data_nef_c17586_2lc1 save_entry_information _nef_nmr_meta_data.sf_category nef_nmr_meta_data _nef_nmr_meta_data.sf_framecode entry_information _nef_nmr_meta_data.format_name nmr_exchange_format _nef_nmr_meta_data.format_version 1.1 loop_ _nef_related_entries.database_name _nef_related_entries.database_accession_code BMRB 17585 stop_ save_ save_assembly _nef_molecular_system.sf_category nef_molecular_system _nef_molecular_system.sf_framecode assembly loop_ _nef_sequence.index _nef_sequence.chain_code _nef_sequence.sequence_code _nef_sequence.residue_name _nef_sequence.linking _nef_sequence.residue_variant _nef_sequence.cis_peptide 1 A 1 GLY start . false 2 A 2 HIS middle . . 3 A 3 GLY middle . false 4 A 4 SER middle . . 5 A 5 ALA middle . . 6 A 6 GLY middle . false 7 A 7 THR middle . . 8 A 8 SER middle . . 9 A 9 VAL middle . . 10 A 10 THR middle . . 11 A 11 LEU middle . . 12 A 12 GLN middle . . 13 A 13 LEU middle . . 14 A 14 ASP middle . . 15 A 15 ASP middle . . 16 A 16 GLY middle . false 17 A 17 SER middle . . 18 A 18 GLY middle . false 19 A 19 ARG middle . . 20 A 20 THR middle . . 21 A 21 TYR middle . . 22 A 22 GLN middle . . 23 A 23 LEU middle . . 24 A 24 ARG middle . . 25 A 25 GLU middle . . 26 A 26 GLY middle . false 27 A 27 SER middle . . 28 A 28 ASN middle . . 29 A 29 ILE middle . . 30 A 30 ILE middle . . 31 A 31 GLY middle . false 32 A 32 ARG middle . . 33 A 33 GLY middle . false 34 A 34 GLN middle . . 35 A 35 ASP middle . . 36 A 36 ALA middle . . 37 A 37 GLN middle . . 38 A 38 PHE middle . . 39 A 39 ARG middle . . 40 A 40 LEU middle . . 41 A 41 PRO middle . false 42 A 42 ASP middle . . 43 A 43 THR middle . . 44 A 44 GLY middle . false 45 A 45 VAL middle . . 46 A 46 SER middle . . 47 A 47 ARG middle . . 48 A 48 ARG middle . . 49 A 49 HIS middle . . 50 A 50 LEU middle . . 51 A 51 GLU middle . . 52 A 52 ILE middle . . 53 A 53 ARG middle . . 54 A 54 TRP middle . . 55 A 55 ASP middle . . 56 A 56 GLY middle . false 57 A 57 GLN middle . . 58 A 58 VAL middle . . 59 A 59 ALA middle . . 60 A 60 LEU middle . . 61 A 61 LEU middle . . 62 A 62 ALA middle . . 63 A 63 ASP middle . . 64 A 64 LEU middle . . 65 A 65 ASN middle . . 66 A 66 SER middle . . 67 A 67 THR middle . . 68 A 68 ASN middle . . 69 A 69 GLY middle . false 70 A 70 THR middle . . 71 A 71 THR middle . . 72 A 72 VAL middle . . 73 A 73 ASN middle . . 74 A 74 ASN middle . . 75 A 75 ALA middle . . 76 A 76 PRO middle . false 77 A 77 VAL middle . . 78 A 78 GLN middle . . 79 A 79 GLU middle . . 80 A 80 TRP middle . . 81 A 81 GLN middle . . 82 A 82 LEU middle . . 83 A 83 ALA middle . . 84 A 84 ASP middle . . 85 A 85 GLY middle . false 86 A 86 ASP middle . . 87 A 87 VAL middle . . 88 A 88 ILE middle . . 89 A 89 ARG middle . . 90 A 90 LEU middle . . 91 A 91 GLY middle . false 92 A 92 HIS middle . . 93 A 93 SER middle . . 94 A 94 GLU middle . . 95 A 95 ILE middle . . 96 A 96 ILE middle . . 97 A 97 VAL middle . . 98 A 98 ARG middle . . 99 A 99 MET middle . . 100 A 100 HIS end . . stop_ save_ save_assigned_chem_shift_list_1 _nef_chemical_shift_list.sf_category nef_chemical_shift_list _nef_chemical_shift_list.sf_framecode assigned_chem_shift_list_1 loop_ _nef_chemical_shift.chain_code _nef_chemical_shift.sequence_code _nef_chemical_shift.residue_name _nef_chemical_shift.atom_name _nef_chemical_shift.element _nef_chemical_shift.isotope_number _nef_chemical_shift.value _nef_chemical_shift.value_uncertainty A 1 GLY H1 H 1 8.162 0.000 A 1 GLY HAy H 1 3.876 0.000 A 1 GLY HAx H 1 3.839 0.000 A 1 GLY C C 13 174.050 0.000 A 1 GLY CA C 13 45.300 0.000 A 1 GLY N N 15 108.520 0.000 A 2 HIS H H 1 8.138 0.000 A 2 HIS HA H 1 4.497 0.000 A 2 HIS HBx H 1 2.892 0.000 A 2 HIS HBy H 1 3.044 0.000 A 2 HIS HD2 H 1 7.070 0.000 A 2 HIS HE1 H 1 7.751 0.000 A 2 HIS C C 13 176.630 0.000 A 2 HIS CA C 13 58.400 0.000 A 2 HIS CB C 13 38.920 0.000 A 2 HIS N N 15 120.360 0.000 A 3 GLY H H 1 8.381 0.000 A 3 GLY HAx H 1 3.842 0.000 A 3 GLY HAy H 1 3.929 0.000 A 3 GLY C C 13 174.190 0.000 A 3 GLY CA C 13 45.430 0.000 A 3 GLY N N 15 111.160 0.000 A 4 SER H H 1 8.162 0.000 A 4 SER HA H 1 4.429 0.000 A 4 SER HBx H 1 3.839 0.000 A 4 SER HBy H 1 3.871 0.000 A 4 SER C C 13 174.350 0.000 A 4 SER CA C 13 58.470 0.000 A 4 SER CB C 13 64.350 0.000 A 4 SER N N 15 115.850 0.000 A 5 ALA H H 1 8.420 0.000 A 5 ALA HA H 1 4.395 0.000 A 5 ALA HB% H 1 1.412 0.000 A 5 ALA C C 13 178.020 0.000 A 5 ALA CA C 13 52.770 0.000 A 5 ALA CB C 13 19.700 0.000 A 5 ALA N N 15 125.930 0.000 A 6 GLY H H 1 8.326 0.000 A 6 GLY HAx H 1 4.004 0.000 A 6 GLY HAy H 1 4.032 0.000 A 6 GLY C C 13 173.970 0.000 A 6 GLY CA C 13 45.330 0.000 A 6 GLY N N 15 108.290 0.000 A 7 THR H H 1 8.334 0.000 A 7 THR HA H 1 4.597 0.000 A 7 THR HB H 1 4.242 0.000 A 7 THR HG2% H 1 1.287 0.000 A 7 THR C C 13 174.030 0.000 A 7 THR CA C 13 62.590 0.000 A 7 THR CB C 13 70.960 0.000 A 7 THR N N 15 116.430 0.000 A 8 SER H H 1 8.694 0.000 A 8 SER HA H 1 4.562 0.000 A 8 SER HBx H 1 3.327 0.000 A 8 SER HBy H 1 3.554 0.000 A 8 SER C C 13 172.130 0.000 A 8 SER CA C 13 57.500 0.000 A 8 SER CB C 13 65.640 0.000 A 8 SER N N 15 119.480 0.000 A 9 VAL H H 1 8.185 0.000 A 9 VAL HA H 1 4.508 0.000 A 9 VAL HB H 1 0.848 0.000 A 9 VAL HGx% H 1 0.401 0.000 A 9 VAL HGy% H 1 -0.140 0.000 A 9 VAL C C 13 174.630 0.000 A 9 VAL CA C 13 61.190 0.000 A 9 VAL CB C 13 33.740 0.000 A 9 VAL N N 15 122.410 0.000 A 10 THR H H 1 9.139 0.000 A 10 THR HA H 1 4.703 0.000 A 10 THR HB H 1 3.813 0.000 A 10 THR HG2% H 1 0.968 0.000 A 10 THR C C 13 172.630 0.000 A 10 THR CA C 13 61.590 0.000 A 10 THR CB C 13 71.230 0.000 A 10 THR N N 15 122.470 0.000 A 11 LEU H H 1 9.351 0.000 A 11 LEU HA H 1 4.781 0.000 A 11 LEU HBx H 1 1.649 0.000 A 11 LEU HBy H 1 1.798 0.000 A 11 LEU HDx% H 1 0.770 0.000 A 11 LEU HDy% H 1 0.656 0.000 A 11 LEU HG H 1 1.280 0.000 A 11 LEU C C 13 175.260 0.000 A 11 LEU CA C 13 52.970 0.000 A 11 LEU CB C 13 41.990 0.000 A 11 LEU N N 15 124.580 0.000 A 12 GLN H H 1 9.218 0.000 A 12 GLN HA H 1 4.817 0.000 A 12 GLN HBx H 1 1.980 0.000 A 12 GLN HBy H 1 2.064 0.000 A 12 GLN HE2x H 1 6.808 0.000 A 12 GLN HE2y H 1 7.322 0.000 A 12 GLN HGx H 1 2.132 0.000 A 12 GLN HGy H 1 2.185 0.000 A 12 GLN C C 13 175.080 0.000 A 12 GLN CA C 13 54.350 0.000 A 12 GLN CB C 13 30.740 0.000 A 12 GLN N N 15 123.170 0.000 A 12 GLN NE2 N 15 111.160 0.000 A 13 LEU H H 1 8.302 0.000 A 13 LEU HA H 1 4.630 0.000 A 13 LEU HBx H 1 1.603 0.000 A 13 LEU HBy H 1 2.125 0.000 A 13 LEU HDx% H 1 0.840 0.000 A 13 LEU HDy% H 1 0.727 0.000 A 13 LEU HG H 1 1.390 0.000 A 13 LEU C C 13 176.360 0.000 A 13 LEU CA C 13 55.590 0.000 A 13 LEU CB C 13 43.630 0.000 A 13 LEU N N 15 127.920 0.000 A 14 ASP H H 1 9.249 0.000 A 14 ASP HA H 1 5.196 0.000 A 14 ASP HBx H 1 2.216 0.000 A 14 ASP HBy H 1 2.857 0.000 A 14 ASP C C 13 175.440 0.000 A 14 ASP CA C 13 53.710 0.000 A 14 ASP CB C 13 40.980 0.000 A 14 ASP N N 15 130.730 0.000 A 15 ASP H H 1 8.060 0.000 A 15 ASP HA H 1 4.808 0.000 A 15 ASP HBx H 1 2.550 0.000 A 15 ASP HBy H 1 3.126 0.000 A 15 ASP C C 13 177.410 0.000 A 15 ASP CA C 13 53.170 0.000 A 15 ASP CB C 13 42.060 0.000 A 15 ASP N N 15 119.540 0.000 A 16 GLY H H 1 8.772 0.000 A 16 GLY HAx H 1 3.717 0.000 A 16 GLY HAy H 1 4.393 0.000 A 16 GLY C C 13 175.280 0.000 A 16 GLY CA C 13 45.360 0.000 A 16 GLY N N 15 110.630 0.000 A 17 SER H H 1 8.623 0.000 A 17 SER HA H 1 4.268 0.000 A 17 SER HBx H 1 3.943 0.000 A 17 SER HBy H 1 4.015 0.000 A 17 SER C C 13 176.990 0.000 A 17 SER CA C 13 60.650 0.000 A 17 SER CB C 13 64.690 0.000 A 17 SER N N 15 117.250 0.000 A 18 GLY H H 1 9.233 0.000 A 18 GLY HAx H 1 3.859 0.000 A 18 GLY HAy H 1 4.143 0.000 A 18 GLY C C 13 174.650 0.000 A 18 GLY CA C 13 46.070 0.000 A 18 GLY N N 15 113.090 0.000 A 19 ARG H H 1 8.068 0.000 A 19 ARG HA H 1 4.347 0.000 A 19 ARG HBy H 1 2.072 0.000 A 19 ARG HBx H 1 1.902 0.000 A 19 ARG HDx H 1 3.365 0.000 A 19 ARG HDy H 1 3.405 0.000 A 19 ARG HGx H 1 1.776 0.000 A 19 ARG HGy H 1 1.820 0.000 A 19 ARG C C 13 176.340 0.000 A 19 ARG CA C 13 58.600 0.000 A 19 ARG CB C 13 32.170 0.000 A 19 ARG N N 15 120.770 0.000 A 20 THR H H 1 8.302 0.000 A 20 THR HA H 1 5.403 0.000 A 20 THR HB H 1 3.927 0.000 A 20 THR HG2% H 1 1.137 0.000 A 20 THR C C 13 173.320 0.000 A 20 THR CA C 13 59.510 0.000 A 20 THR CB C 13 73.760 0.000 A 20 THR N N 15 113.270 0.000 A 21 TYR H H 1 8.459 0.000 A 21 TYR HA H 1 4.342 0.000 A 21 TYR HBx H 1 1.412 0.000 A 21 TYR HBy H 1 1.671 0.000 A 21 TYR HDx H 1 6.685 0.000 A 21 TYR HDy H 1 6.685 0.000 A 21 TYR HEx H 1 6.630 0.000 A 21 TYR HEy H 1 6.630 0.000 A 21 TYR C C 13 172.910 0.000 A 21 TYR CA C 13 57.430 0.000 A 21 TYR CB C 13 41.100 0.000 A 21 TYR N N 15 121.300 0.000 A 22 GLN H H 1 7.849 0.000 A 22 GLN HA H 1 4.682 0.000 A 22 GLN HBx H 1 1.603 0.000 A 22 GLN HBy H 1 1.640 0.000 A 22 GLN HE2x H 1 6.779 0.000 A 22 GLN HE2y H 1 7.316 0.000 A 22 GLN HGx H 1 2.095 0.000 A 22 GLN HGy H 1 2.129 0.000 A 22 GLN C C 13 174.480 0.000 A 22 GLN CA C 13 53.980 0.000 A 22 GLN CB C 13 29.790 0.000 A 22 GLN N N 15 129.500 0.000 A 22 GLN NE2 N 15 111.800 0.000 A 23 LEU H H 1 7.856 0.000 A 23 LEU HA H 1 3.696 0.000 A 23 LEU HBx H 1 0.892 0.000 A 23 LEU HBy H 1 0.976 0.000 A 23 LEU HDx% H 1 0.713 0.000 A 23 LEU HDy% H 1 0.410 0.000 A 23 LEU HG H 1 1.280 0.000 A 23 LEU C C 13 177.330 0.000 A 23 LEU CA C 13 56.260 0.000 A 23 LEU CB C 13 40.900 0.000 A 23 LEU N N 15 120.010 0.000 A 24 ARG H H 1 8.662 0.000 A 24 ARG HA H 1 4.675 0.000 A 24 ARG HBx H 1 1.889 0.000 A 24 ARG HBy H 1 1.957 0.000 A 24 ARG HDx H 1 3.222 0.000 A 24 ARG HDy H 1 3.250 0.000 A 24 ARG HGx H 1 1.674 0.000 A 24 ARG HGy H 1 1.745 0.000 A 24 ARG C C 13 176.590 0.000 A 24 ARG CA C 13 53.910 0.000 A 24 ARG CB C 13 32.170 0.000 A 24 ARG N N 15 121.880 0.000 A 25 GLU H H 1 8.944 0.000 A 25 GLU HA H 1 4.281 0.000 A 25 GLU HBx H 1 1.924 0.000 A 25 GLU HBy H 1 1.981 0.000 A 25 GLU HGx H 1 2.222 0.000 A 25 GLU HGy H 1 2.256 0.000 A 25 GLU C C 13 177.230 0.000 A 25 GLU CA C 13 58.670 0.000 A 25 GLU CB C 13 29.580 0.000 A 25 GLU N N 15 121.940 0.000 A 26 GLY H H 1 9.405 0.000 A 26 GLY HAx H 1 3.707 0.000 A 26 GLY HAy H 1 4.474 0.000 A 26 GLY C C 13 173.510 0.000 A 26 GLY CA C 13 44.260 0.000 A 26 GLY N N 15 114.030 0.000 A 27 SER H H 1 8.670 0.000 A 27 SER HA H 1 4.312 0.000 A 27 SER HBx H 1 3.703 0.000 A 27 SER HBy H 1 3.854 0.000 A 27 SER C C 13 174.940 0.000 A 27 SER CA C 13 59.880 0.000 A 27 SER CB C 13 63.530 0.000 A 27 SER N N 15 117.020 0.000 A 28 ASN H H 1 8.029 0.000 A 28 ASN HA H 1 5.124 0.000 A 28 ASN HBx H 1 2.154 0.000 A 28 ASN HBy H 1 3.552 0.000 A 28 ASN HD2x H 1 7.645 0.000 A 28 ASN HD2y H 1 8.876 0.000 A 28 ASN C C 13 172.870 0.000 A 28 ASN CA C 13 52.840 0.000 A 28 ASN CB C 13 41.720 0.000 A 28 ASN N N 15 124.290 0.000 A 28 ASN ND2 N 15 118.000 0.000 A 29 ILE H H 1 9.742 0.000 A 29 ILE HA H 1 5.003 0.000 A 29 ILE HB H 1 2.207 0.000 A 29 ILE HD1% H 1 0.741 0.000 A 29 ILE HG1y H 1 1.580 0.000 A 29 ILE HG1x H 1 1.531 0.000 A 29 ILE HG2% H 1 0.779 0.000 A 29 ILE C C 13 175.650 0.000 A 29 ILE CA C 13 59.310 0.000 A 29 ILE CB C 13 37.490 0.000 A 29 ILE N N 15 125.750 0.000 A 30 ILE H H 1 9.053 0.000 A 30 ILE HA H 1 5.018 0.000 A 30 ILE HB H 1 1.780 0.000 A 30 ILE HD1% H 1 0.723 0.000 A 30 ILE HG1x H 1 1.282 0.000 A 30 ILE HG1y H 1 1.535 0.000 A 30 ILE HG2% H 1 0.772 0.000 A 30 ILE C C 13 175.810 0.000 A 30 ILE CA C 13 59.170 0.000 A 30 ILE CB C 13 39.260 0.000 A 30 ILE N N 15 129.090 0.000 A 31 GLY H H 1 7.966 0.000 A 31 GLY HAx H 1 4.026 0.000 A 31 GLY HAy H 1 4.320 0.000 A 31 GLY C C 13 170.600 0.000 A 31 GLY CA C 13 46.000 0.000 A 31 GLY N N 15 112.860 0.000 A 32 ARG H H 1 8.514 0.000 A 32 ARG HA H 1 5.098 0.000 A 32 ARG HBx H 1 1.549 0.000 A 32 ARG HBy H 1 1.789 0.000 A 32 ARG HDx H 1 3.122 0.000 A 32 ARG HDy H 1 3.446 0.000 A 32 ARG HGx H 1 1.396 0.000 A 32 ARG HGy H 1 1.483 0.000 A 32 ARG C C 13 177.850 0.000 A 32 ARG CA C 13 55.860 0.000 A 32 ARG CB C 13 32.310 0.000 A 32 ARG N N 15 120.770 0.000 A 33 GLY H H 1 9.038 0.000 A 33 GLY HAx H 1 3.876 0.000 A 33 GLY HAy H 1 4.191 0.000 A 33 GLY C C 13 173.900 0.000 A 33 GLY CA C 13 44.790 0.000 A 33 GLY N N 15 110.630 0.000 A 34 GLN H H 1 8.584 0.000 A 34 GLN HA H 1 4.804 0.000 A 34 GLN HBx H 1 2.072 0.000 A 34 GLN HBy H 1 2.103 0.000 A 34 GLN HE2x H 1 6.689 0.000 A 34 GLN HE2y H 1 7.367 0.000 A 34 GLN HGx H 1 2.412 0.000 A 34 GLN HGy H 1 2.437 0.000 A 34 GLN C C 13 176.150 0.000 A 34 GLN CA C 13 58.240 0.000 A 34 GLN CB C 13 28.970 0.000 A 34 GLN N N 15 117.840 0.000 A 34 GLN NE2 N 15 111.980 0.000 A 35 ASP H H 1 8.576 0.000 A 35 ASP HA H 1 4.536 0.000 A 35 ASP HBx H 1 2.637 0.000 A 35 ASP HBy H 1 2.658 0.000 A 35 ASP C C 13 175.660 0.000 A 35 ASP CA C 13 53.510 0.000 A 35 ASP CB C 13 40.290 0.000 A 35 ASP N N 15 115.380 0.000 A 36 ALA H H 1 7.238 0.000 A 36 ALA HA H 1 3.837 0.000 A 36 ALA HB% H 1 1.127 0.000 A 36 ALA C C 13 177.270 0.000 A 36 ALA CA C 13 52.540 0.000 A 36 ALA CB C 13 18.880 0.000 A 36 ALA N N 15 122.350 0.000 A 37 GLN H H 1 8.115 0.000 A 37 GLN HA H 1 4.206 0.000 A 37 GLN HBx H 1 2.072 0.000 A 37 GLN HBy H 1 2.339 0.000 A 37 GLN HE2x H 1 6.789 0.000 A 37 GLN HE2y H 1 7.865 0.000 A 37 GLN HGx H 1 2.549 0.000 A 37 GLN HGy H 1 2.679 0.000 A 37 GLN C C 13 175.980 0.000 A 37 GLN CA C 13 59.810 0.000 A 37 GLN CB C 13 29.650 0.000 A 37 GLN N N 15 121.940 0.000 A 37 GLN NE2 N 15 114.790 0.000 A 38 PHE H H 1 7.278 0.000 A 38 PHE HA H 1 4.840 0.000 A 38 PHE HBy H 1 2.672 0.000 A 38 PHE HBx H 1 1.434 0.000 A 38 PHE HDx H 1 6.976 0.000 A 38 PHE HDy H 1 6.976 0.000 A 38 PHE HEx H 1 6.832 0.000 A 38 PHE HEy H 1 6.832 0.000 A 38 PHE C C 13 172.370 0.000 A 38 PHE CA C 13 53.740 0.000 A 38 PHE CB C 13 38.580 0.000 A 38 PHE N N 15 118.250 0.000 A 39 ARG H H 1 8.654 0.000 A 39 ARG HA H 1 4.986 0.000 A 39 ARG HBx H 1 1.500 0.000 A 39 ARG HBy H 1 1.680 0.000 A 39 ARG HDx H 1 3.025 0.000 A 39 ARG HDy H 1 3.025 0.000 A 39 ARG HGx H 1 1.230 0.000 A 39 ARG HGy H 1 1.230 0.000 A 39 ARG C C 13 175.900 0.000 A 39 ARG CA C 13 54.750 0.000 A 39 ARG CB C 13 31.770 0.000 A 39 ARG N N 15 126.630 0.000 A 40 LEU H H 1 8.201 0.000 A 40 LEU HA H 1 4.525 0.000 A 40 LEU HBx H 1 1.178 0.000 A 40 LEU HBy H 1 1.434 0.000 A 40 LEU HDx% H 1 0.442 0.000 A 40 LEU HDy% H 1 0.310 0.000 A 40 LEU HG H 1 1.302 0.000 A 40 LEU C C 13 175.380 0.000 A 40 LEU CA C 13 51.330 0.000 A 40 LEU CB C 13 43.560 0.000 A 40 LEU N N 15 127.680 0.000 A 41 PRO HA H 1 4.538 0.000 A 41 PRO HBy H 1 2.135 0.000 A 41 PRO HBx H 1 1.949 0.000 A 41 PRO HDx H 1 3.418 0.000 A 41 PRO HDy H 1 3.731 0.000 A 41 PRO HGx H 1 2.013 0.000 A 41 PRO HGy H 1 2.033 0.000 A 41 PRO C C 13 175.450 0.000 A 41 PRO CA C 13 62.260 0.000 A 41 PRO CB C 13 30.200 0.000 A 42 ASP H H 1 6.855 0.000 A 42 ASP HA H 1 4.531 0.000 A 42 ASP HBx H 1 2.411 0.000 A 42 ASP HBy H 1 2.473 0.000 A 42 ASP C C 13 176.910 0.000 A 42 ASP CA C 13 53.340 0.000 A 42 ASP CB C 13 42.940 0.000 A 42 ASP N N 15 122.060 0.000 A 43 THR H H 1 8.521 0.000 A 43 THR HA H 1 3.912 0.000 A 43 THR HB H 1 4.414 0.000 A 43 THR HG2% H 1 1.334 0.000 A 43 THR C C 13 175.930 0.000 A 43 THR CA C 13 64.400 0.000 A 43 THR CB C 13 69.050 0.000 A 43 THR N N 15 117.080 0.000 A 44 GLY H H 1 9.304 0.000 A 44 GLY HAx H 1 3.544 0.000 A 44 GLY HAy H 1 4.192 0.000 A 44 GLY C C 13 173.710 0.000 A 44 GLY CA C 13 45.300 0.000 A 44 GLY N N 15 109.870 0.000 A 45 VAL H H 1 7.544 0.000 A 45 VAL HA H 1 4.327 0.000 A 45 VAL HB H 1 2.284 0.000 A 45 VAL HGx% H 1 0.956 0.000 A 45 VAL HGy% H 1 0.625 0.000 A 45 VAL C C 13 176.390 0.000 A 45 VAL CA C 13 60.820 0.000 A 45 VAL CB C 13 32.650 0.000 A 45 VAL N N 15 122.530 0.000 A 46 SER H H 1 11.924 0.000 A 46 SER HA H 1 4.642 0.000 A 46 SER HBx H 1 3.498 0.000 A 46 SER HBy H 1 4.176 0.000 A 46 SER C C 13 175.060 0.000 A 46 SER CA C 13 61.690 0.000 A 46 SER CB C 13 64.620 0.000 A 46 SER N N 15 127.390 0.000 A 47 ARG H H 1 9.770 0.000 A 47 ARG HA H 1 4.802 0.000 