data_nef_c16824_2k42 save_entry_information _nef_nmr_meta_data.sf_category nef_nmr_meta_data _nef_nmr_meta_data.sf_framecode entry_information _nef_nmr_meta_data.format_name nmr_exchange_format _nef_nmr_meta_data.format_version 1.1 save_ save_assembly _nef_molecular_system.sf_category nef_molecular_system _nef_molecular_system.sf_framecode assembly loop_ _nef_sequence.index _nef_sequence.chain_code _nef_sequence.sequence_code _nef_sequence.residue_name _nef_sequence.linking _nef_sequence.residue_variant _nef_sequence.cis_peptide 1 A 1 GLY start . false 2 A 2 HIS middle . . 3 A 3 MET middle . . 4 A 4 SER middle . . 5 A 5 GLY middle . false 6 A 6 PHE middle . . 7 A 7 LYS middle . . 8 A 8 HIS middle . . 9 A 9 VAL middle . . 10 A 10 SER middle . . 11 A 11 HIS middle . . 12 A 12 VAL middle . . 13 A 13 GLY middle . false 14 A 14 TRP middle . . 15 A 15 ASP middle . . 16 A 16 PRO middle . false 17 A 17 GLN middle . . 18 A 18 ASN middle . . 19 A 19 GLY middle . false 20 A 20 PHE middle . . 21 A 21 ASP middle . . 22 A 22 VAL middle . . 23 A 23 ASN middle . . 24 A 24 ASN middle . . 25 A 25 LEU middle . . 26 A 26 ASP middle . . 27 A 27 PRO middle . false 28 A 28 ASP middle . . 29 A 29 LEU middle . . 30 A 30 ARG middle . . 31 A 31 SER middle . . 32 A 32 LEU middle . . 33 A 33 PHE middle . . 34 A 34 SER middle . . 35 A 35 ARG middle . . 36 A 36 ALA middle . . 37 A 37 GLY middle . false 38 A 38 ILE middle . . 39 A 39 SER middle . . 40 A 40 GLU middle . . 41 A 41 ALA middle . . 42 A 42 GLN middle . . 43 A 43 LEU middle . . 44 A 44 THR middle . . 45 A 45 ASP middle . . 46 A 46 ALA middle . . 47 A 47 GLU middle . . 48 A 48 THR middle . . 49 A 49 SER middle . . 50 A 50 LYS middle . . 51 A 51 LEU middle . . 52 A 52 ILE middle . . 53 A 53 TYR middle . . 54 A 54 ASP middle . . 55 A 55 PHE middle . . 56 A 56 ILE middle . . 57 A 57 GLU middle . . 58 A 58 ASP middle . . 59 A 59 GLN middle . . 60 A 60 GLY middle . false 61 A 61 GLY middle . false 62 A 62 LEU middle . . 63 A 63 GLU middle . . 64 A 64 ALA middle . . 65 A 65 VAL middle . . 66 A 66 ARG middle . . 67 A 67 GLN middle . . 68 A 68 GLU middle . . 69 A 69 MET middle . . 70 A 70 ARG middle . . 71 A 71 ARG middle . . 72 A 72 GLN end . . 73 B 73 GLY start . false 74 B 74 HIS middle . . 75 B 75 MET middle . . 76 B 76 LEU middle . . 77 B 77 PRO middle . false 78 B 78 ASP middle . . 79 B 79 VAL middle . . 80 B 80 ALA middle . . 81 B 81 GLN middle . . 82 B 82 ARG middle . . 83 B 83 LEU middle . . 84 B 84 MET middle . . 85 B 85 GLN middle . . 86 B 86 HIS middle . . 87 B 87 LEU middle . . 88 B 88 ALA middle . . 89 B 89 GLU middle . . 90 B 90 HIS middle . . 91 B 91 GLY middle . false 92 B 92 ILE middle . . 93 B 93 GLN middle . . 94 B 94 PRO middle . false 95 B 95 ALA middle . . 96 B 96 ARG middle . . 97 B 97 ASN middle . . 98 B 98 MET middle . . 99 B 99 ALA middle . . 100 B 100 GLU middle . . 101 B 101 HIS middle . . 102 B 102 ILE middle . . 103 B 103 PRO middle . false 104 B 104 PRO middle . false 105 B 105 ALA middle . . 106 B 106 PRO middle . false 107 B 107 ASN middle . . 108 B 108 TRP 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 3 MET HA H 1 4.517 . A 3 MET HBx H 1 1.988 . A 3 MET HBy H 1 2.089 . A 3 MET HE% H 1 2.093 . A 3 MET HGx H 1 2.448 . A 3 MET HGy H 1 2.544 . A 3 MET C C 13 176.121 . A 3 MET CA C 13 55.540 . A 3 MET CB C 13 32.800 . A 3 MET CE C 13 16.889 . A 3 MET CG C 13 32.080 . A 4 SER H H 1 8.412 . A 4 SER HA H 1 4.430 . A 4 SER HBy H 1 3.900 . A 4 SER HBx H 1 3.766 . A 4 SER C C 13 174.917 . A 4 SER CA C 13 58.761 . A 4 SER CB C 13 63.742 . A 4 SER N N 15 117.326 . A 5 GLY H H 1 8.450 . A 5 GLY HAx H 1 3.881 . A 5 GLY HAy