU H A 30 VAL HG1% 1.0 1.8 5.0 335 282 A 56 LEU H A 30 VAL HA 1.0 1.8 6.0 336 283 A 30 VAL HG1% A 57 THR H 1.0 1.8 5.0 337 284 A 30 VAL HG1% A 59 ALA HB% 1.0 1.8 5.0 338 285 A 30 VAL HG1% A 59 ALA H 1.0 1.8 6.0 339 286 A 30 VAL HG1% A 60 LEU HD1% 1.0 1.8 6.0 340 287 A 30 VAL HG1% A 60 LEU H 1.0 1.8 6.0 341 288 A 31 LEU HD2% A 31 LEU HA 1.0 1.8 5.0 342 289 A 31 LEU HA A 31 LEU HG 1.0 1.8 5.0 343 290 A 31 LEU HBy A 31 LEU HD2% 1.0 1.8 5.0 344 291 A 31 LEU HBx A 31 LEU HD2% 1.0 1.8 5.0 345 292 A 31 LEU HA A 31 LEU HD1% 1.0 1.8 3.5 346 293 A 31 LEU HBy A 31 LEU HD1% 1.0 1.8 3.5 347 294 A 31 LEU HBx A 31 LEU HD1% 1.0 1.8 5.0 348 295 A 31 LEU H A 31 LEU HBy 1.0 1.8 3.5 349 296 A 31 LEU H A 31 LEU HBx 1.0 1.8 3.5 350 297 A 31 LEU H A 31 LEU HD2% 1.0 1.8 5.0 351 298 A 31 LEU H A 31 LEU HD1% 1.0 1.8 5.0 352 299 A 31 LEU H A 31 LEU HG 1.0 1.8 5.0 353 300 A 31 LEU HBy A 32 SER H 1.0 1.8 5.0 354 301 A 31 LEU HBx A 32 SER H 1.0 1.8 3.5 355 302 A 31 LEU HD2% A 32 SER H 1.0 1.8 5.0 356 303 A 32 SER H A 31 LEU HD1% 1.0 1.8 5.0 357 304 A 32 SER H A 31 LEU HG 1.0 1.8 5.0 358 305 A 31 LEU H A 32 SER H 1.0 1.8 3.5 359 306 A 31 LEU H A 33 ASP H 1.0 1.8 5.0 360 307 A 31 LEU H A 33 ASP HBx 1.0 1.8 6.0 361 307 A 31 LEU H A 33 ASP HBy 1.0 1.8 6.0 362 308 A 31 LEU HD1% A 34 PHE HE% 1.0 1.8 6.0 363 309 A 34 PHE HD% A 31 LEU HD1% 1.0 1.8 5.0 364 310 A 31 LEU HA A 34 PHE HBy 1.0 1.8 5.0 365 311 A 31 LEU HA A 34 PHE HBx 1.0 1.8 5.0 366 312 A 31 LEU HA A 34 PHE HD% 1.0 1.8 5.0 367 313 A 34 PHE HD% A 31 LEU HG 1.0 1.8 6.0 368 314 A 31 LEU H A 34 PHE H 1.0 1.8 5.0 369 315 A 31 LEU HA A 34 PHE H 1.0 1.8 5.0 370 316 A 31 LEU H A 34 PHE HBx 1.0 1.8 6.0 371 316 A 31 LEU H A 34 PHE HBy 1.0 1.8 6.0 372 317 A 31 LEU HA A 35 VAL HG2% 1.0 1.8 6.0 373 318 A 31 LEU HD1% A 35 VAL HG2% 1.0 1.8 3.5 374 319 A 31 LEU HG A 35 VAL HG2% 1.0 1.8 5.0 375 320 A 31 LEU HBy A 35 VAL HG2% 1.0 1.8 6.0 376 321 A 31 LEU HG A 35 VAL HG1% 1.0 1.8 5.0 377 322 A 31 LEU HD1% A 35 VAL HB 1.0 1.8 6.0 378 323 A 31 LEU HD1% A 35 VAL H 1.0 1.8 5.0 379 324 A 31 LEU HG A 35 VAL HB 1.0 1.8 6.0 380 325 A 31 LEU HA A 35 VAL H 1.0 1.8 5.0 381 326 A 31 LEU HD2% A 42 PRO HBy 1.0 1.8 5.0 382 327 A 31 LEU HD1% A 42 PRO HBx 1.0 1.8 5.0 383 328 A 31 LEU HD1% A 42 PRO HA 1.0 1.8 5.0 384 329 A 31 LEU HG A 42 PRO HA 1.0 1.8 5.0 385 330 A 31 LEU HD2% A 42 PRO HBx 1.0 1.8 5.0 386 331 A 31 LEU HD2% A 42 PRO HA 1.0 1.8 5.0 387 332 A 31 LEU HD2% A 43 GLY HAy 1.0 1.8 6.0 388 333 A 31 LEU HD1% A 44 LEU H 1.0 1.8 6.0 389 334 A 31 LEU HA A 45 ALA HB% 1.0 1.8 6.0 390 335 A 31 LEU HA A 45 ALA HA 1.0 1.8 6.0 391 336 A 31 LEU HD1% A 45 ALA HB% 1.0 1.8 3.5 392 337 A 31 LEU HBy A 45 ALA HB% 1.0 1.8 5.0 393 338 A 31 LEU HD1% A 45 ALA HA 1.0 1.8 5.0 394 339 A 31 LEU H A 45 ALA HB% 1.0 1.8 6.0 395 340 A 31 LEU HD1% A 45 ALA H 1.0 1.8 5.0 396 341 A 31 LEU HD2% A 46 ARG HBy 1.0 1.8 5.0 397 342 A 31 LEU HD2% A 46 ARG HBx 1.0 1.8 5.0 398 343 A 31 LEU HD1% A 46 ARG HBy 1.0 1.8 5.0 399 344 A 31 LEU HD1% A 46 ARG HBx 1.0 1.8 5.0 400 345 A 31 LEU HD1% A 46 ARG HA 1.0 1.8 5.0 401 346 A 31 LEU HD2% A 46 ARG HA 1.0 1.8 5.0 402 347 A 31 LEU HD2% A 46 ARG HGx 1.0 1.8 5.0 403 348 A 31 LEU HD2% A 46 ARG HGy 1.0 1.8 6.0 404 349 A 31 LEU HD1% A 46 ARG H 1.0 1.8 5.0 405 350 A 31 LEU HD2% A 46 ARG H 1.0 1.8 5.0 406 351 A 31 LEU HD1% A 47 ASP H 1.0 1.8 5.0 407 352 A 49 LEU HD2% A 31 LEU HA 1.0 1.8 5.0 408 353 A 31 LEU HBx A 49 LEU HD1% 1.0 1.8 5.0 409 354 A 49 LEU HD2% A 31 LEU HBy 1.0 1.8 6.0 410 355 A 31 LEU HD2% A 49 LEU HD1% 1.0 1.8 5.0 411 356 A 49 LEU HD1% A 31 LEU HD1% 1.0 1.8 3.5 412 357 A 49 LEU HD1% A 31 LEU HG 1.0 1.8 5.0 413 358 A 31 LEU HBy A 49 LEU HD1% 1.0 1.8 5.0 414 359 A 31 LEU HA A 49 LEU HD1% 1.0 1.8 3.5 415 360 A 49 LEU HD2% A 31 LEU HD1% 1.0 1.8 6.0 416 361 A 49 LEU HG A 31 LEU HD1% 1.0 1.8 5.0 417 362 A 49 LEU HD2% A 31 LEU H 1.0 1.8 6.0 418 363 A 31 LEU H A 49 LEU HD1% 1.0 1.8 5.0 419 364 A 31 LEU HD1% A 49 LEU H 1.0 1.8 6.0 420 365 A 54 TRP HZ3 A 31 LEU HA 1.0 1.8 5.0 421 366 A 54 TRP HZ3 A 31 LEU HBx 1.0 1.8 5.0 422 367 A 54 TRP HZ3 A 31 LEU HBy 1.0 1.8 5.0 423 368 A 54 TRP HZ3 A 31 LEU HD2% 1.0 1.8 5.0 424 369 A 54 TRP HH2 A 31 LEU HD2% 1.0 1.8 5.0 425 370 A 54 TRP HH2 A 31 LEU HD1% 1.0 1.8 5.0 426 371 A 54 TRP HZ3 A 31 LEU HD1% 1.0 1.8 5.0 427 372 A 54 TRP HZ3 A 31 LEU HG 1.0 1.8 6.0 428 373 A 54 TRP HH2 A 31 LEU HBy 1.0 1.8 5.0 429 374 A 54 TRP HH2 A 31 LEU HBx 1.0 1.8 6.0 430 375 A 54 TRP HE3 A 31 LEU HD1% 1.0 1.8 5.0 431 376 A 54 TRP HE3 A 31 LEU HBy 1.0 1.8 6.0 432 377 A 31 LEU H A 54 TRP HZ3 1.0 1.8 5.0 433 378 A 54 TRP HE3 A 31 LEU H 1.0 1.8 5.0 434 379 A 31 LEU H A 54 TRP HH2 1.0 1.8 6.0 435 380 A 56 LEU HD1% A 31 LEU HA 1.0 1.8 5.0 436 381 A 32 SER HBy A 32 SER HA 1.0 1.8 3.5 437 382 A 32 SER H A 32 SER HBy 1.0 1.8 3.5 438 383 A 32 SER H A 32 SER HBx 1.0 1.8 3.5 439 384 A 32 SER H A 33 ASP H 1.0 1.8 3.5 440 385 A 32 SER HBy A 33 ASP H 1.0 1.8 5.0 441 386 A 32 SER HBx A 33 ASP H 1.0 1.8 5.0 442 387 A 34 PHE H A 32 SER HA 1.0 1.8 5.0 443 388 A 32 SER H A 34 PHE H 1.0 1.8 5.0 444 389 A 32 SER HBy A 35 VAL HB 1.0 1.8 6.0 445 390 A 35 VAL HB A 32 SER HA 1.0 1.8 5.0 446 391 A 35 VAL HG2% A 32 SER HA 1.0 1.8 5.0 447 392 A 35 VAL HG1% A 32 SER HA 1.0 1.8 5.0 448 393 A 32 SER H A 35 VAL HB 1.0 1.8 6.0 449 394 A 32 SER H A 35 VAL H 1.0 1.8 6.0 450 395 A 35 VAL H A 32 SER HA 1.0 1.8 5.0 451 396 A 32 SER HA A 36 ARG H 1.0 1.8 5.0 452 397 A 32 SER H A 49 LEU HD1% 1.0 1.8 6.0 453 398 A 33 ASP H A 33 ASP HBx 1.0 1.8 3.5 454 398 A 33 ASP H A 33 ASP HBy 1.0 1.8 3.5 455 399 A 33 ASP H A 34 PHE H 1.0 1.8 3.5 456 400 A 34 PHE H A 33 ASP HBx 1.0 1.8 5.0 457 401 A 33 ASP HBy A 34 PHE H 1.0 1.8 5.0 458 402 A 34 PHE H A 33 ASP HBx 1.0 1.8 3.5 459 402 A 33 ASP HBy A 34 PHE H 1.0 1.8 3.5 460 403 A 33 ASP H A 35 VAL HG2% 1.0 1.8 6.0 461 404 A 35 VAL H A 33 ASP HA 1.0 1.8 5.0 462 405 A 33 ASP H A 35 VAL H 1.0 1.8 5.0 463 406 A 33 ASP HA A 36 ARG HBy 1.0 1.8 5.0 464 407 A 33 ASP HA A 36 ARG HBx 1.0 1.8 5.0 465 408 A 33 ASP HA A 36 ARG HDx 1.0 1.8 5.0 466 408 A 33 ASP HA A 36 ARG HDy 1.0 1.8 5.0 467 409 A 33 ASP HA A 36 ARG HGy 1.0 1.8 6.0 468 410 A 33 ASP HA A 36 ARG HGx 1.0 1.8 6.0 469 411 A 33 ASP H A 36 ARG H 1.0 1.8 5.0 470 412 A 36 ARG H A 33 ASP HA 1.0 1.8 5.0 471 413 A 36 ARG H A 33 ASP HBx 1.0 1.8 6.0 472 413 A 33 ASP HBy A 36 ARG H 1.0 1.8 6.0 473 414 A 33 ASP HA A 37 SER H 1.0 1.8 5.0 474 415 A 56 LEU HD1% A 33 ASP HBx 1.0 1.8 5.0 475 416 A 56 LEU HD2% A 33 ASP HBx 1.0 1.8 5.0 476 417 A 56 LEU HD2% A 33 ASP HA 1.0 1.8 6.0 477 418 A 33 ASP HBy A 56 LEU HD2% 1.0 1.8 5.0 478 419 A 33 ASP HBy A 56 LEU HD1% 1.0 1.8 5.0 479 420 A 33 ASP H A 56 LEU HD2% 1.0 1.8 6.0 480 421 A 33 ASP H A 56 LEU HD1% 1.0 1.8 5.0 481 422 A 56 LEU HD1% A 33 ASP HBx 1.0 1.8 3.5 482 422 A 33 ASP HBy A 56 LEU HD1% 1.0 1.8 3.5 483 423 A 56 LEU HD2% A 33 ASP HBx 1.0 1.8 3.5 484 423 A 33 ASP HBy A 56 LEU HD2% 1.0 1.8 3.5 485 424 A 34 PHE HD% A 34 PHE HA 1.0 1.8 5.0 486 425 A 34 PHE H A 34 PHE HBx 1.0 1.8 3.5 487 426 A 34 PHE H A 34 PHE HBy 1.0 1.8 3.5 488 427 A 34 PHE H A 34 PHE HD% 1.0 1.8 5.0 489 428 A 34 PHE H A 34 PHE HBx 1.0 1.8 3.5 490 428 A 34 PHE H A 34 PHE HBy 1.0 1.8 3.5 491 429 A 35 VAL HG2% A 34 PHE HBx 1.0 1.8 5.0 492 430 A 34 PHE HBy A 35 VAL HG2% 1.0 1.8 5.0 493 431 A 34 PHE HD% A 35 VAL HA 1.0 1.8 5.0 494 432 A 34 PHE H A 35 VAL HG2% 1.0 1.8 5.0 495 433 A 34 PHE HD% A 35 VAL HG2% 1.0 1.8 5.0 496 434 A 35 VAL HG2% A 34 PHE HZ 1.0 1.8 6.0 497 435 A 34 PHE HD% A 35 VAL HG1% 1.0 1.8 5.0 498 436 A 34 PHE HBy A 35 VAL H 1.0 1.8 5.0 499 437 A 34 PHE H A 35 VAL H 1.0 1.8 3.5 500 438 A 35 VAL H A 34 PHE HBx 1.0 1.8 5.0 501 439 A 34 PHE HD% A 35 VAL H 1.0 1.8 5.0 502 440 A 35 VAL H A 34 PHE HBx 1.0 1.8 5.0 503 440 A 34 PHE HBy A 35 VAL H 1.0 1.8 5.0 504 441 A 36 ARG H A 34 PHE HA 1.0 1.8 6.0 505 442 A 34 PHE H A 36 ARG H 1.0 1.8 5.0 506 443 A 36 ARG H A 34 PHE HBx 1.0 1.8 6.0 507 443 A 34 PHE HBy A 36 ARG H 1.0 1.8 6.0 508 444 A 37 SER H A 34 PHE HA 1.0 1.8 5.0 509 445 A 34 PHE HA A 38 THR HG2% 1.0 1.8 5.0 510 446 A 34 PHE HZ A 38 THR HG2% 1.0 1.8 5.0 511 447 A 34 PHE HE% A 38 THR HG2% 1.0 1.8 5.0 512 448 A 34 PHE HD% A 38 THR HG2% 1.0 1.8 5.0 513 449 A 38 THR HG2% A 34 PHE HBx 1.0 1.8 6.0 514 449 A 34 PHE HBy A 38 THR HG2% 1.0 1.8 6.0 515 450 A 34 PHE HE% A 40 ALA HB% 1.0 1.8 5.0 516 451 A 34 PHE HZ A 40 ALA HB% 1.0 1.8 5.0 517 452 A 34 PHE HE% A 40 ALA H 1.0 1.8 5.0 518 453 A 34 PHE HD% A 40 ALA H 1.0 1.8 6.0 519 454 A 34 PHE HZ A 44 LEU HD2% 1.0 1.8 5.0 520 455 A 34 PHE HE% A 44 LEU HD2% 1.0 1.8 5.0 521 456 A 34 PHE HZ A 44 LEU HG 1.0 1.8 6.0 522 457 A 45 ALA HB% A 34 PHE HBx 1.0 1.8 6.0 523 458 A 34 PHE HBy A 45 ALA HB% 1.0 1.8 6.0 524 459 A 34 PHE HE% A 45 ALA HB% 1.0 1.8 5.0 525 460 A 45 ALA HB% A 34 PHE HZ 1.0 1.8 5.0 526 461 