A 47 ARG HBx H 1 1.919 0.000 A 47 ARG HBy H 1 1.946 0.000 A 47 ARG C C 13 178.040 0.000 A 47 ARG CA C 13 61.120 0.000 A 47 ARG CB C 13 29.650 0.000 A 47 ARG N N 15 125.860 0.000 A 48 ARG H H 1 8.334 0.000 A 48 ARG HA H 1 4.007 0.000 A 48 ARG HBx H 1 1.727 0.000 A 48 ARG HBy H 1 1.769 0.000 A 48 ARG HDx H 1 3.133 0.000 A 48 ARG HDy H 1 3.344 0.000 A 48 ARG HGx H 1 1.375 0.000 A 48 ARG HGy H 1 1.514 0.000 A 48 ARG C C 13 172.380 0.000 A 48 ARG CA C 13 55.960 0.000 A 48 ARG CB C 13 31.360 0.000 A 48 ARG N N 15 117.660 0.000 A 49 HIS H H 1 8.130 0.000 A 49 HIS HA H 1 4.188 0.000 A 49 HIS HBx H 1 3.114 0.000 A 49 HIS HBy H 1 3.176 0.000 A 49 HIS HD2 H 1 6.702 0.000 A 49 HIS HE1 H 1 7.886 0.000 A 49 HIS HE2 H 1 10.580 0.000 A 49 HIS C C 13 174.470 0.000 A 49 HIS CA C 13 59.610 0.000 A 49 HIS CB C 13 35.170 0.000 A 49 HIS N N 15 124.520 0.000 A 49 HIS NE2 N 15 170.160 0.000 A 50 LEU H H 1 8.381 0.000 A 50 LEU HA H 1 5.328 0.000 A 50 LEU HBx H 1 1.704 0.000 A 50 LEU HBy H 1 1.801 0.000 A 50 LEU HDx% H 1 1.060 0.000 A 50 LEU HDy% H 1 0.869 0.000 A 50 LEU HG H 1 1.673 0.000 A 50 LEU C C 13 174.320 0.000 A 50 LEU CA C 13 53.380 0.000 A 50 LEU CB C 13 46.690 0.000 A 50 LEU N N 15 111.630 0.000 A 51 GLU H H 1 9.155 0.000 A 51 GLU HA H 1 5.290 0.000 A 51 GLU HBx H 1 1.934 0.000 A 51 GLU HBy H 1 2.067 0.000 A 51 GLU HGx H 1 2.180 0.000 A 51 GLU HGy H 1 2.230 0.000 A 51 GLU C C 13 175.810 0.000 A 51 GLU CA C 13 54.280 0.000 A 51 GLU CB C 13 34.630 0.000 A 51 GLU N N 15 121.710 0.000 A 52 ILE H H 1 9.499 0.000 A 52 ILE HA H 1 5.305 0.000 A 52 ILE HB H 1 1.665 0.000 A 52 ILE HD1% H 1 0.865 0.000 A 52 ILE HG1x H 1 1.491 0.000 A 52 ILE HG1y H 1 1.805 0.000 A 52 ILE HG2% H 1 0.780 0.000 A 52 ILE C C 13 176.700 0.000 A 52 ILE CA C 13 60.180 0.000 A 52 ILE CB C 13 40.700 0.000 A 52 ILE N N 15 125.110 0.000 A 53 ARG H H 1 9.585 0.000 A 53 ARG HA H 1 5.255 0.000 A 53 ARG HBx H 1 1.840 0.000 A 53 ARG HBy H 1 1.907 0.000 A 53 ARG HDx H 1 3.165 0.000 A 53 ARG HDy H 1 3.225 0.000 A 53 ARG HE H 1 7.260 0.000 A 53 ARG HGx H 1 1.492 0.000 A 53 ARG HGy H 1 1.671 0.000 A 53 ARG C C 13 175.370 0.000 A 53 ARG CA C 13 55.350 0.000 A 53 ARG CB C 13 31.830 0.000 A 53 ARG N N 15 131.670 0.000 A 53 ARG NE N 15 84.030 0.000 A 54 TRP H H 1 8.819 0.000 A 54 TRP HA H 1 5.916 0.000 A 54 TRP HBy H 1 3.597 0.000 A 54 TRP HBx H 1 2.882 0.000 A 54 TRP HD1 H 1 6.628 0.000 A 54 TRP HE1 H 1 10.510 0.000 A 54 TRP HE3 H 1 7.424 0.000 A 54 TRP HH2 H 1 6.834 0.000 A 54 TRP HZ2 H 1 7.345 0.000 A 54 TRP HZ3 H 1 6.660 0.000 A 54 TRP C C 13 175.120 0.000 A 54 TRP CA C 13 55.120 0.000 A 54 TRP CB C 13 33.880 0.000 A 54 TRP N N 15 125.870 0.000 A 54 TRP NE1 N 15 130.140 0.000 A 55 ASP H H 1 7.497 0.000 A 55 ASP HA H 1 4.752 0.000 A 55 ASP HBx H 1 2.453 0.000 A 55 ASP HBy H 1 2.994 0.000 A 55 ASP C C 13 176.430 0.000 A 55 ASP CA C 13 52.070 0.000 A 55 ASP CB C 13 41.580 0.000 A 55 ASP N N 15 126.100 0.000 A 56 GLY HAy H 1 3.962 0.000 A 56 GLY HAx H 1 2.581 0.000 A 56 GLY C C 13 172.460 0.000 A 56 GLY CA C 13 45.230 0.000 A 57 GLN H H 1 7.880 0.000 A 57 GLN HA H 1 4.256 0.000 A 57 GLN HBx H 1 1.847 0.000 A 57 GLN HBy H 1 1.952 0.000 A 57 GLN HGx H 1 2.059 0.000 A 57 GLN HGy H 1 2.102 0.000 A 57 GLN C C 13 174.850 0.000 A 57 GLN CA C 13 57.470 0.000 A 57 GLN CB C 13 32.310 0.000 A 57 GLN N N 15 118.310 0.000 A 58 VAL H H 1 9.562 0.000 A 58 VAL HA H 1 4.322 0.000 A 58 VAL HB H 1 1.928 0.000 A 58 VAL HGx% H 1 0.849 0.000 A 58 VAL HGy% H 1 0.830 0.000 A 58 VAL C C 13 173.880 0.000 A 58 VAL CA C 13 61.420 0.000 A 58 VAL CB C 13 35.580 0.000 A 58 VAL N N 15 122.290 0.000 A 59 ALA H H 1 9.773 0.000 A 59 ALA HA H 1 5.632 0.000 A 59 ALA HB% H 1 1.263 0.000 A 59 ALA C C 13 174.410 0.000 A 59 ALA CA C 13 49.960 0.000 A 59 ALA CB C 13 20.310 0.000 A 59 ALA N N 15 131.380 0.000 A 60 LEU H H 1 8.780 0.000 A 60 LEU HA H 1 4.895 0.000 A 60 LEU HBx H 1 1.552 0.000 A 60 LEU HBy H 1 1.822 0.000 A 60 LEU HDx% H 1 0.874 0.000 A 60 LEU HDy% H 1 0.851 0.000 A 60 LEU HG H 1 1.525 0.000 A 60 LEU C C 13 175.100 0.000 A 60 LEU CA C 13 53.710 0.000 A 60 LEU CB C 13 44.440 0.000 A 60 LEU N N 15 125.220 0.000 A 61 LEU H H 1 9.570 0.000 A 61 LEU HA H 1 5.165 0.000 A 61 LEU HBx H 1 1.662 0.000 A 61 LEU HBy H 1 2.139 0.000 A 61 LEU HDx% H 1 0.866 0.000 A 61 LEU HDy% H 1 0.738 0.000 A 61 LEU HG H 1 1.402 0.000 A 61 LEU C C 13 174.970 0.000 A 61 LEU CA C 13 54.950 0.000 A 61 LEU CB C 13 44.920 0.000 A 61 LEU N N 15 129.970 0.000 A 62 ALA H H 1 9.491 0.000 A 62 ALA HA H 1 5.389 0.000 A 62 ALA HB% H 1 1.480 0.000 A 62 ALA C C 13 176.470 0.000 A 62 ALA CA C 13 51.770 0.000 A 62 ALA CB C 13 22.020 0.000 A 62 ALA N N 15 128.270 0.000 A 63 ASP H H 1 8.553 0.000 A 63 ASP HA H 1 4.740 0.000 A 63 ASP HBx H 1 2.433 0.000 A 63 ASP HBy H 1 2.908 0.000 A 63 ASP C C 13 176.900 0.000 A 63 ASP CA C 13 55.290 0.000 A 63 ASP CB C 13 44.310 0.000 A 63 ASP N N 15 123.700 0.000 A 64 LEU H H 1 8.490 0.000 A 64 LEU HA H 1 4.601 0.000 A 64 LEU HBx H 1 1.355 0.000 A 64 LEU HBy H 1 1.505 0.000 A 64 LEU HDx% H 1 0.750 0.000 A 64 LEU HDy% H 1 0.633 0.000 A 64 LEU HG H 1 1.081 0.000 A 64 LEU C C 13 176.070 0.000 A 64 LEU CA C 13 53.210 0.000 A 64 LEU CB C 13 38.580 0.000 A 64 LEU N N 15 130.090 0.000 A 65 ASN H H 1 7.958 0.000 A 65 ASN HA H 1 4.327 0.000 A 65 ASN HBx H 1 2.761 0.000 A 65 ASN HBy H 1 2.980 0.000 A 65 ASN HD2x H 1 6.837 0.000 A 65 ASN HD2y H 1 7.568 0.000 A 65 ASN C C 13 175.630 0.000 A 65 ASN CA C 13 54.080 0.000 A 65 ASN CB C 13 37.420 0.000 A 65 ASN N N 15 119.190 0.000 A 65 ASN ND2 N 15 112.550 0.000 A 66 SER H H 1 8.772 0.000 A 66 SER HA H 1 3.942 0.000 A 66 SER HBx H 1 3.072 0.000 A 66 SER HBy H 1 3.280 0.000 A 66 SER C C 13 176.090 0.000 A 66 SER CA C 13 59.110 0.000 A 66 SER CB C 13 61.760 0.000 A 66 SER N N 15 116.840 0.000 A 67 THR H H 1 7.567 0.000 A 67 THR HA H 1 4.068 0.000 A 67 THR HB H 1 3.868 0.000 A 67 THR HG2% H 1 1.180 0.000 A 67 THR C C 13 176.440 0.000 A 67 THR CA C 13 67.120 0.000 A 67 THR CB C 13 68.510 0.000 A 67 THR N N 15 117.200 0.000 A 68 ASN H H 1 8.873 0.000 A 68 ASN HA H 1 4.975 0.000 A 68 ASN HBx H 1 2.887 0.000 A 68 ASN HBy H 1 3.094 0.000 A 68 ASN HD2x H 1 7.122 0.000 A 68 ASN HD2y H 1 8.069 0.000 A 68 ASN C C 13 176.300 0.000 A 68 ASN CA C 13 53.610 0.000 A 68 ASN CB C 13 40.700 0.000 A 68 ASN N N 15 114.500 0.000 A 68 ASN ND2 N 15 115.140 0.000 A 69 GLY H H 1 7.731 0.000 A 69 GLY HAx H 1 3.857 0.000 A 69 GLY HAy H 1 4.242 0.000 A 69 GLY C C 13 173.660 0.000 A 69 GLY CA C 13 45.060 0.000 A 69 GLY N N 15 111.100 0.000 A 70 THR H H 1 8.881 0.000 A 70 THR HA H 1 4.790 0.000 A 70 THR HB H 1 3.705 0.000 A 70 THR HG1 H 1 7.103 0.000 A 70 THR HG2% H 1 1.032 0.000 A 70 THR C C 13 174.010 0.000 A 70 THR CA C 13 63.900 0.000 A 70 THR CB C 13 71.850 0.000 A 70 THR N N 15 118.480 0.000 A 71 THR H H 1 8.373 0.000 A 71 THR HA H 1 5.181 0.000 A 71 THR HB H 1 3.568 0.000 A 71 THR HG2% H 1 0.888 0.000 A 71 THR C C 13 174.120 0.000 A 71 THR CA C 13 58.740 0.000 A 71 THR CB C 13 72.730 0.000 A 71 THR N N 15 114.730 0.000 A 72 VAL H H 1 8.490 0.000 A 72 VAL HA H 1 4.567 0.000 A 72 VAL HB H 1 0.231 0.000 A 72 VAL HGx% H 1 0.578 0.000 A 72 VAL HGy% H 1 0.483 0.000 A 72 VAL C C 13 176.350 0.000 A 72 VAL CA C 13 61.380 0.000 A 72 VAL CB C 13 33.130 0.000 A 72 VAL N N 15 119.830 0.000 A 73 ASN H H 1 9.648 0.000 A 73 ASN HA H 1 4.360 0.000 A 73 ASN HBx H 1 2.871 0.000 A 73 ASN HBy H 1 2.963 0.000 A 73 ASN HD2x H 1 7.648 0.000 A 73 ASN HD2y H 1 7.758 0.000 A 73 ASN C C 13 175.040 0.000 A 73 ASN CA C 13 54.750 0.000 A 73 ASN CB C 13 36.540 0.000 A 73 ASN N N 15 128.740 0.000 A 73 ASN ND2 N 15 116.900 0.000 A 74 ASN H H 1 8.967 0.000 A 74 ASN HA H 1 4.007 0.000 A 74 ASN HBx H 1 3.005 0.000 A 74 ASN HBy H 1 3.056 0.000 A 74 ASN HD2x H 1 6.873 0.000 A 74 ASN HD2y H 1 7.539 0.000 A 74 ASN C C 13 173.220 0.000 A 74 ASN CA C 13 55.050 0.000 A 74 ASN CB C 13 38.040 0.000 A 74 ASN N N 15 107.120 0.000 A 74 ASN ND2 N 15 113.590 0.000 A 75 ALA H H 1 7.786 0.000 A 75 ALA HA H 1 4.992 0.000 A 75 ALA HB% H 1 1.276 0.000 A 75 ALA C C 13 174.160 0.000 A 75 ALA CA C 13 49.320 0.000 A 75 ALA CB C 13 19.900 0.000 A 75 ALA N N 15 124.870 0.000 A 76 PRO HA H 1 4.617 0.000 A 76 PRO HBx H 1 1.920 0.000 A 76 PRO HBy H 1 2.327 0.000 A 76 PRO HDx H 1 3.742 0.000 A 76 PRO HDy H 1 3.852 0.000 A 76 PRO HGx H 1 1.989 0.000 A 76 PRO HGy H 1 2.181 0.000 A 76 PRO C C 13 177.350 0.000 A 76 PRO CA C 13 63.330 0.000 A 76 PRO CB C 13 32.240 0.000 A 77 VAL H H 1 8.013 0.000 A 77 VAL HA H 1 4.832 0.000 A 77 VAL HB H 1 2.100 0.000 A 77 VAL HGx% H 1 0.731 0.000 A 77 VAL HGy% H 1 0.504 0.000 A 77 VAL C C 13 174.370 0.000 A 77 VAL CA C 13 59.580 0.000 A 77 VAL CB C 13 36.400 0.000 A 77 VAL N N 15 114.850 0.000 A 78 GLN H H 1 8.756 0.000 A 78 GLN HA H 1 4.617 0.000 A 78 GLN HBx H 1 2.117 0.000 A 78 GLN HBy H 1 2.174 0.000 A 78 GLN HE2x H 1 6.980 0.000 A 78 GLN HE2y H 1 7.674 0.000 A 78 GLN HGx H 1 2.337 0.000 A 78 GLN HGy H 1 2.513 0.000 A 78 GLN C C 13 175.540 0.000 A 78 GLN CA C 13 57.630 0.000 A 78 GLN CB C 13 30.200 0.000 A 78 GLN N N 15 119.360 0.000 A 78 GLN NE2 N 15 112.920 0.000 A 79 GLU H H 1 7.794 0.000 A 79 GLU HA H 1 5.648 0.000 A 79 GLU HBx H 1 2.093 0.000 A 79 GLU HBy H 1 2.142 0.000 A 79 GLU HGx H 1 2.320 0.000 A 79 GLU HGy H 1 2.343 0.000 A 79 GLU C C 13 175.950 0.000 A 79 GLU CA C 13 55.120 0.000 A 79 GLU CB C 13 33.880 0.000 A 79 GLU N N 15 116.840 0.000 A 80 TRP H H 1 9.194 0.000 A 80 TRP HA H 1 4.778 0.000 A 80 TRP HBx H 1 2.836 0.000 A 80 TRP HBy H 1 3.298 0.000 A 80 TRP HD1 H 1 6.731 0.000 A 80 TRP HE1 H 1 10.590 0.000 A 80 TRP HE3 H 1 7.908 0.000 A 80 TRP HH2 H 1 7.276 0.000 A 80 TRP HZ2 H 1 7.649 0.000 A 80 TRP HZ3 H 1 7.213 0.000 A 80 TRP C C 13 173.420 0.000 A 80 TRP CA C 13 57.570 0.000 A 80 TRP CB C 13 34.900 0.000 A 80 TRP N N 15 123.520 0.000 A 80 TRP NE1 N 15 133.070 0.000 A 81 GLN H H 1 7.794 0.000 A 81 GLN HA H 1 4.712 0.000 A 81 GLN HBx H 1 1.653 0.000 A 81 GLN HBy H 1 1.689 0.000 A 81 GLN HE2x H 1 6.814 0.000 A 81 GLN HE2y H 1 7.477 0.000 A 81 GLN HGx H 1 2.123 0.000 A 81 GLN HGy H 1 2.168 0.000 A 81 GLN C C 13 173.800 0.000 A 81 GLN CA C 13 55.450 0.000 A 81 GLN CB C 13 28.150 0.000 A 81 GLN N N 15 129.910 0.000 A 81 GLN NE2 N 15 111.930 0.000 A 82 LEU H H 1 8.388 0.000 A 82 LEU HA H 1 4.634 0.000 A 82 LEU HBx H 1 1.452 0.000 A 82 LEU HBy H 1 1.936 0.000 A 82 LEU HDx% H 1 1.245 0.000 A 82 LEU HDy% H 1 0.935 0.000 A 82 LEU HG H 1 1.993 0.000 A 82 LEU C C 13 175.530 0.000 A 82 LEU CA C 13 55.820 0.000 A 82 LEU CB C 13 44.170 0.000 A 82 LEU N N 15 125.050 0.000 A 83 ALA H H 1 9.139 0.000 A 83 ALA HA H 1 4.696 0.000 A 83 ALA HB% H 1 1.484 0.000 A 83 ALA C C 13 176.180 0.000 A 83 ALA CA C 13 50.220 0.000 A 83 ALA CB C 13 23.180 0.000 A 83 ALA N N 15 125.110 0.000 A 84 ASP H H 1 8.506 0.000 A 84 ASP HA H 1 4.185 0.000 A 84 ASP HBy H 1 2.817 0.000 A 84 ASP HBx H 1 2.594 0.000 A 84 ASP C C 13 177.630 0.000 A 84 ASP CA C 13 57.300 0.000 A 84 ASP CB C 13 42.940 0.000 A 84 ASP N N 15 118.190 0.000 A 85 GLY H H 1 9.319 0.000 A 85 GLY HAx H 1 3.521 0.000 A 85 GLY HAy H 1 4.362 0.000 A 85 GLY C C 13 174.400 0.000 A 85 GLY CA C 13 45.230 0.000 A 85 GLY N N 15 116.260 0.000 A 86 ASP H H 1 8.099 0.000 A 86 ASP HA H 1 4.886 0.000 A 86 ASP HBx H 1 2.305 0.000 A 86 ASP HBy H 1 2.830 0.000 A 86 ASP C C 13 175.040 0.000 A 86 ASP CA C 13 56.090 0.000 A 86 ASP CB C 13 42.400 0.000 A 86 ASP N N 15 122.410 0.000 A 87 VAL H H 1 8.076 0.000 A 87 VAL HA H 1 4.844 0.000 A 87 VAL HB H 1 1.936 0.000 A 87 VAL HGx% H 1 1.019 0.000 A 87 VAL HGy% H 1 0.711 0.000 A 87 VAL C C 13 176.840 0.000 A 87 VAL CA C 13 61.220 0.000 A 87 VAL CB C 13 33.950 0.000 A 87 VAL N N 15 117.660 0.000 A 88 ILE H H 1 9.859 0.000 A 88 ILE HA H 1 4.628 0.000 A 88 ILE HB H 1 1.641 0.000 A 88 ILE HD1% H 1 0.631 0.000 A 88 ILE HG1x H 1 1.480 0.000 A 88 ILE HG1y H 1 1.545 0.000 A 88 ILE HG2% H 1 0.727 0.000 A 88 ILE C C 13 175.000 0.000 A 88 ILE CA C 13 59.950 0.000 A 88 ILE CB C 13 40.760 0.000 A 88 ILE N N 15 132.430 0.000 A 89 ARG H H 1 8.967 0.000 A 89 ARG HA H 1 5.267 0.000 A 89 ARG HBx H 1 1.418 0.000 A 89 ARG HBy H 1 1.765 0.000 A 89 ARG HDy H 1 3.054 0.000 A 89 ARG HDx H 1 3.022 0.000 A 89 ARG HE H 1 7.314 0.000 A 89 ARG HGx H 1 1.263 0.000 A 89 ARG HGy H 1 1.375 0.000 A 89 ARG C C 13 174.440 0.000 A 89 ARG CA C 13 55.520 0.000 A 89 ARG CB C 13 31.770 0.000 A 89 ARG N N 15 126.510 0.000 A 89 ARG NE N 15 86.200 0.000 A 90 LEU H H 1 8.076 0.000 A 90 LEU HA H 1 4.650 0.000 A 90 LEU HBx H 1 0.708 0.000 A 90 LEU HBy H 1 1.148 0.000 A 90 LEU HDx% H 1 0.571 0.000 A 90 LEU HDy% H 1 0.169 0.000 A 90 LEU HG H 1 1.432 0.000 A 90 LEU C C 13 175.020 0.000 A 90 LEU CA C 13 54.380 0.000 A 90 LEU CB C 13 42.330 0.000 A 90 LEU N N 15 125.630 0.000 A 91 GLY H H 1 9.883 0.000 A 91 GLY HAx H 1 3.345 0.000 A 91 GLY HAy H 1 3.584 0.000 A 91 GLY C C 13 175.080 0.000 A 91 GLY CA C 13 47.270 0.000 A 91 GLY N N 15 114.380 0.000 A 92 HIS H H 1 10.774 0.000 A 92 HIS HA H 1 4.799 0.000 A 92 HIS HBx H 1 3.067 0.000 A 92 HIS HBy H 1 3.390 0.000 A 92 HIS HD2 H 1 7.143 0.000 A 92 HIS HE1 H 1 8.209 0.000 A 92 HIS C C 13 175.080 0.000 A 92 HIS CA C 13 55.690 0.000 A 92 HIS CB C 13 29.450 0.000 A 92 HIS N N 15 130.440 0.000 A 93 SER H H 1 8.819 0.000 A 93 SER HA H 1 4.722 0.000 A 93 SER HBx H 1 3.387 0.000 A 93 SER HBy H 1 3.842 0.000 A 93 SER C C 13 172.090 0.000 A 93 SER CA C 13 59.740 0.000 A 93 SER CB C 13 65.710 0.000 A 93 SER N N 15 119.300 0.000 A 94 GLU H H 1 8.584 0.000 A 94 GLU HA H 1 5.172 0.000 A 94 GLU HBx H 1 1.757 0.000 A 94 GLU HBy H 1 1.907 0.000 A 94 GLU HGx H 1 2.180 0.000 A 94 GLU HGy H 1 2.221 0.000 A 94 GLU C C 13 174.550 0.000 A 94 GLU CA C 13 55.020 0.000 A 94 GLU CB C 13 32.720 0.000 A 94 GLU N N 15 123.000 0.000 A 95 ILE H H 1 9.366 0.000 A 95 ILE HA H 1 4.810 0.000 A 95 ILE HB H 1 1.545 0.000 A 95 ILE HD1% H 1 0.780 0.000 A 95 ILE HG1x H 1 1.430 0.000 A 95 ILE HG1y H 1 1.657 0.000 A 95 ILE HG2% H 1 0.705 0.000 A 95 ILE C C 13 174.050 0.000 A 95 ILE CA C 13 59.380 0.000 A 95 ILE CB C 13 42.400 0.000 A 95 ILE N N 15 122.760 0.000 A 96 ILE H H 1 9.179 0.000 A 96 ILE HA H 1 4.695 0.000 A 96 ILE HB H 1 1.697 0.000 A 96 ILE HD1% H 1 1.111 0.000 A 96 ILE HG1x H 1 1.562 0.000 A 96 ILE HG1y H 1 1.668 0.000 A 96 ILE HG2% H 1 0.797 0.000 A 96 ILE C C 13 175.770 0.000 A 96 ILE CA C 13 60.820 0.000 A 96 ILE CB C 13 40.700 0.000 A 96 ILE N N 15 127.980 0.000 A 97 VAL H H 1 8.780 0.000 A 97 VAL HA H 1 4.183 0.000 A 97 VAL HB H 1 2.343 0.000 A 97 VAL HGx% H 1 0.941 0.000 A 97 VAL HGy% H 1 0.679 0.000 A 97 VAL C C 13 175.060 0.000 A 97 VAL CA C 13 62.800 0.000 A 97 VAL CB C 13 32.520 0.000 A 97 VAL N N 15 128.620 0.000 A 98 ARG H H 1 8.991 0.000 A 98 ARG HA H 1 5.128 0.000 A 98 ARG HBx H 1 1.633 0.000 A 98 ARG HBy H 1 1.748 0.000 A 98 ARG HDx H 1 3.125 0.000 A 98 ARG HDy H 1 3.185 0.000 A 98 ARG HE H 1 7.370 0.000 A 98 ARG HGx H 1 1.425 0.000 A 98 ARG HGy H 1 1.550 0.000 A 98 ARG C C 13 175.140 0.000 A 98 ARG CA C 13 53.410 0.000 A 98 ARG CB C 13 32.110 0.000 A 98 ARG N N 15 127.390 0.000 A 98 ARG NE N 15 84.380 0.000 A 99 MET H H 1 9.241 0.000 A 99 MET HA H 1 5.049 0.000 A 99 MET HBy H 1 2.075 0.000 A 99 MET HBx H 1 1.748 0.000 A 99 MET HE% H 1 2.243 0.000 A 99 MET HGx H 1 2.389 0.000 A 99 MET HGy H 1 2.411 0.000 A 99 MET C C 13 174.840 0.000 A 99 MET CA C 13 55.220 0.000 A 99 MET CB C 13 34.760 0.000 A 99 MET N N 15 125.750 0.000 A 100 HIS H H 1 8.381 0.000 A 100 HIS HA H 1 4.492 0.000 A 100 HIS HBx H 1 3.043 0.000 A 100 HIS HBy H 1 3.153 0.000 A 100 HIS HD2 H 1 6.926 0.000 A 100 HIS HE1 H 1 7.971 0.000 A 100 HIS C C 13 178.850 0.000 A 100 HIS CA C 13 57.330 0.000 A 100 HIS CB C 13 31.080 0.000 A 100 HIS N N 15 125.520 0.000 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 noe _nef_distance_restraint_list.potential_type square-well-parabolic loop_ _nef_distance_restraint.index _nef_distance_restraint.restraint_id _nef_distance_restraint.chain_code_1 _nef_distance_restraint.sequence_code_1 _nef_distance_restraint.residue_name_1 _nef_distance_restraint.atom_name_1 _nef_distance_restraint.chain_code_2 _nef_distance_restraint.sequence_code_2 _nef_distance_restraint.residue_name_2 _nef_distance_restraint.atom_name_2 _nef_distance_restraint.weight _nef_distance_restraint.lower_limit _nef_distance_restraint.upper_limit 1 1 A 2 HIS H A 1 GLY HAy 1.0 1.8 3.10 2 1 A 1 GLY HAx A 2 HIS H 1.0 1.8 3.10 3 2 A 3 GLY H A 2 HIS HBy 1.0 1.8 4.09 4 2 A 2 HIS HBx A 3 GLY H 1.0 1.8 4.09 5 3 A 3 GLY H A 2 HIS HBy 1.0 1.8 4.72 6 4 A 2 HIS HBx A 3 GLY H 1.0 1.8 4.72 7 5 A 2 HIS H A 2 HIS HBy 1.0 1.8 3.46 8 5 A 2 HIS H A 2 HIS HBx 1.0 1.8 3.46 9 6 A 2 HIS H A 2 HIS HBy 1.0 1.8 3.99 10 7 A 2 HIS H A 2 HIS HBx 1.0 1.8 3.99 11 8 A 2 HIS H A 2 HIS HD2 1.0 1.8 4.52 12 9 A 2 HIS H A 3 GLY H 1.0 1.8 4.45 13 10 A 5 ALA HB% A 4 SER HBx 1.0 1.8 4.44 14 10 A 4 SER HBy A 5 ALA HB% 1.0 1.8 4.44 15 11 A 5 ALA H A 4 SER HBx 1.0 1.8 4.37 16 11 A 4 SER HBy A 5 ALA H 1.0 1.8 4.37 17 12 A 5 ALA HA A 6 GLY H 1.0 1.8 3.51 18 13 A 5 ALA HB% A 6 GLY H 1.0 1.8 4.18 19 14 A 5 ALA HB% A 5 ALA H 1.0 1.8 3.69 20 15 A 7 THR H A 6 GLY HAx 1.0 1.8 2.95 21 15 A 6 GLY HAy A 7 THR H 1.0 1.8 2.95 22 16 A 7 THR HA A 8 SER H 1.0 1.8 2.94 23 17 A 8 SER H A 7 THR HB 1.0 1.8 4.36 24 18 A 7 THR HB A 54 TRP HH2 1.0 1.8 4.22 25 19 A 7 THR HB A 54 TRP HZ2 1.0 1.8 3.91 26 20 A 8 SER H A 7 THR HG2% 1.0 1.8 3.64 27 21 A 7 THR HG2% A 9 VAL H 1.0 1.8 4.75 28 22 A 7 THR HG2% A 54 TRP HE1 1.0 1.8 5.50 29 23 A 54 TRP HZ2 A 7 THR HG2% 1.0 1.8 4.14 30 24 A 7 THR HG2% A 99 MET HGx 1.0 1.8 4.56 31 25 A 7 THR HG2% A 100 HIS H 1.0 1.8 4.66 32 26 A 7 THR H A 7 THR HB 1.0 1.8 3.52 33 27 A 7 THR H A 7 THR HG2% 1.0 1.8 4.24 34 28 A 7 THR H A 8 SER H 1.0 1.8 4.62 35 29 A 9 VAL H A 8 SER HA 1.0 1.8 2.75 36 30 A 8 SER HA A 100 HIS HBx 1.0 1.8 5.50 37 31 A 9 VAL H A 8 SER HBy 1.0 1.8 3.44 38 31 A 9 VAL H A 8 SER HBx 1.0 1.8 3.44 39 32 A 9 VAL H A 8 SER HBy 1.0 1.8 4.22 40 33 A 9 VAL H A 8 SER HBx 1.0 1.8 4.22 41 34 A 8 SER H A 8 SER HBy 1.0 1.8 3.64 42 34 A 8 SER H A 8 SER HBx 1.0 1.8 3.64 43 35 A 8 SER H A 9 VAL H 1.0 1.8 4.43 44 36 A 8 SER H A 100 HIS H 1.0 1.8 3.74 45 37 A 9 VAL HA A 9 VAL HGy% 1.0 1.8 3.13 46 37 A 9 VAL HA A 9 VAL HGx% 1.0 1.8 3.13 47 38 A 9 VAL HA A 9 VAL HGx% 1.0 1.8 3.77 48 39 A 9 VAL HA A 9 VAL HGy% 1.0 1.8 3.77 49 40 A 9 VAL HA A 10 THR H 1.0 1.8 2.73 50 41 A 9 VAL HA A 97 VAL HGx% 1.0 1.8 5.30 51 42 A 9 VAL HA A 98 ARG HA 1.0 1.8 5.50 52 43 A 9 VAL HA A 98 ARG H 1.0 1.8 4.73 53 44 A 9 VAL HA A 99 MET HA 1.0 1.8 3.35 54 45 A 9 VAL HA A 100 HIS HD2 1.0 1.8 4.79 55 46 A 10 THR H A 9 VAL HB 1.0 1.8 4.58 56 47 A 9 VAL HB A 54 TRP HE3 1.0 1.8 5.50 57 48 A 10 THR H A 9 VAL HGy% 1.0 1.8 3.13 58 48 A 9 VAL HGx% A 10 THR H 1.0 1.8 3.13 59 49 A 23 LEU HBx A 9 VAL HGy% 1.0 1.8 4.98 60 49 A 9 VAL HGx% A 23 LEU HBx 1.0 1.8 4.98 61 50 A 23 LEU HDx% A 9 VAL HGy% 1.0 1.8 3.88 62 50 A 9 VAL HGx% A 23 LEU HDx% 1.0 1.8 3.88 63 51 A 54 TRP HE1 A 9 VAL HGy% 1.0 1.8 5.44 64 51 A 54 TRP HE1 A 9 VAL HGx% 1.0 1.8 5.44 65 52 A 54 TRP HE3 A 9 VAL HGy% 1.0 1.8 5.22 66 52 A 9 VAL HGx% A 54 TRP HE3 1.0 1.8 5.22 67 53 A 54 TRP HH2 A 9 VAL HGy% 1.0 1.8 4.73 68 53 A 54 TRP HH2 A 9 VAL HGx% 1.0 1.8 4.73 69 54 A 54 TRP HZ2 A 9 VAL HGy% 1.0 1.8 4.66 70 54 A 54 TRP HZ2 A 9 VAL HGx% 1.0 1.8 4.66 71 55 A 54 TRP HZ3 A 9 VAL HGy% 1.0 1.8 4.72 72 55 A 9 VAL HGx% A 54 TRP HZ3 1.0 1.8 4.72 73 56 A 59 ALA HB% A 9 VAL HGy% 1.0 1.8 3.81 74 56 A 9 VAL HGx% A 59 ALA HB% 1.0 1.8 3.81 75 57 A 97 VAL HA A 9 VAL HGy% 1.0 1.8 5.00 76 57 A 9 VAL HGx% A 97 VAL HA 1.0 1.8 5.00 77 58 A 98 ARG H A 9 VAL HGy% 1.0 1.8 4.10 78 58 A 9 VAL HGx% A 98 ARG H 1.0 1.8 4.10 79 59 A 99 MET HA A 9 VAL HGy% 1.0 1.8 4.00 80 59 A 9 VAL HGx% A 99 MET HA 1.0 1.8 4.00 81 60 A 99 MET HBx A 9 VAL HGy% 1.0 1.8 5.44 82 60 A 9 VAL HGx% A 99 MET HBx 1.0 1.8 5.44 83 61 A 99 MET HGx A 9 VAL HGy% 1.0 1.8 3.53 84 61 A 99 MET HGx A 9 VAL HGx% 1.0 1.8 3.53 85 62 A 9 VAL HGx% A 10 THR H 1.0 1.8 4.25 86 63 A 9 VAL HGx% A 99 MET HA 1.0 1.8 4.82 87 64 A 99 MET HGx A 9 VAL HGx% 1.0 1.8 4.05 88 65 A 10 THR H A 9 VAL HGy% 1.0 1.8 4.25 89 66 A 99 MET HA A 9 VAL HGy% 1.0 1.8 4.82 90 67 A 99 MET HGx A 9 VAL HGy% 1.0 1.8 4.05 91 68 A 9 VAL H A 9 VAL HB 1.0 1.8 3.33 92 69 A 9 VAL H A 9 VAL HGy% 1.0 1.8 3.40 93 69 A 9 VAL H A 9 VAL HGx% 1.0 1.8 3.40 94 70 A 9 VAL H A 9 VAL HGx% 1.0 1.8 4.26 95 71 A 9 VAL H A 9 VAL HGy% 1.0 1.8 4.26 96 72 A 9 VAL H A 10 THR H 1.0 1.8 4.70 97 73 A 9 VAL H A 22 GLN HE2y 1.0 1.8 4.46 98 73 A 9 VAL H A 22 GLN HE2x 1.0 1.8 4.46 99 74 A 9 VAL H A 22 GLN HGy 1.0 1.8 4.21 100 74 A 9 VAL H A 22 GLN HGx 1.0 1.8 4.21 101 75 A 9 VAL H A 22 GLN HGy 1.0 1.8 5.01 102 76 A 9 VAL H A 22 GLN HGx 1.0 1.8 5.01 103 77 A 9 VAL H A 23 LEU HBy 1.0 1.8 5.50 104 78 A 9 VAL H A 23 LEU HDx% 1.0 1.8 4.74 105 79 A 9 VAL H A 23 LEU H 1.0 1.8 4.25 106 80 A 10 THR HA A 10 THR HG2% 1.0 1.8 3.33 107 81 A 10 THR HA A 11 LEU HG 1.0 1.8 4.76 108 82 A 10 THR HA A 11 LEU H 1.0 1.8 2.76 109 83 A 10 THR HA A 21 TYR H 1.0 1.8 4.41 110 84 A 10 THR HA A 23 LEU HG 1.0 1.8 5.13 111 85 A 11 LEU H A 10 THR HB 1.0 1.8 4.30 112 86 A 10 THR HB A 98 ARG HBx 1.0 1.8 4.02 113 87 A 98 ARG H A 10 THR HB 1.0 1.8 4.44 114 88 A 100 HIS HD2 A 10 THR HB 1.0 1.8 4.72 115 89 A 10 THR HG2% A 11 LEU HA 1.0 1.8 4.77 116 90 A 10 THR HG2% A 11 LEU H 1.0 1.8 3.36 117 91 A 10 THR HG2% A 12 GLN H 1.0 1.8 5.20 118 92 A 10 THR HG2% A 20 THR HA 1.0 1.8 4.33 119 93 A 10 THR HG2% A 20 THR HB 1.0 1.8 3.34 120 94 A 10 THR HG2% A 21 TYR H 1.0 1.8 3.52 121 95 A 10 THR HG2% A 22 GLN HA 1.0 1.8 4.33 122 96 A 10 THR HG2% A 22 GLN HGy 1.0 1.8 5.08 123 96 A 22 GLN HGx A 10 THR HG2% 1.0 1.8 5.08 124 97 A 10 THR HG2% A 22 GLN H 1.0 1.8 4.54 125 98 A 10 THR HG2% A 98 ARG HBx 1.0 1.8 5.50 126 99 A 100 HIS HD2 A 10 THR HG2% 1.0 1.8 5.14 127 100 A 10 THR H A 10 THR HB 1.0 1.8 3.33 128 101 A 10 THR H A 10 THR HG2% 1.0 1.8 4.37 129 102 A 10 THR H A 97 VAL HGx% 1.0 1.8 4.62 130 103 A 10 THR H A 97 VAL HGy% 1.0 1.8 5.42 131 104 A 10 THR H A 98 ARG HBx 1.0 1.8 4.34 132 105 A 10 THR H A 98 ARG H 1.0 1.8 4.00 133 106 A 10 THR H A 99 MET HA 1.0 1.8 3.91 134 107 A 99 MET HGx A 10 THR H 1.0 1.8 4.71 135 108 A 10 THR H A 100 HIS HD2 1.0 1.8 4.26 136 109 A 11 LEU HA A 11 LEU HDy% 1.0 1.8 3.73 137 109 A 11 LEU HA A 11 LEU HDx% 1.0 1.8 3.73 138 110 A 11 LEU HA A 12 GLN H 1.0 1.8 2.87 139 111 A 11 LEU HA A 95 ILE HG1y 1.0 1.8 5.28 140 111 A 11 LEU HA A 95 ILE HG1x 1.0 1.8 5.28 141 112 A 11 LEU HBy A 11 LEU HDy% 1.0 1.8 2.82 142 112 A 11 LEU HBx A 11 LEU HDy% 1.0 1.8 2.82 143 112 A 11 LEU HDx% A 11 LEU HBy 1.0 1.8 2.82 144 112 A 11 LEU HDx% A 11 LEU HBx 1.0 1.8 2.82 145 113 A 21 TYR H A 11 LEU HBy 1.0 1.8 4.61 146 113 A 21 TYR H A 11 LEU HBx 1.0 1.8 4.61 147 114 A 11 LEU HDx% A 21 TYR HBy 1.0 1.8 3.74 148 114 A 11 LEU HDy% A 21 TYR HBy 1.0 1.8 3.74 149 114 A 21 TYR HBx A 11 LEU HDy% 1.0 1.8 3.74 150 114 A 11 LEU HDx% A 21 TYR HBx 1.0 1.8 3.74 151 115 A 11 LEU HG A 12 GLN H 1.0 1.8 4.95 152 116 A 11 LEU HG A 21 TYR HBy 1.0 1.8 3.70 153 116 A 11 LEU HG A 21 TYR HBx 1.0 1.8 3.70 154 117 A 11 LEU HG A 21 TYR HD% 1.0 1.8 4.17 155 118 A 11 LEU HG A 21 TYR H 1.0 1.8 4.20 156 119 A 11 LEU H A 11 LEU HBy 1.0 1.8 3.30 157 119 A 11 LEU H A 11 LEU HBx 1.0 1.8 3.30 158 120 A 11 LEU H A 11 LEU HBy 1.0 1.8 3.81 159 121 A 11 LEU H A 11 LEU HBx 1.0 1.8 3.81 160 122 A 11 LEU H A 11 LEU HDy% 1.0 1.8 3.51 161 122 A 11 LEU H A 11 LEU HDx% 1.0 1.8 3.51 162 123 A 11 LEU H A 11 LEU HDx% 1.0 1.8 4.06 163 124 A 11 LEU H A 11 LEU HDy% 1.0 1.8 4.06 164 125 A 11 LEU HG A 11 LEU H 1.0 1.8 3.73 165 126 A 11 LEU H A 21 TYR HBy 1.0 1.8 4.36 166 126 A 11 LEU H A 21 TYR HBx 1.0 1.8 4.36 167 127 A 11 LEU H A 21 TYR HD% 1.0 1.8 4.66 168 128 A 11 LEU H A 21 TYR H 1.0 1.8 3.59 169 129 A 11 LEU H A 22 GLN H 1.0 1.8 5.50 170 130 A 23 LEU H A 11 LEU H 1.0 1.8 4.93 171 131 A 12 GLN HA A 13 LEU HBx 1.0 1.8 5.09 172 131 A 12 GLN HA A 13 LEU HBy 1.0 1.8 5.09 173 132 A 12 GLN HA A 13 LEU H 1.0 1.8 3.43 174 133 A 20 THR HA A 12 GLN HA 1.0 1.8 5.07 175 134 A 20 THR HB A 12 GLN HA 1.0 1.8 4.21 176 135 A 12 GLN HA A 20 THR HG2% 1.0 1.8 3.46 177 136 A 12 GLN HBy A 12 GLN HE2y 1.0 1.8 3.56 178 136 A 12 GLN HBx A 12 GLN HE2y 1.0 1.8 3.56 179 136 A 12 GLN HE2x A 12 GLN HBy 1.0 1.8 3.56 180 136 A 12 GLN HBx A 12 GLN HE2x 1.0 1.8 3.56 181 137 A 20 THR HB A 12 GLN HBy 1.0 1.8 5.30 182 137 A 20 THR HB A 12 GLN HBx 1.0 1.8 5.30 183 138 A 20 THR HG2% A 12 GLN HBy 1.0 1.8 4.61 184 138 A 20 THR HG2% A 12 GLN HBx 1.0 1.8 4.61 185 139 A 96 ILE HB A 12 GLN HBy 1.0 1.8 3.75 186 139 A 12 GLN HBx A 96 ILE HB 1.0 1.8 3.75 187 140 A 96 ILE H A 12 GLN HBy 1.0 1.8 3.75 188 140 A 12 GLN HBx A 96 ILE H 1.0 1.8 3.75 189 141 A 96 ILE H A 12 GLN HBy 1.0 1.8 4.46 190 142 A 12 GLN HBx A 96 ILE H 1.0 1.8 4.46 191 143 A 13 LEU H A 12 GLN HE2y 1.0 1.8 4.59 192 143 A 13 LEU H A 12 GLN HE2x 1.0 1.8 4.59 193 144 A 20 THR HG2% A 12 GLN HE2y 1.0 1.8 4.80 194 144 A 20 THR HG2% A 12 GLN HE2x 1.0 1.8 4.80 195 145 A 12 GLN HE2y A 12 GLN HGy 1.0 1.8 3.26 196 145 A 12 GLN HE2x A 12 GLN HGy 1.0 1.8 3.26 197 145 A 12 GLN HGx A 12 GLN HE2y 1.0 1.8 3.26 198 145 A 12 GLN HE2x A 12 GLN HGx 1.0 1.8 3.26 199 146 A 13 LEU H A 12 GLN HGy 1.0 1.8 3.96 200 146 A 13 LEU H A 12 GLN HGx 1.0 1.8 3.96 201 147 A 20 THR HA A 12 GLN HGy 1.0 1.8 4.49 202 147 A 20 THR HA A 12 GLN HGx 1.0 1.8 4.49 203 148 A 12 GLN H A 12 GLN HBy 1.0 1.8 3.02 204 148 A 12 GLN H A 12 GLN HBx 1.0 1.8 3.02 205 149 A 12 GLN H A 12 GLN HBy 1.0 1.8 3.56 206 150 A 12 GLN H A 12 GLN HBx 1.0 1.8 3.56 207 151 A 12 GLN H A 12 GLN HGy 1.0 1.8 4.56 208 151 A 12 GLN H A 12 GLN HGx 1.0 1.8 4.56 209 152 A 12 GLN H A 12 GLN HGy 1.0 1.8 5.27 210 153 A 12 GLN H A 12 GLN HGx 1.0 1.8 5.27 211 154 A 12 GLN H A 13 LEU H 1.0 1.8 4.47 212 155 A 12 GLN H A 20 THR HG2% 1.0 1.8 4.83 213 156 A 12 GLN H A 95 ILE HD1% 1.0 1.8 3.21 214 157 A 12 GLN H A 95 ILE HG1x 1.0 1.8 4.55 215 158 A 12 GLN H A 96 ILE HB 1.0 1.8 4.25 216 159 A 97 VAL HA A 12 GLN H 1.0 1.8 4.14 217 160 A 98 ARG HBx A 12 GLN H 1.0 1.8 5.26 218 161 A 98 ARG H A 12 GLN H 1.0 1.8 4.78 219 162 A 13 LEU HA A 13 LEU HG 1.0 1.8 3.87 220 163 A 13 LEU HA A 14 ASP H 1.0 1.8 2.95 221 164 A 14 ASP H A 13 LEU HBx 1.0 1.8 4.24 222 164 A 13 LEU HBy A 14 ASP H 1.0 1.8 4.24 223 165 A 19 ARG HBy A 13 LEU HBx 1.0 1.8 4.58 224 165 A 13 LEU HBy A 19 ARG HBy 1.0 1.8 4.58 225 166 A 14 ASP H A 13 LEU HDx% 1.0 1.8 3.32 226 166 A 14 ASP H A 13 LEU HDy% 1.0 1.8 3.32 227 167 A 15 ASP H A 13 LEU HDx% 1.0 1.8 3.86 228 167 A 13 LEU HDy% A 15 ASP H 1.0 1.8 3.86 229 168 A 19 ARG HBy A 13 LEU HDx% 1.0 1.8 3.51 230 168 A 19 ARG HBy A 13 LEU HDy% 1.0 1.8 3.51 231 169 A 19 ARG H A 13 LEU HDx% 1.0 1.8 4.91 232 169 A 13 LEU HDy% A 19 ARG H 1.0 1.8 4.91 233 170 A 13 LEU HG A 14 ASP H 1.0 1.8 4.21 234 171 A 13 LEU HG A 15 ASP H 1.0 1.8 4.60 235 172 A 13 LEU HG A 19 ARG H 1.0 1.8 4.70 236 173 A 13 LEU H A 13 LEU HDx% 1.0 1.8 4.48 237 173 A 13 LEU H A 13 LEU HDy% 1.0 1.8 4.48 238 174 A 13 LEU H A 13 LEU HG 1.0 1.8 4.19 239 175 A 13 LEU H A 14 ASP H 1.0 1.8 4.72 240 176 A 13 LEU H A 19 ARG H 1.0 1.8 4.11 241 177 A 20 THR HA A 13 LEU H 1.0 1.8 3.96 242 178 A 13 LEU H A 20 THR HG2% 1.0 1.8 4.23 243 179 A 15 ASP H A 14 ASP HA 1.0 1.8 3.10 244 180 A 14 ASP HA A 16 GLY H 1.0 1.8 4.41 245 181 A 15 ASP H A 14 ASP HBx 1.0 1.8 4.07 246 181 A 15 ASP H A 14 ASP HBy 1.0 1.8 4.07 247 182 A 15 ASP H A 14 ASP HBy 1.0 1.8 4.67 248 183 A 15 ASP H A 14 ASP HBx 1.0 1.8 4.67 249 184 A 14 ASP H A 14 ASP HBy 1.0 1.8 3.46 250 185 A 14 ASP H A 14 ASP HBx 1.0 1.8 3.46 251 186 A 14 ASP H A 15 ASP HA 1.0 1.8 4.88 252 187 A 14 ASP H A 15 ASP H 1.0 1.8 4.41 253 188 A 17 SER H A 15 ASP HBx 1.0 1.8 4.49 254 188 A 15 ASP HBy A 17 SER H 1.0 1.8 4.49 255 189 A 15 ASP H A 15 ASP HBx 1.0 1.8 3.36 256 189 A 15 ASP H A 15 ASP HBy 1.0 1.8 3.36 257 190 A 15 ASP H A 15 ASP HBy 1.0 1.8 3.99 258 191 A 15 ASP H A 15 ASP HBx 1.0 1.8 3.99 259 192 A 15 ASP H A 16 GLY H 1.0 1.8 3.62 260 193 A 15 ASP H A 17 SER H 1.0 1.8 3.64 261 194 A 15 ASP H A 18 GLY H 1.0 1.8 3.82 262 195 A 16 GLY H A 17 SER H 1.0 1.8 4.02 263 196 A 16 GLY H A 18 GLY H 1.0 1.8 4.61 264 197 A 17 SER H A 17 SER HBx 1.0 1.8 3.30 265 197 A 17 SER H A 17 SER HBy 1.0 1.8 3.30 266 198 A 17 SER H A 18 GLY H 1.0 1.8 3.20 267 199 A 19 ARG H A 17 SER H 1.0 1.8 5.03 268 200 A 18 GLY HAx A 19 ARG HGx 1.0 1.8 5.18 269 200 A 18 GLY HAy A 19 ARG HGx 1.0 1.8 5.18 270 200 A 19 ARG HGy A 18 GLY HAx 1.0 1.8 5.18 271 200 A 18 GLY HAy A 19 ARG HGy 1.0 1.8 5.18 272 201 A 18 GLY H A 19 ARG HGx 1.0 1.8 4.90 273 201 A 18 GLY H A 19 ARG HGy 1.0 1.8 4.90 274 202 A 19 ARG H A 18 GLY H 1.0 1.8 3.44 275 203 A 19 ARG HA A 19 ARG HDx 1.0 1.8 4.31 276 203 A 19 ARG HA A 19 ARG HDy 1.0 1.8 4.31 277 204 A 19 ARG HA A 19 ARG HGx 1.0 1.8 3.45 278 204 A 19 ARG HGy A 19 ARG HA 1.0 1.8 3.45 279 205 A 20 THR HA A 19 ARG HA 1.0 1.8 5.50 280 206 A 20 THR HG2% A 19 ARG HA 1.0 1.8 4.35 281 207 A 19 ARG HA A 20 THR H 1.0 1.8 2.68 282 208 A 20 THR HG2% A 19 ARG HBx 1.0 1.8 4.61 283 209 A 20 THR H A 19 ARG HBx 1.0 1.8 3.61 284 210 A 21 TYR H A 19 ARG HBx 1.0 1.8 5.50 285 211 A 19 ARG HBy A 20 THR H 1.0 1.8 4.10 286 212 A 20 THR H A 19 ARG HDx 1.0 1.8 4.61 287 212 A 19 ARG HDy A 20 THR H 1.0 1.8 4.61 288 213 A 20 THR H A 19 ARG HGx 1.0 1.8 4.25 289 213 A 19 ARG HGy A 20 THR H 1.0 1.8 4.25 290 214 A 19 ARG H A 19 ARG HBx 1.0 1.8 3.72 291 215 A 19 ARG HBy A 19 ARG H 1.0 1.8 3.11 292 216 A 19 ARG H A 19 ARG HGx 1.0 1.8 4.09 293 216 A 19 ARG H A 19 ARG HGy 1.0 1.8 4.09 294 217 A 19 ARG H A 20 THR H 1.0 1.8 4.57 295 218 A 20 THR HA A 20 THR HG2% 1.0 1.8 3.33 296 219 A 20 THR HA A 21 TYR HA 1.0 1.8 5.50 297 220 A 20 THR HA A 21 TYR HBy 1.0 1.8 5.29 298 220 A 20 THR HA A 21 TYR HBx 1.0 1.8 5.29 299 221 A 21 TYR H A 20 THR HA 1.0 1.8 2.85 300 222 A 20 THR HB A 21 TYR HBy 1.0 1.8 5.32 301 222 A 20 THR HB A 21 TYR HBx 1.0 1.8 5.32 302 223 A 21 TYR H A 20 THR HB 1.0 1.8 3.09 303 224 A 21 TYR H A 20 THR HG2% 1.0 1.8 4.09 304 225 A 20 THR HB A 20 THR H 1.0 1.8 3.99 305 226 A 20 THR HG2% A 20 THR H 1.0 1.8 3.56 306 227 A 21 TYR H A 20 THR H 1.0 1.8 4.47 307 228 A 21 TYR HD% A 21 TYR HA 1.0 1.8 3.62 308 229 A 22 GLN H A 21 TYR HA 1.0 1.8 2.63 309 230 A 22 GLN H A 21 TYR HBy 1.0 1.8 4.45 310 230 A 22 GLN H A 21 TYR HBx 1.0 1.8 4.45 311 231 A 22 GLN H A 21 TYR HD% 1.0 1.8 3.72 312 232 A 21 TYR HD% A 23 LEU HA 1.0 1.8 4.38 313 233 A 23 LEU HDx% A 21 TYR HD% 1.0 1.8 5.50 314 234 A 23 LEU HG A 21 TYR HD% 1.0 1.8 4.79 315 235 A 21 TYR HE% A 24 ARG H 1.0 1.8 4.77 316 236 A 21 TYR H A 21 TYR HBy 1.0 1.8 3.52 317 237 A 21 TYR H A 21 TYR HBx 1.0 1.8 3.52 318 238 A 21 TYR H A 21 TYR HD% 1.0 1.8 4.50 319 239 A 21 TYR H A 22 GLN H 1.0 1.8 4.63 320 240 A 22 GLN HA A 23 LEU HA 1.0 1.8 5.48 321 241 A 23 LEU H A 22 GLN HA 1.0 1.8 2.86 322 242 A 22 GLN HBx A 22 GLN HE2y 1.0 1.8 4.42 323 242 A 22 GLN HBy A 22 GLN HE2y 1.0 1.8 4.42 324 242 A 22 GLN HE2x A 22 GLN HBx 1.0 1.8 4.42 325 242 A 22 GLN HE2x A 22 GLN HBy 1.0 1.8 4.42 326 243 A 23 LEU H A 22 GLN HBx 1.0 1.8 4.10 327 243 A 23 LEU H A 22 GLN HBy 1.0 1.8 4.10 328 244 A 22 GLN HE2x A 22 GLN HGy 1.0 1.8 2.94 329 244 A 22 GLN HE2y A 22 GLN HGy 1.0 1.8 2.94 330 244 A 22 GLN HGx A 22 GLN HE2y 1.0 1.8 2.94 331 244 A 22 GLN HE2x A 22 GLN HGx 1.0 1.8 2.94 332 245 A 23 LEU H A 22 GLN HGy 1.0 1.8 3.62 333 245 A 22 GLN HGx A 23 LEU H 1.0 1.8 3.62 334 246 A 22 GLN H A 22 GLN HBx 1.0 1.8 2.72 335 246 A 22 GLN H A 22 GLN HBy 1.0 1.8 2.72 336 247 A 22 GLN H A 22 GLN HGy 1.0 1.8 4.56 337 247 A 22 GLN HGx A 22 GLN H 1.0 1.8 4.56 338 248 A 22 GLN H A 22 GLN HGy 1.0 1.8 5.34 339 249 A 22 GLN HGx A 22 GLN H 1.0 1.8 5.34 340 250 A 23 LEU HDx% A 23 LEU HA 1.0 1.8 4.53 341 251 A 23 LEU HA A 23 LEU HDy% 1.0 1.8 3.23 342 252 A 23 LEU HA A 24 ARG HA 1.0 1.8 5.50 