H 1 3.967 . A 5 GLY C C 13 173.790 . A 5 GLY CA C 13 45.250 . A 5 GLY N N 15 110.830 . A 6 PHE H H 1 8.060 . A 6 PHE HA H 1 4.601 . A 6 PHE HBy H 1 3.096 . A 6 PHE HBx H 1 3.000 . A 6 PHE HDx H 1 7.202 . A 6 PHE HDy H 1 7.202 . A 6 PHE HEx H 1 7.312 . A 6 PHE HEy H 1 7.312 . A 6 PHE C C 13 175.541 . A 6 PHE CA C 13 57.760 . A 6 PHE CB C 13 39.730 . A 6 PHE N N 15 119.950 . A 7 LYS H H 1 8.210 . A 7 LYS HA H 1 4.269 . A 7 LYS HBy H 1 1.720 . A 7 LYS HBx H 1 1.675 . A 7 LYS HDy H 1 1.663 . A 7 LYS HDx H 1 1.650 . A 7 LYS HEx H 1 2.963 . A 7 LYS HEy H 1 3.009 . A 7 LYS HGy H 1 1.340 . A 7 LYS HGx H 1 1.312 . A 7 LYS C C 13 175.712 . A 7 LYS CA C 13 56.290 . A 7 LYS CB C 13 33.230 . A 7 LYS CD C 13 29.011 . A 7 LYS CE C 13 42.163 . A 7 LYS CG C 13 24.702 . A 7 LYS N N 15 123.160 . A 8 HIS H H 1 8.331 . A 8 HIS HA H 1 4.635 . A 8 HIS HBy H 1 3.144 . A 8 HIS HBx H 1 3.066 . A 8 HIS HD2 H 1 7.075 . A 8 HIS HE1 H 1 7.949 . A 8 HIS C C 13 175.116 . A 8 HIS CA C 13 56.204 . A 8 HIS CB C 13 30.762 . A 8 HIS CD2 C 13 119.574 . A 8 HIS CE1 C 13 137.959 . A 8 HIS N N 15 121.154 . A 9 VAL H H 1 8.150 . A 9 VAL HA H 1 4.179 . A 9 VAL HB H 1 2.090 . A 9 VAL HGx% H 1 0.936 . A 9 VAL HGy% H 1 0.924 . A 9 VAL C C 13 175.813 . A 9 VAL CA C 13 62.260 . A 9 VAL CB C 13 33.040 . A 9 VAL CG1 C 13 20.483 . A 9 VAL CG2 C 13 21.050 . A 9 VAL N N 15 122.060 . A 10 SER H H 1 8.540 . A 10 SER HA H 1 4.559 . A 10 SER HBy H 1 3.940 . A 10 SER HBx H 1 3.920 . A 10 SER CA C 13 58.250 . A 10 SER CB C 13 63.930 . A 10 SER N N 15 119.490 . A 11 HIS HA H 1 4.860 . A 11 HIS HBy H 1 3.305 . A 11 HIS HBx H 1 3.211 . A 11 HIS HD2 H 1 7.138 . A 11 HIS HE1 H 1 8.043 . A 11 HIS C C 13 175.131 . A 11 HIS CA C 13 56.211 . A 11 HIS CB C 13 30.940 . A 11 HIS CE1 C 13 137.959 . A 12 VAL H H 1 8.410 . A 12 VAL HA H 1 4.233 . A 12 VAL HB H 1 2.412 . A 12 VAL HGx% H 1 1.178 . A 12 VAL HGy% H 1 1.176 . A 12 VAL C C 13 175.974 . A 12 VAL CA C 13 62.640 . A 12 VAL CB C 13 32.850 . A 12 VAL CGy C 13 22.168 . A 12 VAL CGx C 13 21.520 . A 12 VAL N N 15 120.200 . A 13 GLY H H 1 8.470 . A 13 GLY HAy H 1 4.187 . A 13 GLY HAx H 1 4.027 . A 13 GLY C C 13 173.007 . A 13 GLY CA C 13 46.470 . A 13 GLY N N 15 110.910 . A 14 TRP H H 1 7.760 . A 14 TRP HA H 1 4.309 . A 14 TRP HBy H 1 2.607 . A 14 TRP HBx H 1 2.353 . A 14 TRP HD1 H 1 5.715 . A 14 TRP HE1 H 1 9.400 . A 14 TRP HE3 H 1 6.510 . A 14 TRP HH2 H 1 6.910 . A 14 TRP HZ2 H 1 7.180 . A 14 TRP HZ3 H 1 6.540 . A 14 TRP C C 13 173.437 . A 14 TRP CA C 13 57.320 . A 14 TRP CB C 13 31.380 . A 14 TRP CD1 C 13 124.818 . A 14 TRP CH2 C 13 123.200 . A 14 TRP CZ2 C 13 113.000 . A 14 TRP N N 15 122.550 . A 14 TRP NE1 N 15 127.338 . A 15 ASP H H 1 7.050 . A 15 ASP HA H 1 4.206 . A 15 ASP HBx H 1 2.316 . A 15 ASP HBy H 1 2.451 . A 15 ASP CA C 13 51.030 . A 15 ASP CB C 13 44.430 . A 15 ASP N N 15 127.420 . A 16 PRO HA H 1 3.593 . A 16 PRO HBy H 1 2.122 . A 16 PRO HBx H 1 1.730 . A 16 PRO HDy H 1 3.340 . A 16 PRO HDx H 1 2.950 . A 16 PRO HGx H 1 1.780 . A 16 PRO HGy H 1 1.786 . A 16 PRO C C 13 177.255 . A 16 PRO CA C 13 63.667 . A 16 PRO CB C 13 31.844 . A 16 PRO CD C 13 50.107 . A 16 PRO CG C 13 26.850 . A 17 GLN H H 1 7.970 . A 17 GLN HA H 1 4.235 . A 17 GLN HBx H 1 1.907 . A 17 GLN HBy H 1 1.918 . A 17 GLN HE2y H 1 7.500 . A 17 GLN HE2x H 1 6.780 . A 17 GLN HGx H 1 2.215 . A 17 GLN HGy H 1 2.245 . A 17 GLN C C 13 176.736 . A 17 GLN CA C 13 57.130 . A 17 GLN CB C 13 29.690 . A 17 GLN CG C 13 34.471 . A 17 GLN N N 15 115.180 . A 17 GLN NE2 N 15 112.200 . A 18 ASN H H 1 8.470 . A 18 ASN HA H 1 4.712 . A 18 ASN HBy H 1 2.727 . A 18 ASN HBx H 1 2.500 . A 18 ASN HD2y H 1 7.850 . A 18 ASN HD2x H 1 6.820 . A 