A 34 PHE HD% A 45 ALA HA 1.0 1.8 5.0 527 462 A 34 PHE HD% A 45 ALA HB% 1.0 1.8 3.5 528 463 A 34 PHE HE% A 45 ALA HA 1.0 1.8 5.0 529 464 A 34 PHE HE% A 45 ALA H 1.0 1.8 6.0 530 465 A 45 ALA HB% A 34 PHE HBx 1.0 1.8 5.0 531 465 A 34 PHE HBy A 45 ALA HB% 1.0 1.8 5.0 532 466 A 34 PHE HE% A 48 LEU HD1% 1.0 1.8 5.0 533 467 A 34 PHE HZ A 48 LEU HD1% 1.0 1.8 5.0 534 468 A 34 PHE HZ A 48 LEU HD2% 1.0 1.8 5.0 535 469 A 34 PHE HE% A 48 LEU HD2% 1.0 1.8 6.0 536 470 A 34 PHE HZ A 48 LEU HBy 1.0 1.8 6.0 537 471 A 49 LEU HD1% A 34 PHE HBx 1.0 1.8 5.0 538 472 A 34 PHE HD% A 49 LEU HD1% 1.0 1.8 5.0 539 473 A 34 PHE HBy A 49 LEU HD1% 1.0 1.8 5.0 540 474 A 49 LEU HD1% A 34 PHE HE% 1.0 1.8 6.0 541 475 A 34 PHE H A 49 LEU HD1% 1.0 1.8 5.0 542 476 A 49 LEU HD2% A 34 PHE HBx 1.0 1.8 5.0 543 476 A 49 LEU HD2% A 34 PHE HBy 1.0 1.8 5.0 544 477 A 56 LEU HD2% A 34 PHE HA 1.0 1.8 5.0 545 478 A 56 LEU HD1% A 34 PHE HBx 1.0 1.8 5.0 546 479 A 56 LEU HD1% A 34 PHE HBy 1.0 1.8 5.0 547 480 A 56 LEU HD1% A 34 PHE HE% 1.0 1.8 6.0 548 481 A 56 LEU HD1% A 34 PHE HA 1.0 1.8 3.5 549 482 A 56 LEU HD1% A 34 PHE HD% 1.0 1.8 3.5 550 483 A 34 PHE HD% A 56 LEU HG 1.0 1.8 6.0 551 484 A 56 LEU HD2% A 34 PHE H 1.0 1.8 6.0 552 485 A 56 LEU HD1% A 34 PHE H 1.0 1.8 5.0 553 486 A 56 LEU HD1% A 34 PHE HBx 1.0 1.8 3.5 554 486 A 56 LEU HD1% A 34 PHE HBy 1.0 1.8 3.5 555 487 A 59 ALA HB% A 34 PHE HE% 1.0 1.8 5.0 556 488 A 34 PHE HD% A 59 ALA HB% 1.0 1.8 5.0 557 489 A 59 ALA HB% A 34 PHE HZ 1.0 1.8 5.0 558 490 A 59 ALA HB% A 34 PHE HBx 1.0 1.8 5.0 559 490 A 34 PHE HBy A 59 ALA HB% 1.0 1.8 5.0 560 491 A 60 LEU HD2% A 34 PHE HBx 1.0 1.8 6.0 561 492 A 34 PHE HE% A 60 LEU HD2% 1.0 1.8 5.0 562 493 A 34 PHE HD% A 60 LEU HD2% 1.0 1.8 5.0 563 494 A 34 PHE HBy A 60 LEU HD2% 1.0 1.8 6.0 564 495 A 34 PHE HZ A 60 LEU HA 1.0 1.8 5.0 565 496 A 34 PHE HD% A 60 LEU HA 1.0 1.8 5.0 566 497 A 34 PHE HD% A 60 LEU HD1% 1.0 1.8 5.0 567 498 A 60 LEU HD1% A 34 PHE HE% 1.0 1.8 6.0 568 499 A 34 PHE HA A 60 LEU HD2% 1.0 1.8 3.5 569 500 A 34 PHE HE% A 60 LEU HA 1.0 1.8 5.0 570 501 A 34 PHE HZ A 60 LEU HD2% 1.0 1.8 5.0 571 502 A 34 PHE HE% A 60 LEU HG 1.0 1.8 5.0 572 503 A 34 PHE HE% A 60 LEU HBy 1.0 1.8 5.0 573 504 A 34 PHE H A 60 LEU HD2% 1.0 1.8 6.0 574 505 A 60 LEU H A 34 PHE HE% 1.0 1.8 5.0 575 506 A 34 PHE HD% A 60 LEU H 1.0 1.8 5.0 576 507 A 60 LEU HD2% A 34 PHE HBx 1.0 1.8 5.0 577 507 A 34 PHE HBy A 60 LEU HD2% 1.0 1.8 5.0 578 508 A 34 PHE HZ A 63 TYR HBx 1.0 1.8 5.0 579 509 A 34 PHE HE% A 63 TYR HBy 1.0 1.8 5.0 580 510 A 34 PHE HE% A 63 TYR HBx 1.0 1.8 5.0 581 511 A 34 PHE HZ A 63 TYR HA 1.0 1.8 5.0 582 512 A 34 PHE HD% A 63 TYR HBx 1.0 1.8 6.0 583 513 A 34 PHE HD% A 63 TYR HBy 1.0 1.8 6.0 584 514 A 34 PHE HZ A 63 TYR HBy 1.0 1.8 5.0 585 515 A 34 PHE HE% A 63 TYR HD% 1.0 1.8 5.0 586 516 A 34 PHE HZ A 63 TYR HD% 1.0 1.8 5.0 587 517 A 34 PHE HZ A 63 TYR H 1.0 1.8 5.0 588 518 A 34 PHE HD% A 63 TYR H 1.0 1.8 6.0 589 519 A 35 VAL HG2% A 35 VAL HA 1.0 1.8 3.5 590 520 A 35 VAL HG1% A 35 VAL HA 1.0 1.8 3.5 591 521 A 35 VAL HG1% A 35 VAL H 1.0 1.8 5.0 592 522 A 35 VAL HB A 35 VAL H 1.0 1.8 3.5 593 523 A 35 VAL HG2% A 35 VAL H 1.0 1.8 3.5 594 524 A 35 VAL HG1% A 36 ARG HGx 1.0 1.8 6.0 595 525 A 35 VAL HG1% A 36 ARG HBy 1.0 1.8 5.0 596 526 A 35 VAL HG1% A 36 ARG HA 1.0 1.8 5.0 597 527 A 35 VAL HB A 36 ARG HA 1.0 1.8 5.0 598 528 A 35 VAL HG2% A 36 ARG H 1.0 1.8 5.0 599 529 A 35 VAL H A 36 ARG HBx 1.0 1.8 6.0 600 530 A 35 VAL HB A 36 ARG H 1.0 1.8 3.5 601 531 A 35 VAL HG1% A 36 ARG H 1.0 1.8 5.0 602 532 A 35 VAL H A 36 ARG H 1.0 1.8 3.5 603 533 A 35 VAL HG1% A 37 SER H 1.0 1.8 5.0 604 534 A 37 SER H A 35 VAL HA 1.0 1.8 5.0 605 535 A 35 VAL H A 37 SER H 1.0 1.8 5.0 606 536 A 35 VAL HG2% A 38 THR HG2% 1.0 1.8 6.0 607 537 A 35 VAL HA A 38 THR H 1.0 1.8 5.0 608 538 A 35 VAL HG1% A 38 THR H 1.0 1.8 6.0 609 539 A 35 VAL HG2% A 38 THR H 1.0 1.8 6.0 610 540 A 35 VAL HG1% A 39 GLY H 1.0 1.8 5.0 611 541 A 35 VAL HG1% A 39 GLY HAy 1.0 1.8 5.0 612 542 A 35 VAL HA A 39 GLY H 1.0 1.8 5.0 613 543 A 35 VAL HA A 40 ALA HB% 1.0 1.8 5.0 614 544 A 35 VAL HG2% A 40 ALA HB% 1.0 1.8 5.0 615 545 A 35 VAL HG2% A 40 ALA H 1.0 1.8 5.0 616 546 A 35 VAL HG1% A 40 ALA HB% 1.0 1.8 5.0 617 547 A 35 VAL HG1% A 40 ALA HA 1.0 1.8 5.0 618 548 A 35 VAL HG1% A 40 ALA H 1.0 1.8 5.0 619 549 A 35 VAL HB A 40 ALA H 1.0 1.8 6.0 620 550 A 35 VAL HA A 40 ALA H 1.0 1.8 3.5 621 551 A 35 VAL HG1% A 41 GLU HA 1.0 1.8 5.0 622 552 A 35 VAL HG2% A 41 GLU HA 1.0 1.8 6.0 623 553 A 35 VAL HG2% A 41 GLU HGx 1.0 1.8 6.0 624 554 A 35 VAL HG1% A 41 GLU H 1.0 1.8 6.0 625 555 A 35 VAL HG2% A 41 GLU H 1.0 1.8 6.0 626 556 A 35 VAL HG2% A 42 PRO HBy 1.0 1.8 5.0 627 557 A 35 VAL HG2% A 42 PRO HBx 1.0 1.8 5.0 628 558 A 35 VAL HG1% A 42 PRO HA 1.0 1.8 5.0 629 559 A 35 VAL HG1% A 42 PRO HDy 1.0 1.8 6.0 630 560 A 35 VAL HG2% A 42 PRO HDy 1.0 1.8 6.0 631 561 A 35 VAL HG1% A 42 PRO HDx 1.0 1.8 5.0 632 562 A 35 VAL HG2% A 42 PRO HDx 1.0 1.8 6.0 633 563 A 35 VAL HG2% A 42 PRO HGy 1.0 1.8 6.0 634 564 A 35 VAL HG1% A 42 PRO HGx 1.0 1.8 6.0 635 565 A 35 VAL HG2% A 42 PRO HGx 1.0 1.8 6.0 636 566 A 35 VAL HB A 42 PRO HA 1.0 1.8 6.0 637 567 A 35 VAL HG2% A 42 PRO HA 1.0 1.8 3.5 638 568 A 35 VAL HG2% A 43 GLY H 1.0 1.8 6.0 639 569 A 35 VAL HG2% A 44 LEU HBx 1.0 1.8 6.0 640 570 A 35 VAL HG2% A 45 ALA H 1.0 1.8 5.0 641 571 A 45 ALA HB% A 35 VAL HA 1.0 1.8 6.0 642 572 A 56 LEU HD1% A 35 VAL H 1.0 1.8 5.0 643 573 A 36 ARG HGy A 36 ARG HA 1.0 1.8 5.0 644 574 A 36 ARG HGx A 36 ARG HA 1.0 1.8 5.0 645 575 A 36 ARG HA A 36 ARG HDx 1.0 1.8 5.0 646 575 A 36 ARG HDy A 36 ARG HA 1.0 1.8 5.0 647 576 A 36 ARG HBx A 36 ARG HDx 1.0 1.8 3.5 648 576 A 36 ARG HBx A 36 ARG HDy 1.0 1.8 3.5 649 577 A 36 ARG HBy A 36 ARG HDx 1.0 1.8 5.0 650 577 A 36 ARG HBy A 36 ARG HDy 1.0 1.8 5.0 651 578 A 36 ARG HGy A 36 ARG HDx 1.0 1.8 3.5 652 578 A 36 ARG HDy A 36 ARG HGy 1.0 1.8 3.5 653 579 A 36 ARG H A 36 ARG HBx 1.0 1.8 3.5 654 580 A 36 ARG H A 36 ARG HBy 1.0 1.8 3.5 655 581 A 36 ARG H A 36 ARG HDx 1.0 1.8 5.0 656 581 A 36 ARG H A 36 ARG HDy 1.0 1.8 5.0 657 582 A 36 ARG H A 36 ARG HGy 1.0 1.8 5.0 658 583 A 36 ARG H A 36 ARG HGx 1.0 1.8 5.0 659 584 A 36 ARG HGy A 37 SER HA 1.0 1.8 5.0 660 585 A 36 ARG HBx A 37 SER HA 1.0 1.8 5.0 661 586 A 36 ARG HGx A 37 SER H 1.0 1.8 6.0 662 587 A 36 ARG H A 37 SER HA 1.0 1.8 6.0 663 588 A 36 ARG HBx A 37 SER H 1.0 1.8 3.5 664 589 A 36 ARG HBy A 37 SER H 1.0 1.8 5.0 665 590 A 37 SER H A 36 ARG HDx 1.0 1.8 6.0 666 590 A 36 ARG HDy A 37 SER H 1.0 1.8 6.0 667 591 A 36 ARG HGy A 37 SER H 1.0 1.8 6.0 668 592 A 36 ARG H A 37 SER H 1.0 1.8 3.5 669 593 A 36 ARG H A 37 SER HBy 1.0 1.8 6.0 670 593 A 36 ARG H A 37 SER HBx 1.0 1.8 6.0 671 594 A 36 ARG H A 38 THR H 1.0 1.8 5.0 672 595 A 36 ARG HA A 38 THR H 1.0 1.8 6.0 673 596 A 36 ARG HA A 39 GLY HAy 1.0 1.8 5.0 674 597 A 36 ARG HA A 39 GLY H 1.0 1.8 5.0 675 598 A 37 SER H A 37 SER HBy 1.0 1.8 5.0 676 599 A 37 SER H A 37 SER HBx 1.0 1.8 5.0 677 600 A 37 SER H A 37 SER HBy 1.0 1.8 3.5 678 600 A 37 SER H A 37 SER HBx 1.0 1.8 3.5 679 601 A 38 THR HG2% A 37 SER HBy 1.0 1.8 5.0 680 602 A 38 THR HG2% A 37 SER HA 1.0 1.8 5.0 681 603 A 38 THR HG2% A 37 SER HBx 1.0 1.8 5.0 682 604 A 37 SER H A 38 THR HG2% 1.0 1.8 5.0 683 605 A 37 SER H A 38 THR H 1.0 1.8 3.5 684 606 A 38 THR H A 37 SER HBx 1.0 1.8 5.0 685 607 A 38 THR H A 37 SER HBy 1.0 1.8 5.0 686 608 A 38 THR HG2% A 37 SER HBy 1.0 1.8 5.0 687 608 A 38 THR HG2% A 37 SER HBx 1.0 1.8 5.0 688 609 A 37 SER H A 39 GLY H 1.0 1.8 5.0 689 610 A 39 GLY H A 37 SER HA 1.0 1.8 5.0 690 611 A 60 LEU HD2% A 37 SER HBx 1.0 1.8 5.0 691 612 A 60 LEU HD2% A 37 SER HBy 1.0 1.8 5.0 692 613 A 60 LEU HD2% A 37 SER HA 1.0 1.8 6.0 693 614 A 37 SER H A 60 LEU HD2% 1.0 1.8 5.0 694 615 A 38 THR HG2% A 38 THR HA 1.0 1.8 3.5 695 616 A 38 THR H A 38 THR HB 1.0 1.8 5.0 696 617 A 38 THR HG2% A 38 THR H 1.0 1.8 3.5 697 618 A 38 THR HG2% A 39 GLY H 1.0 1.8 5.0 698 619 A 38 THR H A 39 GLY H 1.0 1.8 3.5 699 620 A 40 ALA H A 38 THR HB 1.0 1.8 5.0 700 621 A 38 THR HG2% A 40 ALA H 1.0 1.8 5.0 701 622 A 38 THR HG2% A 40 ALA HB% 1.0 1.8 5.0 702 623 A 40 ALA HB% A 38 THR HB 1.0 1.8 5.0 703 624 A 40 ALA HB% A 38 THR HA 1.0 1.8 5.0 704 625 A 40 ALA HB% A 38 THR H 1.0 1.8 6.0 705 626 A 40 ALA H A 38 THR H 1.0 1.8 5.0 706 627 A 40 ALA H A 38 THR HA 1.0 1.8 5.0 707 628 A 45 ALA HB% A 38 THR HG2% 1.0 1.8 6.0 708 629 A 38 THR HG2% A 48 LEU HD1% 1.0 1.8 6.0 709 630 A 38 THR HG2% A 60 LEU HA 1.0 1.8 5.0 710 631 A 38 THR HG2% A 60 LEU HD2% 1.0 1.8 3.5 711 632 A 60 LEU HD1% A 38 THR HG2% 1.0 1.8 5.0 712 633 A 60 LEU HD2% A 38 THR HA 1.0 1.8 5.0 713 634 A 38 THR HG2% A 63 TYR HBx 1.0 1.8 5.0 714 635 A 38 THR HG2% A 63 TYR HBy 1.0 1.8 6.0 715 636 A 63 TYR HBx A 38 THR HB 1.0 1.8 5.0 716 637 A 38 THR HG2% A 63 TYR HD% 1.0 1.8 3.5 717 638 A 