343 253 A 23 LEU HA A 24 ARG H 1.0 1.8 2.98 344 254 A 23 LEU HA A 28 ASN HD2x 1.0 1.8 4.42 345 254 A 23 LEU HA A 28 ASN HD2y 1.0 1.8 4.42 346 255 A 23 LEU HBy A 24 ARG H 1.0 1.8 3.88 347 256 A 23 LEU HBy A 28 ASN HD2x 1.0 1.8 4.07 348 256 A 23 LEU HBy A 28 ASN HD2y 1.0 1.8 4.07 349 257 A 23 LEU HBy A 28 ASN HD2x 1.0 1.8 4.68 350 258 A 23 LEU HBy A 28 ASN HD2y 1.0 1.8 4.68 351 259 A 23 LEU HBy A 54 TRP HBy 1.0 1.8 4.41 352 260 A 23 LEU HBy A 54 TRP HD1 1.0 1.8 4.54 353 261 A 54 TRP HE1 A 23 LEU HBy 1.0 1.8 5.50 354 262 A 23 LEU HBx A 23 LEU HDx% 1.0 1.8 3.51 355 263 A 54 TRP HE1 A 23 LEU HBx 1.0 1.8 5.50 356 264 A 23 LEU HDx% A 52 ILE HB 1.0 1.8 4.31 357 265 A 23 LEU HDx% A 52 ILE HD1% 1.0 1.8 3.21 358 266 A 23 LEU HDx% A 52 ILE HG2% 1.0 1.8 3.19 359 267 A 23 LEU HDx% A 54 TRP HA 1.0 1.8 4.67 360 268 A 23 LEU HDx% A 54 TRP HBx 1.0 1.8 4.00 361 269 A 23 LEU HDx% A 54 TRP HBy 1.0 1.8 4.23 362 270 A 23 LEU HDx% A 54 TRP HD1 1.0 1.8 4.87 363 271 A 54 TRP HE3 A 23 LEU HDx% 1.0 1.8 4.77 364 272 A 23 LEU HDx% A 59 ALA HA 1.0 1.8 5.36 365 273 A 24 ARG H A 23 LEU HDy% 1.0 1.8 3.83 366 274 A 23 LEU HDy% A 28 ASN HD2x 1.0 1.8 4.44 367 275 A 23 LEU HDy% A 28 ASN HD2y 1.0 1.8 4.44 368 276 A 23 LEU HDy% A 52 ILE HA 1.0 1.8 5.27 369 277 A 23 LEU HBy A 23 LEU H 1.0 1.8 3.62 370 278 A 23 LEU HDx% A 23 LEU H 1.0 1.8 3.78 371 279 A 23 LEU H A 23 LEU HDy% 1.0 1.8 3.71 372 280 A 23 LEU H A 23 LEU HG 1.0 1.8 3.20 373 281 A 23 LEU H A 24 ARG H 1.0 1.8 4.93 374 282 A 24 ARG HA A 24 ARG HDx 1.0 1.8 4.73 375 282 A 24 ARG HA A 24 ARG HDy 1.0 1.8 4.73 376 283 A 24 ARG HA A 24 ARG HDy 1.0 1.8 5.50 377 284 A 24 ARG HA A 24 ARG HDx 1.0 1.8 5.50 378 285 A 24 ARG HA A 25 GLU H 1.0 1.8 2.78 379 286 A 24 ARG HBx A 24 ARG HDx 1.0 1.8 3.12 380 286 A 24 ARG HBy A 24 ARG HDx 1.0 1.8 3.12 381 286 A 24 ARG HDy A 24 ARG HBx 1.0 1.8 3.12 382 286 A 24 ARG HDy A 24 ARG HBy 1.0 1.8 3.12 383 287 A 25 GLU H A 24 ARG HBx 1.0 1.8 2.65 384 287 A 25 GLU H A 24 ARG HBy 1.0 1.8 2.65 385 288 A 24 ARG HDy A 25 GLU H 1.0 1.8 5.50 386 289 A 25 GLU H A 24 ARG HDx 1.0 1.8 5.50 387 290 A 25 GLU H A 24 ARG HGx 1.0 1.8 4.54 388 290 A 25 GLU H A 24 ARG HGy 1.0 1.8 4.54 389 291 A 24 ARG H A 24 ARG HBx 1.0 1.8 3.47 390 291 A 24 ARG H A 24 ARG HBy 1.0 1.8 3.47 391 292 A 24 ARG H A 24 ARG HGx 1.0 1.8 3.69 392 292 A 24 ARG H A 24 ARG HGy 1.0 1.8 3.69 393 293 A 24 ARG H A 28 ASN HD2x 1.0 1.8 3.85 394 293 A 24 ARG H A 28 ASN HD2y 1.0 1.8 3.85 395 294 A 24 ARG H A 28 ASN HD2x 1.0 1.8 4.41 396 295 A 24 ARG H A 28 ASN HD2y 1.0 1.8 4.41 397 296 A 24 ARG H A 54 TRP HD1 1.0 1.8 5.04 398 297 A 25 GLU HA A 26 GLY H 1.0 1.8 3.33 399 298 A 54 TRP HE1 A 25 GLU HA 1.0 1.8 4.21 400 299 A 26 GLY H A 25 GLU HBx 1.0 1.8 4.47 401 299 A 26 GLY H A 25 GLU HBy 1.0 1.8 4.47 402 300 A 54 TRP HD1 A 25 GLU HBx 1.0 1.8 4.68 403 300 A 54 TRP HD1 A 25 GLU HBy 1.0 1.8 4.68 404 301 A 54 TRP HE1 A 25 GLU HBx 1.0 1.8 4.75 405 301 A 54 TRP HE1 A 25 GLU HBy 1.0 1.8 4.75 406 302 A 25 GLU H A 26 GLY H 1.0 1.8 4.72 407 303 A 54 TRP HD1 A 25 GLU H 1.0 1.8 3.91 408 304 A 27 SER HBy A 26 GLY HAy 1.0 1.8 4.23 409 304 A 26 GLY HAx A 27 SER HBy 1.0 1.8 4.23 410 305 A 27 SER H A 26 GLY HAy 1.0 1.8 2.62 411 305 A 26 GLY HAx A 27 SER H 1.0 1.8 2.62 412 306 A 27 SER H A 26 GLY HAy 1.0 1.8 3.06 413 307 A 26 GLY HAx A 27 SER H 1.0 1.8 3.06 414 308 A 26 GLY H A 27 SER H 1.0 1.8 4.69 415 309 A 54 TRP HD1 A 26 GLY H 1.0 1.8 4.66 416 310 A 26 GLY H A 54 TRP H 1.0 1.8 4.04 417 311 A 27 SER HA A 28 ASN HA 1.0 1.8 5.10 418 312 A 28 ASN HD2x A 27 SER HA 1.0 1.8 4.06 419 312 A 28 ASN HD2y A 27 SER HA 1.0 1.8 4.06 420 313 A 28 ASN HD2x A 27 SER HA 1.0 1.8 4.70 421 314 A 28 ASN HD2y A 27 SER HA 1.0 1.8 4.70 422 315 A 27 SER HA A 28 ASN H 1.0 1.8 2.89 423 316 A 27 SER HA A 53 ARG HA 1.0 1.8 3.54 424 317 A 27 SER HA A 53 ARG HDx 1.0 1.8 5.34 425 317 A 27 SER HA A 53 ARG HDy 1.0 1.8 5.34 426 318 A 27 SER HA A 53 ARG HGx 1.0 1.8 3.77 427 318 A 27 SER HA A 53 ARG HGy 1.0 1.8 3.77 428 319 A 54 TRP HA A 27 SER HA 1.0 1.8 5.50 429 320 A 54 TRP HBx A 27 SER HA 1.0 1.8 4.38 430 321 A 54 TRP H A 27 SER HA 1.0 1.8 3.90 431 322 A 27 SER HBy A 28 ASN H 1.0 1.8 4.32 432 323 A 27 SER HBy A 53 ARG HGx 1.0 1.8 4.56 433 323 A 27 SER HBy A 53 ARG HGy 1.0 1.8 4.56 434 324 A 28 ASN HD2x A 27 SER HBx 1.0 1.8 5.34 435 324 A 28 ASN HD2y A 27 SER HBx 1.0 1.8 5.34 436 325 A 28 ASN H A 27 SER HBx 1.0 1.8 4.21 437 326 A 52 ILE HG2% A 27 SER HBx 1.0 1.8 5.48 438 327 A 53 ARG HA A 27 SER HBx 1.0 1.8 5.31 439 328 A 27 SER HBx A 53 ARG HGx 1.0 1.8 4.52 440 328 A 53 ARG HGy A 27 SER HBx 1.0 1.8 4.52 441 329 A 27 SER HBy A 27 SER H 1.0 1.8 3.38 442 330 A 27 SER H A 28 ASN H 1.0 1.8 4.63 443 331 A 27 SER H A 53 ARG HGx 1.0 1.8 5.34 444 331 A 27 SER H A 53 ARG HGy 1.0 1.8 5.34 445 332 A 27 SER H A 54 TRP H 1.0 1.8 4.86 446 333 A 28 ASN HD2x A 28 ASN HA 1.0 1.8 4.51 447 333 A 28 ASN HD2y A 28 ASN HA 1.0 1.8 4.51 448 334 A 28 ASN HA A 29 ILE H 1.0 1.8 2.82 449 335 A 28 ASN HA A 37 GLN HBy 1.0 1.8 5.15 450 335 A 28 ASN HA A 37 GLN HBx 1.0 1.8 5.15 451 336 A 28 ASN HA A 37 GLN HGy 1.0 1.8 4.38 452 336 A 28 ASN HA A 37 GLN HGx 1.0 1.8 4.38 453 337 A 28 ASN HD2y A 28 ASN HBx 1.0 1.8 3.20 454 337 A 28 ASN HD2x A 28 ASN HBy 1.0 1.8 3.20 455 337 A 28 ASN HD2x A 28 ASN HBx 1.0 1.8 3.20 456 337 A 28 ASN HD2y A 28 ASN HBy 1.0 1.8 3.20 457 338 A 29 ILE HA A 28 ASN HBy 1.0 1.8 5.04 458 338 A 28 ASN HBx A 29 ILE HA 1.0 1.8 5.04 459 339 A 51 GLU HA A 28 ASN HBy 1.0 1.8 5.17 460 339 A 28 ASN HBx A 51 GLU HA 1.0 1.8 5.17 461 340 A 52 ILE HB A 28 ASN HBy 1.0 1.8 4.62 462 340 A 52 ILE HB A 28 ASN HBx 1.0 1.8 4.62 463 341 A 52 ILE HD1% A 28 ASN HBy 1.0 1.8 4.89 464 341 A 52 ILE HD1% A 28 ASN HBx 1.0 1.8 4.89 465 342 A 52 ILE H A 28 ASN HBy 1.0 1.8 4.56 466 342 A 28 ASN HBx A 52 ILE H 1.0 1.8 4.56 467 343 A 28 ASN HD2x A 52 ILE HB 1.0 1.8 5.03 468 343 A 28 ASN HD2y A 52 ILE HB 1.0 1.8 5.03 469 344 A 28 ASN HD2x A 53 ARG HA 1.0 1.8 4.88 470 344 A 28 ASN HD2y A 53 ARG HA 1.0 1.8 4.88 471 345 A 28 ASN HD2x A 54 TRP HBx 1.0 1.8 4.51 472 345 A 28 ASN HD2y A 54 TRP HBx 1.0 1.8 4.51 473 346 A 28 ASN HD2x A 54 TRP H 1.0 1.8 4.74 474 346 A 28 ASN HD2y A 54 TRP H 1.0 1.8 4.74 475 347 A 28 ASN H A 28 ASN HBy 1.0 1.8 3.34 476 347 A 28 ASN H A 28 ASN HBx 1.0 1.8 3.34 477 348 A 28 ASN H A 28 ASN HBy 1.0 1.8 3.96 478 349 A 28 ASN H A 28 ASN HBx 1.0 1.8 3.96 479 350 A 28 ASN HD2x A 28 ASN H 1.0 1.8 3.57 480 350 A 28 ASN HD2y A 28 ASN H 1.0 1.8 3.57 481 351 A 28 ASN HD2x A 28 ASN H 1.0 1.8 4.29 482 352 A 28 ASN HD2y A 28 ASN H 1.0 1.8 4.29 483 353 A 28 ASN H A 29 ILE H 1.0 1.8 4.53 484 354 A 28 ASN H A 51 GLU HBy 1.0 1.8 5.50 485 355 A 28 ASN H A 51 GLU HBx 1.0 1.8 4.53 486 356 A 52 ILE HB A 28 ASN H 1.0 1.8 4.03 487 357 A 52 ILE HG2% A 28 ASN H 1.0 1.8 4.52 488 358 A 28 ASN H A 52 ILE H 1.0 1.8 3.76 489 359 A 28 ASN H A 53 ARG HA 1.0 1.8 3.66 490 360 A 28 ASN H A 53 ARG HGx 1.0 1.8 5.34 491 360 A 28 ASN H A 53 ARG HGy 1.0 1.8 5.34 492 361 A 29 ILE HA A 29 ILE HG1y 1.0 1.8 3.47 493 361 A 29 ILE HA A 29 ILE HG1x 1.0 1.8 3.47 494 362 A 29 ILE HA A 30 ILE H 1.0 1.8 3.04 495 363 A 29 ILE HA A 50 LEU H 1.0 1.8 5.30 496 364 A 29 ILE HA A 51 GLU HA 1.0 1.8 3.74 497 365 A 29 ILE HA A 51 GLU HBx 1.0 1.8 5.02 498 366 A 29 ILE HA A 52 ILE H 1.0 1.8 4.27 499 367 A 30 ILE H A 29 ILE HB 1.0 1.8 4.73 500 368 A 29 ILE HB A 36 ALA HA 1.0 1.8 3.33 501 369 A 29 ILE HB A 36 ALA HB% 1.0 1.8 4.32 502 370 A 29 ILE HB A 37 GLN H 1.0 1.8 3.39 503 371 A 29 ILE HB A 48 ARG HGx 1.0 1.8 4.70 504 372 A 36 ALA HA A 29 ILE HG1y 1.0 1.8 5.01 505 372 A 29 ILE HG1x A 36 ALA HA 1.0 1.8 5.01 506 373 A 37 GLN H A 29 ILE HG1y 1.0 1.8 5.00 507 373 A 29 ILE HG1x A 37 GLN H 1.0 1.8 5.00 508 374 A 29 ILE HG2% A 29 ILE HG1y 1.0 1.8 3.14 509 374 A 29 ILE HG1x A 29 ILE HG2% 1.0 1.8 3.14 510 375 A 30 ILE H A 29 ILE HG2% 1.0 1.8 3.25 511 376 A 29 ILE HG2% A 31 GLY HAy 1.0 1.8 4.45 512 377 A 36 ALA HA A 29 ILE HG2% 1.0 1.8 3.43 513 378 A 29 ILE HG2% A 36 ALA H 1.0 1.8 4.57 514 379 A 37 GLN H A 29 ILE HG2% 1.0 1.8 3.74 515 380 A 29 ILE HG2% A 38 PHE H 1.0 1.8 4.96 516 381 A 29 ILE HG2% A 48 ARG HDx 1.0 1.8 4.21 517 381 A 29 ILE HG2% A 48 ARG HDy 1.0 1.8 4.21 518 382 A 48 ARG HGx A 29 ILE HG2% 1.0 1.8 3.59 519 383 A 29 ILE HG2% A 49 HIS H 1.0 1.8 3.74 520 384 A 50 LEU H A 29 ILE HG2% 1.0 1.8 4.09 521 385 A 29 ILE H A 29 ILE HB 1.0 1.8 3.07 522 386 A 29 ILE H A 29 ILE HD1% 1.0 1.8 4.49 523 387 A 29 ILE H A 29 ILE HG1y 1.0 1.8 3.22 524 387 A 29 ILE H A 29 ILE HG1x 1.0 1.8 3.22 525 388 A 29 ILE H A 29 ILE HG2% 1.0 1.8 4.29 526 389 A 29 ILE H A 30 ILE H 1.0 1.8 4.81 527 390 A 29 ILE H A 36 ALA HA 1.0 1.8 5.21 528 391 A 29 ILE H A 37 GLN HBy 1.0 1.8 3.51 529 391 A 29 ILE H A 37 GLN HBx 1.0 1.8 3.51 530 392 A 29 ILE H A 37 GLN HGy 1.0 1.8 4.06 531 392 A 29 ILE H A 37 GLN HGx 1.0 1.8 4.06 532 393 A 29 ILE H A 37 GLN H 1.0 1.8 3.86 533 394 A 30 ILE HA A 30 ILE HG1y 1.0 1.8 3.56 534 394 A 30 ILE HA A 30 ILE HG1x 1.0 1.8 3.56 535 395 A 30 ILE HA A 30 ILE HG2% 1.0 1.8 2.91 536 396 A 31 GLY HAy A 30 ILE HA 1.0 1.8 5.37 537 397 A 30 ILE HA A 31 GLY HAx 1.0 1.8 4.78 538 398 A 30 ILE HA A 31 GLY H 1.0 1.8 3.31 539 399 A 36 ALA HB% A 30 ILE HA 1.0 1.8 3.99 540 400 A 37 GLN H A 30 ILE HA 1.0 1.8 4.47 541 401 A 30 ILE HA A 38 PHE HBx 1.0 1.8 4.17 542 401 A 30 ILE HA A 38 PHE HBy 1.0 1.8 4.17 543 402 A 30 ILE HA A 38 PHE HD% 1.0 1.8 4.81 544 403 A 38 PHE H A 30 ILE HA 1.0 1.8 3.97 545 404 A 30 ILE HA A 40 LEU HDy% 1.0 1.8 5.15 546 404 A 30 ILE HA A 40 LEU HDx% 1.0 1.8 5.15 547 405 A 50 LEU H A 30 ILE HA 1.0 1.8 5.50 548 406 A 38 PHE HD% A 30 ILE HB 1.0 1.8 4.39 549 407 A 30 ILE HB A 38 PHE HE% 1.0 1.8 5.50 550 408 A 50 LEU H A 30 ILE HB 1.0 1.8 3.89 551 409 A 30 ILE HD1% A 38 PHE HBx 1.0 1.8 4.52 552 409 A 38 PHE HBy A 30 ILE HD1% 1.0 1.8 4.52 553 410 A 38 PHE HE% A 30 ILE HD1% 1.0 1.8 4.77 554 411 A 30 ILE HD1% A 40 LEU HDy% 1.0 1.8 4.42 555 411 A 40 LEU HDx% A 30 ILE HD1% 1.0 1.8 4.42 556 412 A 30 ILE HG1y A 38 PHE HBx 1.0 1.8 3.52 557 412 A 30 ILE HG1x A 38 PHE HBx 1.0 1.8 3.52 558 412 A 38 PHE HBy A 30 ILE HG1y 1.0 1.8 3.52 559 412 A 30 ILE HG1x A 38 PHE HBy 1.0 1.8 3.52 560 413 A 38 PHE HD% A 30 ILE HG1y 1.0 1.8 4.02 561 413 A 30 ILE HG1x A 38 PHE HD% 1.0 1.8 4.02 562 414 A 31 GLY HAy A 30 ILE HG2% 1.0 1.8 4.88 563 415 A 30 ILE HG2% A 31 GLY HAx 1.0 1.8 3.49 564 416 A 30 ILE HG2% A 31 GLY H 1.0 1.8 3.82 565 417 A 30 ILE HG2% A 38 PHE HD% 1.0 1.8 3.18 566 418 A 38 PHE H A 30 ILE HG2% 1.0 1.8 5.43 567 419 A 30 ILE HG2% A 40 LEU HDy% 1.0 1.8 3.08 568 419 A 30 ILE HG2% A 40 LEU HDx% 1.0 1.8 3.08 569 420 A 30 ILE HG2% A 40 LEU HDx% 1.0 1.8 3.98 570 421 A 30 ILE HG2% A 40 LEU HDy% 1.0 1.8 3.98 571 422 A 50 LEU H A 30 ILE HG2% 1.0 1.8 4.51 572 423 A 30 ILE H A 30 ILE HB 1.0 1.8 3.54 573 424 A 30 ILE H A 30 ILE HG1y 1.0 1.8 3.86 574 424 A 30 ILE H A 30 ILE HG1x 1.0 1.8 3.86 575 425 A 30 ILE H A 30 ILE HG1x 1.0 1.8 4.50 576 426 A 30 ILE H A 49 HIS H 1.0 1.8 4.73 577 427 A 30 ILE H A 50 LEU H 1.0 1.8 3.77 578 428 A 51 GLU HA A 30 ILE H 1.0 1.8 4.26 579 429 A 31 GLY HAy A 32 ARG H 1.0 1.8 3.37 580 430 A 36 ALA HB% A 31 GLY HAy 1.0 1.8 5.00 581 431 A 31 GLY HAy A 40 LEU HDy% 1.0 1.8 5.23 582 431 A 31 GLY HAy A 40 LEU HDx% 1.0 1.8 5.23 583 432 A 31 GLY HAy A 49 HIS HBx 1.0 1.8 5.01 584 433 A 31 GLY HAy A 49 HIS H 1.0 1.8 3.56 585 434 A 50 LEU H A 31 GLY HAy 1.0 1.8 4.65 586 435 A 31 GLY HAx A 32 ARG HGx 1.0 1.8 3.92 587 435 A 31 GLY HAx A 32 ARG HGy 1.0 1.8 3.92 588 436 A 31 GLY HAx A 32 ARG HGy 1.0 1.8 4.54 589 437 A 31 GLY HAx A 32 ARG HGx 1.0 1.8 4.54 590 438 A 31 GLY HAx A 32 ARG H 1.0 1.8 3.41 591 439 A 36 ALA HB% A 31 GLY HAx 1.0 1.8 4.58 592 440 A 31 GLY HAx A 45 VAL HGy% 1.0 1.8 3.76 593 440 A 31 GLY HAx A 45 VAL HGx% 1.0 1.8 3.76 594 441 A 31 GLY H A 32 ARG HGx 1.0 1.8 4.87 595 441 A 31 GLY H A 32 ARG HGy 1.0 1.8 4.87 596 442 A 31 GLY H A 32 ARG H 1.0 1.8 4.54 597 443 A 31 GLY H A 33 GLY H 1.0 1.8 5.50 598 444 A 36 ALA HB% A 31 GLY H 1.0 1.8 3.80 599 445 A 38 PHE H A 31 GLY H 1.0 1.8 4.70 600 446 A 32 ARG HA A 32 ARG HDx 1.0 1.8 4.87 601 446 A 32 ARG HA A 32 ARG HDy 1.0 1.8 4.87 602 447 A 32 ARG HA A 32 ARG HGx 1.0 1.8 3.65 603 447 A 32 ARG HGy A 32 ARG HA 1.0 1.8 3.65 604 448 A 32 ARG HA A 39 ARG HDy 1.0 1.8 5.50 605 449 A 32 ARG HA A 39 ARG HDx 1.0 1.8 5.50 606 450 A 32 ARG HA A 39 ARG HGx 1.0 1.8 4.33 607 450 A 32 ARG HA A 39 ARG HGy 1.0 1.8 4.33 608 451 A 32 ARG HA A 39 ARG HGy 1.0 1.8 5.10 609 452 A 32 ARG HA A 39 ARG HGx 1.0 1.8 5.10 610 453 A 32 ARG HA A 45 VAL HGy% 1.0 1.8 4.84 611 453 A 45 VAL HGx% A 32 ARG HA 1.0 1.8 4.84 612 454 A 32 ARG HA A 47 ARG HA 1.0 1.8 5.10 613 455 A 33 GLY H A 32 ARG HBy 1.0 1.8 3.98 614 456 A 32 ARG HBx A 33 GLY HAy 1.0 1.8 5.50 615 457 A 33 GLY H A 32 ARG HBx 1.0 1.8 4.51 616 458 A 32 ARG HBx A 45 VAL HGy% 1.0 1.8 5.11 617 458 A 45 VAL HGx% A 32 ARG HBx 1.0 1.8 5.11 618 459 A 47 ARG HA A 32 ARG HBx 1.0 1.8 4.68 619 460 A 36 ALA HB% A 32 ARG HGx 1.0 1.8 4.88 620 460 A 36 ALA HB% A 32 ARG HGy 1.0 1.8 4.88 621 461 A 32 ARG HGy A 45 VAL HGy% 1.0 1.8 4.77 622 461 A 45 VAL HGx% A 32 ARG HGx 1.0 1.8 4.77 623 461 A 32 ARG HGy A 45 VAL HGx% 1.0 1.8 4.77 624 461 A 32 ARG HGx A 45 VAL HGy% 1.0 1.8 4.77 625 462 A 32 ARG H A 32 ARG HBy 1.0 1.8 3.95 626 463 A 32 ARG H A 32 ARG HBx 1.0 1.8 3.84 627 464 A 32 ARG H A 32 ARG HDx 1.0 1.8 4.94 628 464 A 32 ARG H A 32 ARG HDy 1.0 1.8 4.94 629 465 A 32 ARG H A 32 ARG HGx 1.0 1.8 4.08 630 465 A 32 ARG H A 32 ARG HGy 1.0 1.8 4.08 631 466 A 32 ARG H A 33 GLY H 1.0 1.8 4.25 632 467 A 36 ALA HB% A 32 ARG H 1.0 1.8 4.62 633 468 A 32 ARG H A 45 VAL HGy% 1.0 1.8 3.48 634 468 A 32 ARG H A 45 VAL HGx% 1.0 1.8 3.48 635 469 A 32 ARG H A 45 VAL HGx% 1.0 1.8 4.78 636 470 A 32 ARG H A 45 VAL HGy% 1.0 1.8 4.78 637 471 A 32 ARG H A 47 ARG HBy 1.0 1.8 5.34 638 471 A 32 ARG H A 47 ARG HBx 1.0 1.8 5.34 639 472 A 33 GLY HAy A 34 GLN HGy 1.0 1.8 5.34 640 472 A 33 GLY HAy A 34 GLN HGx 1.0 1.8 5.34 641 473 A 33 GLY HAy A 35 ASP H 1.0 1.8 3.77 642 474 A 33 GLY HAy A 47 ARG HGx 1.0 1.8 4.50 643 474 A 33 GLY HAy A 47 ARG HGy 1.0 1.8 4.50 644 475 A 33 GLY HAx A 34 GLN HA 1.0 1.8 4.35 645 476 A 35 ASP H A 33 GLY HAx 1.0 1.8 4.75 646 477 A 33 GLY HAx A 47 ARG HBy 1.0 1.8 5.34 647 477 A 47 ARG HBx A 33 GLY HAx 1.0 1.8 5.34 648 478 A 36 ALA HB% A 33 GLY H 1.0 1.8 4.06 649 479 A 33 GLY H A 47 ARG HBy 1.0 1.8 4.51 650 479 A 33 GLY H A 47 ARG HBx 1.0 1.8 4.51 651 480 A 33 GLY H A 47 ARG HBy 1.0 1.8 5.37 652 481 A 33 GLY H A 47 ARG HBx 1.0 1.8 5.37 653 482 A 35 ASP H A 34 GLN HA 1.0 1.8 3.55 654 483 A 35 ASP H A 34 GLN HBy 1.0 1.8 4.06 655 483 A 35 ASP H A 34 GLN HBx 1.0 1.8 4.06 656 484 A 36 ALA H A 34 GLN HBy 1.0 1.8 5.34 657 484 A 36 ALA H A 34 GLN HBx 1.0 1.8 5.34 658 485 A 35 ASP H A 34 GLN HBy 1.0 1.8 4.89 659 486 A 35 ASP H A 34 GLN HBx 1.0 1.8 4.89 660 487 A 35 ASP H A 34 GLN HGy 1.0 1.8 5.50 661 488 A 34 GLN HGx A 35 ASP H 1.0 1.8 5.50 662 489 A 34 GLN H A 34 GLN HGy 1.0 1.8 4.61 663 489 A 34 GLN HGx A 34 GLN H 1.0 1.8 4.61 664 490 A 34 GLN H A 34 GLN HGy 1.0 1.8 5.41 665 491 A 34 GLN HGx A 34 GLN H 1.0 1.8 5.41 666 492 A 36 ALA H A 35 ASP HBx 1.0 1.8 4.13 667 492 A 36 ALA H A 35 ASP HBy 1.0 1.8 4.13 668 493 A 36 ALA H A 35 ASP HBy 1.0 1.8 4.93 669 494 A 36 ALA H A 35 ASP HBx 1.0 1.8 4.93 670 495 A 35 ASP H A 35 ASP HBx 1.0 1.8 3.16 671 495 A 35 ASP H A 35 ASP HBy 1.0 1.8 3.16 672 496 A 36 ALA HB% A 35 ASP H 1.0 1.8 4.27 673 497 A 36 ALA H A 35 ASP H 1.0 1.8 3.18 674 498 A 36 ALA HA A 37 GLN HGy 1.0 1.8 5.28 675 498 A 37 GLN HGx A 36 ALA HA 1.0 1.8 5.28 676 499 A 36 ALA HA A 37 GLN H 1.0 1.8 2.85 677 500 A 36 ALA HA A 38 PHE H 1.0 1.8 4.41 678 501 A 36 ALA HB% A 37 GLN H 1.0 1.8 3.26 679 502 A 36 ALA HB% A 38 PHE H 1.0 1.8 3.71 680 503 A 36 ALA HB% A 39 ARG HDx 1.0 1.8 5.33 681 503 A 36 ALA HB% A 39 ARG HDy 1.0 1.8 5.33 682 504 A 36 ALA HB% A 39 ARG H 1.0 1.8 5.19 683 505 A 36 ALA HB% A 48 ARG HGy 1.0 1.8 4.82 684 506 