18 ASN C C 13 175.138 . A 18 ASN CA C 13 53.280 . A 18 ASN CB C 13 39.980 . A 18 ASN N N 15 116.380 . A 18 ASN ND2 N 15 115.200 . A 19 GLY H H 1 7.840 . A 19 GLY HAy H 1 4.110 . A 19 GLY HAx H 1 3.581 . A 19 GLY C C 13 175.631 . A 19 GLY CA C 13 45.350 . A 19 GLY N N 15 107.790 . A 20 PHE H H 1 8.710 . A 20 PHE HA H 1 4.853 . A 20 PHE HBx H 1 2.884 . A 20 PHE HBy H 1 2.936 . A 20 PHE HDx H 1 7.700 . A 20 PHE HDy H 1 7.700 . A 20 PHE HEx H 1 7.450 . A 20 PHE HEy H 1 7.450 . A 20 PHE HZ H 1 7.060 . A 20 PHE C C 13 175.456 . A 20 PHE CA C 13 59.040 . A 20 PHE CB C 13 40.330 . A 20 PHE CDx C 13 132.539 . A 20 PHE CDy C 13 132.539 . A 20 PHE CEx C 13 131.125 . A 20 PHE CEy C 13 131.125 . A 20 PHE CZ C 13 128.833 . A 20 PHE N N 15 120.580 . A 21 ASP H H 1 8.330 . A 21 ASP HA H 1 4.701 . A 21 ASP HBy H 1 2.950 . A 21 ASP HBx H 1 2.660 . A 21 ASP C C 13 177.528 . A 21 ASP CA C 13 52.520 . A 21 ASP CB C 13 39.760 . A 21 ASP N N 15 119.530 . A 22 VAL H H 1 8.110 . A 22 VAL HA H 1 3.761 . A 22 VAL HB H 1 2.239 . A 22 VAL HGx% H 1 1.036 . A 22 VAL HGy% H 1 1.012 . A 22 VAL C C 13 176.869 . A 22 VAL CA C 13 65.150 . A 22 VAL CB C 13 31.470 . A 22 VAL CGy C 13 22.318 . A 22 VAL CGx C 13 20.389 . A 22 VAL N N 15 122.440 . A 23 ASN H H 1 8.360 . A 23 ASN HA H 1 4.647 . A 23 ASN HBx H 1 2.822 . A 23 ASN HBy H 1 2.824 . A 23 ASN HD2y H 1 7.790 . A 23 ASN HD2x H 1 7.010 . A 23 ASN C C 13 175.608 . A 23 ASN CA C 13 54.940 . A 23 ASN CB C 13 38.670 . A 23 ASN N N 15 117.200 . A 23 ASN ND2 N 15 114.300 . A 24 ASN H H 1 7.590 . A 24 ASN HA H 1 5.011 . A 24 ASN HBy H 1 2.930 . A 24 ASN HBx H 1 2.392 . A 24 ASN HD2y H 1 8.280 . A 24 ASN HD2x H 1 6.870 . A 24 ASN C C 13 173.895 . A 24 ASN CA C 13 52.390 . A 24 ASN CB C 13 39.850 . A 24 ASN N N 15 117.390 . A 24 ASN ND2 N 15 115.800 . A 25 LEU H H 1 7.310 . A 25 LEU HA H 1 4.405 . A 25 LEU HBx H 1 1.487 . A 25 LEU HBy H 1 1.721 . A 25 LEU HD11 H 1 0.958 . A 25 LEU HD12 H 1 0.958 . A 25 LEU HD13 H 1 0.958 . A 25 LEU HD21 H 1 1.019 . A 25 LEU HD22 H 1 1.019 . A 25 LEU HD23 H 1 1.019 . A 25 LEU HG H 1 2.011 . A 25 LEU C C 13 176.635 . A 25 LEU CA C 13 54.880 . A 25 LEU CB C 13 43.980 . A 25 LEU CD1 C 13 25.312 . A 25 LEU CD2 C 13 25.564 . A 25 LEU CG C 13 26.240 . A 25 LEU N N 15 121.570 . A 26 ASP H H 1 8.640 . A 26 ASP HA H 1 4.726 . A 26 ASP HBy H 1 2.844 . A 26 ASP HBx H 1 2.430 . A 26 ASP CA C 13 52.900 . A 26 ASP CB C 13 43.180 . A 26 ASP N N 15 126.370 . A 27 PRO HA H 1 4.177 . A 27 PRO HBy H 1 2.382 . A 27 PRO HBx H 1 1.985 . A 27 PRO HDy H 1 3.899 . A 27 PRO HDx H 1 3.774 . A 27 PRO HGx H 1 2.074 . A 27 PRO C C 13 179.309 . A 27 PRO CA C 13 65.530 . A 27 PRO CB C 13 32.373 . A 27 PRO CD C 13 51.050 . A 27 PRO CG C 13 27.696 . A 28 ASP H H 1 8.550 . A 28 ASP HA H 1 4.566 . A 28 ASP HBx H 1 2.442 . A 28 ASP HBy H 1 2.614 . A 28 ASP C C 13 178.681 . A 28 ASP CA C 13 57.650 . A 28 ASP CB C 13 39.930 . A 28 ASP N N 15 118.620 . A 29 LEU H H 1 7.660 . A 29 LEU HA H 1 3.596 . A 29 LEU HBy H 1 1.684 . A 29 LEU HBx H 1 0.988 . A 29 LEU HDx% H 1 0.621 . A 29 LEU HDy% H 1 0.943 . A 29 LEU HG H 1 1.407 . A 29 LEU C C 13 177.244 . A 29 LEU CA C 13 56.800 . A 29 LEU CB C 13 40.280 . A 29 LEU CDx C 13 22.903 . A 29 LEU CDy C 13 25.577 . A 29 LEU CG C 13 26.372 . A 29 LEU N N 15 119.980 . A 30 ARG H H 1 8.280 . A 30 ARG HA H 1 3.733 . A 30 ARG HBy H 1 1.919 . A 30 ARG HBx H 1 1.744 . A 30 ARG HDx H 1 3.192 . A 30 ARG HDy H 1 3.304 . A 30 ARG HGx H 1 1.580 . A 30 ARG HGy H 1 1.690 . A 30 ARG C C 13 179.313 . A 30 ARG CA C 13 60.090 . A 30 ARG CB C 13 29.750 . A 30 ARG CD C 13 43.357 . A 30 ARG CG C 13 27.576 . A 30 ARG N N 15 117.550 . A 31 SER H H 1 7.730 . A 31 SER HA H 1 4.230 . A 31 SER HBy H 1 4.000 . A 31 SER HBx H 1 3.956 . A 31 SER C C 13 176.073 . A 31 SER CA C 13 61.300 . A 31 SER CB C 13 62.590 . A 31 SER N N 15 113.840 . A 32 LEU H H 1 7.740 . A 32 LEU HA H 1 3.916 . A 32 LEU HBy H 1 1.722 . A 32 LEU HBx H 1 1.567 . A 32 LEU HDx% H 1 0.729 . A 32 LEU HDy% H 1 0.900 . A 32 LEU HG H 1 1.363 . A 32 LEU C C 13 177.798 . A 32 LEU CA C 13 58.630 . A 32 LEU CB C 13 40.790 . A 32 LEU CDy C 13 25.680 . A 32 LEU CDx C 13 23.435 . A 32 LEU CG C 13 27.584 . A 32 LEU N N 15 123.630 . A 33 PHE H H 1 8.380 . A 33 PHE HA H 1 4.453 . A 33 PHE HBy H 1 3.170 . A 33 PHE HBx H 1 3.109 . A 33 PHE HDx H 1 6.776 . A 33 PHE HDy H 1 6.776 . A 33 PHE HEx H 1 6.623 . A 33 PHE HEy H 1 6.623 . A 33 PHE HZ H 1 6.430 . A 33 PHE C C 13 178.011 . A 33 PHE CA C 13 57.410 . A 33 PHE CB C 13 36.150 . A 33 PHE CDx C 13 130.000 . A 33 PHE CDy C 13 130.200 . A 33 PHE CEy C 13 130.200 . A 33 PHE CEx C 13 130.000 . A 33 PHE CZ C 13 128.625 . A 33 PHE N N 15 116.010 . A 34 SER H H 1 8.220 . A 34 SER HA H 1 4.397 . A 34 SER HBy H 1 4.087 . A 34 SER HBx H 1 4.053 . A 34 SER C C 13 178.630 . A 34 SER CA C 13 61.430 . A 34 SER CB C 13 62.570 . A 34 SER N N 15 114.260 . A 35 ARG H H 1 8.420 . A 35 ARG HA H 1 4.118 . A 35 ARG HBy H 1 1.923 . A 35 ARG HBx H 1 1.855 . A 35 ARG HDx H 1 3.154 . A 35 ARG HDy H 1 3.156 . A 35 ARG HGx H 1 1.711 . A 35 ARG HGy H 1 1.883 . A 35 ARG C C 13 177.647 . A 35 ARG CA C 13 59.030 . A 35 ARG CB C 13 30.130 . A 35 ARG CD C 13 43.663 . A 35 ARG CG C 13 27.838 . A 35 ARG N N 15 122.540 . A 36 ALA H H 1 8.020 . A 36 ALA HA H 1 4.471 . A 36 ALA HB% H 1 1.513 . A 36 ALA C C 13 175.590 . A 36 ALA CA C 13 52.080 . A 36 ALA CB C 13 19.670 . A 36 ALA N N 15 118.890 . A 37 GLY H H 1 7.600 . A 37 GLY HAx H 1 3.727 . A 37 GLY HAy H 1 4.076 . A 37 GLY C C 13 174.122 . A 37 GLY CA C 13 46.410 . A 37 GLY N N 15 104.900 . A 38 ILE H H 1 7.960 . A 38 ILE HA H 1 4.287 . A 38 ILE HB H 1 1.588 . A 38 ILE HD1% H 1 0.611 . A 38 ILE HG12 H 1 0.924 . A 38 ILE HG13 H 1 1.424 . A 38 ILE HG21 H 1 0.663 . A 38 ILE HG22 H 1 0.663 . A 38 ILE HG23 H 1 0.663 . A 38 ILE C C 13 176.096 . A 38 ILE CA C 13 59.990 . A 38 ILE CB C 13 38.510 . A 38 ILE CD1 C 13 13.479 . A 38 ILE CG1 C 13 27.916 . A 38 ILE CG2 C 13 17.613 . A 38 ILE N N 15 121.110 . A 39 SER H H 1 8.820 . A 39 SER HA H 1 4.644 . A 39 SER HBx H 1 3.844 . A 39 SER HBy H 1 4.376 . A 39 SER C C 13 175.150 . A 39 SER CA C 13 56.710 . A 39 SER CB C 13 66.130 . A 39 SER N N 15 124.030 . A 40 GLU H H 1 9.000 . A 40 GLU HA H 1 3.869 . A 40 GLU HBx H 1 2.090 . A 40 GLU HBy H 1 2.100 . A 40 GLU HGx H 1 2.289 . A 40 GLU HGy H 1 2.424 . A 40 GLU C C 13 178.614 . A 40 GLU CA C 13 60.640 . A 40 GLU CB C 13 29.170 . A 40 GLU CG C 13 37.480 . A 40 GLU N N 15 120.850 . A 41 ALA H H 1 8.160 . A 41 ALA HA H 1 4.121 . A 41 ALA HB% H 1 1.408 . A 41 ALA C C 13 180.477 . A 41 ALA CA C 13 54.680 . A 41 ALA CB C 13 18.189 . A 41 ALA N N 15 119.930 . A 42 GLN H H 1 7.520 . A 42 GLN HA H 1 4.046 . A 42 GLN HBy H 1 2.551 . A 42 GLN HBx H 1 1.648 . A 42 GLN HE2y H 1 7.510 . A 42 GLN HE2x H 1 6.840 . A 42 GLN HGy H 1 2.550 . A 42 GLN HGx H 1 2.379 . A 42 GLN C C 13 177.259 . A 42 GLN CA C 13 59.100 . A 42 GLN CB C 13 29.920 . A 42 GLN CG C 13 35.903 . A 42 GLN N N 15 117.210 . A 42 GLN NE2 N 15 110.800 . A 43 LEU H H 1 7.500 . A 43 LEU HA H 1 4.007 . A 43 LEU HBy H 1 2.118 . A 43 LEU HBx H 1 1.440 . A 43 LEU HD11 H 1 0.672 . A 43 LEU HD12 H 1 0.672 . A 43 LEU HD13 H 1 0.672 . A 43 LEU HD21 H 1 -0.137 . A 43 LEU HD22 H 1 -0.137 . A 43 LEU HD23 H 1 -0.137 . A 43 LEU HG H 1 1.678 . A 43 LEU C C 13 177.590 . A 43 LEU CA C 13 56.610 . A 