63 TYR HD% A 38 THR HB 1.0 1.8 5.0 718 639 A 38 THR HG2% A 63 TYR HE% 1.0 1.8 5.0 719 640 A 38 THR HB A 63 TYR HE% 1.0 1.8 3.5 720 641 A 40 ALA HB% A 39 GLY H 1.0 1.8 5.0 721 642 A 40 ALA H A 39 GLY HAx 1.0 1.8 3.5 722 643 A 40 ALA H A 39 GLY H 1.0 1.8 3.5 723 644 A 40 ALA HB% A 40 ALA H 1.0 1.8 2.7 724 645 A 40 ALA H A 41 GLU H 1.0 1.8 5.0 725 646 A 40 ALA HA A 41 GLU H 1.0 1.8 2.7 726 647 A 40 ALA HB% A 41 GLU H 1.0 1.8 3.5 727 648 A 40 ALA HB% A 44 LEU HG 1.0 1.8 6.0 728 649 A 40 ALA HB% A 44 LEU HBx 1.0 1.8 5.0 729 650 A 45 ALA HA A 40 ALA HB% 1.0 1.8 5.0 730 651 A 45 ALA HB% A 40 ALA HB% 1.0 1.8 5.0 731 652 A 45 ALA H A 40 ALA HB% 1.0 1.8 5.0 732 653 A 40 ALA HB% A 48 LEU HD1% 1.0 1.8 5.0 733 654 A 40 ALA HB% A 63 TYR HE% 1.0 1.8 3.5 734 655 A 40 ALA HB% A 63 TYR HD% 1.0 1.8 5.0 735 656 A 40 ALA HA A 63 TYR HE% 1.0 1.8 5.0 736 657 A 40 ALA H A 63 TYR HE% 1.0 1.8 6.0 737 658 A 41 GLU HA A 41 GLU HGx 1.0 1.8 5.0 738 659 A 41 GLU HA A 41 GLU HGy 1.0 1.8 5.0 739 660 A 41 GLU H A 41 GLU HBx 1.0 1.8 3.5 740 661 A 41 GLU H A 41 GLU HBy 1.0 1.8 5.0 741 662 A 41 GLU HGx A 41 GLU H 1.0 1.8 5.0 742 663 A 41 GLU H A 41 GLU HGy 1.0 1.8 5.0 743 664 A 42 PRO HDy A 41 GLU HGy 1.0 1.8 5.0 744 665 A 42 PRO HDx A 41 GLU HBx 1.0 1.8 5.0 745 666 A 41 GLU HGx A 42 PRO HDy 1.0 1.8 5.0 746 667 A 42 PRO HDy A 41 GLU HBx 1.0 1.8 5.0 747 668 A 41 GLU HGx A 42 PRO HGx 1.0 1.8 5.0 748 669 A 41 GLU HGx A 42 PRO HGy 1.0 1.8 5.0 749 670 A 41 GLU HA A 42 PRO HGy 1.0 1.8 5.0 750 671 A 41 GLU HA A 42 PRO HDy 1.0 1.8 3.5 751 672 A 41 GLU HA A 42 PRO HDx 1.0 1.8 3.5 752 673 A 42 PRO HDx A 41 GLU HBy 1.0 1.8 5.0 753 674 A 42 PRO HDy A 41 GLU HBy 1.0 1.8 5.0 754 675 A 41 GLU H A 42 PRO HDx 1.0 1.8 6.0 755 676 A 41 GLU H A 42 PRO HDy 1.0 1.8 5.0 756 677 A 41 GLU HGy A 43 GLY HAx 1.0 1.8 5.0 757 678 A 41 GLU HGx A 43 GLY HAx 1.0 1.8 5.0 758 679 A 43 GLY H A 41 GLU HBx 1.0 1.8 6.0 759 680 A 41 GLU HA A 43 GLY H 1.0 1.8 5.0 760 681 A 41 GLU HGx A 43 GLY H 1.0 1.8 5.0 761 682 A 43 GLY H A 41 GLU HGy 1.0 1.8 5.0 762 683 A 43 GLY H A 41 GLU HBy 1.0 1.8 5.0 763 684 A 41 GLU HGx A 44 LEU HD1% 1.0 1.8 6.0 764 685 A 41 GLU HBx A 44 LEU HBy 1.0 1.8 5.0 765 686 A 44 LEU H A 41 GLU HBx 1.0 1.8 5.0 766 687 A 41 GLU HGy A 44 LEU HBy 1.0 1.8 5.0 767 688 A 41 GLU HBy A 44 LEU HBy 1.0 1.8 6.0 768 689 A 41 GLU HGx A 44 LEU HBy 1.0 1.8 5.0 769 690 A 41 GLU HGx A 44 LEU HBx 1.0 1.8 6.0 770 691 A 44 LEU HD2% A 41 GLU HGy 1.0 1.8 5.0 771 692 A 44 LEU HD2% A 41 GLU H 1.0 1.8 5.0 772 693 A 41 GLU HBx A 44 LEU HD1% 1.0 1.8 6.0 773 694 A 41 GLU HGy A 44 LEU HD1% 1.0 1.8 5.0 774 695 A 41 GLU H A 44 LEU HD1% 1.0 1.8 5.0 775 696 A 41 GLU H A 44 LEU HBy 1.0 1.8 5.0 776 697 A 41 GLU H A 44 LEU HBx 1.0 1.8 5.0 777 698 A 44 LEU H A 41 GLU HBy 1.0 1.8 5.0 778 699 A 44 LEU H A 41 GLU HGx 1.0 1.8 5.0 779 700 A 44 LEU H A 41 GLU H 1.0 1.8 6.0 780 701 A 44 LEU H A 41 GLU HGy 1.0 1.8 5.0 781 702 A 45 ALA HB% A 41 GLU HGx 1.0 1.8 6.0 782 703 A 42 PRO HBx A 43 GLY H 1.0 1.8 5.0 783 704 A 42 PRO HDx A 43 GLY H 1.0 1.8 5.0 784 705 A 42 PRO HBy A 43 GLY HAx 1.0 1.8 5.0 785 706 A 42 PRO HBy A 43 GLY HAy 1.0 1.8 5.0 786 707 A 42 PRO HBy A 43 GLY H 1.0 1.8 3.5 787 708 A 42 PRO HDy A 43 GLY H 1.0 1.8 5.0 788 709 A 42 PRO HGx A 43 GLY H 1.0 1.8 5.0 789 710 A 42 PRO HGy A 43 GLY H 1.0 1.8 5.0 790 711 A 42 PRO HA A 44 LEU H 1.0 1.8 5.0 791 712 A 44 LEU H A 42 PRO HGy 1.0 1.8 5.0 792 713 A 42 PRO HBx A 45 ALA HB% 1.0 1.8 5.0 793 714 A 42 PRO HA A 45 ALA HB% 1.0 1.8 3.5 794 715 A 42 PRO HA A 45 ALA H 1.0 1.8 5.0 795 716 A 42 PRO HA A 46 ARG H 1.0 1.8 5.0 796 717 A 43 GLY H A 43 GLY HAx 1.0 1.8 3.5 797 718 A 43 GLY H A 44 LEU HBy 1.0 1.8 6.0 798 719 A 43 GLY H A 44 LEU HBx 1.0 1.8 6.0 799 720 A 43 GLY H A 44 LEU HA 1.0 1.8 6.0 800 721 A 44 LEU H A 43 GLY H 1.0 1.8 3.5 801 722 A 44 LEU H A 43 GLY HAx 1.0 1.8 3.5 802 723 A 45 ALA H A 43 GLY HAx 1.0 1.8 6.0 803 724 A 43 GLY HAy A 46 ARG H 1.0 1.8 5.0 804 725 A 46 ARG H A 43 GLY HAx 1.0 1.8 6.0 805 726 A 43 GLY HAy A 47 ASP H 1.0 1.8 5.0 806 727 A 44 LEU HD2% A 44 LEU HA 1.0 1.8 5.0 807 728 A 44 LEU HG A 44 LEU HA 1.0 1.8 5.0 808 729 A 44 LEU HD2% A 44 LEU HBy 1.0 1.8 5.0 809 730 A 44 LEU HD2% A 44 LEU HBx 1.0 1.8 3.5 810 731 A 44 LEU HD1% A 44 LEU HA 1.0 1.8 3.5 811 732 A 44 LEU HD1% A 44 LEU HBy 1.0 1.8 3.5 812 733 A 44 LEU HBx A 44 LEU HD1% 1.0 1.8 5.0 813 734 A 44 LEU H A 44 LEU HD1% 1.0 1.8 5.0 814 735 A 44 LEU H A 44 LEU HBy 1.0 1.8 3.5 815 736 A 44 LEU H A 44 LEU HBx 1.0 1.8 3.5 816 737 A 44 LEU H A 44 LEU HD2% 1.0 1.8 5.0 817 738 A 44 LEU H A 44 LEU HG 1.0 1.8 5.0 818 739 A 45 ALA HA A 44 LEU HD2% 1.0 1.8 5.0 819 740 A 45 ALA HB% A 44 LEU HBx 1.0 1.8 6.0 820 741 A 45 ALA HB% A 44 LEU HBy 1.0 1.8 6.0 821 742 A 45 ALA H A 44 LEU HD1% 1.0 1.8 5.0 822 743 A 44 LEU H A 45 ALA HB% 1.0 1.8 5.0 823 744 A 44 LEU H A 45 ALA H 1.0 1.8 3.5 824 745 A 45 ALA H A 44 LEU HBy 1.0 1.8 5.0 825 746 A 45 ALA H A 44 LEU HBx 1.0 1.8 3.5 826 747 A 45 ALA H A 44 LEU HD2% 1.0 1.8 5.0 827 748 A 45 ALA H A 44 LEU HG 1.0 1.8 5.0 828 749 A 44 LEU H A 46 ARG H 1.0 1.8 5.0 829 750 A 44 LEU HA A 47 ASP HBy 1.0 1.8 5.0 830 751 A 44 LEU HD1% A 47 ASP HBx 1.0 1.8 5.0 831 752 A 44 LEU HA A 47 ASP HBx 1.0 1.8 5.0 832 753 A 44 LEU H A 47 ASP H 1.0 1.8 5.0 833 754 A 47 ASP H A 44 LEU HG 1.0 1.8 6.0 834 755 A 47 ASP H A 44 LEU HA 1.0 1.8 5.0 835 756 A 48 LEU HD1% A 44 LEU HBx 1.0 1.8 5.0 836 757 A 44 LEU HD2% A 48 LEU HD1% 1.0 1.8 3.5 837 758 A 44 LEU HD2% A 48 LEU HD2% 1.0 1.8 5.0 838 759 A 48 LEU HD2% A 44 LEU HD1% 1.0 1.8 3.5 839 760 A 44 LEU HA A 48 LEU H 1.0 1.8 5.0 840 761 A 44 LEU HG A 48 LEU HD1% 1.0 1.8 3.5 841 762 A 44 LEU HG A 48 LEU HD2% 1.0 1.8 5.0 842 763 A 44 LEU HG A 48 LEU HG 1.0 1.8 3.5 843 764 A 44 LEU HD2% A 48 LEU H 1.0 1.8 6.0 844 765 A 63 TYR HD% A 44 LEU HD1% 1.0 1.8 6.0 845 766 A 44 LEU HD2% A 63 TYR HD% 1.0 1.8 3.5 846 767 A 44 LEU HG A 63 TYR HD% 1.0 1.8 5.0 847 768 A 63 TYR HE% A 44 LEU HD1% 1.0 1.8 5.0 848 769 A 44 LEU HD2% A 63 TYR HE% 1.0 1.8 3.5 849 770 A 45 ALA HB% A 45 ALA H 1.0 1.8 3.5 850 771 A 45 ALA HB% A 46 ARG HBx 1.0 1.8 6.0 851 772 A 45 ALA HB% A 46 ARG HA 1.0 1.8 6.0 852 773 A 45 ALA HB% A 46 ARG H 1.0 1.8 3.5 853 774 A 45 ALA HB% A 47 ASP H 1.0 1.8 5.0 854 775 A 45 ALA HA A 47 ASP H 1.0 1.8 5.0 855 776 A 45 ALA H A 47 ASP H 1.0 1.8 6.0 856 777 A 45 ALA H A 48 LEU HD1% 1.0 1.8 5.0 857 778 A 45 ALA HA A 48 LEU HBy 1.0 1.8 5.0 858 779 A 45 ALA HA A 48 LEU HD1% 1.0 1.8 5.0 859 780 A 45 ALA HA A 48 LEU HBx 1.0 1.8 6.0 860 781 A 45 ALA HA A 48 LEU H 1.0 1.8 5.0 861 782 A 49 LEU HG A 45 ALA HA 1.0 1.8 5.0 862 783 A 49 LEU HD1% A 45 ALA HB% 1.0 1.8 5.0 863 784 A 49 LEU HD1% A 45 ALA HA 1.0 1.8 5.0 864 785 A 45 ALA HA A 49 LEU H 1.0 1.8 5.0 865 786 A 59 ALA HB% A 45 ALA HA 1.0 1.8 5.0 866 787 A 46 ARG HA A 46 ARG HGx 1.0 1.8 5.0 867 788 A 46 ARG HA A 46 ARG HDx 1.0 1.8 5.0 868 789 A 46 ARG HBx A 46 ARG HDx 1.0 1.8 5.0 869 790 A 46 ARG HBx A 46 ARG HDy 1.0 1.8 5.0 870 791 A 46 ARG HBy A 46 ARG HDy 1.0 1.8 5.0 871 792 A 46 ARG HA A 46 ARG HGy 1.0 1.8 5.0 872 793 A 46 ARG HBx A 46 ARG H 1.0 1.8 3.5 873 794 A 46 ARG HBy A 46 ARG H 1.0 1.8 3.5 874 795 A 46 ARG H A 46 ARG HDy 1.0 1.8 5.0 875 796 A 46 ARG HBy A 47 ASP H 1.0 1.8 5.0 876 797 A 47 ASP H A 46 ARG HDx 1.0 1.8 5.0 877 798 A 47 ASP H A 46 ARG HDy 1.0 1.8 5.0 878 799 A 46 ARG HBx A 47 ASP H 1.0 1.8 3.5 879 800 A 46 ARG HGy A 47 ASP H 1.0 1.8 5.0 880 801 A 46 ARG H A 47 ASP H 1.0 1.8 3.5 881 802 A 48 LEU H A 46 ARG HDx 1.0 1.8 5.0 882 803 A 46 ARG HA A 48 LEU H 1.0 1.8 5.0 883 804 A 46 ARG HBy A 49 LEU HBy 1.0 1.8 5.0 884 805 A 46 ARG HA A 49 LEU HBy 1.0 1.8 5.0 885 806 A 49 LEU HD1% A 46 ARG HA 1.0 1.8 5.0 886 807 A 46 ARG HGy A 49 LEU H 1.0 1.8 6.0 887 808 A 46 ARG H A 49 LEU H 1.0 1.8 5.0 888 809 A 46 ARG HA A 49 LEU H 1.0 1.8 5.0 889 810 A 46 ARG HGy A 50 GLU HGy 1.0 1.8 6.0 890 811 A 46 ARG HGy A 50 GLU HGx 1.0 1.8 6.0 891 812 A 46 ARG HA A 50 GLU H 1.0 1.8 5.0 892 813 A 54 TRP HZ2 A 46 ARG HA 1.0 1.8 5.0 893 814 A 54 TRP HZ2 A 46 ARG HBx 1.0 1.8 6.0 894 815 A 54 TRP HZ2 A 46 ARG HGx 1.0 1.8 6.0 895 816 A 47 ASP H A 47 ASP HBy 1.0 1.8 3.5 896 817 A 47 ASP H A 47 ASP HBx 1.0 1.8 3.5 897 818 A 47 ASP H A 48 LEU HA 1.0 1.8 6.0 898 819 A 48 LEU HG A 47 ASP HA 1.0 1.8 6.0 899 820 A 48 LEU HD1% A 47 ASP HBx 1.0 1.8 5.0 900 821 A 47 ASP H A 48 LEU HD1% 1.0 1.8 6.0 901 822 A 47 ASP H A 48 LEU HBy 1.0 1.8 6.0 902 823 A 47 ASP H A 48 LEU HG 1.0 1.8 6.0 903 824 A 47 ASP H A 48 LEU H 1.0 1.8 3.5 904 825 A 47 ASP HBy A 48 LEU H 1.0 1.8 5.0 905 826 A 47 ASP HBx A 48 LEU H 1.0 1.8 3.5 906 827 A 49 LEU H A 47 ASP HA 1.0 1.8 6.0 907 828 A 47 ASP H A 49 LEU H 1.0 1.8 5.0 908 829 A 47 ASP HA A 50 GLU HBy 1.0 1.8 5.0 909 830 A 47 ASP HA A 50 GLU HBx 1.0 1.8 5.0 910 831 A 50 GLU HGx A 47 ASP HA 1.0 1.8 