A 36 ALA HB% A 36 ALA H 1.0 1.8 2.83 685 507 A 36 ALA H A 48 ARG HGy 1.0 1.8 5.50 686 508 A 37 GLN HA A 37 GLN HGy 1.0 1.8 3.26 687 508 A 37 GLN HGx A 37 GLN HA 1.0 1.8 3.26 688 509 A 37 GLN HA A 37 GLN HGy 1.0 1.8 3.85 689 510 A 37 GLN HGx A 37 GLN HA 1.0 1.8 3.85 690 511 A 37 GLN HBx A 38 PHE HBx 1.0 1.8 4.08 691 511 A 37 GLN HBy A 38 PHE HBx 1.0 1.8 4.08 692 511 A 38 PHE HBy A 37 GLN HBy 1.0 1.8 4.08 693 511 A 37 GLN HBx A 38 PHE HBy 1.0 1.8 4.08 694 512 A 38 PHE H A 37 GLN HBy 1.0 1.8 4.00 695 512 A 37 GLN HBx A 38 PHE H 1.0 1.8 4.00 696 513 A 38 PHE H A 37 GLN HBy 1.0 1.8 4.59 697 514 A 37 GLN HBx A 38 PHE H 1.0 1.8 4.59 698 515 A 37 GLN HE2x A 37 GLN HGy 1.0 1.8 3.18 699 515 A 37 GLN HE2y A 37 GLN HGy 1.0 1.8 3.18 700 515 A 37 GLN HGx A 37 GLN HE2y 1.0 1.8 3.18 701 515 A 37 GLN HGx A 37 GLN HE2x 1.0 1.8 3.18 702 516 A 37 GLN H A 37 GLN HBy 1.0 1.8 3.01 703 516 A 37 GLN HBx A 37 GLN H 1.0 1.8 3.01 704 517 A 37 GLN H A 37 GLN HBy 1.0 1.8 3.54 705 518 A 37 GLN HBx A 37 GLN H 1.0 1.8 3.54 706 519 A 37 GLN H A 37 GLN HGy 1.0 1.8 3.72 707 519 A 37 GLN HGx A 37 GLN H 1.0 1.8 3.72 708 520 A 37 GLN H A 37 GLN HGy 1.0 1.8 4.38 709 521 A 37 GLN HGx A 37 GLN H 1.0 1.8 4.38 710 522 A 37 GLN H A 38 PHE HBx 1.0 1.8 4.81 711 522 A 37 GLN H A 38 PHE HBy 1.0 1.8 4.81 712 523 A 37 GLN H A 38 PHE H 1.0 1.8 3.08 713 524 A 38 PHE HD% A 38 PHE HA 1.0 1.8 3.66 714 525 A 39 ARG H A 38 PHE HA 1.0 1.8 2.78 715 526 A 39 ARG H A 38 PHE HBx 1.0 1.8 4.43 716 526 A 38 PHE HBy A 39 ARG H 1.0 1.8 4.43 717 527 A 38 PHE HD% A 39 ARG H 1.0 1.8 3.69 718 528 A 38 PHE HD% A 40 LEU HBy 1.0 1.8 5.34 719 528 A 38 PHE HD% A 40 LEU HBx 1.0 1.8 5.34 720 529 A 38 PHE HD% A 40 LEU HDy% 1.0 1.8 3.89 721 529 A 38 PHE HD% A 40 LEU HDx% 1.0 1.8 3.89 722 530 A 38 PHE HD% A 40 LEU HDx% 1.0 1.8 4.85 723 531 A 38 PHE HD% A 40 LEU HDy% 1.0 1.8 4.85 724 532 A 38 PHE HD% A 40 LEU HG 1.0 1.8 4.57 725 533 A 38 PHE HD% A 41 PRO HDy 1.0 1.8 5.34 726 533 A 38 PHE HD% A 41 PRO HDx 1.0 1.8 5.34 727 534 A 38 PHE HE% A 40 LEU HDy% 1.0 1.8 4.50 728 534 A 40 LEU HDx% A 38 PHE HE% 1.0 1.8 4.50 729 535 A 40 LEU HDx% A 38 PHE HE% 1.0 1.8 5.36 730 536 A 38 PHE HE% A 40 LEU HDy% 1.0 1.8 5.36 731 537 A 38 PHE HE% A 40 LEU HG 1.0 1.8 4.71 732 538 A 38 PHE H A 38 PHE HBx 1.0 1.8 3.97 733 539 A 38 PHE H A 38 PHE HBy 1.0 1.8 3.97 734 540 A 38 PHE H A 39 ARG H 1.0 1.8 4.59 735 541 A 39 ARG HA A 39 ARG HDx 1.0 1.8 4.56 736 541 A 39 ARG HDy A 39 ARG HA 1.0 1.8 4.56 737 542 A 39 ARG HDy A 39 ARG HA 1.0 1.8 5.31 738 543 A 39 ARG HA A 39 ARG HDx 1.0 1.8 5.31 739 544 A 39 ARG HA A 40 LEU H 1.0 1.8 2.96 740 545 A 39 ARG HBx A 39 ARG HDx 1.0 1.8 3.28 741 545 A 39 ARG HBy A 39 ARG HDx 1.0 1.8 3.28 742 545 A 39 ARG HDy A 39 ARG HBy 1.0 1.8 3.28 743 545 A 39 ARG HDy A 39 ARG HBx 1.0 1.8 3.28 744 546 A 39 ARG H A 39 ARG HBy 1.0 1.8 3.01 745 546 A 39 ARG H A 39 ARG HBx 1.0 1.8 3.01 746 547 A 39 ARG H A 39 ARG HBy 1.0 1.8 3.65 747 548 A 39 ARG H A 39 ARG HBx 1.0 1.8 3.65 748 549 A 39 ARG HDy A 39 ARG H 1.0 1.8 5.50 749 550 A 39 ARG H A 39 ARG HDx 1.0 1.8 5.50 750 551 A 39 ARG H A 39 ARG HGx 1.0 1.8 4.75 751 551 A 39 ARG HGy A 39 ARG H 1.0 1.8 4.75 752 552 A 39 ARG HGy A 39 ARG H 1.0 1.8 5.45 753 553 A 39 ARG H A 39 ARG HGx 1.0 1.8 5.45 754 554 A 39 ARG H A 40 LEU H 1.0 1.8 4.67 755 555 A 40 LEU HA A 40 LEU HDy% 1.0 1.8 3.57 756 555 A 40 LEU HDx% A 40 LEU HA 1.0 1.8 3.57 757 556 A 40 LEU HG A 40 LEU HA 1.0 1.8 3.91 758 557 A 40 LEU HA A 41 PRO HDy 1.0 1.8 3.39 759 558 A 41 PRO HDx A 40 LEU HA 1.0 1.8 3.39 760 559 A 40 LEU HA A 45 VAL HGy% 1.0 1.8 5.42 761 559 A 45 VAL HGx% A 40 LEU HA 1.0 1.8 5.42 762 560 A 40 LEU HBy A 41 PRO HDy 1.0 1.8 4.23 763 560 A 40 LEU HBx A 41 PRO HDy 1.0 1.8 4.23 764 560 A 41 PRO HDx A 40 LEU HBy 1.0 1.8 4.23 765 560 A 40 LEU HBx A 41 PRO HDx 1.0 1.8 4.23 766 561 A 42 ASP H A 40 LEU HBy 1.0 1.8 3.87 767 561 A 40 LEU HBx A 42 ASP H 1.0 1.8 3.87 768 562 A 40 LEU HBx A 45 VAL HGy% 1.0 1.8 3.45 769 562 A 40 LEU HBy A 45 VAL HGy% 1.0 1.8 3.45 770 562 A 45 VAL HGx% A 40 LEU HBy 1.0 1.8 3.45 771 562 A 45 VAL HGx% A 40 LEU HBx 1.0 1.8 3.45 772 563 A 45 VAL HGx% A 40 LEU HBy 1.0 1.8 5.82 773 564 A 40 LEU HBy A 45 VAL HGy% 1.0 1.8 5.82 774 565 A 45 VAL HGx% A 40 LEU HBx 1.0 1.8 5.82 775 566 A 40 LEU HBx A 45 VAL HGy% 1.0 1.8 5.82 776 567 A 40 LEU HDy% A 41 PRO HBy 1.0 1.8 5.28 777 567 A 40 LEU HDx% A 41 PRO HBy 1.0 1.8 5.28 778 567 A 41 PRO HBx A 40 LEU HDy% 1.0 1.8 5.28 779 567 A 40 LEU HDx% A 41 PRO HBx 1.0 1.8 5.28 780 568 A 40 LEU HDy% A 41 PRO HDy 1.0 1.8 3.61 781 568 A 40 LEU HDx% A 41 PRO HDy 1.0 1.8 3.61 782 568 A 41 PRO HDx A 40 LEU HDy% 1.0 1.8 3.61 783 568 A 40 LEU HDx% A 41 PRO HDx 1.0 1.8 3.61 784 569 A 45 VAL HA A 40 LEU HDy% 1.0 1.8 5.44 785 569 A 40 LEU HDx% A 45 VAL HA 1.0 1.8 5.44 786 570 A 40 LEU HDy% A 45 VAL HGy% 1.0 1.8 4.33 787 570 A 40 LEU HDx% A 45 VAL HGy% 1.0 1.8 4.33 788 570 A 45 VAL HGx% A 40 LEU HDy% 1.0 1.8 4.33 789 570 A 40 LEU HDx% A 45 VAL HGx% 1.0 1.8 4.33 790 571 A 40 LEU HDx% A 41 PRO HDy 1.0 1.8 4.89 791 572 A 40 LEU HDx% A 41 PRO HDx 1.0 1.8 4.89 792 573 A 40 LEU HDy% A 41 PRO HDy 1.0 1.8 4.89 793 574 A 41 PRO HDx A 40 LEU HDy% 1.0 1.8 4.89 794 575 A 40 LEU H A 40 LEU HBy 1.0 1.8 3.35 795 575 A 40 LEU HBx A 40 LEU H 1.0 1.8 3.35 796 576 A 40 LEU H A 40 LEU HDy% 1.0 1.8 3.97 797 576 A 40 LEU HDx% A 40 LEU H 1.0 1.8 3.97 798 577 A 40 LEU HDx% A 40 LEU H 1.0 1.8 4.60 799 578 A 40 LEU H A 40 LEU HDy% 1.0 1.8 4.60 800 579 A 40 LEU HG A 40 LEU H 1.0 1.8 4.52 801 580 A 42 ASP H A 41 PRO HBy 1.0 1.8 3.96 802 580 A 42 ASP H A 41 PRO HBx 1.0 1.8 3.96 803 581 A 42 ASP H A 41 PRO HDy 1.0 1.8 4.18 804 581 A 41 PRO HDx A 42 ASP H 1.0 1.8 4.18 805 582 A 42 ASP HA A 43 THR H 1.0 1.8 3.24 806 583 A 42 ASP HA A 45 VAL HGy% 1.0 1.8 5.44 807 583 A 45 VAL HGx% A 42 ASP HA 1.0 1.8 5.44 808 584 A 42 ASP HBy A 43 THR HA 1.0 1.8 4.43 809 585 A 42 ASP HBy A 43 THR HB 1.0 1.8 5.50 810 586 A 43 THR H A 42 ASP HBy 1.0 1.8 4.53 811 587 A 42 ASP H A 42 ASP HBx 1.0 1.8 3.15 812 588 A 42 ASP H A 45 VAL HB 1.0 1.8 5.50 813 589 A 42 ASP H A 45 VAL HGy% 1.0 1.8 4.42 814 589 A 45 VAL HGx% A 42 ASP H 1.0 1.8 4.42 815 590 A 43 THR HA A 43 THR HG2% 1.0 1.8 3.41 816 591 A 43 THR HA A 45 VAL H 1.0 1.8 4.55 817 592 A 43 THR H A 43 THR HG2% 1.0 1.8 3.75 818 593 A 43 THR H A 44 GLY H 1.0 1.8 4.59 819 594 A 45 VAL HA A 44 GLY H 1.0 1.8 5.30 820 595 A 44 GLY H A 45 VAL HGy% 1.0 1.8 4.52 821 595 A 45 VAL HGx% A 44 GLY H 1.0 1.8 4.52 822 596 A 45 VAL H A 44 GLY H 1.0 1.8 3.57 823 597 A 45 VAL HGx% A 45 VAL HA 1.0 1.8 3.40 824 598 A 45 VAL HA A 45 VAL HGy% 1.0 1.8 3.40 825 599 A 45 VAL HA A 46 SER H 1.0 1.8 3.02 826 600 A 49 HIS HBx A 45 VAL HA 1.0 1.8 5.19 827 601 A 45 VAL HB A 46 SER H 1.0 1.8 4.41 828 602 A 45 VAL HB A 49 HIS HBy 1.0 1.8 5.34 829 603 A 46 SER H A 45 VAL HGy% 1.0 1.8 3.27 830 603 A 45 VAL HGx% A 46 SER H 1.0 1.8 3.27 831 604 A 49 HIS HBx A 45 VAL HGy% 1.0 1.8 3.90 832 604 A 49 HIS HBx A 45 VAL HGx% 1.0 1.8 3.90 833 605 A 49 HIS HE1 A 45 VAL HGy% 1.0 1.8 4.86 834 605 A 45 VAL HGx% A 49 HIS HE1 1.0 1.8 4.86 835 606 A 49 HIS H A 45 VAL HGy% 1.0 1.8 4.25 836 606 A 49 HIS H A 45 VAL HGx% 1.0 1.8 4.25 837 607 A 45 VAL HGx% A 46 SER H 1.0 1.8 4.11 838 608 A 46 SER H A 45 VAL HGy% 1.0 1.8 4.11 839 609 A 45 VAL HB A 45 VAL H 1.0 1.8 3.36 840 610 A 45 VAL H A 45 VAL HGy% 1.0 1.8 3.38 841 610 A 45 VAL HGx% A 45 VAL H 1.0 1.8 3.38 842 611 A 45 VAL HGx% A 45 VAL H 1.0 1.8 4.11 843 612 A 45 VAL H A 45 VAL HGy% 1.0 1.8 4.11 844 613 A 45 VAL H A 46 SER H 1.0 1.8 4.77 845 614 A 47 ARG HA A 46 SER HA 1.0 1.8 5.26 846 615 A 46 SER HBx A 47 ARG HGx 1.0 1.8 4.97 847 615 A 46 SER HBy A 47 ARG HGx 1.0 1.8 4.97 848 615 A 47 ARG HGy A 46 SER HBy 1.0 1.8 4.97 849 615 A 47 ARG HGy A 46 SER HBx 1.0 1.8 4.97 850 616 A 48 ARG H A 46 SER HBy 1.0 1.8 3.75 851 616 A 46 SER HBx A 48 ARG H 1.0 1.8 3.75 852 617 A 48 ARG H A 46 SER HBy 1.0 1.8 4.62 853 618 A 46 SER HBx A 48 ARG H 1.0 1.8 4.62 854 619 A 46 SER H A 46 SER HBy 1.0 1.8 3.74 855 620 A 46 SER H A 46 SER HBx 1.0 1.8 3.74 856 621 A 49 HIS HBx A 46 SER H 1.0 1.8 3.68 857 622 A 47 ARG HA A 47 ARG HDx 1.0 1.8 4.43 858 622 A 47 ARG HA A 47 ARG HDy 1.0 1.8 4.43 859 623 A 47 ARG HA A 47 ARG HGx 1.0 1.8 3.49 860 623 A 47 ARG HA A 47 ARG HGy 1.0 1.8 3.49 861 624 A 47 ARG HBy A 47 ARG HDx 1.0 1.8 3.20 862 624 A 47 ARG HBx A 47 ARG HDx 1.0 1.8 3.20 863 624 A 47 ARG HDy A 47 ARG HBy 1.0 1.8 3.20 864 624 A 47 ARG HBx A 47 ARG HDy 1.0 1.8 3.20 865 625 A 48 ARG HA A 48 ARG HDx 1.0 1.8 4.76 866 625 A 48 ARG HDy A 48 ARG HA 1.0 1.8 4.76 867 626 A 49 HIS H A 48 ARG HA 1.0 1.8 2.87 868 627 A 50 LEU H A 48 ARG HA 1.0 1.8 3.97 869 628 A 48 ARG HBy A 48 ARG HDx 1.0 1.8 3.26 870 628 A 48 ARG HBx A 48 ARG HDx 1.0 1.8 3.26 871 628 A 48 ARG HDy A 48 ARG HBx 1.0 1.8 3.26 872 628 A 48 ARG HDy A 48 ARG HBy 1.0 1.8 3.26 873 629 A 49 HIS H A 48 ARG HBx 1.0 1.8 4.13 874 629 A 49 HIS H A 48 ARG HBy 1.0 1.8 4.13 875 630 A 48 ARG HDx A 64 LEU HDy% 1.0 1.8 3.78 876 630 A 64 LEU HDx% A 48 ARG HDx 1.0 1.8 3.78 877 630 A 48 ARG HDy A 64 LEU HDx% 1.0 1.8 3.78 878 630 A 48 ARG HDy A 64 LEU HDy% 1.0 1.8 3.78 879 631 A 64 LEU HG A 48 ARG HDx 1.0 1.8 5.34 880 631 A 48 ARG HDy A 64 LEU HG 1.0 1.8 5.34 881 632 A 48 ARG HGx A 49 HIS H 1.0 1.8 5.16 882 633 A 48 ARG H A 48 ARG HBx 1.0 1.8 3.45 883 633 A 48 ARG H A 48 ARG HBy 1.0 1.8 3.45 884 634 A 48 ARG HGy A 48 ARG H 1.0 1.8 3.58 885 635 A 48 ARG HGx A 48 ARG H 1.0 1.8 4.71 886 636 A 49 HIS HA A 49 HIS HD2 1.0 1.8 5.02 887 637 A 49 HIS HBy A 50 LEU HBy 1.0 1.8 4.30 888 638 A 50 LEU H A 49 HIS HBy 1.0 1.8 3.36 889 639 A 49 HIS HD2 A 50 LEU HA 1.0 1.8 4.56 890 640 A 49 HIS HD2 A 50 LEU HBy 1.0 1.8 3.84 891 641 A 49 HIS HD2 A 50 LEU HBx 1.0 1.8 3.40 892 642 A 49 HIS HD2 A 50 LEU HDx% 1.0 1.8 3.95 893 643 A 50 LEU H A 49 HIS HD2 1.0 1.8 4.54 894 644 A 49 HIS HD2 A 90 LEU HDx% 1.0 1.8 4.87 895 645 A 49 HIS HE1 A 90 LEU HA 1.0 1.8 5.12 896 646 A 49 HIS HE1 A 90 LEU HBy 1.0 1.8 4.90 897 646 A 49 HIS HE1 A 90 LEU HBx 1.0 1.8 4.90 898 647 A 49 HIS HE1 A 90 LEU HDx% 1.0 1.8 5.12 899 648 A 49 HIS HE1 A 91 GLY H 1.0 1.8 4.55 900 649 A 50 LEU HBy A 49 HIS HE2 1.0 1.8 4.85 901 650 A 50 LEU HDx% A 49 HIS HE2 1.0 1.8 4.46 902 651 A 49 HIS HE2 A 70 THR HB 1.0 1.8 5.38 903 652 A 49 HIS HE2 A 70 THR HG1 1.0 1.8 3.86 904 653 A 49 HIS HE2 A 70 THR HG2% 1.0 1.8 4.78 905 654 A 49 HIS HE2 A 90 LEU HBy 1.0 1.8 3.78 906 654 A 90 LEU HBx A 49 HIS HE2 1.0 1.8 3.78 907 655 A 49 HIS HE2 A 90 LEU HBy 1.0 1.8 4.44 908 656 A 90 LEU HBx A 49 HIS HE2 1.0 1.8 4.44 909 657 A 90 LEU HDx% A 49 HIS HE2 1.0 1.8 4.79 910 658 A 49 HIS H A 49 HIS HBx 1.0 1.8 3.30 911 659 A 50 LEU H A 49 HIS H 1.0 1.8 3.16 912 660 A 49 HIS H A 64 LEU HBx 1.0 1.8 4.06 913 660 A 49 HIS H A 64 LEU HBy 1.0 1.8 4.06 914 661 A 49 HIS H A 64 LEU HDy% 1.0 1.8 4.92 915 661 A 49 HIS H A 64 LEU HDx% 1.0 1.8 4.92 916 662 A 49 HIS H A 64 LEU HG 1.0 1.8 5.14 917 663 A 50 LEU HA A 50 LEU HDx% 1.0 1.8 3.94 918 664 A 50 LEU HA A 50 LEU HG 1.0 1.8 3.86 919 665 A 50 LEU HA A 51 GLU H 1.0 1.8 2.92 920 666 A 50 LEU HA A 63 ASP HA 1.0 1.8 3.99 921 667 A 50 LEU HA A 64 LEU HA 1.0 1.8 5.31 922 668 A 50 LEU HA A 64 LEU HBx 1.0 1.8 3.42 923 668 A 50 LEU HA A 64 LEU HBy 1.0 1.8 3.42 924 669 A 50 LEU HA A 64 LEU H 1.0 1.8 3.58 925 670 A 50 LEU HBy A 50 LEU HDx% 1.0 1.8 3.80 926 671 A 50 LEU HBy A 50 LEU HDy% 1.0 1.8 3.68 927 672 A 50 LEU HBy A 51 GLU H 1.0 1.8 4.42 928 673 A 50 LEU HBy A 63 ASP HA 1.0 1.8 4.40 929 674 A 50 LEU HBy A 64 LEU H 1.0 1.8 4.56 930 675 A 50 LEU HBy A 90 LEU HDx% 1.0 1.8 5.50 931 676 A 50 LEU HBx A 50 LEU HDx% 1.0 1.8 3.67 932 677 A 50 LEU HBx A 63 ASP HA 1.0 1.8 3.66 933 678 A 50 LEU HBx A 63 ASP HBx 1.0 1.8 5.16 934 678 A 50 LEU HBx A 63 ASP HBy 1.0 1.8 5.16 935 679 A 50 LEU HDx% A 51 GLU H 1.0 1.8 4.16 936 680 A 50 LEU HDx% A 63 ASP HA 1.0 1.8 3.77 937 681 A 50 LEU HDx% A 63 ASP HBx 1.0 1.8 4.59 938 681 A 50 LEU HDx% A 63 ASP HBy 1.0 1.8 4.59 939 682 A 50 LEU HDx% A 64 LEU H 1.0 1.8 4.59 940 683 A 51 GLU H A 50 LEU HDy% 1.0 1.8 4.09 941 684 A 50 LEU HG A 51 GLU HGy 1.0 1.8 4.31 942 684 A 50 LEU HG A 51 GLU HGx 1.0 1.8 4.31 943 685 A 50 LEU HG A 51 GLU H 1.0 1.8 3.36 944 686 A 50 LEU HG A 63 ASP HBx 1.0 1.8 5.30 945 686 A 50 LEU HG A 63 ASP HBy 1.0 1.8 5.30 946 687 A 50 LEU HG A 64 LEU H 1.0 1.8 4.52 947 688 A 50 LEU H A 50 LEU HBy 1.0 1.8 4.08 948 689 A 50 LEU H A 50 LEU HBx 1.0 1.8 3.93 949 690 A 50 LEU H A 50 LEU HDx% 1.0 1.8 5.50 950 691 A 50 LEU H A 50 LEU HDy% 1.0 1.8 4.29 951 692 A 50 LEU H A 64 LEU HBx 1.0 1.8 4.09 952 692 A 50 LEU H A 64 LEU HBy 1.0 1.8 4.09 953 693 A 50 LEU H A 64 LEU HDy% 1.0 1.8 4.99 954 693 A 50 LEU H A 64 LEU HDx% 1.0 1.8 4.99 955 694 A 50 LEU H A 64 LEU HG 1.0 1.8 5.50 956 695 A 51 GLU HA A 51 GLU HGy 1.0 1.8 3.62 957 695 A 51 GLU HA A 51 GLU HGx 1.0 1.8 3.62 958 696 A 51 GLU HA A 52 ILE H 1.0 1.8 3.21 959 697 A 52 ILE H A 51 GLU HBx 1.0 1.8 3.99 960 698 A 62 ALA H A 51 GLU HGy 1.0 1.8 4.16 961 698 A 51 GLU HGx A 62 ALA H 1.0 1.8 4.16 962 699 A 52 ILE H A 51 GLU HGy 1.0 1.8 5.50 963 700 A 52 ILE H A 51 GLU HGx 1.0 1.8 5.50 964 701 A 51 GLU HBy A 51 GLU H 1.0 1.8 3.79 965 702 A 51 GLU H A 51 GLU HGy 1.0 1.8 3.59 966 702 A 51 GLU H A 51 GLU HGx 1.0 1.8 3.59 967 703 A 51 GLU H A 51 GLU HGy 1.0 1.8 4.16 968 704 A 51 GLU H A 51 GLU HGx 1.0 1.8 4.16 969 705 A 51 GLU H A 61 LEU HDy% 1.0 1.8 4.58 970 705 A 51 GLU H A 61 LEU HDx% 1.0 1.8 4.58 971 706 A 51 GLU H A 62 ALA H 1.0 1.8 3.99 972 707 A 51 GLU H A 64 LEU HBx 1.0 1.8 5.34 973 707 A 64 LEU HBy A 51 GLU H 1.0 1.8 5.34 974 708 A 51 GLU H A 64 LEU H 1.0 1.8 4.26 975 709 A 52 ILE HD1% A 52 ILE HA 1.0 1.8 3.89 976 710 A 52 ILE HA A 52 ILE HG1x 1.0 1.8 3.73 977 711 A 52 ILE HG2% A 52 ILE HA 1.0 1.8 3.84 978 712 A 52 ILE HA A 53 ARG H 1.0 1.8 2.93 979 713 A 52 ILE HA A 60 LEU H 1.0 1.8 5.44 980 714 A 52 ILE HA A 61 LEU HA 1.0 1.8 3.46 981 715 A 52 ILE HA A 61 LEU H 1.0 1.8 5.50 982 716 A 52 ILE HA A 62 ALA H 1.0 1.8 3.54 983 717 A 52 ILE HB A 52 ILE HD1% 1.0 1.8 2.88 984 718 A 52 ILE HB A 53 ARG H 1.0 1.8 4.98 985 719 A 62 ALA H A 52 ILE HG1x 1.0 1.8 4.96 986 720 A 52 ILE HG2% A 53 ARG H 1.0 1.8 3.43 987 721 A 52 ILE HG2% A 54 TRP HBx 1.0 1.8 4.52 988 722 A 54 TRP HE3 A 52 ILE HG2% 1.0 1.8 5.50 989 723 A 52 ILE HB A 52 ILE H 1.0 1.8 3.61 990 724 A 52 ILE HG2% A 52 ILE H 1.0 1.8 3.95 991 725 A 53 ARG HA A 53 ARG HDx 1.0 1.8 4.71 992 725 A 53 ARG HA A 53 ARG HDy 1.0 1.8 4.71 993 726 A 53 ARG HA A 53 ARG HDy 1.0 1.8 5.49 994 727 A 53 ARG HA A 53 ARG HDx 1.0 1.8 5.49 995 728 A 53 ARG HA A 53 ARG HGx 1.0 1.8 3.51 996 728 A 53 ARG HA A 53 ARG HGy 1.0 1.8 3.51 997 729 A 54 TRP HA A 53 ARG HA 1.0 1.8 5.36 998 730 A 54 TRP H A 53 ARG HA 1.0 1.8 2.90 999 731 A 53 ARG HBx A 53 ARG HDx 1.0 1.8 3.37 1000 731 A 53 ARG HBy A 53 ARG HDx 1.0 1.8 3.37 1001 731 A 53 ARG HDy A 53 ARG HBx 1.0 1.8 3.37 1002 731 A 53 ARG HDy A 53 ARG HBy 1.0 1.8 3.37 1003 732 A 54 TRP H A 53 ARG HBx 1.0 1.8 4.37 1004 732 A 54 TRP H A 53 ARG HBy 1.0 1.8 4.37 1005 733 A 54 TRP H A 53 ARG HGx 1.0 1.8 4.30 1006 733 A 54 TRP H A 53 ARG HGy 1.0 1.8 4.30 1007 734 A 53 ARG H A 53 ARG HBx 1.0 1.8 3.29 1008 734 A 53 ARG H A 53 ARG HBy 1.0 1.8 3.29 1009 735 A 53 ARG H A 53 ARG HGx 1.0 1.8 4.31 1010 735 A 53 ARG HGy A 53 ARG H 1.0 1.8 4.31 1011 736 A 53 ARG H A 60 LEU H 1.0 1.8 3.98 1012 737 A 53 ARG H A 61 LEU HA 1.0 1.8 4.20 1013 738 A 54 TRP HE3 A 54 TRP HA 1.0 1.8 3.48 1014 739 A 54 TRP HZ3 A 54 TRP HA 1.0 1.8 4.59 1015 740 A 54 TRP HA A 55 ASP H 1.0 1.8 3.07 1016 741 A 54 TRP HA A 59 ALA HA 1.0 1.8 3.63 1017 742 A 59 ALA HB% A 54 TRP HA 1.0 1.8 4.24 1018 743 A 54 TRP HA A 60 LEU HDy% 1.0 1.8 5.44 1019 743 A 54 TRP HA A 60 LEU HDx% 1.0 1.8 5.44 1020 744 A 54 TRP HA A 60 LEU H 1.0 1.8 4.32 1021 745 A 54 TRP HBx A 55 ASP H 1.0 1.8 4.63 1022 746 A 54 TRP HBx A 59 ALA HA 1.0 1.8 5.50 1023 747 A 54 TRP HBy A 54 TRP HD1 1.0 1.8 3.75 1024 748 A 54 TRP HBy A 59 ALA HA 