43 LEU CB C 13 42.270 . A 43 LEU CD1 C 13 25.800 . A 43 LEU CD2 C 13 23.066 . A 43 LEU CG C 13 25.978 . A 43 LEU N N 15 114.580 . A 44 THR H H 1 7.560 . A 44 THR HA H 1 4.752 . A 44 THR HB H 1 4.621 . A 44 THR HG2% H 1 1.443 . A 44 THR C C 13 173.311 . A 44 THR CA C 13 61.380 . A 44 THR CB C 13 69.250 . A 44 THR CG2 C 13 21.873 . A 44 THR N N 15 106.040 . A 45 ASP H H 1 7.190 . A 45 ASP HA H 1 4.762 . A 45 ASP HBy H 1 3.019 . A 45 ASP HBx H 1 2.942 . A 45 ASP C C 13 177.441 . A 45 ASP CA C 13 53.740 . A 45 ASP CB C 13 43.570 . A 45 ASP N N 15 123.530 . A 46 ALA H H 1 9.220 . A 46 ALA HA H 1 3.811 . A 46 ALA HB% H 1 1.531 . A 46 ALA C C 13 179.666 . A 46 ALA CA C 13 56.800 . A 46 ALA CB C 13 18.570 . A 46 ALA N N 15 105.700 . A 47 GLU H H 1 8.540 . A 47 GLU HA H 1 4.191 . A 47 GLU HBx H 1 2.169 . A 47 GLU HBy H 1 2.171 . A 47 GLU HGx H 1 2.290 . A 47 GLU HGy H 1 2.397 . A 47 GLU C C 13 179.522 . A 47 GLU CA C 13 59.610 . A 47 GLU CB C 13 29.740 . A 47 GLU CG C 13 36.611 . A 47 GLU N N 15 117.610 . A 48 THR H H 1 8.820 . A 48 THR HA H 1 3.815 . A 48 THR HB H 1 4.582 . A 48 THR HG2% H 1 1.171 . A 48 THR C C 13 176.684 . A 48 THR CA C 13 67.230 . A 48 THR CB C 13 67.780 . A 48 THR CG2 C 13 22.404 . A 48 THR N N 15 117.600 . A 49 SER H H 1 8.794 . A 49 SER HA H 1 4.102 . A 49 SER HBx H 1 4.462 . A 49 SER C C 13 176.076 . A 49 SER CA C 13 62.802 . A 49 SER CB C 13 62.999 . A 49 SER N N 15 116.094 . A 50 LYS H H 1 7.510 . A 50 LYS HA H 1 3.742 . A 50 LYS HBx H 1 2.079 . A 50 LYS HBy H 1 2.172 . A 50 LYS HDx H 1 1.542 . A 50 LYS HDy H 1 1.831 . A 50 LYS HEx H 1 3.046 . A 50 LYS HGx H 1 1.388 . A 50 LYS HGy H 1 1.509 . A 50 LYS C C 13 177.248 . A 50 LYS CA C 13 59.210 . A 50 LYS CB C 13 32.340 . A 50 LYS CD C 13 28.501 . A 50 LYS CE C 13 42.560 . A 50 LYS CG C 13 25.022 . A 50 LYS N N 15 124.570 . A 51 LEU H H 1 7.290 . A 51 LEU HA H 1 4.240 . A 51 LEU HBy H 1 2.110 . A 51 LEU HBx H 1 1.166 . A 51 LEU HDx% H 1 0.720 . A 51 LEU HD21 H 1 0.495 . A 51 LEU HDy% H 1 0.495 . A 51 LEU HG H 1 1.784 . A 51 LEU C C 13 180.726 . A 51 LEU CA C 13 57.760 . A 51 LEU CB C 13 42.770 . A 51 LEU CD1 C 13 26.636 . A 51 LEU CD2 C 13 22.987 . A 51 LEU CG C 13 26.946 . A 51 LEU N N 15 117.280 . A 52 ILE H H 1 7.710 . A 52 ILE HA H 1 3.553 . A 52 ILE HB H 1 2.105 . A 52 ILE HD1% H 1 0.542 . A 52 ILE HG12 H 1 0.727 . A 52 ILE HG13 H 1 2.044 . A 52 ILE HG21 H 1 0.862 . A 52 ILE HG22 H 1 0.862 . A 52 ILE HG23 H 1 0.862 . A 52 ILE C C 13 176.675 . A 52 ILE CA C 13 65.790 . A 52 ILE CB C 13 38.530 . A 52 ILE CD1 C 13 14.673 . A 52 ILE CG1 C 13 30.037 . A 52 ILE CG2 C 13 19.045 . A 52 ILE N N 15 119.480 . A 53 TYR H H 1 8.820 . A 53 TYR HA H 1 3.863 . A 53 TYR HBy H 1 2.270 . A 53 TYR HBx H 1 1.930 . A 53 TYR HDx H 1 6.517 . A 53 TYR HDy H 1 6.517 . A 53 TYR HEx H 1 6.687 . A 53 TYR HEy H 1 6.687 . A 53 TYR C C 13 177.347 . A 53 TYR CA C 13 62.750 . A 53 TYR CB C 13 37.620 . A 53 TYR CDx C 13 132.723 . A 53 TYR CDy C 13 132.723 . A 53 TYR CEx C 13 117.839 . A 53 TYR CEy C 13 117.839 . A 53 TYR N N 15 122.070 . A 54 ASP H H 1 8.840 . A 54 ASP HA H 1 4.112 . A 54 ASP HBx H 1 2.648 . A 54 ASP HBy H 1 2.807 . A 54 ASP C C 13 178.273 . A 54 ASP CA C 13 57.150 . A 54 ASP CB C 13 39.560 . A 54 ASP N N 15 119.080 . A 55 PHE H H 1 7.540 . A 55 PHE HA H 1 3.943 . A 55 PHE HBx H 1 2.497 . A 55 PHE HBy H 1 3.315 . A 55 PHE HDx H 1 6.711 . A 55 PHE HDy H 1 6.711 . A 55 PHE HEx H 1 6.975 . A 55 PHE HEy H 1 6.975 . A 55 PHE HZ H 1 7.137 . A 55 PHE C C 13 177.174 . A 55 PHE CA C 13 61.460 . A 55 PHE CB C 13 38.310 . A 55 PHE CDx C 13 132.171 . A 55 PHE CDy C 13 132.171 . A 55 PHE CEx C 13 130.525 . A 55 PHE CEy C 13 130.525 . A 