5.0 911 832 A 47 ASP H A 50 GLU H 1.0 1.8 6.0 912 833 A 50 GLU H A 47 ASP HA 1.0 1.8 5.0 913 834 A 47 ASP HA A 51 GLY H 1.0 1.8 6.0 914 835 A 48 LEU HD1% A 48 LEU HA 1.0 1.8 5.0 915 836 A 48 LEU HG A 48 LEU HA 1.0 1.8 5.0 916 837 A 48 LEU HD1% A 48 LEU HBy 1.0 1.8 3.5 917 838 A 48 LEU HD1% A 48 LEU HBx 1.0 1.8 3.5 918 839 A 48 LEU HD2% A 48 LEU HA 1.0 1.8 3.5 919 840 A 48 LEU HD2% A 48 LEU HBx 1.0 1.8 3.5 920 841 A 48 LEU HD2% A 48 LEU HBy 1.0 1.8 5.0 921 842 A 48 LEU H A 48 LEU HBx 1.0 1.8 5.0 922 843 A 48 LEU HBy A 48 LEU H 1.0 1.8 3.5 923 844 A 48 LEU HD1% A 48 LEU H 1.0 1.8 5.0 924 845 A 48 LEU HD2% A 48 LEU H 1.0 1.8 5.0 925 846 A 48 LEU H A 48 LEU HG 1.0 1.8 3.5 926 847 A 49 LEU HD1% A 48 LEU H 1.0 1.8 6.0 927 848 A 49 LEU H A 48 LEU HD2% 1.0 1.8 5.0 928 849 A 49 LEU H A 48 LEU HD1% 1.0 1.8 5.0 929 850 A 49 LEU H A 48 LEU H 1.0 1.8 3.5 930 851 A 49 LEU H A 48 LEU HBx 1.0 1.8 5.0 931 852 A 49 LEU H A 48 LEU HBy 1.0 1.8 3.5 932 853 A 49 LEU H A 48 LEU HG 1.0 1.8 5.0 933 854 A 48 LEU H A 50 GLU H 1.0 1.8 5.0 934 855 A 48 LEU HA A 51 GLY HAx 1.0 1.8 5.0 935 856 A 48 LEU H A 51 GLY H 1.0 1.8 6.0 936 857 A 48 LEU HA A 51 GLY H 1.0 1.8 5.0 937 858 A 48 LEU HBx A 52 LYS HEy 1.0 1.8 6.0 938 859 A 48 LEU HBx A 52 LYS HEx 1.0 1.8 6.0 939 860 A 48 LEU HBx A 52 LYS HGy 1.0 1.8 5.0 940 861 A 48 LEU HBx A 52 LYS H 1.0 1.8 6.0 941 862 A 48 LEU HA A 52 LYS H 1.0 1.8 6.0 942 863 A 48 LEU HBx A 52 LYS HDx 1.0 1.8 6.0 943 863 A 48 LEU HBx A 52 LYS HDy 1.0 1.8 6.0 944 864 A 48 LEU HD2% A 59 ALA HA 1.0 1.8 6.0 945 865 A 48 LEU HBy A 59 ALA HA 1.0 1.8 5.0 946 866 A 59 ALA HB% A 48 LEU H 1.0 1.8 6.0 947 867 A 59 ALA HB% A 48 LEU HBy 1.0 1.8 5.0 948 868 A 59 ALA HB% A 48 LEU HD1% 1.0 1.8 5.0 949 869 A 48 LEU HD1% A 62 ASP HBx 1.0 1.8 5.0 950 870 A 48 LEU HD2% A 62 ASP HBx 1.0 1.8 5.0 951 871 A 48 LEU HD2% A 62 ASP HBy 1.0 1.8 6.0 952 872 A 48 LEU HBx A 62 ASP HBx 1.0 1.8 6.0 953 873 A 48 LEU HBx A 62 ASP HBy 1.0 1.8 6.0 954 874 A 48 LEU HD1% A 63 TYR HBy 1.0 1.8 5.0 955 875 A 48 LEU HD1% A 63 TYR HE% 1.0 1.8 5.0 956 876 A 48 LEU HD2% A 63 TYR HD% 1.0 1.8 5.0 957 877 A 48 LEU HD2% A 63 TYR HE% 1.0 1.8 6.0 958 878 A 48 LEU HD1% A 63 TYR HA 1.0 1.8 5.0 959 879 A 48 LEU HD1% A 63 TYR HBx 1.0 1.8 5.0 960 880 A 48 LEU HD2% A 63 TYR HBy 1.0 1.8 6.0 961 881 A 48 LEU HBy A 63 TYR HBy 1.0 1.8 6.0 962 882 A 48 LEU HD1% A 63 TYR HD% 1.0 1.8 3.5 963 883 A 48 LEU HD1% A 63 TYR H 1.0 1.8 5.0 964 884 A 48 LEU HD2% A 63 TYR H 1.0 1.8 5.0 965 885 A 49 LEU HG A 49 LEU HA 1.0 1.8 5.0 966 886 A 49 LEU HD1% A 49 LEU HA 1.0 1.8 5.0 967 887 A 49 LEU HD1% A 49 LEU HBx 1.0 1.8 5.0 968 888 A 49 LEU HD1% A 49 LEU HBy 1.0 1.8 5.0 969 889 A 49 LEU HD2% A 49 LEU HA 1.0 1.8 3.5 970 890 A 49 LEU HD2% A 49 LEU HBx 1.0 1.8 5.0 971 891 A 49 LEU H A 49 LEU HBx 1.0 1.8 5.0 972 892 A 49 LEU H A 49 LEU HBy 1.0 1.8 3.5 973 893 A 49 LEU HD1% A 49 LEU H 1.0 1.8 5.0 974 894 A 49 LEU HD2% A 49 LEU H 1.0 1.8 5.0 975 895 A 49 LEU HG A 49 LEU H 1.0 1.8 3.5 976 896 A 49 LEU HD2% A 50 GLU H 1.0 1.8 6.0 977 897 A 49 LEU H A 50 GLU H 1.0 1.8 3.5 978 898 A 50 GLU H A 49 LEU HBx 1.0 1.8 5.0 979 899 A 49 LEU HBy A 50 GLU H 1.0 1.8 5.0 980 900 A 49 LEU HD1% A 50 GLU H 1.0 1.8 5.0 981 901 A 51 GLY H A 49 LEU HA 1.0 1.8 6.0 982 902 A 49 LEU H A 51 GLY H 1.0 1.8 5.0 983 903 A 49 LEU HA A 52 LYS HBy 1.0 1.8 5.0 984 904 A 49 LEU HD2% A 52 LYS H 1.0 1.8 6.0 985 905 A 52 LYS H A 49 LEU HA 1.0 1.8 5.0 986 906 A 54 TRP HA A 49 LEU HD1% 1.0 1.8 5.0 987 907 A 54 TRP HZ3 A 49 LEU HD1% 1.0 1.8 5.0 988 908 A 54 TRP HH2 A 49 LEU HD1% 1.0 1.8 5.0 989 909 A 49 LEU HD2% A 54 TRP HA 1.0 1.8 5.0 990 910 A 49 LEU HD2% A 54 TRP HBy 1.0 1.8 5.0 991 911 A 49 LEU HD2% A 54 TRP HE3 1.0 1.8 5.0 992 912 A 54 TRP HA A 49 LEU HBx 1.0 1.8 5.0 993 913 A 54 TRP HE3 A 49 LEU HD1% 1.0 1.8 5.0 994 914 A 49 LEU HD2% A 54 TRP HZ3 1.0 1.8 5.0 995 915 A 54 TRP HE3 A 49 LEU HBx 1.0 1.8 5.0 996 916 A 54 TRP HE3 A 49 LEU HBy 1.0 1.8 6.0 997 917 A 54 TRP HA A 49 LEU H 1.0 1.8 6.0 998 918 A 49 LEU HD2% A 54 TRP H 1.0 1.8 5.0 999 919 A 49 LEU HBy A 54 TRP H 1.0 1.8 6.0 1000 920 A 49 LEU HA A 54 TRP H 1.0 1.8 5.0 1001 921 A 49 LEU HD2% A 55 ASP H 1.0 1.8 5.0 1002 922 A 49 LEU HD2% A 55 ASP HA 1.0 1.8 5.0 1003 923 A 55 ASP H A 49 LEU HBx 1.0 1.8 6.0 1004 924 A 49 LEU HD1% A 56 LEU HA 1.0 1.8 5.0 1005 925 A 49 LEU HD2% A 56 LEU HBy 1.0 1.8 5.0 1006 926 A 49 LEU HD2% A 56 LEU HA 1.0 1.8 3.5 1007 927 A 49 LEU HD2% A 56 LEU HD1% 1.0 1.8 5.0 1008 928 A 56 LEU HD1% A 49 LEU HD1% 1.0 1.8 5.0 1009 929 A 49 LEU HD2% A 56 LEU H 1.0 1.8 5.0 1010 930 A 49 LEU HD2% A 59 ALA HB% 1.0 1.8 3.5 1011 931 A 49 LEU HD1% A 59 ALA HB% 1.0 1.8 5.0 1012 932 A 49 LEU HG A 59 ALA HB% 1.0 1.8 5.0 1013 933 A 59 ALA HB% A 49 LEU HBy 1.0 1.8 5.0 1014 934 A 59 ALA HB% A 49 LEU HA 1.0 1.8 5.0 1015 935 A 49 LEU HD2% A 59 ALA HA 1.0 1.8 5.0 1016 936 A 49 LEU HD2% A 59 ALA H 1.0 1.8 5.0 1017 937 A 59 ALA HB% A 49 LEU H 1.0 1.8 5.0 1018 938 A 50 GLU HGy A 50 GLU HA 1.0 1.8 5.0 1019 939 A 50 GLU HGx A 50 GLU HA 1.0 1.8 5.0 1020 940 A 50 GLU H A 50 GLU HBx 1.0 1.8 5.0 1021 941 A 50 GLU H A 50 GLU HBy 1.0 1.8 3.5 1022 942 A 50 GLU HGy A 50 GLU H 1.0 1.8 5.0 1023 943 A 50 GLU HGx A 50 GLU H 1.0 1.8 5.0 1024 944 A 50 GLU HBx A 51 GLY HAy 1.0 1.8 6.0 1025 945 A 50 GLU HGy A 51 GLY H 1.0 1.8 6.0 1026 946 A 50 GLU HGx A 51 GLY H 1.0 1.8 6.0 1027 947 A 50 GLU H A 51 GLY H 1.0 1.8 3.5 1028 948 A 50 GLU HBx A 51 GLY H 1.0 1.8 5.0 1029 949 A 50 GLU HBy A 51 GLY H 1.0 1.8 5.0 1030 950 A 52 LYS H A 50 GLU HA 1.0 1.8 5.0 1031 951 A 50 GLU H A 52 LYS H 1.0 1.8 5.0 1032 952 A 50 GLU HA A 53 ASN HA 1.0 1.8 5.0 1033 953 A 50 GLU HA A 53 ASN H 1.0 1.8 5.0 1034 954 A 54 TRP HZ2 A 50 GLU HGx 1.0 1.8 5.0 1035 955 A 54 TRP HD1 A 50 GLU HA 1.0 1.8 5.0 1036 956 A 54 TRP HZ2 A 50 GLU HGy 1.0 1.8 5.0 1037 957 A 50 GLU H A 54 TRP H 1.0 1.8 5.0 1038 958 A 54 TRP HZ2 A 50 GLU H 1.0 1.8 6.0 1039 959 A 54 TRP HE1 A 50 GLU HBx 1.0 1.8 6.0 1040 960 A 54 TRP HE1 A 50 GLU HGy 1.0 1.8 5.0 1041 961 A 54 TRP HE1 A 50 GLU HGx 1.0 1.8 5.0 1042 962 A 54 TRP HE1 A 50 GLU H 1.0 1.8 6.0 1043 963 A 54 TRP HE1 A 50 GLU HA 1.0 1.8 5.0 1044 964 A 54 TRP H A 50 GLU HA 1.0 1.8 5.0 1045 965 A 51 GLY HAx A 52 LYS HGy 1.0 1.8 5.0 1046 966 A 51 GLY HAx A 52 LYS HEy 1.0 1.8 6.0 1047 967 A 51 GLY HAx A 52 LYS HEx 1.0 1.8 6.0 1048 968 A 51 GLY H A 52 LYS H 1.0 1.8 3.5 1049 969 A 51 GLY H A 53 ASN H 1.0 1.8 5.0 1050 970 A 51 GLY HAx A 53 ASN H 1.0 1.8 5.0 1051 971 A 51 GLY HAy A 53 ASN H 1.0 1.8 5.0 1052 972 A 52 LYS HA A 52 LYS HEy 1.0 1.8 6.0 1053 973 A 52 LYS HGy A 52 LYS HA 1.0 1.8 5.0 1054 974 A 52 LYS HA A 52 LYS HDx 1.0 1.8 5.0 1055 975 A 52 LYS HDy A 52 LYS HA 1.0 1.8 5.0 1056 976 A 52 LYS H A 52 LYS HDx 1.0 1.8 6.0 1057 977 A 52 LYS HA A 52 LYS HEx 1.0 1.8 6.0 1058 978 A 52 LYS HGx A 52 LYS HEy 1.0 1.8 5.0 1059 979 A 52 LYS HGy A 52 LYS HEx 1.0 1.8 5.0 1060 980 A 52 LYS HGy A 52 LYS HEy 1.0 1.8 5.0 1061 981 A 52 LYS HGx A 52 LYS HEx 1.0 1.8 5.0 1062 982 A 52 LYS H A 52 LYS HBy 1.0 1.8 3.5 1063 983 A 52 LYS H A 52 LYS HBx 1.0 1.8 5.0 1064 984 A 52 LYS H A 52 LYS HDy 1.0 1.8 6.0 1065 985 A 52 LYS H A 52 LYS HGx 1.0 1.8 5.0 1066 986 A 52 LYS HGy A 52 LYS H 1.0 1.8 3.5 1067 987 A 52 LYS H A 52 LYS HDx 1.0 1.8 5.0 1068 987 A 52 LYS H A 52 LYS HDy 1.0 1.8 5.0 1069 988 A 52 LYS HA A 52 LYS HDx 1.0 1.8 3.5 1070 988 A 52 LYS HDy A 52 LYS HA 1.0 1.8 3.5 1071 989 A 52 LYS HA A 52 LYS HEx 1.0 1.8 5.0 1072 989 A 52 LYS HA A 52 LYS HEy 1.0 1.8 5.0 1073 990 A 52 LYS HBy A 53 ASN H 1.0 1.8 5.0 1074 991 A 52 LYS H A 53 ASN HA 1.0 1.8 5.0 1075 992 A 53 ASN H A 52 LYS HBx 1.0 1.8 6.0 1076 993 A 52 LYS HGy A 53 ASN H 1.0 1.8 5.0 1077 994 A 52 LYS H A 53 ASN H 1.0 1.8 3.5 1078 995 A 52 LYS HBy A 54 TRP H 1.0 1.8 6.0 1079 996 A 52 LYS H A 54 TRP H 1.0 1.8 5.0 1080 997 A 52 LYS HBx A 55 ASP HBx 1.0 1.8 5.0 1081 998 A 52 LYS HBx A 55 ASP HBy 1.0 1.8 5.0 1082 999 A 55 ASP H A 52 LYS HBx 1.0 1.8 5.0 1083 1000 A 55 ASP H A 52 LYS HBy 1.0 1.8 5.0 1084 1001 A 52 LYS HBy A 55 ASP HBx 1.0 1.8 5.0 1085 1001 A 52 LYS HBy A 55 ASP HBy 1.0 1.8 5.0 1086 1002 A 52 LYS HBx A 58 ALA HB% 1.0 1.8 5.0 1087 1003 A 52 LYS HA A 58 ALA HB% 1.0 1.8 5.0 1088 1004 A 52 LYS HGx A 58 ALA HB% 1.0 1.8 5.0 1089 1005 A 52 LYS HGx A 58 ALA H 1.0 1.8 6.0 1090 1006 A 58 ALA HB% A 52 LYS HDx 1.0 1.8 5.0 1091 1006 A 52 LYS HDy A 58 ALA HB% 1.0 1.8 5.0 1092 1007 A 58 ALA HB% A 52 LYS HEx 1.0 1.8 5.0 1093 1007 A 52 LYS HEy A 58 ALA HB% 1.0 1.8 5.0 1094 1008 A 59 ALA HB% A 52 LYS HGy 1.0 1.8 6.0 1095 1009 A 59 ALA HB% A 52 LYS HGx 1.0 1.8 5.0 1096 1010 A 59 ALA HA A 52 LYS HGx 1.0 1.8 5.0 1097 1011 A 52 LYS HGy A 59 ALA HA 1.0 1.8 5.0 1098 1012 A 59 ALA HB% A 52 LYS HBy 1.0 1.8 5.0 1099 1013 A 59 ALA HB% A 52 LYS HBx 1.0 1.8 6.0 1100 1014 A 59 ALA HA A 52 LYS HBy 