1.0 1.8 5.28 1025 749 A 54 TRP HE1 A 56 GLY HAy 1.0 1.8 4.85 1026 750 A 54 TRP HE3 A 58 VAL HA 1.0 1.8 5.08 1027 751 A 54 TRP HE3 A 59 ALA HA 1.0 1.8 3.66 1028 752 A 54 TRP HE3 A 59 ALA HB% 1.0 1.8 3.65 1029 753 A 54 TRP HE3 A 59 ALA H 1.0 1.8 4.33 1030 754 A 54 TRP HE3 A 60 LEU H 1.0 1.8 4.02 1031 755 A 54 TRP HBx A 54 TRP H 1.0 1.8 3.76 1032 756 A 54 TRP HBy A 54 TRP H 1.0 1.8 3.52 1033 757 A 54 TRP HD1 A 54 TRP H 1.0 1.8 4.86 1034 758 A 54 TRP HZ2 A 56 GLY HAx 1.0 1.8 5.50 1035 759 A 54 TRP HZ2 A 56 GLY HAy 1.0 1.8 4.44 1036 760 A 54 TRP HZ3 A 58 VAL HA 1.0 1.8 3.44 1037 761 A 54 TRP HZ3 A 58 VAL HB 1.0 1.8 5.19 1038 762 A 54 TRP HZ3 A 58 VAL H 1.0 1.8 4.73 1039 763 A 54 TRP HZ3 A 59 ALA HA 1.0 1.8 4.74 1040 764 A 54 TRP HZ3 A 59 ALA HB% 1.0 1.8 4.05 1041 765 A 54 TRP HZ3 A 59 ALA H 1.0 1.8 3.94 1042 766 A 54 TRP HZ3 A 60 LEU H 1.0 1.8 5.50 1043 767 A 55 ASP H A 55 ASP HBx 1.0 1.8 3.66 1044 767 A 55 ASP H A 55 ASP HBy 1.0 1.8 3.66 1045 768 A 55 ASP H A 56 GLY HAy 1.0 1.8 5.23 1046 769 A 55 ASP H A 57 GLN H 1.0 1.8 4.37 1047 770 A 55 ASP H A 58 VAL HGy% 1.0 1.8 5.19 1048 770 A 55 ASP H A 58 VAL HGx% 1.0 1.8 5.19 1049 771 A 55 ASP H A 58 VAL H 1.0 1.8 4.22 1050 772 A 59 ALA HA A 55 ASP H 1.0 1.8 4.45 1051 773 A 56 GLY HAy A 57 GLN HBx 1.0 1.8 5.39 1052 774 A 57 GLN HA A 58 VAL HGy% 1.0 1.8 5.23 1053 774 A 58 VAL HGx% A 57 GLN HA 1.0 1.8 5.23 1054 775 A 57 GLN HBy A 58 VAL HGy% 1.0 1.8 2.94 1055 775 A 58 VAL HGx% A 57 GLN HBy 1.0 1.8 2.94 1056 776 A 58 VAL H A 57 GLN HBy 1.0 1.8 3.34 1057 777 A 58 VAL H A 57 GLN HGx 1.0 1.8 4.58 1058 777 A 58 VAL H A 57 GLN HGy 1.0 1.8 4.58 1059 778 A 57 GLN H A 57 GLN HBy 1.0 1.8 3.85 1060 779 A 57 GLN H A 57 GLN HBx 1.0 1.8 3.80 1061 780 A 57 GLN H A 57 GLN HGx 1.0 1.8 4.55 1062 780 A 57 GLN H A 57 GLN HGy 1.0 1.8 4.55 1063 781 A 57 GLN H A 58 VAL HGy% 1.0 1.8 4.60 1064 781 A 57 GLN H A 58 VAL HGx% 1.0 1.8 4.60 1065 782 A 58 VAL H A 57 GLN H 1.0 1.8 3.06 1066 783 A 59 ALA HA A 58 VAL HA 1.0 1.8 5.45 1067 784 A 59 ALA HB% A 58 VAL HA 1.0 1.8 4.88 1068 785 A 58 VAL HA A 59 ALA H 1.0 1.8 2.66 1069 786 A 59 ALA HA A 58 VAL HB 1.0 1.8 5.50 1070 787 A 59 ALA H A 58 VAL HB 1.0 1.8 3.88 1071 788 A 59 ALA HA A 58 VAL HGy% 1.0 1.8 4.63 1072 788 A 59 ALA HA A 58 VAL HGx% 1.0 1.8 4.63 1073 789 A 59 ALA H A 58 VAL HGy% 1.0 1.8 3.93 1074 789 A 59 ALA H A 58 VAL HGx% 1.0 1.8 3.93 1075 790 A 59 ALA H A 58 VAL HGx% 1.0 1.8 4.49 1076 791 A 59 ALA H A 58 VAL HGy% 1.0 1.8 4.49 1077 792 A 58 VAL H A 58 VAL HGy% 1.0 1.8 3.55 1078 792 A 58 VAL H A 58 VAL HGx% 1.0 1.8 3.55 1079 793 A 59 ALA HA A 60 LEU HA 1.0 1.8 5.23 1080 794 A 59 ALA HA A 60 LEU HBy 1.0 1.8 4.43 1081 794 A 59 ALA HA A 60 LEU HBx 1.0 1.8 4.43 1082 795 A 59 ALA HA A 60 LEU HBy 1.0 1.8 5.25 1083 796 A 59 ALA HA A 60 LEU HBx 1.0 1.8 5.25 1084 797 A 59 ALA HA A 60 LEU H 1.0 1.8 2.78 1085 798 A 59 ALA HB% A 60 LEU HA 1.0 1.8 5.13 1086 799 A 59 ALA HB% A 60 LEU H 1.0 1.8 3.60 1087 800 A 59 ALA HB% A 82 LEU H 1.0 1.8 3.72 1088 801 A 59 ALA HB% A 59 ALA H 1.0 1.8 3.11 1089 802 A 60 LEU H A 59 ALA H 1.0 1.8 4.66 1090 803 A 60 LEU HA A 60 LEU HDy% 1.0 1.8 3.57 1091 803 A 60 LEU HDx% A 60 LEU HA 1.0 1.8 3.57 1092 804 A 60 LEU HDx% A 60 LEU HA 1.0 1.8 4.16 1093 805 A 60 LEU HA A 60 LEU HDy% 1.0 1.8 4.16 1094 806 A 60 LEU HA A 61 LEU HBx 1.0 1.8 4.76 1095 807 A 61 LEU H A 60 LEU HA 1.0 1.8 2.77 1096 808 A 60 LEU HA A 81 GLN HA 1.0 1.8 3.76 1097 809 A 60 LEU HA A 82 LEU H 1.0 1.8 4.07 1098 810 A 61 LEU H A 60 LEU HBy 1.0 1.8 4.16 1099 810 A 61 LEU H A 60 LEU HBx 1.0 1.8 4.16 1100 811 A 61 LEU H A 60 LEU HDy% 1.0 1.8 3.77 1101 811 A 61 LEU H A 60 LEU HDx% 1.0 1.8 3.77 1102 812 A 61 LEU H A 60 LEU HG 1.0 1.8 4.00 1103 813 A 60 LEU H A 60 LEU HBy 1.0 1.8 2.98 1104 813 A 60 LEU H A 60 LEU HBx 1.0 1.8 2.98 1105 814 A 60 LEU H A 60 LEU HBy 1.0 1.8 3.59 1106 815 A 60 LEU H A 60 LEU HBx 1.0 1.8 3.59 1107 816 A 60 LEU H A 60 LEU HDy% 1.0 1.8 3.67 1108 816 A 60 LEU H A 60 LEU HDx% 1.0 1.8 3.67 1109 817 A 60 LEU H A 61 LEU H 1.0 1.8 4.72 1110 818 A 61 LEU HA A 62 ALA HB% 1.0 1.8 4.54 1111 819 A 62 ALA H A 61 LEU HA 1.0 1.8 2.85 1112 820 A 61 LEU HBy A 62 ALA HA 1.0 1.8 5.50 1113 821 A 61 LEU HBy A 80 TRP HBy 1.0 1.8 4.86 1114 822 A 61 LEU HBy A 80 TRP H 1.0 1.8 4.19 1115 823 A 82 LEU H A 61 LEU HBy 1.0 1.8 3.81 1116 824 A 61 LEU HBx A 61 LEU HDy% 1.0 1.8 3.06 1117 824 A 61 LEU HDx% A 61 LEU HBx 1.0 1.8 3.06 1118 825 A 61 LEU HBx A 80 TRP HD1 1.0 1.8 5.47 1119 826 A 61 LEU HBx A 82 LEU HDx% 1.0 1.8 5.13 1120 827 A 82 LEU H A 61 LEU HBx 1.0 1.8 3.78 1121 828 A 62 ALA HA A 61 LEU HDy% 1.0 1.8 3.74 1122 828 A 61 LEU HDx% A 62 ALA HA 1.0 1.8 3.74 1123 829 A 62 ALA H A 61 LEU HDy% 1.0 1.8 3.35 1124 829 A 62 ALA H A 61 LEU HDx% 1.0 1.8 3.35 1125 830 A 63 ASP HA A 61 LEU HDy% 1.0 1.8 4.05 1126 830 A 63 ASP HA A 61 LEU HDx% 1.0 1.8 4.05 1127 831 A 61 LEU HDy% A 63 ASP HBx 1.0 1.8 4.32 1128 831 A 61 LEU HDx% A 63 ASP HBx 1.0 1.8 4.32 1129 831 A 63 ASP HBy A 61 LEU HDy% 1.0 1.8 4.32 1130 831 A 63 ASP HBy A 61 LEU HDx% 1.0 1.8 4.32 1131 832 A 63 ASP H A 61 LEU HDy% 1.0 1.8 3.93 1132 832 A 61 LEU HDx% A 63 ASP H 1.0 1.8 3.93 1133 833 A 79 GLU HA A 61 LEU HDy% 1.0 1.8 3.98 1134 833 A 61 LEU HDx% A 79 GLU HA 1.0 1.8 3.98 1135 834 A 80 TRP HBy A 61 LEU HDy% 1.0 1.8 3.78 1136 834 A 61 LEU HDx% A 80 TRP HBy 1.0 1.8 3.78 1137 835 A 80 TRP HBx A 61 LEU HDy% 1.0 1.8 4.67 1138 835 A 61 LEU HDx% A 80 TRP HBx 1.0 1.8 4.67 1139 836 A 80 TRP HD1 A 61 LEU HDy% 1.0 1.8 4.14 1140 836 A 61 LEU HDx% A 80 TRP HD1 1.0 1.8 4.14 1141 837 A 80 TRP H A 61 LEU HDy% 1.0 1.8 3.67 1142 837 A 61 LEU HDx% A 80 TRP H 1.0 1.8 3.67 1143 838 A 62 ALA H A 61 LEU HDx% 1.0 1.8 4.02 1144 839 A 61 LEU HDx% A 63 ASP H 1.0 1.8 5.50 1145 840 A 62 ALA H A 61 LEU HDy% 1.0 1.8 4.02 1146 841 A 63 ASP H A 61 LEU HDy% 1.0 1.8 5.50 1147 842 A 61 LEU H A 61 LEU HBy 1.0 1.8 3.28 1148 843 A 61 LEU H A 61 LEU HBx 1.0 1.8 3.23 1149 844 A 61 LEU H A 61 LEU HDy% 1.0 1.8 3.99 1150 844 A 61 LEU HDx% A 61 LEU H 1.0 1.8 3.99 1151 845 A 61 LEU H A 79 GLU HA 1.0 1.8 5.22 1152 846 A 61 LEU H A 80 TRP HBy 1.0 1.8 5.30 1153 847 A 61 LEU H A 80 TRP H 1.0 1.8 3.76 1154 848 A 61 LEU H A 81 GLN HA 1.0 1.8 3.86 1155 849 A 61 LEU H A 82 LEU HG 1.0 1.8 4.32 1156 850 A 61 LEU H A 82 LEU H 1.0 1.8 4.40 1157 851 A 62 ALA HA A 63 ASP H 1.0 1.8 2.89 1158 852 A 62 ALA HA A 79 GLU HA 1.0 1.8 3.18 1159 853 A 62 ALA HA A 79 GLU HBx 1.0 1.8 5.11 1160 854 A 62 ALA HA A 80 TRP H 1.0 1.8 4.11 1161 855 A 62 ALA HB% A 63 ASP H 1.0 1.8 3.51 1162 856 A 62 ALA HB% A 79 GLU HA 1.0 1.8 3.98 1163 857 A 62 ALA HB% A 79 GLU HBy 1.0 1.8 4.19 1164 858 A 62 ALA H A 62 ALA HB% 1.0 1.8 3.17 1165 859 A 62 ALA H A 63 ASP H 1.0 1.8 4.64 1166 860 A 63 ASP HA A 64 LEU H 1.0 1.8 3.10 1167 861 A 70 THR HB A 63 ASP HA 1.0 1.8 5.24 1168 862 A 64 LEU H A 63 ASP HBx 1.0 1.8 4.41 1169 862 A 64 LEU H A 63 ASP HBy 1.0 1.8 4.41 1170 863 A 63 ASP HBx A 69 GLY HAy 1.0 1.8 4.66 1171 863 A 63 ASP HBy A 69 GLY HAy 1.0 1.8 4.66 1172 863 A 69 GLY HAx A 63 ASP HBx 1.0 1.8 4.66 1173 863 A 63 ASP HBy A 69 GLY HAx 1.0 1.8 4.66 1174 864 A 70 THR HB A 63 ASP HBx 1.0 1.8 3.61 1175 864 A 70 THR HB A 63 ASP HBy 1.0 1.8 3.61 1176 865 A 70 THR HG2% A 63 ASP HBx 1.0 1.8 5.08 1177 865 A 70 THR HG2% A 63 ASP HBy 1.0 1.8 5.08 1178 866 A 70 THR H A 63 ASP HBx 1.0 1.8 3.94 1179 866 A 63 ASP HBy A 70 THR H 1.0 1.8 3.94 1180 867 A 78 GLN HA A 63 ASP HBx 1.0 1.8 4.52 1181 867 A 63 ASP HBy A 78 GLN HA 1.0 1.8 4.52 1182 868 A 79 GLU HA A 63 ASP HBx 1.0 1.8 5.34 1183 868 A 63 ASP HBy A 79 GLU HA 1.0 1.8 5.34 1184 869 A 70 THR HB A 63 ASP HBy 1.0 1.8 4.20 1185 870 A 63 ASP HBy A 70 THR H 1.0 1.8 4.59 1186 871 A 70 THR HB A 63 ASP HBx 1.0 1.8 4.20 1187 872 A 70 THR H A 63 ASP HBx 1.0 1.8 4.59 1188 873 A 63 ASP H A 63 ASP HBx 1.0 1.8 3.03 1189 873 A 63 ASP HBy A 63 ASP H 1.0 1.8 3.03 1190 874 A 63 ASP HBy A 63 ASP H 1.0 1.8 3.61 1191 875 A 63 ASP H A 63 ASP HBx 1.0 1.8 3.61 1192 876 A 70 THR HB A 63 ASP H 1.0 1.8 5.50 1193 877 A 63 ASP H A 78 GLN HA 1.0 1.8 4.34 1194 878 A 63 ASP H A 78 GLN HBx 1.0 1.8 5.34 1195 878 A 63 ASP H A 78 GLN HBy 1.0 1.8 5.34 1196 879 A 63 ASP H A 79 GLU HA 1.0 1.8 3.95 1197 880 A 63 ASP H A 79 GLU HBy 1.0 1.8 5.50 1198 881 A 65 ASN H A 64 LEU HDy% 1.0 1.8 4.42 1199 881 A 64 LEU HDx% A 65 ASN H 1.0 1.8 4.42 1200 882 A 64 LEU H A 64 LEU HBx 1.0 1.8 3.00 1201 882 A 64 LEU HBy A 64 LEU H 1.0 1.8 3.00 1202 883 A 64 LEU H A 64 LEU HDy% 1.0 1.8 3.91 1203 883 A 64 LEU HDx% A 64 LEU H 1.0 1.8 3.91 1204 884 A 64 LEU HDx% A 64 LEU H 1.0 1.8 4.52 1205 885 A 64 LEU H A 64 LEU HDy% 1.0 1.8 4.52 1206 886 A 64 LEU HG A 64 LEU H 1.0 1.8 5.07 1207 887 A 64 LEU H A 65 ASN H 1.0 1.8 4.58 1208 888 A 65 ASN HBx A 65 ASN HD2x 1.0 1.8 3.26 1209 888 A 65 ASN HBy A 65 ASN HD2x 1.0 1.8 3.26 1210 888 A 65 ASN HD2y A 65 ASN HBx 1.0 1.8 3.26 1211 888 A 65 ASN HBy A 65 ASN HD2y 1.0 1.8 3.26 1212 889 A 65 ASN H A 66 SER H 1.0 1.8 4.29 1213 890 A 67 THR H A 66 SER HBy 1.0 1.8 3.59 1214 890 A 66 SER HBx A 67 THR H 1.0 1.8 3.59 1215 891 A 67 THR H A 66 SER HBy 1.0 1.8 4.30 1216 892 A 66 SER HBx A 67 THR H 1.0 1.8 4.30 1217 893 A 67 THR HA A 67 THR HG2% 1.0 1.8 3.36 1218 894 A 67 THR HB A 68 ASN H 1.0 1.8 4.26 1219 895 A 67 THR HG2% A 68 ASN HBy 1.0 1.8 5.34 1220 895 A 67 THR HG2% A 68 ASN HBx 1.0 1.8 5.34 1221 896 A 67 THR HG2% A 68 ASN HD2x 1.0 1.8 4.26 1222 896 A 67 THR HG2% A 68 ASN HD2y 1.0 1.8 4.26 1223 897 A 67 THR HG2% A 68 ASN H 1.0 1.8 4.64 1224 898 A 67 THR H A 67 THR HG2% 1.0 1.8 4.36 1225 899 A 67 THR H A 68 ASN H 1.0 1.8 3.91 1226 900 A 68 ASN HD2y A 68 ASN HBy 1.0 1.8 3.09 1227 900 A 68 ASN HBx A 68 ASN HD2y 1.0 1.8 3.09 1228 900 A 68 ASN HD2x A 68 ASN HBy 1.0 1.8 3.09 1229 900 A 68 ASN HBx A 68 ASN HD2x 1.0 1.8 3.09 1230 901 A 69 GLY H A 68 ASN HBy 1.0 1.8 4.20 1231 901 A 68 ASN HBx A 69 GLY H 1.0 1.8 4.20 1232 902 A 68 ASN HD2x A 68 ASN HBy 1.0 1.8 4.05 1233 903 A 68 ASN HD2y A 68 ASN HBy 1.0 1.8 4.05 1234 904 A 68 ASN HBx A 68 ASN HD2x 1.0 1.8 4.05 1235 905 A 68 ASN HBx A 68 ASN HD2y 1.0 1.8 4.05 1236 906 A 68 ASN H A 69 GLY H 1.0 1.8 3.45 1237 907 A 70 THR H A 69 GLY HAy 1.0 1.8 2.83 1238 907 A 69 GLY HAx A 70 THR H 1.0 1.8 2.83 1239 908 A 70 THR H A 69 GLY HAy 1.0 1.8 3.43 1240 909 A 69 GLY HAx A 70 THR H 1.0 1.8 3.43 1241 910 A 70 THR H A 69 GLY H 1.0 1.8 4.65 1242 911 A 70 THR HG2% A 70 THR HA 1.0 1.8 3.33 1243 912 A 70 THR HA A 71 THR HG2% 1.0 1.8 5.13 1244 913 A 70 THR HG2% A 71 THR HA 1.0 1.8 4.77 1245 914 A 70 THR HG2% A 71 THR H 1.0 1.8 4.00 1246 915 A 90 LEU HA A 70 THR HG2% 1.0 1.8 4.57 1247 916 A 70 THR HB A 70 THR H 1.0 1.8 3.13 1248 917 A 70 THR HG1 A 70 THR H 1.0 1.8 3.66 1249 918 A 70 THR HG2% A 70 THR H 1.0 1.8 3.83 1250 919 A 70 THR H A 71 THR H 1.0 1.8 4.88 1251 920 A 71 THR HG2% A 71 THR HA 1.0 1.8 3.23 1252 921 A 71 THR HA A 72 VAL H 1.0 1.8 2.86 1253 922 A 71 THR HA A 75 ALA H 1.0 1.8 4.49 1254 923 A 71 THR HA A 76 PRO HA 1.0 1.8 3.28 1255 924 A 71 THR HA A 76 PRO HBy 1.0 1.8 4.81 1256 925 A 71 THR HA A 77 VAL HGy% 1.0 1.8 4.32 1257 926 A 71 THR HA A 77 VAL H 1.0 1.8 3.67 1258 927 A 72 VAL H A 71 THR HB 1.0 1.8 3.70 1259 928 A 71 THR HB A 74 ASN HA 1.0 1.8 3.92 1260 929 A 71 THR HB A 74 ASN H 1.0 1.8 4.17 1261 930 A 75 ALA H A 71 THR HB 1.0 1.8 4.16 1262 931 A 76 PRO HBy A 71 THR HB 1.0 1.8 5.45 1263 932 A 71 THR HG2% A 72 VAL HGy% 1.0 1.8 4.20 1264 932 A 71 THR HG2% A 72 VAL HGx% 1.0 1.8 4.20 1265 933 A 71 THR HG2% A 72 VAL H 1.0 1.8 3.68 1266 934 A 71 THR HG2% A 74 ASN HA 1.0 1.8 4.03 1267 935 A 71 THR HG2% A 74 ASN H 1.0 1.8 4.36 1268 936 A 71 THR HG2% A 75 ALA HA 1.0 1.8 4.91 1269 937 A 71 THR HG2% A 75 ALA H 1.0 1.8 4.34 1270 938 A 71 THR HG2% A 76 PRO HA 1.0 1.8 3.11 1271 939 A 71 THR HG2% A 77 VAL H 1.0 1.8 4.17 1272 940 A 71 THR HG2% A 89 ARG H 1.0 1.8 4.73 1273 941 A 71 THR HG2% A 71 THR H 1.0 1.8 4.40 1274 942 A 71 THR H A 89 ARG H 1.0 1.8 3.91 1275 943 A 72 VAL HA A 73 ASN H 1.0 1.8 2.94 1276 944 A 74 ASN H A 72 VAL HA 1.0 1.8 4.50 1277 945 A 72 VAL HA A 88 ILE HB 1.0 1.8 5.26 1278 946 A 72 VAL HB A 73 ASN HA 1.0 1.8 5.15 1279 947 A 72 VAL HB A 73 ASN HBx 1.0 1.8 4.94 1280 948 A 72 VAL HB A 73 ASN HD2x 1.0 1.8 4.27 1281 948 A 72 VAL HB A 73 ASN HD2y 1.0 1.8 4.27 1282 949 A 73 ASN H A 72 VAL HB 1.0 1.8 3.42 1283 950 A 80 TRP HBy A 72 VAL HB 1.0 1.8 4.28 1284 951 A 80 TRP HD1 A 72 VAL HB 1.0 1.8 3.89 1285 952 A 72 VAL HB A 80 TRP HE1 1.0 1.8 3.76 1286 953 A 72 VAL HB A 80 TRP HH2 1.0 1.8 5.50 1287 954 A 72 VAL HB A 80 TRP HZ2 1.0 1.8 4.58 1288 955 A 72 VAL HB A 82 LEU HDy% 1.0 1.8 4.95 1289 956 A 72 VAL HB A 86 ASP HBx 1.0 1.8 4.21 1290 956 A 72 VAL HB A 86 ASP HBy 1.0 1.8 4.21 1291 957 A 72 VAL HB A 88 ILE HA 1.0 1.8 4.39 1292 958 A 73 ASN H A 72 VAL HGy% 1.0 1.8 3.72 1293 958 A 72 VAL HGx% A 73 ASN H 1.0 1.8 3.72 1294 959 A 80 TRP HE1 A 72 VAL HGy% 1.0 1.8 4.63 1295 959 A 72 VAL HGx% A 80 TRP HE1 1.0 1.8 4.63 1296 960 A 72 VAL HGx% A 86 ASP HBx 1.0 1.8 5.22 1297 960 A 86 ASP HBy A 72 VAL HGy% 1.0 1.8 5.22 1298 960 A 72 VAL HGx% A 86 ASP HBy 1.0 1.8 5.22 1299 960 A 72 VAL HGy% A 86 ASP HBx 1.0 1.8 5.22 1300 961 A 72 VAL HGx% A 73 ASN H 1.0 1.8 4.45 1301 962 A 73 ASN H A 72 VAL HGy% 1.0 1.8 4.45 1302 963 A 72 VAL H A 72 VAL HGx% 1.0 1.8 3.37 1303 964 A 72 VAL H A 72 VAL HGy% 1.0 1.8 3.37 1304 965 A 72 VAL H A 73 ASN H 1.0 1.8 4.41 1305 966 A 72 VAL H A 74 ASN HA 1.0 1.8 5.15 1306 967 A 72 VAL H A 74 ASN H 1.0 1.8 4.84 1307 968 A 72 VAL H A 75 ALA HB% 1.0 1.8 4.07 1308 969 A 72 VAL H A 75 ALA H 1.0 1.8 3.51 1309 970 A 72 VAL H A 76 PRO HA 1.0 1.8 4.08 1310 971 A 72 VAL H A 77 VAL HGx% 1.0 1.8 4.41 1311 972 A 72 VAL H A 77 VAL H 1.0 1.8 4.59 1312 973 A 72 VAL H A 89 ARG H 1.0 1.8 5.50 1313 974 A 73 ASN HA A 74 ASN HBx 1.0 1.8 4.84 1314 974 A 73 ASN HA A 74 ASN HBy 1.0 1.8 4.84 1315 975 A 74 ASN H A 73 ASN HA 1.0 1.8 3.57 1316 976 A 73 ASN HA A 87 VAL HB 1.0 1.8 3.64 1317 977 A 73 ASN HA A 87 VAL HGx% 1.0 1.8 5.02 1318 978 A 73 ASN HA A 87 VAL H 1.0 1.8 4.45 1319 979 A 87 VAL HB A 73 ASN HBy 1.0 1.8 5.19 1320 980 A 86 ASP HA A 73 ASN HD2x 1.0 1.8 4.00 1321 980 A 86 ASP HA A 73 ASN HD2y 1.0 1.8 4.00 1322 981 A 87 VAL H A 73 ASN HD2x 1.0 1.8 4.62 1323 982 A 87 VAL H A 73 ASN HD2y 1.0 1.8 4.62 1324 983 A 74 ASN HA A 73 ASN H 1.0 1.8 5.10 1325 984 A 74 ASN H A 73 ASN H 1.0 1.8 3.57 1326 985 A 75 ALA H A 73 ASN H 1.0 1.8 4.54 1327 986 A 73 ASN H A 87 VAL HA 1.0 1.8 4.51 1328 987 A 73 ASN H A 87 VAL HB 1.0 1.8 4.00 1329 988 A 73 ASN H A 87 VAL HGx% 1.0 1.8 4.21 1330 989 A 73 ASN H A 87 VAL HGy% 1.0 1.8 4.44 1331 990 A 73 ASN H A 87 VAL H 1.0 1.8 3.89 1332 991 A 74 ASN HA A 87 VAL HB 1.0 1.8 5.50 1333 992 A 74 ASN HBx A 74 ASN HD2x 1.0 1.8 3.23 1334 992 A 74 ASN HBy A 74 ASN HD2x 1.0 1.8 3.23 1335 992 A 74 ASN HD2y A 74 ASN HBx 1.0 1.8 3.23 1336 992 A 74 ASN HBy A 74 ASN HD2y 1.0 1.8 3.23 1337 993 A 87 VAL HGx% A 74 ASN HBx 1.0 1.8 5.34 1338 993 A 74 ASN HBy A 87 VAL HGx% 1.0 1.8 5.34 1339 994 A 74 ASN H A 74 ASN HBx 1.0 1.8 3.52 1340 994 A 74 ASN H A 74 ASN HBy 1.0 1.8 3.52 1341 995 A 75 ALA H A 74 ASN H 1.0 1.8 3.86 1342 996 A 75 ALA HA A 76 PRO HDy 1.0 1.8 2.94 1343 996 A 75 ALA HA A 76 PRO HDx 1.0 1.8 2.94 1344 997 A 75 ALA HA A 76 PRO HDy 1.0 1.8 3.37 1345 998 A 75 ALA HA A 76 PRO HDx 1.0 1.8 3.37 1346 999 A 75 ALA HA A 76 PRO HGx 1.0 1.8 4.40 1347 999 A 75 ALA HA A 76 PRO HGy 1.0 1.8 4.40 1348 1000 A 75 ALA HB% A 76 PRO HDy 1.0 1.8 3.41 1349 1000 A 75 ALA HB% A 76 PRO HDx 1.0 1.8 3.41 1350 1001 A 75 ALA HB% A 76 PRO HDy 1.0 1.8 3.98 1351 1002 A 75 ALA HB% A 76 PRO HDx 1.0 1.8 3.98 1352 1003 A 75 ALA HB% A 76 PRO HGx 1.0 1.8 5.34 1353 1003 A 75 ALA HB% A 76 PRO HGy 1.0 1.8 5.34 1354 1004 A 75 ALA H A 75 ALA HB% 1.0 1.8 3.12 1355 1005 A 75 ALA H A 77 VAL HGx% 1.0 1.8 5.14 1356 1006 A 76 PRO HA A 77 VAL HGy% 1.0 1.8 3.70 1357 1007 A 76 PRO HA A 77 VAL H 1.0 1.8 2.94 1358 1008 A 76 PRO HBy A 77 VAL H 1.0 1.8 4.12 1359 1009 A 77 VAL H A 76 PRO HBx 1.0 1.8 