55 PHE CZ C 13 129.398 . A 55 PHE N N 15 120.100 . A 56 ILE H H 1 8.120 . A 56 ILE HA H 1 3.152 . A 56 ILE HB H 1 2.134 . A 56 ILE HD1% H 1 1.041 . A 56 ILE HG12 H 1 1.190 . A 56 ILE HG13 H 1 2.082 . A 56 ILE HG21 H 1 0.731 . A 56 ILE HG22 H 1 0.731 . A 56 ILE HG23 H 1 0.731 . A 56 ILE C C 13 178.735 . A 56 ILE CA C 13 65.210 . A 56 ILE CB C 13 36.890 . A 56 ILE CD1 C 13 13.765 . A 56 ILE CG1 C 13 28.834 . A 56 ILE CG2 C 13 16.333 . A 56 ILE N N 15 119.970 . A 57 GLU H H 1 7.990 . A 57 GLU HA H 1 3.795 . A 57 GLU HBx H 1 1.849 . A 57 GLU HBy H 1 1.942 . A 57 GLU HGx H 1 1.845 . A 57 GLU HGy H 1 2.000 . A 57 GLU C C 13 180.423 . A 57 GLU CA C 13 59.480 . A 57 GLU CB C 13 29.200 . A 57 GLU CG C 13 36.052 . A 57 GLU N N 15 119.870 . A 58 ASP H H 1 8.470 . A 58 ASP HA H 1 4.331 . A 58 ASP HBy H 1 2.630 . A 58 ASP HBx H 1 2.441 . A 58 ASP C C 13 177.653 . A 58 ASP CA C 13 56.790 . A 58 ASP CB C 13 40.480 . A 58 ASP N N 15 122.050 . A 59 GLN H H 1 7.390 . A 59 GLN HA H 1 3.967 . A 59 GLN HBx H 1 1.602 . A 59 GLN HBy H 1 2.139 . A 59 GLN HE2x H 1 6.340 . A 59 GLN HE2y H 1 6.750 . A 59 GLN HGx H 1 1.264 . A 59 GLN HGy H 1 1.894 . A 59 GLN C C 13 175.240 . A 59 GLN CA C 13 54.480 . A 59 GLN CB C 13 27.870 . A 59 GLN CG C 13 33.061 . A 59 GLN N N 15 114.880 . A 59 GLN NE2 N 15 117.100 . A 60 GLY H H 1 7.580 . A 60 GLY HAy H 1 4.385 . A 60 GLY HAx H 1 3.639 . A 60 GLY C C 13 174.948 . A 60 GLY CA C 13 44.360 . A 60 GLY N N 15 103.530 . A 61 GLY H H 1 8.200 . A 61 GLY HAx H 1 3.550 . A 61 GLY HAy H 1 4.564 . A 61 GLY C C 13 173.250 . A 61 GLY CA C 13 43.790 . A 61 GLY N N 15 110.060 . A 62 LEU H H 1 8.760 . A 62 LEU HA H 1 3.735 . A 62 LEU HBy H 1 1.793 . A 62 LEU HBx H 1 1.495 . A 62 LEU HDx% H 1 0.939 . A 62 LEU HDy% H 1 0.910 . A 62 LEU HG H 1 1.507 . A 62 LEU C C 13 177.907 . A 62 LEU CA C 13 58.520 . A 62 LEU CB C 13 42.170 . A 62 LEU CDy C 13 25.797 . A 62 LEU CDx C 13 23.303 . A 62 LEU CG C 13 27.124 . A 62 LEU N N 15 119.580 . A 63 GLU H H 1 8.630 . A 63 GLU HA H 1 4.087 . A 63 GLU HBy H 1 2.025 . A 63 GLU HBx H 1 1.989 . A 63 GLU HGy H 1 2.408 . A 63 GLU HGx H 1 2.360 . A 63 GLU C C 13 178.592 . A 63 GLU CA C 13 59.010 . A 63 GLU CB C 13 28.250 . A 63 GLU CG C 13 35.912 . A 63 GLU N N 15 116.020 . A 64 ALA H H 1 7.330 . A 64 ALA HA H 1 4.141 . A 64 ALA HB% H 1 1.374 . A 64 ALA C C 13 180.857 . A 64 ALA CA C 13 54.810 . A 64 ALA CB C 13 18.320 . A 64 ALA N N 15 122.050 . A 65 VAL H H 1 7.800 . A 65 VAL HA H 1 3.639 . A 65 VAL HB H 1 2.133 . A 65 VAL HGx% H 1 0.802 . A 65 VAL HGy% H 1 0.910 . A 65 VAL C C 13 177.484 . A 65 VAL CA C 13 66.330 . A 65 VAL CB C 13 31.560 . A 65 VAL CGx C 13 21.750 . A 65 VAL CGy C 13 23.425 . A 65 VAL N N 15 118.790 . A 66 ARG H H 1 8.640 . A 66 ARG HA H 1 3.721 . A 66 ARG HBy H 1 1.884 . A 66 ARG HBx H 1 1.808 . A 66 ARG HDy H 1 3.298 . A 66 ARG HDx H 1 3.182 . A 66 ARG HGx H 1 1.500 . A 66 ARG HGy H 1 1.858 . A 66 ARG C C 13 178.566 . A 66 ARG CA C 13 60.240 . A 66 ARG CB C 13 30.200 . A 66 ARG CD C 13 43.285 . A 66 ARG CG C 13 27.143 . A 66 ARG N N 15 120.170 . A 67 GLN H H 1 7.870 . A 67 GLN HA H 1 3.987 . A 67 GLN HBx H 1 2.164 . A 67 GLN HBy H 1 2.176 . A 67 GLN HE2y H 1 7.610 . A 67 GLN HE2x H 1 6.830 . A 67 GLN HGy H 1 2.540 . A 67 GLN HGx H 1 2.485 . A 67 GLN C C 13 178.756 . A 67 GLN CA C 13 58.600 . A 67 GLN CB C 13 28.230 . A 67 GLN CG C 13 33.909 . A 67 GLN N N 15 115.990 . A 67 GLN NE2 N 15 112.050 . A 68 GLU H H 1 7.770 . A 68 GLU HA H 1 4.122 . A 68 GLU HBx H 1 2.140 . A 68 GLU HBy H 1 2.152 . A 68 GLU HGx H 1 2.337 . A 68 GLU HGy H 1 2.375 . A 68 GLU C C 13 178.991 . A 68 GLU CA C 13 59.040 . A 68 GLU CB C 13 29.600 . A 68 GLU CG