1.0 1.8 5.0 1101 1015 A 59 ALA HA A 52 LYS HEy 1.0 1.8 6.0 1102 1016 A 59 ALA HA A 52 LYS HEx 1.0 1.8 6.0 1103 1017 A 59 ALA HB% A 52 LYS H 1.0 1.8 6.0 1104 1018 A 59 ALA H A 52 LYS HGx 1.0 1.8 5.0 1105 1019 A 59 ALA H A 52 LYS HBy 1.0 1.8 5.0 1106 1020 A 59 ALA H A 52 LYS HDx 1.0 1.8 6.0 1107 1020 A 59 ALA H A 52 LYS HDy 1.0 1.8 6.0 1108 1021 A 59 ALA HA A 52 LYS HDx 1.0 1.8 6.0 1109 1021 A 52 LYS HDy A 59 ALA HA 1.0 1.8 6.0 1110 1022 A 59 ALA HB% A 52 LYS HEx 1.0 1.8 6.0 1111 1022 A 59 ALA HB% A 52 LYS HEy 1.0 1.8 6.0 1112 1023 A 62 ASP HBy A 52 LYS HGx 1.0 1.8 5.0 1113 1024 A 62 ASP HBx A 52 LYS HGx 1.0 1.8 5.0 1114 1025 A 53 ASN HA A 53 ASN H 1.0 1.8 2.7 1115 1026 A 53 ASN H A 53 ASN HBx 1.0 1.8 5.0 1116 1027 A 53 ASN H A 53 ASN HBy 1.0 1.8 5.0 1117 1028 A 53 ASN H A 53 ASN HBx 1.0 1.8 5.0 1118 1028 A 53 ASN H A 53 ASN HBy 1.0 1.8 5.0 1119 1029 A 54 TRP H A 53 ASN H 1.0 1.8 3.5 1120 1030 A 55 ASP H A 53 ASN H 1.0 1.8 5.0 1121 1031 A 55 ASP H A 53 ASN HA 1.0 1.8 5.0 1122 1032 A 54 TRP HD1 A 54 TRP H 1.0 1.8 5.0 1123 1033 A 54 TRP HA A 54 TRP HE3 1.0 1.8 5.0 1124 1034 A 54 TRP HBy A 54 TRP HD1 1.0 1.8 5.0 1125 1035 A 54 TRP HBx A 54 TRP HE3 1.0 1.8 3.5 1126 1036 A 54 TRP HBy A 54 TRP H 1.0 1.8 5.0 1127 1037 A 54 TRP HA A 55 ASP H 1.0 1.8 3.5 1128 1038 A 54 TRP HBy A 55 ASP H 1.0 1.8 5.0 1129 1039 A 54 TRP HBx A 55 ASP H 1.0 1.8 5.0 1130 1040 A 54 TRP HE3 A 55 ASP H 1.0 1.8 6.0 1131 1041 A 55 ASP H A 54 TRP H 1.0 1.8 5.0 1132 1042 A 54 TRP HA A 59 ALA HB% 1.0 1.8 6.0 1133 1043 A 55 ASP H A 55 ASP HBx 1.0 1.8 5.0 1134 1044 A 55 ASP H A 55 ASP HBy 1.0 1.8 5.0 1135 1045 A 55 ASP H A 55 ASP HBx 1.0 1.8 3.5 1136 1045 A 55 ASP H A 55 ASP HBy 1.0 1.8 3.5 1137 1046 A 55 ASP H A 56 LEU H 1.0 1.8 5.0 1138 1047 A 56 LEU H A 55 ASP HA 1.0 1.8 3.5 1139 1048 A 56 LEU H A 55 ASP HBx 1.0 1.8 6.0 1140 1049 A 56 LEU H A 55 ASP HBy 1.0 1.8 6.0 1141 1050 A 56 LEU H A 55 ASP HBx 1.0 1.8 5.0 1142 1050 A 56 LEU H A 55 ASP HBy 1.0 1.8 5.0 1143 1051 A 55 ASP HA A 57 THR H 1.0 1.8 5.0 1144 1052 A 58 ALA HB% A 55 ASP HBx 1.0 1.8 5.0 1145 1053 A 55 ASP HBy A 58 ALA HB% 1.0 1.8 5.0 1146 1054 A 55 ASP HA A 58 ALA HB% 1.0 1.8 6.0 1147 1055 A 55 ASP H A 58 ALA HB% 1.0 1.8 5.0 1148 1056 A 55 ASP HA A 58 ALA H 1.0 1.8 5.0 1149 1057 A 58 ALA H A 55 ASP HBx 1.0 1.8 5.0 1150 1057 A 55 ASP HBy A 58 ALA H 1.0 1.8 5.0 1151 1058 A 58 ALA HB% A 55 ASP HBx 1.0 1.8 3.5 1152 1058 A 55 ASP HBy A 58 ALA HB% 1.0 1.8 3.5 1153 1059 A 55 ASP H A 59 ALA HB% 1.0 1.8 5.0 1154 1060 A 55 ASP H A 59 ALA H 1.0 1.8 6.0 1155 1061 A 59 ALA H A 55 ASP HBx 1.0 1.8 5.0 1156 1061 A 59 ALA H A 55 ASP HBy 1.0 1.8 5.0 1157 1062 A 56 LEU HD1% A 56 LEU HA 1.0 1.8 3.5 1158 1063 A 56 LEU HD2% A 56 LEU HA 1.0 1.8 5.0 1159 1064 A 56 LEU HD2% A 56 LEU HBx 1.0 1.8 3.5 1160 1065 A 56 LEU HBy A 56 LEU HD2% 1.0 1.8 5.0 1161 1066 A 56 LEU HD1% A 56 LEU HBx 1.0 1.8 5.0 1162 1067 A 56 LEU HBy A 56 LEU HD1% 1.0 1.8 3.5 1163 1068 A 56 LEU H A 56 LEU HD1% 1.0 1.8 5.0 1164 1069 A 56 LEU HA A 56 LEU HG 1.0 1.8 5.0 1165 1070 A 56 LEU H A 56 LEU HG 1.0 1.8 6.0 1166 1071 A 56 LEU HBy A 56 LEU H 1.0 1.8 3.5 1167 1072 A 56 LEU H A 56 LEU HBx 1.0 1.8 3.5 1168 1073 A 56 LEU H A 56 LEU HD2% 1.0 1.8 5.0 1169 1074 A 56 LEU HG A 57 THR HA 1.0 1.8 5.0 1170 1075 A 56 LEU HBx A 57 THR HB 1.0 1.8 6.0 1171 1076 A 56 LEU HD2% A 57 THR HG2% 1.0 1.8 5.0 1172 1077 A 56 LEU HG A 57 THR HG2% 1.0 1.8 5.0 1173 1078 A 56 LEU HBy A 57 THR H 1.0 1.8 5.0 1174 1079 A 56 LEU HD2% A 57 THR H 1.0 1.8 5.0 1175 1080 A 56 LEU HBx A 57 THR H 1.0 1.8 3.5 1176 1081 A 57 THR H A 56 LEU HG 1.0 1.8 5.0 1177 1082 A 56 LEU H A 57 THR H 1.0 1.8 3.5 1178 1083 A 56 LEU HG A 58 ALA H 1.0 1.8 6.0 1179 1084 A 56 LEU HBx A 58 ALA H 1.0 1.8 6.0 1180 1085 A 56 LEU HA A 59 ALA HB% 1.0 1.8 3.5 1181 1086 A 56 LEU HD1% A 59 ALA HB% 1.0 1.8 5.0 1182 1087 A 56 LEU H A 59 ALA HB% 1.0 1.8 5.0 1183 1088 A 59 ALA H A 56 LEU HG 1.0 1.8 6.0 1184 1089 A 56 LEU HA A 59 ALA H 1.0 1.8 5.0 1185 1090 A 56 LEU HD2% A 60 LEU HD2% 1.0 1.8 5.0 1186 1091 A 56 LEU HD1% A 60 LEU HD2% 1.0 1.8 5.0 1187 1092 A 56 LEU HD1% A 60 LEU HD1% 1.0 1.8 3.5 1188 1093 A 56 LEU HD1% A 60 LEU HBx 1.0 1.8 6.0 1189 1094 A 56 LEU HD1% A 60 LEU HG 1.0 1.8 3.5 1190 1095 A 56 LEU HG A 60 LEU HD2% 1.0 1.8 5.0 1191 1096 A 56 LEU HBy A 60 LEU HD1% 1.0 1.8 5.0 1192 1097 A 56 LEU HBx A 60 LEU HD1% 1.0 1.8 5.0 1193 1098 A 56 LEU HD2% A 60 LEU HD1% 1.0 1.8 3.5 1194 1099 A 60 LEU HD1% A 56 LEU HG 1.0 1.8 3.5 1195 1100 A 56 LEU HD2% A 60 LEU H 1.0 1.8 6.0 1196 1101 A 56 LEU HD1% A 60 LEU H 1.0 1.8 5.0 1197 1102 A 60 LEU H A 56 LEU HG 1.0 1.8 5.0 1198 1103 A 56 LEU HA A 60 LEU H 1.0 1.8 5.0 1199 1104 A 57 THR HA A 57 THR HG2% 1.0 1.8 3.5 1200 1105 A 57 THR H A 57 THR HB 1.0 1.8 3.5 1201 1106 A 57 THR H A 57 THR HG2% 1.0 1.8 5.0 1202 1107 A 58 ALA HB% A 57 THR HB 1.0 1.8 5.0 1203 1108 A 58 ALA HB% A 57 THR HG2% 1.0 1.8 5.0 1204 1109 A 57 THR HG2% A 58 ALA HA 1.0 1.8 5.0 1205 1110 A 57 THR H A 58 ALA HB% 1.0 1.8 5.0 1206 1111 A 57 THR H A 58 ALA HA 1.0 1.8 6.0 1207 1112 A 58 ALA H A 57 THR HB 1.0 1.8 3.5 1208 1113 A 58 ALA H A 57 THR HG2% 1.0 1.8 5.0 1209 1114 A 57 THR H A 59 ALA HB% 1.0 1.8 6.0 1210 1115 A 60 LEU HD1% A 57 THR HB 1.0 1.8 6.0 1211 1116 A 60 LEU HBy A 57 THR HG2% 1.0 1.8 5.0 1212 1117 A 60 LEU HD1% A 57 THR HG2% 1.0 1.8 5.0 1213 1118 A 57 THR HA A 60 LEU HBx 1.0 1.8 5.0 1214 1119 A 60 LEU HBy A 57 THR HA 1.0 1.8 5.0 1215 1120 A 60 LEU HD1% A 57 THR HA 1.0 1.8 5.0 1216 1121 A 57 THR H A 60 LEU HD1% 1.0 1.8 5.0 1217 1122 A 60 LEU H A 57 THR HA 1.0 1.8 5.0 1218 1123 A 57 THR H A 60 LEU H 1.0 1.8 6.0 1219 1124 A 57 THR HG2% A 61 SER H 1.0 1.8 5.0 1220 1125 A 57 THR HA A 61 SER H 1.0 1.8 5.0 1221 1126 A 57 THR HG2% A 61 SER HBy 1.0 1.8 5.0 1222 1126 A 57 THR HG2% A 61 SER HBx 1.0 1.8 5.0 1223 1127 A 58 ALA HB% A 58 ALA H 1.0 1.8 3.5 1224 1128 A 59 ALA HB% A 58 ALA HB% 1.0 1.8 5.0 1225 1129 A 59 ALA HA A 58 ALA HB% 1.0 1.8 5.0 1226 1130 A 59 ALA HA A 58 ALA HA 1.0 1.8 5.0 1227 1131 A 59 ALA HB% A 58 ALA H 1.0 1.8 6.0 1228 1132 A 59 ALA HA A 58 ALA H 1.0 1.8 6.0 1229 1133 A 59 ALA H A 58 ALA H 1.0 1.8 3.5 1230 1134 A 59 ALA H A 58 ALA HB% 1.0 1.8 3.5 1231 1135 A 60 LEU H A 58 ALA HB% 1.0 1.8 5.0 1232 1136 A 60 LEU HBy A 58 ALA H 1.0 1.8 6.0 1233 1137 A 60 LEU H A 58 ALA HA 1.0 1.8 5.0 1234 1138 A 60 LEU H A 58 ALA H 1.0 1.8 5.0 1235 1139 A 58 ALA HB% A 61 SER H 1.0 1.8 6.0 1236 1140 A 58 ALA H A 61 SER H 1.0 1.8 6.0 1237 1141 A 58 ALA HA A 61 SER H 1.0 1.8 5.0 1238 1142 A 58 ALA H A 61 SER HBy 1.0 1.8 5.0 1239 1142 A 58 ALA H A 61 SER HBx 1.0 1.8 5.0 1240 1143 A 58 ALA HA A 61 SER HBy 1.0 1.8 3.5 1241 1143 A 58 ALA HA A 61 SER HBx 1.0 1.8 3.5 1242 1144 A 58 ALA HB% A 61 SER HBy 1.0 1.8 5.0 1243 1144 A 58 ALA HB% A 61 SER HBx 1.0 1.8 5.0 1244 1145 A 62 ASP HBy A 58 ALA HB% 1.0 1.8 6.0 1245 1146 A 62 ASP HBy A 58 ALA HA 1.0 1.8 5.0 1246 1147 A 58 ALA HB% A 62 ASP H 1.0 1.8 5.0 1247 1148 A 58 ALA HA A 62 ASP H 1.0 1.8 5.0 1248 1149 A 59 ALA HB% A 59 ALA H 1.0 1.8 3.5 1249 1150 A 59 ALA HB% A 60 LEU HD1% 1.0 1.8 6.0 1250 1151 A 59 ALA HB% A 60 LEU HA 1.0 1.8 5.0 1251 1152 A 59 ALA HB% A 60 LEU HG 1.0 1.8 5.0 1252 1153 A 59 ALA H A 60 LEU HA 1.0 1.8 6.0 1253 1154 A 59 ALA H A 60 LEU HBy 1.0 1.8 6.0 1254 1155 A 59 ALA HB% A 60 LEU H 1.0 1.8 3.5 1255 1156 A 59 ALA H A 60 LEU H 1.0 1.8 3.5 1256 1157 A 59 ALA HA A 61 SER H 1.0 1.8 5.0 1257 1158 A 59 ALA HB% A 61 SER H 1.0 1.8 6.0 1258 1159 A 59 ALA H A 61 SER H 1.0 1.8 5.0 1259 1160 A 59 ALA H A 61 SER HBy 1.0 1.8 6.0 1260 1160 A 59 ALA H A 61 SER HBx 1.0 1.8 6.0 1261 1161 A 59 ALA HA A 62 ASP HBx 1.0 1.8 5.0 1262 1162 A 59 ALA HA A 62 ASP HBy 1.0 1.8 5.0 1263 1163 A 59 ALA HB% A 62 ASP HBy 1.0 1.8 6.0 1264 1164 A 59 ALA H A 62 ASP H 1.0 1.8 5.0 1265 1165 A 59 ALA HA A 62 ASP H 1.0 1.8 5.0 1266 1166 A 63 TYR HBy A 59 ALA HA 1.0 1.8 6.0 1267 1167 A 59 ALA HB% A 63 TYR H 1.0 1.8 5.0 1268 1168 A 63 TYR H A 59 ALA HA 1.0 1.8 5.0 1269 1169 A 60 LEU HD1% A 60 LEU HA 1.0 1.8 5.0 1270 1170 A 60 LEU HA A 60 LEU HG 1.0 1.8 5.0 1271 1171 A 60 LEU HD1% A 60 LEU HBx 1.0 1.8 3.5 1272 1172 A 60 LEU HD1% A 60 LEU HBy 1.0 1.8 3.5 1273 1173 A 60 LEU HD2% A 60 LEU HA 1.0 1.8 3.5 1274 1174 A 60 LEU HD2% A 60 LEU HBx 1.0 1.8 3.5 1275 1175 A 60 LEU HD2% A 60 LEU HBy 1.0 1.8 5.0 1276 1176 A 60 LEU H A 60 LEU HBx 1.0 1.8 5.0 1277 1177 A 60 LEU H A 60 LEU HBy 1.0 1.8 3.5 1278 1178 A 60 LEU HD1% A 60 LEU H 1.0 1.8 5.0 1279 1179 A 60 LEU H A 60 LEU HD2% 1.0 1.8 5.0 1280 1180 A 60 LEU H A 60 LEU HG 1.0 1.8 3.5 1281 1181 A 60 LEU HD1% A 61 SER H 1.0 1.8 5.0 1282 1182 A 60 LEU HBx A 61 SER H 1.0 1.8 5.0 1283 1183 A 60 LEU HBy A 61 SER H 1.0 1.8 3.5 1284 1184 A 60 LEU HD2% A 61 SER H 1.0 1.8 6.0 1285 1185 A 60 LEU HG A 61 SER H 1.0 1.8 5.0 1286 1186 A 60 LEU H A 61 SER H 