4.23 1360 1010 A 77 VAL HGx% A 77 VAL HA 1.0 1.8 2.96 1361 1011 A 77 VAL HGy% A 77 VAL HA 1.0 1.8 3.89 1362 1012 A 77 VAL HA A 78 GLN H 1.0 1.8 2.86 1363 1013 A 77 VAL HA A 79 GLU H 1.0 1.8 4.75 1364 1014 A 78 GLN H A 77 VAL HB 1.0 1.8 3.13 1365 1015 A 79 GLU H A 77 VAL HB 1.0 1.8 3.52 1366 1016 A 77 VAL HB A 80 TRP HE3 1.0 1.8 5.04 1367 1017 A 77 VAL HGx% A 78 GLN H 1.0 1.8 3.96 1368 1018 A 80 TRP HBx A 77 VAL HGx% 1.0 1.8 4.93 1369 1019 A 77 VAL HGx% A 80 TRP HE3 1.0 1.8 3.98 1370 1020 A 77 VAL HGx% A 80 TRP HZ3 1.0 1.8 5.02 1371 1021 A 77 VAL HGy% A 78 GLN H 1.0 1.8 4.00 1372 1022 A 79 GLU HA A 77 VAL HGy% 1.0 1.8 5.50 1373 1023 A 77 VAL HGy% A 79 GLU HGy 1.0 1.8 5.14 1374 1023 A 77 VAL HGy% A 79 GLU HGx 1.0 1.8 5.14 1375 1024 A 77 VAL HGy% A 80 TRP HA 1.0 1.8 4.68 1376 1025 A 80 TRP HBy A 77 VAL HGy% 1.0 1.8 4.05 1377 1026 A 80 TRP HBx A 77 VAL HGy% 1.0 1.8 3.96 1378 1027 A 80 TRP HD1 A 77 VAL HGy% 1.0 1.8 5.14 1379 1028 A 77 VAL HGy% A 80 TRP HE3 1.0 1.8 4.46 1380 1029 A 77 VAL HGy% A 80 TRP HZ3 1.0 1.8 5.50 1381 1030 A 77 VAL H A 77 VAL HB 1.0 1.8 4.14 1382 1031 A 77 VAL H A 77 VAL HGx% 1.0 1.8 3.76 1383 1032 A 77 VAL HGy% A 77 VAL H 1.0 1.8 3.17 1384 1033 A 78 GLN HA A 78 GLN HGy 1.0 1.8 3.61 1385 1033 A 78 GLN HA A 78 GLN HGx 1.0 1.8 3.61 1386 1034 A 79 GLU HA A 78 GLN HA 1.0 1.8 5.40 1387 1035 A 79 GLU H A 78 GLN HGy 1.0 1.8 4.60 1388 1035 A 79 GLU H A 78 GLN HGx 1.0 1.8 4.60 1389 1036 A 78 GLN H A 78 GLN HBx 1.0 1.8 3.33 1390 1036 A 78 GLN HBy A 78 GLN H 1.0 1.8 3.33 1391 1037 A 78 GLN H A 78 GLN HGy 1.0 1.8 3.30 1392 1037 A 78 GLN H A 78 GLN HGx 1.0 1.8 3.30 1393 1038 A 78 GLN H A 78 GLN HGy 1.0 1.8 3.82 1394 1039 A 78 GLN H A 78 GLN HGx 1.0 1.8 3.82 1395 1040 A 78 GLN H A 79 GLU H 1.0 1.8 2.91 1396 1041 A 80 TRP H A 79 GLU HA 1.0 1.8 2.83 1397 1042 A 79 GLU HBx A 80 TRP HA 1.0 1.8 4.93 1398 1043 A 80 TRP H A 79 GLU HBx 1.0 1.8 3.30 1399 1044 A 80 TRP HA A 79 GLU HGy 1.0 1.8 5.28 1400 1044 A 79 GLU HGx A 80 TRP HA 1.0 1.8 5.28 1401 1045 A 80 TRP H A 79 GLU HGy 1.0 1.8 4.75 1402 1045 A 80 TRP H A 79 GLU HGx 1.0 1.8 4.75 1403 1046 A 79 GLU HBy A 79 GLU H 1.0 1.8 3.94 1404 1047 A 79 GLU H A 79 GLU HGy 1.0 1.8 4.12 1405 1048 A 79 GLU H A 79 GLU HGx 1.0 1.8 4.12 1406 1049 A 80 TRP H A 79 GLU H 1.0 1.8 4.76 1407 1050 A 80 TRP HE3 A 80 TRP HA 1.0 1.8 4.21 1408 1051 A 80 TRP HA A 81 GLN HGx 1.0 1.8 5.08 1409 1051 A 80 TRP HA A 81 GLN HGy 1.0 1.8 5.08 1410 1052 A 80 TRP HA A 81 GLN H 1.0 1.8 2.68 1411 1053 A 80 TRP HBy A 81 GLN H 1.0 1.8 4.27 1412 1054 A 80 TRP HBx A 80 TRP HE3 1.0 1.8 3.90 1413 1055 A 80 TRP HBx A 80 TRP HZ3 1.0 1.8 5.50 1414 1056 A 80 TRP HBx A 81 GLN H 1.0 1.8 3.92 1415 1057 A 80 TRP HBx A 82 LEU HDy% 1.0 1.8 5.47 1416 1058 A 80 TRP HD1 A 82 LEU HA 1.0 1.8 3.45 1417 1059 A 80 TRP HD1 A 82 LEU HDy% 1.0 1.8 4.00 1418 1060 A 82 LEU H A 80 TRP HD1 1.0 1.8 4.29 1419 1061 A 80 TRP HD1 A 83 ALA H 1.0 1.8 5.17 1420 1062 A 80 TRP HE1 A 82 LEU HA 1.0 1.8 3.82 1421 1063 A 80 TRP HE1 A 82 LEU HBx 1.0 1.8 4.80 1422 1063 A 80 TRP HE1 A 82 LEU HBy 1.0 1.8 4.80 1423 1064 A 80 TRP HE1 A 83 ALA HB% 1.0 1.8 4.61 1424 1065 A 80 TRP HE1 A 83 ALA H 1.0 1.8 3.98 1425 1066 A 80 TRP HE1 A 86 ASP HBx 1.0 1.8 4.67 1426 1066 A 80 TRP HE1 A 86 ASP HBy 1.0 1.8 4.67 1427 1067 A 80 TRP HBy A 80 TRP H 1.0 1.8 3.74 1428 1068 A 80 TRP H A 80 TRP HBx 1.0 1.8 3.98 1429 1069 A 80 TRP H A 81 GLN H 1.0 1.8 4.35 1430 1070 A 81 GLN HA A 81 GLN HGx 1.0 1.8 3.46 1431 1070 A 81 GLN HA A 81 GLN HGy 1.0 1.8 3.46 1432 1071 A 82 LEU H A 81 GLN HA 1.0 1.8 2.83 1433 1072 A 81 GLN H A 81 GLN HBx 1.0 1.8 2.99 1434 1072 A 81 GLN H A 81 GLN HBy 1.0 1.8 2.99 1435 1073 A 81 GLN H A 81 GLN HGx 1.0 1.8 3.71 1436 1073 A 81 GLN HGy A 81 GLN H 1.0 1.8 3.71 1437 1074 A 82 LEU H A 81 GLN H 1.0 1.8 4.47 1438 1075 A 82 LEU HDx% A 82 LEU HA 1.0 1.8 4.03 1439 1076 A 82 LEU HG A 82 LEU HA 1.0 1.8 3.76 1440 1077 A 82 LEU HA A 83 ALA HB% 1.0 1.8 4.08 1441 1078 A 82 LEU HA A 83 ALA H 1.0 1.8 3.05 1442 1079 A 82 LEU HA A 88 ILE HD1% 1.0 1.8 3.62 1443 1080 A 83 ALA H A 82 LEU HBx 1.0 1.8 4.06 1444 1080 A 83 ALA H A 82 LEU HBy 1.0 1.8 4.06 1445 1081 A 82 LEU HDx% A 88 ILE HD1% 1.0 1.8 3.65 1446 1082 A 82 LEU HDy% A 83 ALA H 1.0 1.8 5.21 1447 1083 A 82 LEU HDy% A 88 ILE HD1% 1.0 1.8 3.21 1448 1084 A 82 LEU H A 82 LEU HBx 1.0 1.8 3.47 1449 1084 A 82 LEU H A 82 LEU HBy 1.0 1.8 3.47 1450 1085 A 82 LEU H A 82 LEU HDx% 1.0 1.8 4.12 1451 1086 A 82 LEU H A 82 LEU HG 1.0 1.8 3.00 1452 1087 A 82 LEU H A 83 ALA H 1.0 1.8 4.68 1453 1088 A 83 ALA HA A 84 ASP H 1.0 1.8 2.81 1454 1089 A 83 ALA HA A 86 ASP H 1.0 1.8 5.50 1455 1090 A 83 ALA HB% A 84 ASP H 1.0 1.8 3.01 1456 1091 A 83 ALA HB% A 86 ASP H 1.0 1.8 4.40 1457 1092 A 83 ALA H A 83 ALA HB% 1.0 1.8 3.26 1458 1093 A 83 ALA H A 84 ASP H 1.0 1.8 4.64 1459 1094 A 83 ALA H A 86 ASP HBx 1.0 1.8 4.05 1460 1094 A 86 ASP HBy A 83 ALA H 1.0 1.8 4.05 1461 1095 A 86 ASP HBy A 83 ALA H 1.0 1.8 4.72 1462 1096 A 83 ALA H A 86 ASP HBx 1.0 1.8 4.72 1463 1097 A 83 ALA H A 86 ASP H 1.0 1.8 4.66 1464 1098 A 83 ALA H A 97 VAL HB 1.0 1.8 5.24 1465 1099 A 97 VAL HGx% A 83 ALA H 1.0 1.8 5.38 1466 1100 A 97 VAL HGy% A 83 ALA H 1.0 1.8 4.64 1467 1101 A 84 ASP HA A 85 GLY H 1.0 1.8 2.85 1468 1102 A 86 ASP H A 84 ASP HA 1.0 1.8 3.74 1469 1103 A 97 VAL HGx% A 84 ASP HA 1.0 1.8 3.85 1470 1104 A 98 ARG HA A 84 ASP HA 1.0 1.8 4.02 1471 1105 A 99 MET HA A 84 ASP HA 1.0 1.8 5.40 1472 1106 A 84 ASP HA A 99 MET HBy 1.0 1.8 4.30 1473 1107 A 84 ASP HA A 99 MET H 1.0 1.8 3.62 1474 1108 A 98 ARG HA A 84 ASP HBy 1.0 1.8 4.92 1475 1108 A 98 ARG HA A 84 ASP HBx 1.0 1.8 4.92 1476 1109 A 99 MET HBy A 84 ASP HBy 1.0 1.8 3.96 1477 1109 A 99 MET HBy A 84 ASP HBx 1.0 1.8 3.96 1478 1110 A 99 MET H A 84 ASP HBy 1.0 1.8 3.88 1479 1110 A 99 MET H A 84 ASP HBx 1.0 1.8 3.88 1480 1111 A 85 GLY H A 84 ASP HBx 1.0 1.8 4.73 1481 1112 A 99 MET HBy A 84 ASP HBx 1.0 1.8 4.71 1482 1113 A 99 MET H A 84 ASP HBx 1.0 1.8 4.48 1483 1114 A 85 GLY H A 84 ASP HBy 1.0 1.8 4.73 1484 1115 A 99 MET HBy A 84 ASP HBy 1.0 1.8 4.71 1485 1116 A 99 MET H A 84 ASP HBy 1.0 1.8 4.48 1486 1117 A 84 ASP H A 84 ASP HBx 1.0 1.8 3.07 1487 1118 A 84 ASP H A 84 ASP HBy 1.0 1.8 3.07 1488 1119 A 84 ASP H A 85 GLY H 1.0 1.8 4.65 1489 1120 A 84 ASP H A 99 MET HBy 1.0 1.8 4.32 1490 1121 A 84 ASP H A 99 MET HGy 1.0 1.8 4.18 1491 1122 A 85 GLY HAx A 98 ARG HDx 1.0 1.8 4.33 1492 1122 A 85 GLY HAy A 98 ARG HDx 1.0 1.8 4.33 1493 1122 A 98 ARG HDy A 85 GLY HAx 1.0 1.8 4.33 1494 1122 A 85 GLY HAy A 98 ARG HDy 1.0 1.8 4.33 1495 1123 A 85 GLY H A 86 ASP HBx 1.0 1.8 4.97 1496 1123 A 86 ASP HBy A 85 GLY H 1.0 1.8 4.97 1497 1124 A 86 ASP H A 85 GLY H 1.0 1.8 3.22 1498 1125 A 97 VAL HB A 85 GLY H 1.0 1.8 4.01 1499 1126 A 97 VAL HGx% A 85 GLY H 1.0 1.8 4.86 1500 1127 A 97 VAL HGy% A 85 GLY H 1.0 1.8 5.27 1501 1128 A 85 GLY H A 97 VAL H 1.0 1.8 4.73 1502 1129 A 98 ARG HA A 85 GLY H 1.0 1.8 3.93 1503 1130 A 87 VAL HB A 86 ASP HA 1.0 1.8 4.86 1504 1131 A 87 VAL H A 86 ASP HA 1.0 1.8 2.88 1505 1132 A 87 VAL H A 86 ASP HBx 1.0 1.8 3.61 1506 1132 A 86 ASP HBy A 87 VAL H 1.0 1.8 3.61 1507 1133 A 88 ILE HD1% A 86 ASP HBx 1.0 1.8 4.02 1508 1133 A 86 ASP HBy A 88 ILE HD1% 1.0 1.8 4.02 1509 1134 A 86 ASP HBx A 88 ILE HG1x 1.0 1.8 4.59 1510 1134 A 86 ASP HBy A 88 ILE HG1x 1.0 1.8 4.59 1511 1134 A 88 ILE HG1y A 86 ASP HBx 1.0 1.8 4.59 1512 1134 A 86 ASP HBy A 88 ILE HG1y 1.0 1.8 4.59 1513 1135 A 97 VAL HGx% A 86 ASP HBx 1.0 1.8 4.06 1514 1135 A 97 VAL HGx% A 86 ASP HBy 1.0 1.8 4.06 1515 1136 A 86 ASP HBy A 87 VAL H 1.0 1.8 4.28 1516 1137 A 87 VAL H A 86 ASP HBx 1.0 1.8 4.28 1517 1138 A 86 ASP H A 86 ASP HBx 1.0 1.8 2.97 1518 1138 A 86 ASP HBy A 86 ASP H 1.0 1.8 2.97 1519 1139 A 86 ASP H A 96 ILE HA 1.0 1.8 5.50 1520 1140 A 86 ASP H A 96 ILE HG2% 1.0 1.8 4.48 1521 1141 A 86 ASP H A 97 VAL HB 1.0 1.8 2.98 1522 1142 A 97 VAL HGx% A 86 ASP H 1.0 1.8 3.88 1523 1143 A 97 VAL HGy% A 86 ASP H 1.0 1.8 4.48 1524 1144 A 86 ASP H A 97 VAL H 1.0 1.8 4.09 1525 1145 A 87 VAL HGx% A 87 VAL HA 1.0 1.8 3.41 1526 1146 A 87 VAL HA A 87 VAL HGy% 1.0 1.8 3.77 1527 1147 A 88 ILE HB A 87 VAL HA 1.0 1.8 4.58 1528 1148 A 87 VAL HA A 88 ILE H 1.0 1.8 3.05 1529 1149 A 87 VAL HA A 96 ILE HG1x 1.0 1.8 4.75 1530 1149 A 87 VAL HA A 96 ILE HG1y 1.0 1.8 4.75 1531 1150 A 87 VAL HA A 97 VAL H 1.0 1.8 4.26 1532 1151 A 87 VAL HB A 88 ILE H 1.0 1.8 4.70 1533 1152 A 87 VAL HGx% A 88 ILE H 1.0 1.8 3.31 1534 1153 A 87 VAL HGy% A 88 ILE H 1.0 1.8 4.25 1535 1154 A 87 VAL HB A 87 VAL H 1.0 1.8 3.46 1536 1155 A 87 VAL HGx% A 87 VAL H 1.0 1.8 4.12 1537 1156 A 87 VAL H A 87 VAL HGy% 1.0 1.8 3.55 1538 1157 A 88 ILE HA A 88 ILE HG1x 1.0 1.8 3.68 1539 1157 A 88 ILE HA A 88 ILE HG1y 1.0 1.8 3.68 1540 1158 A 88 ILE HA A 88 ILE HG2% 1.0 1.8 2.96 1541 1159 A 88 ILE HA A 89 ARG HA 1.0 1.8 5.34 1542 1160 A 89 ARG H A 88 ILE HA 1.0 1.8 3.12 1543 1161 A 88 ILE HB A 88 ILE HD1% 1.0 1.8 3.31 1544 1162 A 89 ARG H A 88 ILE HB 1.0 1.8 4.77 1545 1163 A 88 ILE HG2% A 88 ILE HG1x 1.0 1.8 2.88 1546 1163 A 88 ILE HG1y A 88 ILE HG2% 1.0 1.8 2.88 1547 1164 A 89 ARG H A 88 ILE HG2% 1.0 1.8 3.53 1548 1165 A 88 ILE HG2% A 94 GLU HA 1.0 1.8 4.63 1549 1166 A 88 ILE HB A 88 ILE H 1.0 1.8 3.29 1550 1167 A 88 ILE H A 94 GLU HA 1.0 1.8 5.39 1551 1168 A 88 ILE H A 95 ILE H 1.0 1.8 4.17 1552 1169 A 89 ARG HA A 89 ARG HDy 1.0 1.8 4.48 1553 1169 A 89 ARG HA A 89 ARG HDx 1.0 1.8 4.48 1554 1170 A 89 ARG HA A 89 ARG HGx 1.0 1.8 3.68 1555 1170 A 89 ARG HA A 89 ARG HGy 1.0 1.8 3.68 1556 1171 A 90 LEU HA A 89 ARG HA 1.0 1.8 5.50 1557 1172 A 89 ARG HA A 90 LEU H 1.0 1.8 2.86 1558 1173 A 89 ARG HA A 93 SER H 1.0 1.8 5.39 1559 1174 A 90 LEU H A 89 ARG HBy 1.0 1.8 4.54 1560 1174 A 90 LEU H A 89 ARG HBx 1.0 1.8 4.54 1561 1175 A 94 GLU HA A 89 ARG HDy 1.0 1.8 5.34 1562 1175 A 94 GLU HA A 89 ARG HDx 1.0 1.8 5.34 1563 1176 A 90 LEU H A 89 ARG HGx 1.0 1.8 4.01 1564 1176 A 89 ARG HGy A 90 LEU H 1.0 1.8 4.01 1565 1177 A 94 GLU HA A 89 ARG HGx 1.0 1.8 4.35 1566 1177 A 94 GLU HA A 89 ARG HGy 1.0 1.8 4.35 1567 1178 A 89 ARG HGy A 94 GLU HBy 1.0 1.8 3.43 1568 1178 A 94 GLU HBx A 89 ARG HGx 1.0 1.8 3.43 1569 1178 A 89 ARG HGy A 94 GLU HBx 1.0 1.8 3.43 1570 1178 A 89 ARG HGx A 94 GLU HBy 1.0 1.8 3.43 1571 1179 A 89 ARG HGx A 94 GLU HGx 1.0 1.8 4.72 1572 1179 A 89 ARG HGy A 94 GLU HGx 1.0 1.8 4.72 1573 1179 A 94 GLU HGy A 89 ARG HGx 1.0 1.8 4.72 1574 1179 A 89 ARG HGy A 94 GLU HGy 1.0 1.8 4.72 1575 1180 A 89 ARG H A 89 ARG HBy 1.0 1.8 3.59 1576 1180 A 89 ARG H A 89 ARG HBx 1.0 1.8 3.59 1577 1181 A 89 ARG H A 89 ARG HBy 1.0 1.8 4.09 1578 1182 A 89 ARG H A 89 ARG HBx 1.0 1.8 4.09 1579 1183 A 90 LEU HDx% A 90 LEU HA 1.0 1.8 4.15 1580 1184 A 90 LEU HA A 90 LEU HDy% 1.0 1.8 4.15 1581 1185 A 90 LEU HA A 91 GLY HAx 1.0 1.8 4.31 1582 1186 A 90 LEU HA A 91 GLY H 1.0 1.8 2.93 1583 1187 A 90 LEU HDx% A 90 LEU HBy 1.0 1.8 3.26 1584 1187 A 90 LEU HDx% A 90 LEU HBx 1.0 1.8 3.26 1585 1188 A 90 LEU HDy% A 90 LEU HBy 1.0 1.8 3.39 1586 1188 A 90 LEU HBx A 90 LEU HDy% 1.0 1.8 3.39 1587 1189 A 91 GLY H A 90 LEU HBy 1.0 1.8 3.56 1588 1189 A 90 LEU HBx A 91 GLY H 1.0 1.8 3.56 1589 1190 A 90 LEU HDx% A 90 LEU HBy 1.0 1.8 3.88 1590 1191 A 90 LEU HDy% A 90 LEU HBy 1.0 1.8 4.15 1591 1192 A 91 GLY H A 90 LEU HBy 1.0 1.8 4.12 1592 1193 A 90 LEU HDx% A 90 LEU HBx 1.0 1.8 3.88 1593 1194 A 90 LEU HBx A 90 LEU HDy% 1.0 1.8 4.15 1594 1195 A 90 LEU HBx A 91 GLY H 1.0 1.8 4.12 1595 1196 A 90 LEU HDx% A 93 SER HBy 1.0 1.8 5.31 1596 1196 A 90 LEU HDx% A 93 SER HBx 1.0 1.8 5.31 1597 1197 A 91 GLY H A 90 LEU HDy% 1.0 1.8 4.92 1598 1198 A 90 LEU HDy% A 93 SER HBy 1.0 1.8 4.00 1599 1198 A 90 LEU HDy% A 93 SER HBx 1.0 1.8 4.00 1600 1199 A 90 LEU HDy% A 93 SER HBy 1.0 1.8 4.77 1601 1200 A 90 LEU HDy% A 93 SER HBx 1.0 1.8 4.77 1602 1201 A 93 SER H A 90 LEU HDy% 1.0 1.8 5.04 1603 1202 A 91 GLY H A 90 LEU HG 1.0 1.8 4.75 1604 1203 A 90 LEU HG A 93 SER HBy 1.0 1.8 4.39 1605 1203 A 93 SER HBx A 90 LEU HG 1.0 1.8 4.39 1606 1204 A 93 SER H A 90 LEU HG 1.0 1.8 4.42 1607 1205 A 90 LEU H A 90 LEU HBy 1.0 1.8 3.59 1608 1205 A 90 LEU HBx A 90 LEU H 1.0 1.8 3.59 1609 1206 A 90 LEU H A 90 LEU HDy% 1.0 1.8 3.08 1610 1207 A 90 LEU H A 90 LEU HG 1.0 1.8 3.67 1611 1208 A 91 GLY H A 90 LEU H 1.0 1.8 4.60 1612 1209 A 90 LEU H A 93 SER H 1.0 1.8 3.85 1613 1210 A 94 GLU HA A 90 LEU H 1.0 1.8 4.03 1614 1211 A 90 LEU H A 94 GLU HBy 1.0 1.8 4.46 1615 1211 A 90 LEU H A 94 GLU HBx 1.0 1.8 4.46 1616 1212 A 91 GLY HAy A 92 HIS H 1.0 1.8 3.62 1617 1213 A 91 GLY HAx A 92 HIS HBx 1.0 1.8 4.71 1618 1213 A 91 GLY HAx A 92 HIS HBy 1.0 1.8 4.71 1619 1214 A 91 GLY HAx A 92 HIS H 1.0 1.8 3.21 1620 1215 A 93 SER H A 91 GLY HAx 1.0 1.8 4.57 1621 1216 A 91 GLY H A 92 HIS H 1.0 1.8 4.67 1622 1217 A 91 GLY H A 93 SER H 1.0 1.8 5.41 1623 1218 A 93 SER H A 92 HIS HA 1.0 1.8 3.50 1624 1219 A 93 SER H A 92 HIS HBx 1.0 1.8 4.55 1625 1219 A 93 SER H A 92 HIS HBy 1.0 1.8 4.55 1626 1220 A 92 HIS H A 92 HIS HBx 1.0 1.8 3.58 1627 1220 A 92 HIS H A 92 HIS HBy 1.0 1.8 3.58 1628 1221 A 93 SER H A 92 HIS H 1.0 1.8 3.09 1629 1222 A 93 SER HA A 94 GLU HGx 1.0 1.8 3.97 1630 1222 A 94 GLU HGy A 93 SER HA 1.0 1.8 3.97 1631 1223 A 93 SER HA A 94 GLU H 1.0 1.8 2.98 1632 1224 A 94 GLU H A 93 SER HBy 1.0 1.8 3.57 1633 1224 A 93 SER HBx A 94 GLU H 1.0 1.8 3.57 1634 1225 A 94 GLU H A 93 SER HBy 1.0 1.8 4.21 1635 1226 A 93 SER HBx A 94 GLU H 1.0 1.8 4.21 1636 1227 A 93 SER H A 93 SER HBy 1.0 1.8 3.20 1637 1227 A 93 SER H A 93 SER HBx 1.0 1.8 3.20 1638 1228 A 93 SER H A 94 GLU H 1.0 1.8 4.57 1639 1229 A 94 GLU HA A 95 ILE H 1.0 1.8 3.12 1640 1230 A 95 ILE H A 94 GLU HBy 1.0 1.8 4.14 1641 1231 A 95 ILE H A 94 GLU HBx 1.0 1.8 4.14 1642 1232 A 94 GLU H A 94 GLU HBy 1.0 1.8 3.41 1643 1232 A 94 GLU HBx A 94 GLU H 1.0 1.8 3.41 1644 1233 A 94 GLU H A 94 GLU HBy 1.0 1.8 4.20 1645 1234 A 94 GLU HBx A 94 GLU H 1.0 1.8 4.20 1646 1235 A 94 GLU H A 94 GLU HGx 1.0 1.8 3.99 1647 1235 A 94 GLU HGy A 94 GLU H 1.0 1.8 3.99 1648 1236 A 95 ILE HD1% A 95 ILE HA 1.0 1.8 3.61 1649 1237 A 95 ILE HA A 95 ILE HG2% 1.0 1.8 3.52 1650 1238 A 95 ILE HA A 96 ILE HG1x 1.0 1.8 5.34 1651 1238 A 96 ILE HG1y A 95 ILE HA 1.0 1.8 5.34 1652 1239 A 96 ILE H A 95 ILE HA 1.0 1.8 3.15 1653 1240 A 96 ILE H A 95 ILE HD1% 1.0 1.8 3.44 1654 1241 A 96 ILE H A 95 ILE HG1y 1.0 1.8 4.60 1655 1241 A 95 ILE HG1x A 96 ILE H 1.0 1.8 4.60 1656 1242 A 97 VAL HA A 95 ILE HG1y 1.0 1.8 5.34 1657 1242 A 97 VAL HA A 95 ILE HG1x 1.0 1.8 5.34 1658 1243 A 95 ILE H A 95 ILE HB 1.0 1.8 3.67 1659 1244 A 95 ILE H A 95 ILE HG2% 1.0 1.8 3.71 1660 1245 A 97 VAL HB A 96 ILE HA 1.0 1.8 5.15 1661 1246 A 97 VAL H A 96 ILE HA 1.0 1.8 3.10 1662 1247 A 96 ILE HB A 96 ILE HD1% 1.0 1.8 4.16 1663 1248 A 96 ILE HB A 97 VAL H 1.0 1.8 4.78 1664 1249 A 97 VAL H A 96 ILE HG1x 1.0 1.8 4.55 1665 1249 A 97 VAL H A 96 ILE HG1y 1.0 1.8 4.55 1666 1250 A 96 ILE HG2% A 96 ILE HD1% 1.0 1.8 4.11 1667 1251 A 97 VAL H A 96 ILE HG2% 1.0 1.8 3.55 1668 1252 A 96 ILE HB A 96 ILE H 1.0 1.8 3.30 1669 1253 A 96 ILE H A 96 ILE HD1% 1.0 1.8 4.27 1670 1254 A 96 ILE H A 96 ILE HG1x 1.0 1.8 3.81 1671 1254 A 96 ILE H A 96 ILE HG1y 1.0 1.8 3.81 1672 1255 A 96 ILE H A 97 VAL H 1.0 1.8 4.58 1673 1256 A 97 VAL HGx% A 97 VAL HA 1.0 1.8 4.15 1674 1257 A 97 VAL HA A 97 VAL HGy% 1.0 1.8 3.36 1675 1258 A 97 VAL HA A 98 ARG HGx 1.0 1.8 5.50 1676 1259 A 98 ARG H A 97 VAL HA 1.0 1.8 2.74 1677 1260 A 98 ARG HA A 97 VAL HB 1.0 1.8 5.50 1678 1261 A 98 ARG H A 97 VAL HB 1.0 1.8 4.51 1679 1262 A 97 VAL HGx% A 98 ARG HA 1.0 1.8 5.05 1680 1263 A 97 VAL HGx% A 98 ARG HBx 1.0 1.8 5.50 1681 1264 A 97 VAL HGx% A 98 ARG H 1.0 1.8 3.92 1682 1265 A 98 ARG H A 97 VAL HGy% 1.0 1.8 4.13 1683 1266 A 97 VAL HB A 97 VAL H 1.0 1.8 3.48 1684 1267 A 97 VAL HGx% A 97 VAL H 1.0 1.8 3.71 1685 1268 A 97 VAL HGy% A 97 VAL H 1.0 1.8 4.02 1686 1269 A 98 ARG H A 97 VAL H 1.0 1.8 4.68 1687 1270 A 98 ARG HA A 98 ARG HDy 1.0 1.8 4.03 1688 1271 A 98 ARG HA A 98 ARG HDx 1.0 1.8 4.03 1689 1272 A 