C 13 36.460 . A 68 GLU N N 15 119.080 . A 69 MET H H 1 8.150 . A 69 MET HA H 1 4.331 . A 69 MET HBx H 1 2.157 . A 69 MET HBy H 1 2.159 . A 69 MET HE% H 1 1.990 . A 69 MET HGx H 1 2.520 . A 69 MET HGy H 1 2.714 . A 69 MET C C 13 177.589 . A 69 MET CA C 13 57.250 . A 69 MET CB C 13 32.460 . A 69 MET CE C 13 16.300 . A 69 MET CG C 13 32.460 . A 69 MET N N 15 117.150 . A 70 ARG H H 1 7.650 . A 70 ARG HA H 1 4.336 . A 70 ARG HBy H 1 1.999 . A 70 ARG HBx H 1 1.814 . A 70 ARG HDy H 1 3.186 . A 70 ARG HDx H 1 3.129 . A 70 ARG HGx H 1 1.705 . A 70 ARG C C 13 176.373 . A 70 ARG CA C 13 56.670 . A 70 ARG CB C 13 30.680 . A 70 ARG CD C 13 43.572 . A 70 ARG CG C 13 27.523 . A 70 ARG N N 15 117.730 . A 71 ARG H H 1 7.640 . A 71 ARG HA H 1 4.332 . A 71 ARG HBy H 1 1.966 . A 71 ARG HBx H 1 1.909 . A 71 ARG HDy H 1 3.285 . A 71 ARG HDx H 1 3.212 . A 71 ARG HGx H 1 1.771 . A 71 ARG HGy H 1 1.816 . A 71 ARG C C 13 175.481 . A 71 ARG CA C 13 56.800 . A 71 ARG CB C 13 30.630 . A 71 ARG CD C 13 43.643 . A 71 ARG CG C 13 27.166 . A 71 ARG N N 15 120.660 . A 72 GLN H H 1 7.880 . A 72 GLN HE2y H 1 7.530 . A 72 GLN HE2x H 1 6.920 . A 72 GLN HGy H 1 2.890 . A 72 GLN HGx H 1 2.800 . A 72 GLN CA C 13 57.190 . A 72 GLN CB C 13 30.580 . A 72 GLN CG C 13 34.400 . A 72 GLN N N 15 126.310 . A 72 GLN NE2 N 15 112.400 . B 74 HIS HA H 1 4.701 . B 74 HIS HBy H 1 3.145 . B 74 HIS HBx H 1 3.093 . B 74 HIS HD2 H 1 7.049 . B 74 HIS HE1 H 1 7.918 . B 74 HIS C C 13 175.119 . B 74 HIS CA C 13 56.187 . B 74 HIS CB C 13 31.114 . B 74 HIS CD2 C 13 119.515 . B 74 HIS CE1 C 13 138.104 . B 75 MET H H 1 8.482 . B 75 MET HA H 1 4.475 . B 75 MET HBx H 1 1.975 . B 75 MET HBy H 1 2.056 . B 75 MET HE% H 1 1.990 . B 75 MET HGx H 1 2.507 . B 75 MET HGy H 1 2.547 . B 75 MET C C 13 175.713 . B 75 MET CA C 13 55.547 . B 75 MET CB C 13 32.869 . B 75 MET CE C 13 16.150 . B 75 MET CG C 13 32.042 . B 75 MET N N 15 122.077 . B 76 LEU H H 1 8.453 . B 76 LEU HA H 1 4.639 . B 76 LEU HBx H 1 1.584 . B 76 LEU HBy H 1 1.616 . B 76 LEU HDx% H 1 0.929 . B 76 LEU HDy% H 1 0.936 . B 76 LEU HG H 1 1.686 . B 76 LEU CA C 13 53.063 . B 76 LEU CB C 13 42.061 . B 76 LEU CD1 C 13 23.610 . B 76 LEU CD2 C 13 25.310 . B 76 LEU CG C 13 27.070 . B 76 LEU N N 15 124.910 . B 77 PRO HA H 1 4.501 . B 77 PRO HBy H 1 2.355 . B 77 PRO HBx H 1 1.908 . B 77 PRO HDy H 1 3.916 . B 77 PRO HDx H 1 3.615 . B 77 PRO HGy H 1 2.080 . B 77 PRO HGx H 1 2.044 . B 77 PRO C C 13 176.415 . B 77 PRO CA C 13 62.980 . B 77 PRO CB C 13 32.228 . B 77 PRO CD C 13 50.674 . B 77 PRO CG C 13 27.622 . B 78 ASP H H 1 8.420 . B 78 ASP HA H 1 4.604 . B 78 ASP HBy H 1 3.000 . B 78 ASP HBx H 1 2.783 . B 78 ASP C C 13 177.149 . B 78 ASP CA C 13 54.570 . B 78 ASP CB C 13 41.710 . B 78 ASP N N 15 122.310 . B 79 VAL H H 1 8.640 . B 79 VAL HA H 1 3.782 . B 79 VAL HB H 1 2.228 . B 79 VAL HG11 H 1 1.014 . B 79 VAL HG12 H 1 1.014 . B 79 VAL HG13 H 1 1.014 . B 79 VAL HG21 H 1 1.125 . B 79 VAL HG22 H 1 1.125 . B 79 VAL HG23 H 1 1.125 . B 79 VAL C C 13 176.120 . B 79 VAL CA C 13 66.080 . B 79 VAL CB C 13 31.220 . B 79 VAL CGx C 13 20.522 . B 79 VAL CGy C 13 22.410 . B 79 VAL N N 15 120.360 . B 80 ALA H H 1 7.930 . B 80 ALA HA H 1 3.990 . B 80 ALA HB% H 1 1.411 . B 80 ALA C C 13 179.096 . B 80 ALA CA C 13 55.440 . B 80 ALA CB C 13 18.400 . B 80 ALA N N 15 122.710 . B 81 GLN H H 1 7.970 . B 81 GLN HA H 1 4.089 . B 81 GLN HBx H 1 2.195 . B 81 GLN HBy H 1 2.284 . B 81 GLN HE2y H 1 7.530 . B 81 GLN HE2x H 1 6.820 . B 81 GLN HGy H 1 2.534 . B 81 GLN HGx H 1 2.413 . B 81 GLN C C 13 179.449 . B 81 GLN CA C 13 59.080 . B 81 GLN CB C 13 28.040 . B 81 GLN CG C 13 34.256 . B 81 GLN N N 15 118.410 . B 81 GLN NE2 N 15 