1.0 1.8 3.5 1287 1187 A 60 LEU H A 61 SER HBy 1.0 1.8 5.0 1288 1187 A 60 LEU H A 61 SER HBx 1.0 1.8 5.0 1289 1188 A 60 LEU HBy A 62 ASP H 1.0 1.8 6.0 1290 1189 A 60 LEU H A 62 ASP H 1.0 1.8 5.0 1291 1190 A 60 LEU HD2% A 63 TYR HD% 1.0 1.8 6.0 1292 1191 A 60 LEU HA A 63 TYR H 1.0 1.8 5.0 1293 1192 A 60 LEU HA A 63 TYR HBy 1.0 1.8 5.0 1294 1193 A 60 LEU HA A 63 TYR HBx 1.0 1.8 5.0 1295 1194 A 60 LEU HA A 63 TYR HD% 1.0 1.8 5.0 1296 1195 A 60 LEU HD2% A 63 TYR HBy 1.0 1.8 6.0 1297 1196 A 60 LEU HD2% A 63 TYR HBx 1.0 1.8 5.0 1298 1197 A 60 LEU H A 63 TYR HBx 1.0 1.8 6.0 1299 1198 A 60 LEU H A 63 TYR H 1.0 1.8 6.0 1300 1199 A 60 LEU HD2% A 64 GLU H 1.0 1.8 6.0 1301 1200 A 60 LEU HA A 64 GLU H 1.0 1.8 5.0 1302 1201 A 60 LEU HBx A 64 GLU H 1.0 1.8 6.0 1303 1202 A 61 SER H A 61 SER HBy 1.0 1.8 3.5 1304 1202 A 61 SER H A 61 SER HBx 1.0 1.8 3.5 1305 1203 A 62 ASP HBy A 61 SER H 1.0 1.8 6.0 1306 1204 A 61 SER H A 62 ASP H 1.0 1.8 3.5 1307 1205 A 62 ASP H A 61 SER HBy 1.0 1.8 3.5 1308 1205 A 61 SER HBx A 62 ASP H 1.0 1.8 3.5 1309 1206 A 63 TYR HBx A 61 SER H 1.0 1.8 6.0 1310 1207 A 63 TYR H A 61 SER HA 1.0 1.8 6.0 1311 1208 A 63 TYR H A 61 SER H 1.0 1.8 5.0 1312 1209 A 61 SER HA A 64 GLU HBx 1.0 1.8 5.0 1313 1210 A 61 SER HA A 64 GLU HGy 1.0 1.8 5.0 1314 1211 A 61 SER HA A 64 GLU HBy 1.0 1.8 5.0 1315 1212 A 61 SER HA A 64 GLU HGx 1.0 1.8 5.0 1316 1213 A 64 GLU H A 61 SER HA 1.0 1.8 5.0 1317 1214 A 61 SER H A 64 GLU HGy 1.0 1.8 5.0 1318 1214 A 61 SER H A 64 GLU HGx 1.0 1.8 5.0 1319 1215 A 61 SER HA A 64 GLU HGy 1.0 1.8 5.0 1320 1215 A 61 SER HA A 64 GLU HGx 1.0 1.8 5.0 1321 1216 A 61 SER HA A 65 GLN H 1.0 1.8 5.0 1322 1217 A 61 SER HA A 65 GLN HBx 1.0 1.8 6.0 1323 1217 A 61 SER HA A 65 GLN HBy 1.0 1.8 6.0 1324 1218 A 62 ASP HBx A 62 ASP H 1.0 1.8 3.5 1325 1219 A 62 ASP HBy A 62 ASP H 1.0 1.8 3.5 1326 1220 A 63 TYR HA A 62 ASP HBx 1.0 1.8 5.0 1327 1221 A 63 TYR H A 62 ASP H 1.0 1.8 3.5 1328 1222 A 63 TYR H A 62 ASP HBx 1.0 1.8 5.0 1329 1223 A 63 TYR H A 62 ASP HBy 1.0 1.8 5.0 1330 1224 A 64 GLU H A 62 ASP HA 1.0 1.8 6.0 1331 1225 A 62 ASP H A 64 GLU H 1.0 1.8 5.0 1332 1226 A 62 ASP HA A 64 GLU HGy 1.0 1.8 6.0 1333 1226 A 64 GLU HGx A 62 ASP HA 1.0 1.8 6.0 1334 1227 A 62 ASP HA A 65 GLN HBx 1.0 1.8 5.0 1335 1228 A 65 GLN HBy A 62 ASP HA 1.0 1.8 5.0 1336 1229 A 62 ASP H A 65 GLN H 1.0 1.8 5.0 1337 1230 A 65 GLN H A 62 ASP HA 1.0 1.8 5.0 1338 1231 A 62 ASP HA A 65 GLN HBx 1.0 1.8 3.5 1339 1231 A 65 GLN HBy A 62 ASP HA 1.0 1.8 3.5 1340 1232 A 62 ASP HA A 65 GLN HGx 1.0 1.8 5.0 1341 1232 A 62 ASP HA A 65 GLN HGy 1.0 1.8 5.0 1342 1233 A 62 ASP HBx A 66 LEU HD2% 1.0 1.8 5.0 1343 1234 A 62 ASP HBy A 66 LEU HD2% 1.0 1.8 6.0 1344 1235 A 62 ASP HA A 66 LEU H 1.0 1.8 5.0 1345 1236 A 63 TYR HA A 63 TYR HE% 1.0 1.8 5.0 1346 1237 A 63 TYR HA A 63 TYR HD% 1.0 1.8 3.5 1347 1238 A 63 TYR HBx A 63 TYR H 1.0 1.8 3.5 1348 1239 A 63 TYR HBy A 63 TYR H 1.0 1.8 3.5 1349 1240 A 63 TYR HD% A 63 TYR H 1.0 1.8 5.0 1350 1241 A 63 TYR HBx A 64 GLU HA 1.0 1.8 5.0 1351 1242 A 63 TYR HD% A 64 GLU HA 1.0 1.8 5.0 1352 1243 A 63 TYR HD% A 64 GLU H 1.0 1.8 5.0 1353 1244 A 63 TYR H A 64 GLU H 1.0 1.8 3.5 1354 1245 A 63 TYR HBx A 64 GLU H 1.0 1.8 3.5 1355 1246 A 63 TYR HBy A 64 GLU H 1.0 1.8 5.0 1356 1247 A 63 TYR HE% A 64 GLU H 1.0 1.8 6.0 1357 1248 A 63 TYR H A 65 GLN H 1.0 1.8 5.0 1358 1249 A 63 TYR HBx A 66 LEU HD1% 1.0 1.8 6.0 1359 1250 A 63 TYR HBx A 66 LEU HD2% 1.0 1.8 6.0 1360 1251 A 63 TYR HBy A 66 LEU HD2% 1.0 1.8 6.0 1361 1252 A 63 TYR H A 66 LEU HD2% 1.0 1.8 5.0 1362 1253 A 63 TYR HA A 66 LEU H 1.0 1.8 5.0 1363 1254 A 63 TYR HA A 66 LEU HG 1.0 1.8 5.0 1364 1255 A 63 TYR HA A 66 LEU HD1% 1.0 1.8 5.0 1365 1256 A 63 TYR HA A 66 LEU HD2% 1.0 1.8 3.5 1366 1257 A 63 TYR HD% A 66 LEU HD1% 1.0 1.8 5.0 1367 1258 A 63 TYR HE% A 66 LEU HD1% 1.0 1.8 5.0 1368 1259 A 63 TYR HD% A 66 LEU HG 1.0 1.8 6.0 1369 1260 A 63 TYR HA A 67 ARG H 1.0 1.8 5.0 1370 1261 A 63 TYR HD% A 67 ARG HBx 1.0 1.8 6.0 1371 1262 A 63 TYR HE% A 67 ARG HDx 1.0 1.8 5.0 1372 1262 A 63 TYR HE% A 67 ARG HDy 1.0 1.8 5.0 1373 1263 A 63 TYR HD% A 67 ARG HBy 1.0 1.8 6.0 1374 1264 A 63 TYR HD% A 67 ARG HDx 1.0 1.8 5.0 1375 1264 A 63 TYR HD% A 67 ARG HDy 1.0 1.8 5.0 1376 1265 A 63 TYR HD% A 67 ARG HBx 1.0 1.8 5.0 1377 1265 A 63 TYR HD% A 67 ARG HBy 1.0 1.8 5.0 1378 1266 A 63 TYR HD% A 67 ARG HGx 1.0 1.8 5.0 1379 1266 A 63 TYR HD% A 67 ARG HGy 1.0 1.8 5.0 1380 1267 A 63 TYR HE% A 67 ARG HBx 1.0 1.8 5.0 1381 1267 A 63 TYR HE% A 67 ARG HBy 1.0 1.8 5.0 1382 1268 A 63 TYR HE% A 67 ARG HGx 1.0 1.8 5.0 1383 1268 A 63 TYR HE% A 67 ARG HGy 1.0 1.8 5.0 1384 1269 A 64 GLU H A 64 GLU HBy 1.0 1.8 5.0 1385 1270 A 64 GLU HGx A 64 GLU HA 1.0 1.8 5.0 1386 1271 A 64 GLU HA A 64 GLU HGy 1.0 1.8 5.0 1387 1272 A 64 GLU H A 64 GLU HGx 1.0 1.8 5.0 1388 1273 A 64 GLU H A 64 GLU HBx 1.0 1.8 3.5 1389 1274 A 64 GLU H A 64 GLU HGy 1.0 1.8 5.0 1390 1275 A 64 GLU H A 64 GLU HGy 1.0 1.8 3.5 1391 1275 A 64 GLU H A 64 GLU HGx 1.0 1.8 3.5 1392 1276 A 64 GLU H A 65 GLN HBy 1.0 1.8 6.0 1393 1277 A 64 GLU H A 65 GLN HBx 1.0 1.8 6.0 1394 1278 A 64 GLU HBy A 65 GLN H 1.0 1.8 5.0 1395 1279 A 64 GLU HBx A 65 GLN H 1.0 1.8 5.0 1396 1280 A 64 GLU HGx A 65 GLN H 1.0 1.8 5.0 1397 1281 A 64 GLU H A 65 GLN H 1.0 1.8 3.5 1398 1282 A 65 GLN H A 64 GLU HGy 1.0 1.8 5.0 1399 1283 A 65 GLN H A 64 GLU HGy 1.0 1.8 3.5 1400 1283 A 64 GLU HGx A 65 GLN H 1.0 1.8 3.5 1401 1284 A 65 GLN HA A 64 GLU HGy 1.0 1.8 6.0 1402 1284 A 64 GLU HGx A 65 GLN HA 1.0 1.8 6.0 1403 1285 A 64 GLU HA A 66 LEU HD1% 1.0 1.8 5.0 1404 1286 A 64 GLU H A 66 LEU HD1% 1.0 1.8 6.0 1405 1287 A 64 GLU H A 66 LEU HG 1.0 1.8 6.0 1406 1288 A 66 LEU H A 64 GLU HA 1.0 1.8 6.0 1407 1289 A 64 GLU H A 66 LEU H 1.0 1.8 5.0 1408 1290 A 64 GLU HA A 67 ARG HBx 1.0 1.8 5.0 1409 1291 A 64 GLU HA A 67 ARG HBy 1.0 1.8 5.0 1410 1292 A 64 GLU HA A 67 ARG HDx 1.0 1.8 5.0 1411 1292 A 64 GLU HA A 67 ARG HDy 1.0 1.8 5.0 1412 1293 A 64 GLU H A 67 ARG H 1.0 1.8 6.0 1413 1294 A 64 GLU HA A 67 ARG H 1.0 1.8 5.0 1414 1295 A 64 GLU H A 67 ARG HBx 1.0 1.8 6.0 1415 1295 A 64 GLU H A 67 ARG HBy 1.0 1.8 6.0 1416 1296 A 64 GLU H A 67 ARG HGx 1.0 1.8 6.0 1417 1296 A 64 GLU H A 67 ARG HGy 1.0 1.8 6.0 1418 1297 A 64 GLU HA A 67 ARG HBx 1.0 1.8 5.0 1419 1297 A 64 GLU HA A 67 ARG HBy 1.0 1.8 5.0 1420 1298 A 64 GLU HA A 67 ARG HGx 1.0 1.8 5.0 1421 1298 A 64 GLU HA A 67 ARG HGy 1.0 1.8 5.0 1422 1299 A 64 GLU HA A 68 GLN H 1.0 1.8 5.0 1423 1300 A 65 GLN HA A 65 GLN HGx 1.0 1.8 5.0 1424 1301 A 65 GLN HGy A 65 GLN HA 1.0 1.8 5.0 1425 1302 A 65 GLN H A 65 GLN HGx 1.0 1.8 5.0 1426 1303 A 65 GLN H A 65 GLN HBx 1.0 1.8 3.5 1427 1304 A 65 GLN H A 65 GLN HBy 1.0 1.8 3.5 1428 1305 A 65 GLN H A 65 GLN HGy 1.0 1.8 5.0 1429 1306 A 65 GLN HA A 65 GLN HE2y 1.0 1.8 6.0 1430 1307 A 65 GLN HA A 65 GLN HE2x 1.0 1.8 6.0 1431 1308 A 65 GLN H A 65 GLN HBx 1.0 1.8 2.7 1432 1308 A 65 GLN H A 65 GLN HBy 1.0 1.8 2.7 1433 1309 A 65 GLN H A 65 GLN HGx 1.0 1.8 5.0 1434 1309 A 65 GLN H A 65 GLN HGy 1.0 1.8 5.0 1435 1310 A 65 GLN H A 65 GLN HE2y 1.0 1.8 5.0 1436 1310 A 65 GLN H A 65 GLN HE2x 1.0 1.8 5.0 1437 1311 A 65 GLN HA A 65 GLN HGx 1.0 1.8 5.0 1438 1311 A 65 GLN HGy A 65 GLN HA 1.0 1.8 5.0 1439 1312 A 65 GLN HA A 65 GLN HE2y 1.0 1.8 5.0 1440 1312 A 65 GLN HA A 65 GLN HE2x 1.0 1.8 5.0 1441 1313 A 65 GLN HE2y A 65 GLN HBx 1.0 1.8 5.0 1442 1313 A 65 GLN HBy A 65 GLN HE2x 1.0 1.8 5.0 1443 1313 A 65 GLN HBy A 65 GLN HE2y 1.0 1.8 5.0 1444 1313 A 65 GLN HE2x A 65 GLN HBx 1.0 1.8 5.0 1445 1314 A 65 GLN HGy A 66 LEU H 1.0 1.8 5.0 1446 1315 A 65 GLN H A 66 LEU HG 1.0 1.8 5.0 1447 1316 A 65 GLN H A 66 LEU H 1.0 1.8 3.5 1448 1317 A 66 LEU H A 65 GLN HBx 1.0 1.8 5.0 1449 1318 A 65 GLN HBy A 66 LEU H 1.0 1.8 5.0 1450 1319 A 66 LEU H A 65 GLN HGx 1.0 1.8 5.0 1451 1320 A 66 LEU H A 65 GLN HBx 1.0 1.8 5.0 1452 1320 A 65 GLN HBy A 66 LEU H 1.0 1.8 5.0 1453 1321 A 65 GLN HA A 68 GLN HBx 1.0 1.8 5.0 1454 1322 A 65 GLN HA A 68 GLN HBy 1.0 1.8 5.0 1455 1323 A 65 GLN HA A 68 GLN H 1.0 1.8 5.0 1456 1324 A 65 GLN H A 68 GLN HBx 1.0 1.8 6.0 1457 1324 A 65 GLN H A 68 GLN HBy 1.0 1.8 6.0 1458 1325 A 65 GLN HA A 68 GLN HBx 1.0 1.8 5.0 1459 1325 A 65 GLN HA A 68 GLN HBy 1.0 1.8 5.0 1460 1326 A 65 GLN HA A 68 GLN HGx 1.0 1.8 5.0 1461 1326 A 65 GLN HA A 68 GLN HGy 1.0 1.8 5.0 1462 1327 A 66 LEU HD1% A 66 LEU HA 1.0 1.8 5.0 1463 1328 A 66 LEU HD2% A 66 LEU HA 1.0 1.8 5.0 1464 1329 A 66 LEU H A 66 LEU HBy 1.0 1.8 5.0 1465 1330 A 66 LEU HD2% A 66 LEU HBx 1.0 1.8 3.5 1466 1331 A 66 LEU HD2% A 66 LEU HBy 1.0 1.8 3.5 1467 1332 A 66 LEU HD2% A 66 LEU H 1.0 1.8 5.0 1468 1333 A 66 LEU H A 66 LEU HBx 1.0 1.8 5.0 1469 1334 A 66 LEU H A 66 LEU HG 1.0 1.8 3.5 1470 1335 A 66 LEU H A 66 LEU HD1% 1.0 1.8 5.0 1471 1336 A 66 LEU H A 66 LEU HBx 1.0 1.8 3.5 1472 1336 A 66 LEU H A 66 LEU HBy 