98 ARG HA A 98 ARG HGx 1.0 1.8 3.93 1690 1273 A 98 ARG HA A 99 MET H 1.0 1.8 2.75 1691 1274 A 99 MET H A 98 ARG HBy 1.0 1.8 3.93 1692 1275 A 100 HIS HD2 A 98 ARG HBy 1.0 1.8 5.39 1693 1276 A 98 ARG HBx A 98 ARG HGy 1.0 1.8 3.00 1694 1277 A 100 HIS HD2 A 98 ARG HBx 1.0 1.8 5.43 1695 1278 A 99 MET H A 98 ARG HDx 1.0 1.8 4.35 1696 1278 A 99 MET H A 98 ARG HDy 1.0 1.8 4.35 1697 1279 A 99 MET H A 98 ARG HGx 1.0 1.8 4.82 1698 1280 A 98 ARG H A 98 ARG HBy 1.0 1.8 3.67 1699 1281 A 98 ARG H A 98 ARG HBx 1.0 1.8 3.60 1700 1282 A 98 ARG H A 98 ARG HGx 1.0 1.8 4.22 1701 1283 A 98 ARG H A 99 MET H 1.0 1.8 4.66 1702 1284 A 99 MET HGx A 99 MET HA 1.0 1.8 3.77 1703 1285 A 99 MET HA A 100 HIS HD2 1.0 1.8 4.92 1704 1286 A 100 HIS H A 99 MET HA 1.0 1.8 2.69 1705 1287 A 100 HIS H A 99 MET HBx 1.0 1.8 3.78 1706 1288 A 100 HIS H A 99 MET HBy 1.0 1.8 4.22 1707 1289 A 99 MET HGx A 100 HIS H 1.0 1.8 4.32 1708 1290 A 99 MET HBx A 99 MET H 1.0 1.8 3.87 1709 1291 A 99 MET HBy A 99 MET H 1.0 1.8 3.28 1710 1292 A 99 MET H A 99 MET HGy 1.0 1.8 3.90 1711 1293 A 100 HIS H A 99 MET H 1.0 1.8 4.75 1712 1294 A 100 HIS H A 100 HIS HBy 1.0 1.8 3.85 1713 1295 A 100 HIS H A 100 HIS HBx 1.0 1.8 3.98 1714 1296 A 100 HIS H A 100 HIS HD2 1.0 1.8 4.09 stop_ save_ save_CNS/XPLOR_distance_constraints_4 _nef_distance_restraint_list.sf_category nef_distance_restraint_list _nef_distance_restraint_list.sf_framecode CNS/XPLOR_distance_constraints_4 _nef_distance_restraint_list.restraint_origin hbond _nef_distance_restraint_list.potential_type square-well-parabolic loop_ _nef_distance_restraint.index _nef_distance_restraint.restraint_id _nef_distance_restraint.chain_code_1 _nef_distance_restraint.sequence_code_1 _nef_distance_restraint.residue_name_1 _nef_distance_restraint.atom_name_1 _nef_distance_restraint.chain_code_2 _nef_distance_restraint.sequence_code_2 _nef_distance_restraint.residue_name_2 _nef_distance_restraint.atom_name_2 _nef_distance_restraint.weight _nef_distance_restraint.lower_limit _nef_distance_restraint.upper_limit 1 1 A 10 THR H A 98 ARG O 1.0 1.8 2.3 2 2 A 98 ARG O A 10 THR N 1.0 1.8 3.3 3 3 A 11 LEU H A 21 TYR O 1.0 1.8 2.3 4 4 A 21 TYR O A 11 LEU N 1.0 1.8 3.3 5 5 A 12 GLN H A 96 ILE O 1.0 1.8 2.3 6 6 A 96 ILE O A 12 GLN N 1.0 1.8 3.3 7 7 A 13 LEU H A 19 ARG O 1.0 1.8 2.3 8 8 A 19 ARG O A 13 LEU N 1.0 1.8 3.3 9 9 A 21 TYR H A 11 LEU O 1.0 1.8 2.3 10 10 A 11 LEU O A 21 TYR N 1.0 1.8 3.3 11 11 A 23 LEU H A 9 VAL O 1.0 1.8 2.3 12 12 A 9 VAL O A 23 LEU N 1.0 1.8 3.3 13 13 A 28 ASN H A 52 ILE O 1.0 1.8 2.3 14 14 A 52 ILE O A 28 ASN N 1.0 1.8 3.3 15 15 A 30 ILE H A 50 LEU O 1.0 1.8 2.3 16 16 A 50 LEU O A 30 ILE N 1.0 1.8 3.3 17 17 A 31 GLY H A 38 PHE O 1.0 1.8 2.3 18 18 A 38 PHE O A 31 GLY N 1.0 1.8 3.3 19 19 A 38 PHE H A 29 ILE O 1.0 1.8 2.3 20 20 A 29 ILE O A 38 PHE N 1.0 1.8 3.3 21 21 A 50 LEU H A 30 ILE O 1.0 1.8 2.3 22 22 A 30 ILE O A 50 LEU N 1.0 1.8 3.3 23 23 A 51 GLU H A 62 ALA O 1.0 1.8 2.3 24 24 A 62 ALA O A 51 GLU N 1.0 1.8 3.3 25 25 A 52 ILE H A 28 ASN O 1.0 1.8 2.3 26 26 A 28 ASN O A 52 ILE N 1.0 1.8 3.3 27 27 A 53 ARG H A 60 LEU O 1.0 1.8 2.3 28 28 A 60 LEU O A 53 ARG N 1.0 1.8 3.3 29 29 A 54 TRP H A 26 GLY O 1.0 1.8 2.3 30 30 A 26 GLY O A 54 TRP N 1.0 1.8 3.3 31 31 A 60 LEU H A 53 ARG O 1.0 1.8 2.3 32 32 A 53 ARG O A 60 LEU N 1.0 1.8 3.3 33 33 A 61 LEU H A 80 TRP O 1.0 1.8 2.3 34 34 A 80 TRP O A 61 LEU N 1.0 1.8 3.3 35 35 A 62 ALA H A 51 GLU O 1.0 1.8 2.3 36 36 A 51 GLU O A 62 ALA N 1.0 1.8 3.3 37 37 A 63 ASP H A 78 GLN O 1.0 1.8 2.3 38 38 A 78 GLN O A 63 ASP N 1.0 1.8 3.3 39 39 A 64 LEU H A 49 HIS O 1.0 1.8 2.3 40 40 A 49 HIS O A 64 LEU N 1.0 1.8 3.3 41 41 A 72 VAL H A 75 ALA O 1.0 1.8 2.3 42 42 A 75 ALA O A 72 VAL N 1.0 1.8 3.3 43 43 A 75 ALA H A 72 VAL O 1.0 1.8 2.3 44 44 A 72 VAL O A 75 ALA N 1.0 1.8 3.3 45 45 A 80 TRP H A 61 LEU O 1.0 1.8 2.3 46 46 A 61 LEU O A 80 TRP N 1.0 1.8 3.3 47 47 A 85 GLY H A 97 VAL O 1.0 1.8 2.3 48 48 A 97 VAL O A 85 GLY N 1.0 1.8 3.3 49 49 A 88 ILE H A 95 ILE O 1.0 1.8 2.3 50 50 A 95 ILE O A 88 ILE N 1.0 1.8 3.3 51 51 A 89 ARG H A 71 THR O 1.0 1.8 2.3 52 52 A 71 THR O A 89 ARG N 1.0 1.8 3.3 53 53 A 90 LEU H A 93 SER O 1.0 1.8 2.3 54 54 A 93 SER O A 90 LEU N 1.0 1.8 3.3 55 55 A 95 ILE H A 88 ILE O 1.0 1.8 2.3 56 56 A 88 ILE O A 95 ILE N 1.0 1.8 3.3 57 57 A 96 ILE H A 12 GLN O 1.0 1.8 2.3 58 58 A 12 GLN O A 96 ILE N 1.0 1.8 3.3 59 59 A 97 VAL H A 86 ASP O 1.0 1.8 2.3 60 60 A 86 ASP O A 97 VAL N 1.0 1.8 3.3 61 61 A 98 ARG H A 10 THR O 1.0 1.8 2.3 62 62 A 10 THR O A 98 ARG N 1.0 1.8 3.3 63 63 A 99 MET H A 84 ASP OD1 1.0 1.8 2.3 64 64 A 84 ASP OD1 A 99 MET N 1.0 1.8 3.3 stop_ save_ save_CNS/XPLOR_dihedral_2 _nef_dihedral_restraint_list.sf_category nef_dihedral_restraint_list _nef_dihedral_restraint_list.sf_framecode CNS/XPLOR_dihedral_2 _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 6 GLY C A 7 THR N A 7 THR CA A 7 THR C 1.0 -146.0 -42.0 PHI 2 2 A 7 THR N A 7 THR CA A 7 THR C A 8 SER N 1.0 117.0 177.0 PSI 3 3 A 7 THR C A 8 SER N A 8 SER CA A 8 SER C 1.0 -161.3 -69.1 PHI 4 4 A 8 SER N A 8 SER CA A 8 SER C A 9 VAL N 1.0 115.5 169.7 PSI 5 5 A 8 SER C A 9 VAL N A 9 VAL CA A 9 VAL C 1.0 -148.8 -64.6 PHI 6 6 A 9 VAL N A 9 VAL CA A 9 VAL C A 10 THR N 1.0 89.3 164.1 PSI 7 7 A 9 VAL C A 10 THR N A 10 THR CA A 10 THR C 1.0 -139.1 -91.9 PHI 8 8 A 10 THR N A 10 THR CA A 10 THR C A 11 LEU N 1.0 112.4 154.4 PSI 9 9 A 10 THR C A 11 LEU N A 11 LEU CA A 11 LEU C 1.0 -142.5 -79.3 PHI 10 10 A 11 LEU N A 11 LEU CA A 11 LEU C A 12 GLN N 1.0 85.8 164.6 PSI 11 11 A 11 LEU C A 12 GLN N A 12 GLN CA A 12 GLN C 1.0 -134.9 -91.3 PHI 12 12 A 12 GLN N A 12 GLN CA A 12 GLN C A 13 LEU N 1.0 106.4 146.4 PSI 13 13 A 12 GLN C A 13 LEU N A 13 LEU CA A 13 LEU C 1.0 -148.1 -46.1 PHI 14 14 A 13 LEU N A 13 LEU CA A 13 LEU C A 14 ASP N 1.0 105.9 145.9 PSI 15 15 A 13 LEU C A 14 ASP N A 14 ASP CA A 14 ASP C 1.0 -130.7 -46.7 PHI 16 16 A 14 ASP N A 14 ASP CA A 14 ASP C A 15 ASP N 1.0 101.6 172.8 PSI 17 17 A 19 ARG C A 20 THR N A 20 THR CA A 20 THR C 1.0 -180.8 -116.0 PHI 18 18 A 20 THR N A 20 THR CA A 20 THR C A 21 TYR N 1.0 132.8 186.6 PSI 19 19 A 20 THR C A 21 TYR N A 21 TYR CA A 21 TYR C 1.0 -162.6 -117.8 PHI 20 20 A 21 TYR N A 21 TYR CA A 21 TYR C A 22 GLN N 1.0 108.0 148.0 PSI 21 21 A 21 TYR C A 22 GLN N A 22 GLN CA A 22 GLN C 1.0 -134.5 -68.3 PHI 22 22 A 22 GLN N A 22 GLN CA A 22 GLN C A 23 LEU N 1.0 80.6 207.4 PSI 23 23 A 22 GLN C A 23 LEU N A 23 LEU CA A 23 LEU C 1.0 -111.9 -47.7 PHI 24 24 A 23 LEU N A 23 LEU CA A 23 LEU C A 24 ARG N 1.0 122.3 162.3 PSI 25 25 A 23 LEU C A 24 ARG N A 24 ARG CA A 24 ARG C 1.0 -158.8 -57.0 PHI 26 26 A 24 ARG N A 24 ARG CA A 24 ARG C A 25 GLU N 1.0 114.3 181.1 PSI 27 27 A 24 ARG C A 25 GLU N A 25 GLU CA A 25 GLU C 1.0 -79.5 -39.5 PHI 28 28 A 25 GLU N A 25 GLU CA A 25 GLU C A 26 GLY N 1.0 113.6 153.6 PSI 29 29 A 26 GLY C A 27 SER N A 27 SER CA A 27 SER C 1.0 -106.2 -53.8 PHI 30 30 A 27 SER N A 27 SER CA A 27 SER C A 28 ASN N 1.0 108.6 162.6 PSI 31 31 A 27 SER C A 28 ASN N A 28 ASN CA A 28 ASN C 1.0 -166.2 -79.8 PHI 32 32 A 28 ASN N A 28 ASN CA A 28 ASN C A 29 ILE N 1.0 110.5 150.5 PSI 33 33 A 28 ASN C A 29 ILE N A 29 ILE CA A 29 ILE C 1.0 -126.2 -86.2 PHI 34 34 A 29 ILE N A 29 ILE CA A 29 ILE C A 30 ILE N 1.0 105.0 145.0 PSI 35 35 A 29 ILE C A 30 ILE N A 30 ILE CA A 30 ILE C 1.0 -138.5 -86.9 PHI 36 36 A 30 ILE N A 30 ILE CA A 30 ILE C A 31 GLY N 1.0 91.3 154.5 PSI 37 37 A 30 ILE C A 31 GLY N A 31 GLY CA A 31 GLY C 1.0 -227.7 -87.7 PHI 38 38 A 31 GLY N A 31 GLY CA A 31 GLY C A 32 ARG N 1.0 127.3 207.9 PSI 39 39 A 31 GLY C A 32 ARG N A 32 ARG CA A 32 ARG C 1.0 -150.4 -64.6 PHI 40 40 A 32 ARG N A 32 ARG CA A 32 ARG C A 33 GLY N 1.0 108.3 172.5 PSI 41 41 A 32 ARG C A 33 GLY N A 33 GLY CA A 33 GLY C 1.0 -182.2 -42.2 PHI 42 42 A 33 GLY N A 33 GLY CA A 33 GLY C A 34 GLN N 1.0 123.8 207.6 PSI 43 43 A 33 GLY C A 34 GLN N A 34 GLN CA A 34 GLN C 1.0 -93.8 -34.6 PHI 44 44 A 34 GLN N A 34 GLN CA A 34 GLN C A 35 ASP N 1.0 -51.6 -11.6 PSI 45 45 A 34 GLN C A 35 ASP N A 35 ASP CA A 35 ASP C 1.0 -128.2 -67.4 PHI 46 46 A 35 ASP N A 35 ASP CA A 35 ASP C A 36 ALA N 1.0 -36.8 25.6 PSI 47 47 A 36 ALA C A 37 GLN N A 37 GLN CA A 37 GLN C 1.0 -109.1 -54.7 PHI 48 48 A 37 GLN N A 37 GLN CA A 37 GLN C A 38 PHE N 1.0 -57.9 -4.9 PSI 49 49 A 37 GLN C A 38 PHE N A 38 PHE CA A 38 PHE C 1.0 -170.2 -42.6 PHI 50 50 A 38 PHE N A 38 PHE CA A 38 PHE C A 39 ARG N 1.0 109.2 174.8 PSI 51 51 A 38 PHE C A 39 ARG N A 39 ARG CA A 39 ARG C 1.0 -119.2 -79.2 PHI 52 52 A 39 ARG N A 39 ARG CA A 39 ARG C A 40 LEU N 1.0 97.9 144.3 PSI 53 53 A 39 ARG C A 40 LEU N A 40 LEU CA A 40 LEU C 1.0 -153.4 -37.2 PHI 54 54 A 40 LEU N A 40 LEU CA A 40 LEU C A 41 PRO N 1.0 90.3 162.9 PSI 55 55 A 41 PRO C A 42 ASP N A 42 ASP CA A 42 ASP C 1.0 -139.4 -46.0 PHI 56 56 A 42 ASP N A 42 ASP CA A 42 ASP C A 43 THR N 1.0 98.4 186.2 PSI 57 57 A 43 THR C A 44 GLY N A 44 GLY CA A 44 GLY C 1.0 63.9 112.3 PHI 58 58 A 44 GLY N A 44 GLY CA A 44 GLY C A 45 VAL N 1.0 -31.4 8.6 PSI 59 59 A 44 GLY C A 45 VAL N A 45 VAL CA A 45 VAL C 1.0 -122.5 -53.9 PHI 60 60 A 45 VAL N A 45 VAL CA A 45 VAL C A 46 SER N 1.0 109.2 149.2 PSI 61 61 A 46 SER C A 47 ARG N A 47 ARG CA A 47 ARG C 1.0 -88.2 -48.2 PHI 62 62 A 47 ARG N A 47 ARG CA A 47 ARG C A 48 ARG N 1.0 -57.4 -6.4 PSI 63 63 A 48 ARG C A 49 HIS N A 49 HIS CA A 49 HIS C 1.0 -103.6 -63.6 PHI 64 64 A 49 HIS N A 49 HIS CA A 49 HIS C A 50 LEU N 1.0 -60.0 -12.2 PSI 65 65 A 49 HIS C A 50 LEU N A 50 LEU CA A 50 LEU C 1.0 -176.6 -112.4 PHI 66 66 A 50 LEU N A 50 LEU CA A 50 LEU C A 51 GLU N 1.0 114.7 181.5 PSI 67 67 A 50 LEU C A 51 GLU N A 51 GLU CA A 51 GLU C 1.0 -164.3 -84.7 PHI 68 68 A 51 GLU N A 51 GLU CA A 51 GLU C A 52 ILE N 1.0 94.8 161.0 PSI 69 69 A 51 GLU C A 52 ILE N A 52 ILE CA A 52 ILE C 1.0 -143.7 -90.3 PHI 70 70 A 52 ILE N A 52 ILE CA A 52 ILE C A 53 ARG N 1.0 104.9 144.9 PSI 71 71 A 52 ILE C A 53 ARG N A 53 ARG CA A 53 ARG C 1.0 -140.9 -91.7 PHI 72 72 A 53 ARG N A 53 ARG CA A 53 ARG C A 54 TRP N 1.0 108.3 148.3 PSI 73 73 A 53 ARG C A 54 TRP N A 54 TRP CA A 54 TRP C 1.0 -150.8 -95.2 PHI 74 74 A 54 TRP N A 54 TRP CA A 54 TRP C A 55 ASP N 1.0 107.3 171.1 PSI 75 75 A 54 TRP C A 55 ASP N A 55 ASP CA A 55 ASP C 1.0 -178.7 -64.9 PHI 76 76 A 55 ASP N A 55 ASP CA A 55 ASP C A 56 GLY N 1.0 79.6 200.6 PSI 77 77 A 57 GLN C A 58 VAL N A 58 VAL CA A 58 VAL C 1.0 -163.7 -95.1 PHI 78 78 A 58 VAL N A 58 VAL CA A 58 VAL C A 59 ALA N 1.0 102.9 159.1 PSI 79 79 A 58 VAL C A 59 ALA N A 59 ALA CA A 59 ALA C 1.0 -130.7 -90.7 PHI 80 80 A 59 ALA N A 59 ALA CA A 59 ALA C A 60 LEU N 1.0 102.9 151.7 PSI 81 81 A 59 ALA C A 60 LEU N A 60 LEU CA A 60 LEU C 1.0 -140.9 -80.9 PHI 82 82 A 60 LEU N A 60 LEU CA A 60 LEU C A 61 LEU N 1.0 100.8 140.8 PSI 83 83 A 60 LEU C A 61 LEU N A 61 LEU CA A 61 LEU C 1.0 -136.9 -85.5 PHI 84 84 A 61 LEU N A 61 LEU CA A 61 LEU C A 62 ALA N 1.0 108.4 148.4 PSI 85 85 A 61 LEU C A 62 ALA N A 62 ALA CA A 62 ALA C 1.0 -140.3 -96.9 PHI 86 86 A 62 ALA N A 62 ALA CA A 62 ALA C A 63 ASP N 1.0 110.9 151.3 PSI 87 87 A 62 ALA C A 63 ASP N A 63 ASP CA A 63 ASP C 1.0 -176.2 -36.2 PHI 88 88 A 63 ASP N A 63 ASP CA A 63 ASP C A 64 LEU N 1.0 60.9 197.7 PSI 89 89 A 63 ASP C A 64 LEU N A 64 LEU CA A 64 LEU C 1.0 -133.8 -63.0 PHI 90 90 A 64 LEU N A 64 LEU CA A 64 LEU C A 65 ASN N 1.0 79.3 179.3 PSI 91 91 A 65 ASN C A 66 SER N A 66 SER CA A 66 SER C 1.0 -108.0 -36.0 PHI 92 92 A 66 SER N A 66 SER CA A 66 SER C A 67 THR N 1.0 -53.0 -13.0 PSI 93 93 A 66 SER C A 67 THR N A 67 THR CA A 67 THR C 1.0 -89.0 -45.0 PHI 94 94 A 67 THR N A 67 THR CA A 67 THR C A 68 ASN N 1.0 -64.0 -12.0 PSI 95 95 A 67 THR C A 68 ASN N A 68 ASN CA A 68 ASN C 1.0 -121.1 -56.3 PHI 96 96 A 68 ASN N A 68 ASN CA A 68 ASN C A 69 GLY N 1.0 -39.7 26.9 PSI 97 97 A 68 ASN C A 69 GLY N A 69 GLY CA A 69 GLY C 1.0 -184.0 -44.0 PHI 98 98 A 69 GLY N A 69 GLY CA A 69 GLY C A 70 THR N 1.0 96.8 236.8 PSI 99 99 A 69 GLY C A 70 THR N A 70 THR CA A 70 THR C 1.0 -154.4 -51.8 PHI 100 100 A 70 THR N A 70 THR CA A 70 THR C A 71 THR N 1.0 115.7 170.9 PSI 101 101 A 70 THR C A 71 THR N A 71 THR CA A 71 THR C 1.0 -168.7 -102.9 PHI 102 102 A 71 THR N A 71 THR CA A 71 THR C A 72 VAL N 1.0 141.4 181.4 PSI 103 103 A 71 THR C A 72 VAL N A 72 VAL CA A 72 VAL C 1.0 -166.2 -70.0 PHI 104 104 A 72 VAL N A 72 VAL CA A 72 VAL C A 73 ASN N 1.0 94.0 148.8 PSI 105 105 A 72 VAL C A 73 ASN N A 73 ASN CA A 73 ASN C 1.0 32.5 72.5 PHI 106 106 A 73 ASN N A 73 ASN CA A 73 ASN C A 74 ASN N 1.0 24.7 64.7 PSI 107 107 A 73 ASN C A 74 ASN N A 74 ASN CA A 74 ASN C 1.0 51.0 91.0 PHI 108 108 A 74 ASN N A 74 ASN CA A 74 ASN C A 75 ALA N 1.0 -18.0 38.0 PSI 109 109 A 74 ASN C A 75 ALA N A 75 ALA CA A 75 ALA C 1.0 -145.3 -65.5 PHI 110 110 A 75 ALA N A 75 ALA CA A 75 ALA C A 76 PRO N 1.0 111.8 151.8 PSI 111 111 A 75 ALA C A 76 PRO N A 76 PRO CA A 76 PRO C 1.0 -85.8 -45.8 PHI 112 112 A 76 PRO N A 76 PRO CA A 76 PRO C A 77 VAL N 1.0 125.8 168.2 PSI 113 113 A 76 PRO C A 77 VAL N A 77 VAL CA A 77 VAL C 1.0 -161.8 -93.2 PHI 114 114 A 77 VAL N A 77 VAL CA A 77 VAL C A 78 GLN N 1.0 141.8 182.6 PSI 115 115 A 77 VAL C A 78 GLN N A 78 GLN CA A 78 GLN C 1.0 -134.3 -53.3 PHI 116 116 A 78 GLN N A 78 GLN CA A 78 GLN C A 79 GLU N 1.0 -61.3 19.9 PSI 117 117 A 78 GLN C A 79 GLU N A 79 GLU CA A 79 GLU C 1.0 -180.3 -93.3 PHI 118 118 A 79 GLU N A 79 GLU CA A 79 GLU C A 80 TRP N 1.0 122.6 165.6 PSI 119 119 A 79 GLU C A 80 TRP N A 80 TRP CA A 80 TRP C 1.0 -170.0 -117.8 PHI 120 120 A 80 TRP N A 80 TRP CA A 80 TRP C A 81 GLN N 1.0 111.7 151.7 PSI 121 121 A 80 TRP C A 81 GLN N A 81 GLN CA A 81 GLN C 1.0 -155.1 -78.1 PHI 122 122 A 81 GLN N A 81 GLN CA A 81 GLN C A 82 LEU N 1.0 103.7 143.7 PSI 123 123 A 81 GLN C A 82 LEU N A 82 LEU CA A 82 LEU C 1.0 -165.3 -57.3 PHI 124 124 A 82 LEU N A 82 LEU CA A 82 LEU C A 83 ALA N 1.0 107.2 150.6 PSI 125 125 A 82 LEU C A 83 ALA N A 83 ALA CA A 83 ALA C 1.0 -161.0 -106.4 PHI 126 126 A 83 ALA N A 83 ALA CA A 83 ALA C A 84 ASP N 1.0 135.8 178.6 PSI 127 127 A 83 ALA C A 84 ASP N A 84 ASP CA A 84 ASP C 1.0 -125.6 -4.0 PHI 128 128 A 84 ASP N A 84 ASP CA A 84 ASP C A 85 GLY N 1.0 112.5 152.5 PSI 129 129 A 84 ASP C A 85 GLY N A 85 GLY CA A 85 GLY C 1.0 68.0 120.0 PHI 130 130 A 85 GLY N A 85 GLY CA A 85 GLY C A 86 ASP N 1.0 -41.0 19.0 PSI 131 131 A 86 ASP C A 87 VAL N A 87 VAL CA A 87 VAL C 1.0 -158.0 -74.0 PHI 132 132 A 87 VAL N A 87 VAL CA A 87 VAL C A 88 ILE N 1.0 114.0 154.0 PSI 133 133 A 87 VAL C A 88 ILE N A 88 ILE CA A 88 ILE C 1.0 -137.0 -97.0 PHI 134 134 A 88 ILE N A 88 ILE CA A 88 ILE C A 89 ARG N 1.0 107.0 147.0 PSI 135 135 A 88 ILE C A 89 ARG N A 89 ARG CA A 89 ARG C 1.0 -140.0 -100.0 PHI 136 136 A 89 ARG N A 89 ARG CA A 89 ARG C A 90 LEU N 1.0 107.0 155.0 PSI 137 137 A 89 ARG C A 90 LEU N A 90 LEU CA A 90 LEU C 1.0 -165.4 -61.2 PHI 138 138 A 90 LEU N A 90 LEU CA A 90 LEU C A 91 GLY N 1.0 75.4 161.8 PSI 139 139 A 90 LEU C A 91 GLY N A 91 GLY CA A 91 GLY C 1.0 -137.6 2.4 PHI 140 140 A 91 GLY N A 91 GLY CA A 91 GLY C A 92 HIS N 1.0 88.8 228.8 PSI 141 141 A 93 SER C A 94 GLU N A 94 GLU CA A 94 GLU C 1.0 -150.8 -74.4 PHI 142 142 A 94 GLU N A 94 GLU CA A 94 GLU C A 95 ILE N 1.0 110.0 171.8 PSI 143 143 A 94 GLU C A 95 ILE N A 95 ILE CA A 95 ILE C 1.0 -148.3 -104.1 PHI 144 144 A 95 ILE N A 95 ILE CA A 95 ILE C A 96 ILE N 1.0 108.8 148.8 PSI 145 145 A 95 ILE C A 96 ILE N A 96 ILE CA A 96 ILE C 1.0 -135.7 -85.7 PHI 146 146 A 96 ILE N A 96 ILE CA A 96 ILE C A 97 VAL N 1.0 112.3 152.3 PSI 147 147 A 96 ILE C A 97 VAL N A 97 VAL CA A 97 VAL C 1.0 -140.6 -75.6 PHI 148 148 A 97 VAL N A 97 VAL CA A 97 VAL C A 98 ARG N 1.0 105.8 145.8 PSI 149 149 A 97 VAL C A 98 ARG N A 98 ARG CA A 98 ARG C 1.0 -140.3 -95.1 PHI 150 150 A 98 ARG N A 98 ARG CA A 98 ARG C A 99 MET N 1.0 110.9 150.9 PSI 151 151 A 98 ARG C A 99 MET N A 99 MET CA A 99 MET C 1.0 -135.9 -59.1 PHI 152 152 A 99 MET N A 99 MET CA A 99 MET C A 100 HIS N 1.0 94.4 152.6 PSI stop_ save_