1.0 1.8 3.5 1473 1337 A 66 LEU HD1% A 66 LEU HBx 1.0 1.8 3.5 1474 1337 A 66 LEU HD1% A 66 LEU HBy 1.0 1.8 3.5 1475 1338 A 66 LEU HG A 67 ARG HA 1.0 1.8 5.0 1476 1339 A 66 LEU HG A 67 ARG HGy 1.0 1.8 6.0 1477 1340 A 66 LEU HG A 67 ARG HGx 1.0 1.8 6.0 1478 1341 A 66 LEU HD1% A 67 ARG HA 1.0 1.8 3.5 1479 1342 A 66 LEU HD1% A 67 ARG H 1.0 1.8 5.0 1480 1343 A 66 LEU HG A 67 ARG H 1.0 1.8 3.5 1481 1344 A 67 ARG H A 66 LEU HBx 1.0 1.8 5.0 1482 1344 A 67 ARG H A 66 LEU HBy 1.0 1.8 5.0 1483 1345 A 66 LEU HG A 67 ARG HGx 1.0 1.8 5.0 1484 1345 A 66 LEU HG A 67 ARG HGy 1.0 1.8 5.0 1485 1346 A 66 LEU HD1% A 67 ARG HGx 1.0 1.8 5.0 1486 1346 A 66 LEU HD1% A 67 ARG HGy 1.0 1.8 5.0 1487 1347 A 66 LEU HD1% A 68 GLN H 1.0 1.8 6.0 1488 1348 A 68 GLN H A 66 LEU HA 1.0 1.8 5.0 1489 1349 A 66 LEU HA A 68 GLN HBx 1.0 1.8 6.0 1490 1349 A 68 GLN HBy A 66 LEU HA 1.0 1.8 6.0 1491 1350 A 68 GLN H A 66 LEU HBx 1.0 1.8 6.0 1492 1350 A 68 GLN H A 66 LEU HBy 1.0 1.8 6.0 1493 1351 A 66 LEU HA A 69 VAL HG2% 1.0 1.8 5.0 1494 1352 A 66 LEU HA A 69 VAL H 1.0 1.8 5.0 1495 1353 A 69 VAL HG2% A 66 LEU HBx 1.0 1.8 6.0 1496 1353 A 66 LEU HBy A 69 VAL HG2% 1.0 1.8 6.0 1497 1354 A 67 ARG HDy A 67 ARG HBx 1.0 1.8 5.0 1498 1354 A 67 ARG HBx A 67 ARG HDx 1.0 1.8 5.0 1499 1355 A 67 ARG H A 67 ARG HBy 1.0 1.8 5.0 1500 1356 A 67 ARG HA A 67 ARG HDx 1.0 1.8 5.0 1501 1356 A 67 ARG HDy A 67 ARG HA 1.0 1.8 5.0 1502 1357 A 67 ARG HDy A 67 ARG HBy 1.0 1.8 5.0 1503 1357 A 67 ARG HBy A 67 ARG HDx 1.0 1.8 5.0 1504 1358 A 67 ARG H A 67 ARG HBx 1.0 1.8 5.0 1505 1359 A 67 ARG H A 67 ARG HDx 1.0 1.8 5.0 1506 1359 A 67 ARG H A 67 ARG HDy 1.0 1.8 5.0 1507 1360 A 67 ARG H A 67 ARG HGy 1.0 1.8 5.0 1508 1361 A 67 ARG H A 67 ARG HGx 1.0 1.8 5.0 1509 1362 A 67 ARG H A 67 ARG HBx 1.0 1.8 3.5 1510 1362 A 67 ARG H A 67 ARG HBy 1.0 1.8 3.5 1511 1363 A 67 ARG H A 67 ARG HGx 1.0 1.8 3.5 1512 1363 A 67 ARG H A 67 ARG HGy 1.0 1.8 3.5 1513 1364 A 67 ARG HA A 67 ARG HGx 1.0 1.8 3.5 1514 1364 A 67 ARG HGy A 67 ARG HA 1.0 1.8 3.5 1515 1365 A 67 ARG HBy A 67 ARG HDx 1.0 1.8 5.0 1516 1365 A 67 ARG HBx A 67 ARG HDx 1.0 1.8 5.0 1517 1365 A 67 ARG HDy A 67 ARG HBx 1.0 1.8 5.0 1518 1365 A 67 ARG HDy A 67 ARG HBy 1.0 1.8 5.0 1519 1366 A 67 ARG HBy A 68 GLN H 1.0 1.8 5.0 1520 1367 A 67 ARG H A 68 GLN HA 1.0 1.8 6.0 1521 1368 A 68 GLN H A 67 ARG HA 1.0 1.8 3.5 1522 1369 A 68 GLN H A 67 ARG HBx 1.0 1.8 5.0 1523 1370 A 67 ARG HGy A 68 GLN H 1.0 1.8 6.0 1524 1371 A 68 GLN H A 67 ARG HGx 1.0 1.8 6.0 1525 1372 A 67 ARG H A 68 GLN HBx 1.0 1.8 5.0 1526 1372 A 67 ARG H A 68 GLN HBy 1.0 1.8 5.0 1527 1373 A 68 GLN H A 67 ARG HBx 1.0 1.8 5.0 1528 1373 A 67 ARG HBy A 68 GLN H 1.0 1.8 5.0 1529 1374 A 68 GLN H A 67 ARG HGx 1.0 1.8 5.0 1530 1374 A 67 ARG HGy A 68 GLN H 1.0 1.8 5.0 1531 1375 A 69 VAL HG2% A 67 ARG HBx 1.0 1.8 6.0 1532 1375 A 67 ARG HBy A 69 VAL HG2% 1.0 1.8 6.0 1533 1376 A 68 GLN HA A 68 GLN HGx 1.0 1.8 5.0 1534 1377 A 68 GLN HGy A 68 GLN HA 1.0 1.8 5.0 1535 1378 A 68 GLN H A 68 GLN HBx 1.0 1.8 5.0 1536 1379 A 68 GLN H A 68 GLN HBy 1.0 1.8 5.0 1537 1380 A 68 GLN H A 68 GLN HE2y 1.0 1.8 6.0 1538 1381 A 68 GLN H A 68 GLN HE2x 1.0 1.8 6.0 1539 1382 A 68 GLN H A 68 GLN HGx 1.0 1.8 5.0 1540 1383 A 68 GLN H A 68 GLN HGy 1.0 1.8 5.0 1541 1384 A 68 GLN H A 68 GLN HBx 1.0 1.8 3.5 1542 1384 A 68 GLN H A 68 GLN HBy 1.0 1.8 3.5 1543 1385 A 68 GLN H A 68 GLN HGx 1.0 1.8 5.0 1544 1385 A 68 GLN H A 68 GLN HGy 1.0 1.8 5.0 1545 1386 A 68 GLN HA A 68 GLN HGx 1.0 1.8 5.0 1546 1386 A 68 GLN HGy A 68 GLN HA 1.0 1.8 5.0 1547 1387 A 68 GLN HE2y A 68 GLN HBx 1.0 1.8 5.0 1548 1387 A 68 GLN HBy A 68 GLN HE2y 1.0 1.8 5.0 1549 1387 A 68 GLN HBy A 68 GLN HE2x 1.0 1.8 5.0 1550 1387 A 68 GLN HE2x A 68 GLN HBx 1.0 1.8 5.0 1551 1388 A 69 VAL HG2% A 68 GLN HA 1.0 1.8 5.0 1552 1389 A 68 GLN H A 69 VAL HG2% 1.0 1.8 6.0 1553 1390 A 69 VAL H A 68 GLN HBx 1.0 1.8 3.5 1554 1390 A 68 GLN HBy A 69 VAL H 1.0 1.8 3.5 1555 1391 A 69 VAL H A 68 GLN HGx 1.0 1.8 5.0 1556 1391 A 68 GLN HGy A 69 VAL H 1.0 1.8 5.0 1557 1392 A 69 VAL HG2% A 68 GLN HGx 1.0 1.8 6.0 1558 1392 A 68 GLN HGy A 69 VAL HG2% 1.0 1.8 6.0 1559 1393 A 69 VAL HA A 69 VAL HG1% 1.0 1.8 3.5 1560 1394 A 69 VAL HG2% A 69 VAL HA 1.0 1.8 3.5 1561 1395 A 69 VAL H A 69 VAL HB 1.0 1.8 5.0 1562 1396 A 69 VAL H A 69 VAL HG1% 1.0 1.8 5.0 1563 1397 A 69 VAL HG2% A 69 VAL H 1.0 1.8 3.5 1564 1398 A 69 VAL HG1% A 70 HIS H 1.0 1.8 6.0 1565 1399 A 69 VAL H A 70 HIS H 1.0 1.8 5.0 1566 1400 A 69 VAL HA A 72 ALA HB% 1.0 1.8 5.0 1567 1401 A 69 VAL HG1% A 72 ALA HB% 1.0 1.8 5.0 1568 1402 A 69 VAL HG2% A 72 ALA HB% 1.0 1.8 5.0 1569 1403 A 69 VAL HG1% A 72 ALA HA 1.0 1.8 5.0 1570 1404 A 69 VAL H A 72 ALA HB% 1.0 1.8 6.0 1571 1405 A 69 VAL HA A 72 ALA H 1.0 1.8 5.0 1572 1406 A 70 HIS HA A 70 HIS HD2 1.0 1.8 5.0 1573 1407 A 70 HIS H A 71 THR H 1.0 1.8 6.0 1574 1408 A 71 THR H A 71 THR HG2% 1.0 1.8 5.0 1575 1409 A 71 THR HG2% A 71 THR HA 1.0 1.8 3.5 1576 1410 A 72 ALA H A 71 THR HB 1.0 1.8 6.0 1577 1411 A 72 ALA H A 71 THR HA 1.0 1.8 5.0 1578 1412 A 72 ALA H A 71 THR H 1.0 1.8 6.0 1579 1413 A 72 ALA HB% A 72 ALA H 1.0 1.8 3.5 1580 1414 A 72 ALA HB% A 73 ASN H 1.0 1.8 5.0 1581 1415 A 73 ASN HA A 74 LEU H 1.0 1.8 3.5 1582 1416 A 73 ASN H A 74 LEU H 1.0 1.8 5.0 1583 1417 A 74 LEU H A 73 ASN HBy 1.0 1.8 5.0 1584 1417 A 74 LEU H A 73 ASN HBx 1.0 1.8 5.0 1585 1418 A 74 LEU HA A 74 LEU HD2% 1.0 1.8 5.0 1586 1419 A 74 LEU HA A 74 LEU HG 1.0 1.8 5.0 1587 1420 A 74 LEU HA A 74 LEU HD1% 1.0 1.8 5.0 1588 1421 A 74 LEU H A 74 LEU HBx 1.0 1.8 5.0 1589 1422 A 74 LEU H A 74 LEU HBy 1.0 1.8 5.0 1590 1423 A 74 LEU H A 74 LEU HD1% 1.0 1.8 5.0 1591 1424 A 74 LEU H A 74 LEU HD2% 1.0 1.8 5.0 1592 1425 A 74 LEU H A 74 LEU HG 1.0 1.8 5.0 1593 1426 A 74 LEU H A 74 LEU HBx 1.0 1.8 3.5 1594 1426 A 74 LEU H A 74 LEU HBy 1.0 1.8 3.5 1595 1427 A 74 LEU HA A 74 LEU HD1% 1.0 1.8 3.5 1596 1427 A 74 LEU HA A 74 LEU HD2% 1.0 1.8 3.5 1597 1428 A 74 LEU HG A 74 LEU HBx 1.0 1.8 2.7 1598 1428 A 74 LEU HG A 74 LEU HBy 1.0 1.8 2.7 1599 1429 A 74 LEU HBx A 74 LEU HD1% 1.0 1.8 3.5 1600 1429 A 74 LEU HBy A 74 LEU HD1% 1.0 1.8 3.5 1601 1429 A 74 LEU HD2% A 74 LEU HBx 1.0 1.8 3.5 1602 1429 A 74 LEU HBy A 74 LEU HD2% 1.0 1.8 3.5 1603 1430 A 74 LEU HBy A 75 PRO HDx 1.0 1.8 5.0 1604 1431 A 74 LEU HBx A 75 PRO HDx 1.0 1.8 5.0 1605 1432 A 75 PRO HDy A 74 LEU HBx 1.0 1.8 5.0 1606 1433 A 74 LEU HBy A 75 PRO HDy 1.0 1.8 5.0 1607 1434 A 74 LEU HA A 75 PRO HDx 1.0 1.8 3.5 1608 1435 A 74 LEU HA A 75 PRO HDy 1.0 1.8 3.5 1609 1436 A 74 LEU HA A 75 PRO HDx 1.0 1.8 3.5 1610 1436 A 74 LEU HA A 75 PRO HDy 1.0 1.8 3.5 1611 1437 A 74 LEU HBy A 75 PRO HDx 1.0 1.8 3.5 1612 1437 A 74 LEU HBx A 75 PRO HDx 1.0 1.8 3.5 1613 1437 A 75 PRO HDy A 74 LEU HBx 1.0 1.8 3.5 1614 1437 A 74 LEU HBy A 75 PRO HDy 1.0 1.8 3.5 1615 1438 A 74 LEU HD1% A 75 PRO HDx 1.0 1.8 5.0 1616 1438 A 74 LEU HD2% A 75 PRO HDx 1.0 1.8 5.0 1617 1438 A 75 PRO HDy A 74 LEU HD1% 1.0 1.8 5.0 1618 1438 A 74 LEU HD2% A 75 PRO HDy 1.0 1.8 5.0 1619 1439 A 76 HIS HA A 77 VAL H 1.0 1.8 3.5 1620 1440 A 77 VAL H A 76 HIS HBx 1.0 1.8 5.0 1621 1440 A 77 VAL H A 76 HIS HBy 1.0 1.8 5.0 1622 1441 A 77 VAL H A 76 HIS H 1.0 1.8 5.0 1623 1442 A 77 VAL HA A 77 VAL HG11 1.0 1.8 3.5 1624 1442 A 77 VAL HA A 77 VAL HG21 1.0 1.8 3.5 1625 1443 A 77 VAL H A 77 VAL HB 1.0 1.8 5.0 1626 1444 A 77 VAL H A 77 VAL HG11 1.0 1.8 5.0 1627 1444 A 77 VAL H A 77 VAL HG21 1.0 1.8 5.0 1628 1445 A 77 VAL H A 78 PHE H 1.0 1.8 5.0 1629 1446 A 77 VAL HA A 78 PHE H 1.0 1.8 3.5 1630 1447 A 77 VAL HB A 78 PHE H 1.0 1.8 5.0 1631 1448 A 78 PHE H A 77 VAL HG11 1.0 1.8 5.0 1632 1448 A 77 VAL HG21 A 78 PHE H 1.0 1.8 5.0 1633 1449 A 77 VAL HA A 79 ASN H 1.0 1.8 6.0 1634 1450 A 78 PHE HA A 78 PHE HD% 1.0 1.8 5.0 1635 1451 A 78 PHE HE% A 78 PHE HZ 1.0 1.8 2.7 1636 1452 A 78 PHE H A 78 PHE HBx 1.0 1.8 5.0 1637 1453 A 78 PHE H A 78 PHE HBy 1.0 1.8 5.0 1638 1454 A 78 PHE H A 78 PHE HD% 1.0 1.8 6.0 1639 1455 A 80 GLU H A 80 GLU HGx 1.0 1.8 5.0 1640 1455 A 80 GLU H A 80 GLU HGy 1.0 1.8 5.0 1641 1456 A 82 ARG H A 82 ARG HGx 1.0 1.8 5.0 1642 1456 A 82 ARG H A 82 ARG HGy 1.0 1.8 5.0 1643 1457 A 83 GLY H A 82 ARG HGx 1.0 1.8 6.0 1644 1457 A 82 ARG HGy A 83 GLY H 1.0 1.8 6.0 stop_ save_ save_CNS/XPLOR_distance_constraints_3 _nef_distance_restraint_list.sf_category nef_distance_restraint_list _nef_distance_restraint_list.sf_framecode CNS/XPLOR_distance_constraints_3 _nef_distance_restraint_list.restraint_origin hbond _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 30 VAL H A 26 ASP O 1.0 1.8 2.3 2 2 A 26 ASP O A 30 VAL N 1.0 2.7 3.3 3 3 A 31 LEU H A 27 MET O 1.0 1.8 2.3 4 4 A 27 MET O A 31 LEU N 1.0 2.7 3.3 5 5 A 32 SER H A 28 ASP O 1.0 1.8 2.3 6 6 A 28 ASP O A 32 SER N 1.0 2.7 3.3 7 7 A 33 ASP H A 29 ALA O 1.0 1.8 2.3 8 8 A 29 ALA O A 33 ASP N 1.0 2.7 3.3 9 9 A 34 PHE H A 30 VAL O 1.0 1.8 2.3 10 10 A 30 VAL O A 34 PHE N 1.0 2.7 3.3 11 11 A 35 VAL H A 31 LEU O 1.0 1.8 2.3 12 12 A 31 LEU O A 35 VAL N 1.0 2.7 3.3 13 13 A 36 ARG H A 32 SER O 1.0 1.8 2.3 14 14 A 32 SER O A 36 ARG N 1.0 2.7 3.3 15 15 A 37 SER H A 33 ASP O 1.0 1.8 2.3 16 16 A 33 ASP O A 37 SER N 1.0 2.7 3.3 17 17 A 46 ARG H A 42 PRO O 1.0 1.8 2.3 18 18 A 42 PRO O A 46 ARG N 1.0 2.7 3.3 19 19 A 47 ASP H A 43 GLY O 1.0 1.8 2.3 20 20 A 43 GLY O A 47 ASP N 1.0 2.7 3.3 21 21 A 48 LEU H A 44 LEU O 1.0 1.8 2.3 22 22 A 44 LEU O A 48 LEU N 1.0 2.7 3.3 23 23 A 49 LEU H A 45 ALA O 1.0 1.8 2.3 24 24 A 45 ALA O A 49 LEU N 1.0 2.7 3.3 25 25 A 50 GLU H A 46 ARG O 1.0 1.8 2.3 26 26 A 46 ARG O A 50 GLU N 1.0 2.7 3.3 27 27 A 60 LEU H A 56 LEU O 1.0 1.8 2.3 28 28 A 56 LEU O A 60 LEU N 1.0 2.7 3.3 29 29 A 61 SER H A 57 THR O 1.0 1.8 2.3 30 30 A 57 THR O A 61 SER N 1.0 2.7 3.3 31 31 A 62 ASP H A 58 ALA O 1.0 1.8 2.3 32 32 A 58 ALA O A 62 ASP N 1.0 2.7 3.3 33 33 A 63 TYR H A 59 ALA O 1.0 1.8 2.3 34 34 A 59 ALA O A 63 TYR N 1.0 2.7 3.3 35 35 A 64 GLU H A 60 LEU O 1.0 1.8 2.3 36 36 A 60 LEU O A 64 GLU N 1.0 2.7 3.3 37 37 A 65 GLN H A 61 SER O 1.0 1.8 2.3 38 38 A 61 SER O A 65 GLN N 1.0 2.7 3.3 39 39 A 66 LEU H A 62 ASP O 1.0 1.8 2.3 40 40 A 62 ASP O A 66 LEU N 1.0 2.7 3.3 41 41 A 67 ARG H A 63 TYR O 1.0 1.8 2.3 42 42 A 63 TYR O A 67 ARG N 1.0 2.7 3.3 stop_ save_ save_CNS/XPLOR_dihedral_4 _nef_dihedral_restraint_list.sf_category nef_dihedral_restraint_list _nef_dihedral_restraint_list.sf_framecode CNS/XPLOR_dihedral_4 _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 24 THR C A 25 LEU N A 25 LEU CA A 25 LEU C 1.0 -191.0 -51.0 PHI 2 2 A 25 LEU N A 25 LEU CA A 25 LEU C A 26 ASP N 1.0 91.0 187.0 PSI 3 3 A 25 LEU C A 26 ASP N A 26 ASP CA A 26 ASP C 1.0 -155.0 -35.0 PHI 4 4 A 26 ASP N A 26 ASP CA A 26 ASP C A 27 MET N 1.0 94.0 194.0 PSI 5 5 A 26 ASP C A 27 MET N A 27 MET CA A 27 MET C 1.0 -79.0 -39.0 PHI 6 6 A 27 MET N A 27 MET CA A 27 MET C A 28 ASP N 1.0 -58.0 -18.0 PSI 7 7 A 27 MET C A 28 ASP N A 28 ASP CA A 28 ASP C 1.0 -83.0 -43.0 PHI 8 8 A 28 ASP N A 28 ASP CA A 28 ASP C A 29 ALA N 1.0 -59.0 -19.0 PSI 9 9 A 28 ASP C A 29 ALA N A 29 ALA CA A 29 ALA C 1.0 -87.0 -47.0 PHI 10 10 A 29 ALA N A 29 ALA CA A 29 ALA C A 30 VAL N 1.0 -60.0 -20.0 PSI 11 11 A 29 ALA C A 30 VAL N A 30 VAL CA A 30 VAL C 1.0 -86.0 -46.0 PHI 12 12 A 30 VAL N A 30 VAL CA A 30 VAL C A 31 LEU N 1.0 -64.0 -24.0 PSI 13 13 A 30 VAL C A 31 LEU N A 31 LEU CA A 31 LEU C 1.0 -81.0 -41.0 PHI 14 14 A 31 LEU N A 31 LEU CA A 31 LEU C A 32 SER N 1.0 -66.0 -26.0 PSI 15 15 A 31 LEU C A 32 SER N A 32 SER CA A 32 SER C 1.0 -84.0 -44.0 PHI 16 16 A 32 SER N A 32 SER CA A 32 SER C A 33 ASP N 1.0 -62.0 -22.0 PSI 17 17 A 32 SER C A 33 ASP N A 33 ASP CA A 33 ASP C 1.0 -84.0 -44.0 PHI 18 18 A 33 ASP N A 33 ASP CA A 33 ASP C A 34 PHE N 1.0 -64.0 -24.0 PSI 19 19 A 33 ASP C A 34 PHE N A 34 PHE CA A 34 PHE C 1.0 -85.0 -45.0 PHI 20 20 A 34 PHE N A 34 PHE CA A 34 PHE C A 35 VAL N 1.0 -59.0 -19.0 PSI 21 21 A 34 PHE C A 35 VAL N A 35 VAL CA A 35 VAL C 1.0 -83.0 -43.0 PHI 22 22 A 35 VAL N A 35 VAL CA A 35 VAL C A 36 ARG N 1.0 -60.0 -20.0 PSI 23 23 A 35 VAL C A 36 ARG N A 36 ARG CA A 36 ARG C 1.0 -85.0 -35.0 PHI 24 24 A 36 ARG N A 36 ARG CA A 36 ARG C A 37 SER N 1.0 -62.0 -22.0 PSI 25 25 A 36 ARG C A 37 SER N A 37 SER CA A 37 SER C 1.0 -100.0 -52.0 PHI 26 26 A 37 SER N A 37 SER CA A 37 SER C A 38 THR N 1.0 -59.0 -7.0 PSI 27 27 A 37 SER C A 38 THR N A 38 THR CA A 38 THR C 1.0 -141.0 -77.0 PHI 28 28 A 38 THR N A 38 THR CA A 38 THR C A 39 GLY N 1.0 -34.0 6.0 PSI 29 29 A 38 THR C A 39 GLY N A 39 GLY CA A 39 GLY C 1.0 48.0 132.0 PHI 30 30 A 39 GLY N A 39 GLY CA A 39 GLY C A 40 ALA N 1.0 -19.0 29.0 PSI 31 31 A 39 GLY C A 40 ALA N A 40 ALA CA A 40 ALA C 1.0 -142.0 -2.0 PHI 32 32 A 40 ALA N A 40 ALA CA A 40 ALA C A 41 GLU N 1.0 97.0 177.0 PSI 33 33 A 40 ALA C A 41 GLU N A 41 GLU CA A 41 GLU C 1.0 -143.0 -31.0 PHI 34 34 A 41 GLU N A 41 GLU CA A 41 GLU C A 42 PRO N 1.0 109.0 181.0 PSI 35 35 A 42 PRO C A 43 GLY N A 43 GLY CA A 43 GLY C 1.0 -87.0 -47.0 PHI 36 36 A 43 GLY N A 43 GLY CA A 43 GLY C A 44 LEU N 1.0 -58.0 -10.0 PSI 37 37 A 43 GLY C A 44 LEU N A 44 LEU CA A 44 LEU C 1.0 -83.0 -43.0 PHI 38 38 A 44 LEU N A 44 LEU CA A 44 LEU C A 45 ALA N 1.0 -67.0 -7.0 PSI 39 39 A 44 LEU C A 45 ALA N A 45 ALA CA A 45 ALA C 1.0 -84.0 -44.0 PHI 40 40 A 45 ALA N A 45 ALA CA A 45 ALA C A 46 ARG N 1.0 -57.0 -17.0 PSI 41 41 A 45 ALA C A 46 ARG N A 46 ARG CA A 46 ARG C 1.0 -81.0 -41.0 PHI 42 42 A 46 ARG N A 46 ARG CA A 46 ARG C A 47 ASP N 1.0 -66.0 -26.0 PSI 43 43 A 46 ARG C A 47 ASP N A 47 ASP CA A 47 ASP C 1.0 -82.0 -42.0 PHI 44 44 A 47 ASP N A 47 ASP CA A 47 ASP C A 48 LEU N 1.0 -63.0 -23.0 PSI 45 45 A 47 ASP C A 48 LEU N A 48 LEU CA A 48 LEU C 1.0 -87.0 -47.0 PHI 46 46 A 48 LEU N A 48 LEU CA A 48 LEU C A 49 LEU N 1.0 -62.0 -22.0 PSI 47 47 A 48 LEU C A 49 LEU N A 49 LEU CA A 49 LEU C 1.0 -82.0 -42.0 PHI 48 48 A 49 LEU N A 49 LEU CA A 49 LEU C A 50 GLU N 1.0 -59.0 -19.0 PSI 49 49 A 49 LEU C A 50 GLU N A 50 GLU CA A 50 GLU C 1.0 -85.0 -45.0 PHI 50 50 A 50 GLU N A 50 GLU CA A 50 GLU C A 51 GLY N 1.0 -59.0 -19.0 PSI 51 51 A 50 GLU C A 51 GLY N A 51 GLY CA A 51 GLY C 1.0 -98.0 -38.0 PHI 52 52 A 51 GLY N A 51 GLY CA A 51 GLY C A 52 LYS N 1.0 -47.0 13.0 PSI 53 53 A 51 GLY C A 52 LYS N A 52 LYS CA A 52 LYS C 1.0 -144.0 -64.0 PHI 54 54 A 52 LYS N A 52 LYS CA A 52 LYS C A 53 ASN N 1.0 -17.0 35.0 PSI 55 55 A 52 LYS C A 53 ASN N A 53 ASN CA A 53 ASN C 1.0 33.0 73.0 PHI 56 56 A 53 ASN N A 53 ASN CA A 53 ASN C A 54 TRP N 1.0 24.0 64.0 PSI 57 57 A 53 ASN C A 54 TRP N A 54 TRP CA A 54 TRP C 1.0 45.0 85.0 PHI 58 58 A 54 TRP N A 54 TRP CA A 54 TRP C A 55 ASP N 1.0 -2.0 46.0 PSI 59 59 A 54 TRP C A 55 ASP N A 55 ASP CA A 55 ASP C 1.0 -140.0 -52.0 PHI 60 60 A 55 ASP N A 55 ASP CA A 55 ASP C A 56 LEU N 1.0 69.0 169.0 PSI 61 61 A 55 ASP C A 56 LEU N A 56 LEU CA A 56 LEU C 1.0 -73.0 -33.0 PHI 62 62 A 56 LEU N A 56 LEU CA A 56 LEU C A 57 THR N 1.0 -69.0 -29.0 PSI 63 63 A 56 LEU C A 57 THR N A 57 THR CA A 57 THR C 1.0 -81.0 -41.0 PHI 64 64 A 57 THR N A 57 THR CA A 57 THR C A 58 ALA N 1.0 -63.0 -23.0 PSI 65 65 A 57 THR C A 58 ALA N A 58 ALA CA A 58 ALA C 1.0 -87.0 -47.0 PHI 66 66 A 58 ALA N A 58 ALA CA A 58 ALA C A 59 ALA N 1.0 -58.0 -18.0 PSI 67 67 A 58 ALA C A 59 ALA N A 59 ALA CA A 59 ALA C 1.0 -87.0 -47.0 PHI 68 68 A 59 ALA N A 59 ALA CA A 59 ALA C A 60 LEU N 1.0 -61.0 -21.0 PSI 69 69 A 59 ALA C A 60 LEU N A 60 LEU CA A 60 LEU C 1.0 -82.0 -42.0 PHI 70 70 A 60 LEU N A 60 LEU CA A 60 LEU C A 61 SER N 1.0 -60.0 -20.0 PSI 71 71 A 60 LEU C A 61 SER N A 61 SER CA A 61 SER C 1.0 -86.0 -46.0 PHI 72 72 A 61 SER N A 61 SER CA A 61 SER C A 62 ASP N 1.0 -61.0 -21.0 PSI 73 73 A 61 SER C A 62 ASP N A 62 ASP CA A 62 ASP C 1.0 -86.0 -46.0 PHI 74 74 A 62 ASP N A 62 ASP CA A 62 ASP C A 63 TYR N 1.0 -60.0 -20.0 PSI 75 75 A 62 ASP C A 63 TYR N A 63 TYR CA A 63 TYR C 1.0 -87.0 -47.0 PHI 76 76 A 63 TYR N A 63 TYR CA A 63 TYR C A 64 GLU N 1.0 -64.0 -24.0 PSI 77 77 A 63 TYR C A 64 GLU N A 64 GLU CA A 64 GLU C 1.0 -84.0 -44.0 PHI 78 78 A 64 GLU N A 64 GLU CA A 64 GLU C A 65 GLN N 1.0 -59.0 -15.0 PSI 79 79 A 64 GLU C A 65 GLN N A 65 GLN CA A 65 GLN C 1.0 -85.0 -45.0 PHI 80 80 A 65 GLN N A 65 GLN CA A 65 GLN C A 66 LEU N 1.0 -61.0 -21.0 PSI 81 81 A 65 GLN C A 66 LEU N A 66 LEU CA A 66 LEU C 1.0 -86.0 -46.0 PHI 82 82 A 66 LEU N A 66 LEU CA A 66 LEU C A 67 ARG N 1.0 -53.0 -13.0 PSI 83 83 A 66 LEU C A 67 ARG N A 67 ARG CA A 67 ARG C 1.0 -87.0 -47.0 PHI 84 84 A 67 ARG N A 67 ARG CA A 67 ARG C A 68 GLN N 1.0 -64.0 -4.0 PSI 85 85 A 67 ARG C A 68 GLN N A 68 GLN CA A 68 GLN C 1.0 -109.0 -33.0 PHI 86 86 A 68 GLN N A 68 GLN CA A 68 GLN C A 69 VAL N 1.0 -65.0 -13.0 PSI stop_ save_ save_spectral_peak_list_1 _nef_nmr_spectrum.sf_category nef_nmr_spectrum _nef_nmr_spectrum.sf_framecode spectral_peak_list_1 _nef_nmr_spectrum.num_dimensions 3 loop_ _nef_spectrum_dimension.dimension_id _nef_spectrum_dimension.axis_code _nef_spectrum_dimension.spectral_width 1 15N 1825.146 2 1H 8404.659 3 1H 8389.262 stop_ save_ save_spectral_peak_list_2 _nef_nmr_spectrum.sf_category nef_nmr_spectrum _nef_nmr_spectrum.sf_framecode spectral_peak_list_2 _nef_nmr_spectrum.num_dimensions 3 loop_ _nef_spectrum_dimension.dimension_id _nef_spectrum_dimension.axis_code _nef_spectrum_dimension.spectral_width 1 13C 14890.541 2 1H 11203.133 3 1H 11160.714 stop_ save_ save_spectral_peak_list_3 _nef_nmr_spectrum.sf_category nef_nmr_spectrum _nef_nmr_spectrum.sf_framecode spectral_peak_list_3 _nef_nmr_spectrum.num_dimensions 3 loop_ _nef_spectrum_dimension.dimension_id _nef_spectrum_dimension.axis_code _nef_spectrum_dimension.spectral_width 1 13C 6037.213 2 1H 11203.133 3 1H 11160.714 stop_ save_