111.900 . B 82 ARG H H 1 8.570 . B 82 ARG HA H 1 4.153 . B 82 ARG HBx H 1 2.067 . B 82 ARG HBy H 1 2.200 . B 82 ARG HDx H 1 3.299 . B 82 ARG HDy H 1 3.425 . B 82 ARG HGx H 1 1.615 . B 82 ARG HGy H 1 2.077 . B 82 ARG C C 13 179.259 . B 82 ARG CA C 13 60.090 . B 82 ARG CB C 13 29.730 . B 82 ARG CD C 13 43.786 . B 82 ARG CG C 13 28.355 . B 82 ARG N N 15 119.100 . B 83 LEU H H 1 8.270 . B 83 LEU HA H 1 3.022 . B 83 LEU HBx H 1 0.948 . B 83 LEU HBy H 1 1.900 . B 83 LEU HD11 H 1 0.463 . B 83 LEU HD12 H 1 0.463 . B 83 LEU HD13 H 1 0.463 . B 83 LEU HD21 H 1 0.774 . B 83 LEU HD22 H 1 0.774 . B 83 LEU HD23 H 1 0.774 . B 83 LEU HG H 1 1.262 . B 83 LEU C C 13 177.566 . B 83 LEU CA C 13 57.700 . B 83 LEU CB C 13 40.080 . B 83 LEU CDx C 13 22.041 . B 83 LEU CDy C 13 26.206 . B 83 LEU CG C 13 26.830 . B 83 LEU N N 15 123.660 . B 84 MET H H 1 8.210 . B 84 MET HA H 1 3.947 . B 84 MET HBy H 1 2.307 . B 84 MET HBx H 1 2.190 . B 84 MET HE% H 1 2.110 . B 84 MET HGy H 1 2.870 . B 84 MET HGx H 1 2.645 . B 84 MET C C 13 179.192 . B 84 MET CA C 13 59.940 . B 84 MET CB C 13 32.940 . B 84 MET CE C 13 16.650 . B 84 MET CG C 13 32.305 . B 84 MET N N 15 118.580 . B 85 GLN H H 1 8.270 . B 85 GLN HA H 1 4.127 . B 85 GLN HBy H 1 2.255 . B 85 GLN HBx H 1 2.199 . B 85 GLN HE2y H 1 7.730 . B 85 GLN HE2x H 1 6.790 . B 85 GLN HGy H 1 2.578 . B 85 GLN HGx H 1 2.488 . B 85 GLN C C 13 177.474 . B 85 GLN CA C 13 58.800 . B 85 GLN CB C 13 28.170 . B 85 GLN CG C 13 33.655 . B 85 GLN N N 15 119.930 . B 85 GLN NE2 N 15 111.600 . B 86 HIS H H 1 8.160 . B 86 HIS HA H 1 4.529 . B 86 HIS HBy H 1 3.240 . B 86 HIS HBx H 1 3.230 . B 86 HIS HD2 H 1 6.370 . B 86 HIS HE1 H 1 8.000 . B 86 HIS C C 13 178.277 . B 86 HIS CA C 13 59.800 . B 86 HIS CB C 13 31.410 . B 86 HIS CD2 C 13 117.289 . B 86 HIS CE1 C 13 139.705 . B 86 HIS N N 15 120.900 . B 87 LEU H H 1 8.230 . B 87 LEU HA H 1 3.818 . B 87 LEU HBy H 1 1.850 . B 87 LEU HBx H 1 1.513 . B 87 LEU HDx% H 1 0.695 . B 87 LEU HD21 H 1 0.699 . B 87 LEU HDy% H 1 0.699 . B 87 LEU HG H 1 1.790 . B 87 LEU C C 13 179.511 . B 87 LEU CA C 13 58.550 . B 87 LEU CB C 13 39.940 . B 87 LEU CDx C 13 22.697 . B 87 LEU CDy C 13 25.482 . B 87 LEU CG C 13 27.192 . B 87 LEU N N 15 118.310 . B 88 ALA H H 1 8.290 . B 88 ALA HA H 1 4.141 . B 88 ALA HB% H 1 1.568 . B 88 ALA C C 13 182.407 . B 88 ALA CA C 13 55.450 . B 88 ALA CB C 13 17.860 . B 88 ALA N N 15 123.720 . B 89 GLU H H 1 8.340 . B 89 GLU HA H 1 4.052 . B 89 GLU HBx H 1 1.950 . B 89 GLU HBy H 1 2.196 . B 89 GLU HGy H 1 2.469 . B 89 GLU HGx H 1 2.276 . B 89 GLU C C 13 177.434 . B 89 GLU CA C 13 58.480 . B 89 GLU CB C 13 29.160 . B 89 GLU CG C 13 36.559 . B 89 GLU N N 15 119.640 . B 90 HIS H H 1 7.570 . B 90 HIS HA H 1 4.544 . B 90 HIS HBx H 1 2.731 . B 90 HIS HBy H 1 3.610 . B 90 HIS HD2 H 1 7.133 . B 90 HIS HE1 H 1 8.130 . B 90 HIS C C 13 174.172 . B 90 HIS CA C 13 56.360 . B 90 HIS CB C 13 29.730 . B 90 HIS N N 15 115.660 . B 90 HIS ND1 N 15 137.021 . B 91 GLY H H 1 7.830 . B 91 GLY HAx H 1 3.792 . B 91 GLY HAy H 1 4.114 . B 91 GLY C C 13 173.809 . B 91 GLY CA C 13 46.000 . B 91 GLY N N 15 107.210 . B 92 ILE H H 1 8.010 . B 92 ILE HA H 1 4.200 . B 92 ILE HB H 1 1.672 . B 92 ILE HD1% H 1 0.830 . B 92 ILE HG12 H 1 1.184 . B 92 ILE HG13 H 1 1.316 . B 92 ILE HG21 H 1 0.770 . B 92 ILE HG22 H 1 0.770 . B 92 ILE HG23 H 1 0.770 . B 92 ILE C C 13 174.571 . B 92 ILE CA C 13 59.580 . B 92 ILE CB C 13 38.060 . B 92 ILE CD1 C 13 12.748 . B 92 ILE CG1 C 13 27.158 . B 92 ILE CG2 C 13 17.496 . B 92 ILE N N 15 122.520 . B 93 GLN H H 1 8.300 . B 93 GLN HA H 1 4.647 . B 93 GLN HBx H 1 1.830 . B 93 GLN HBy H 1 2.101 . B 93 GLN HE2y H 1 7.500 . B 93 GLN HE2x H 1 6.820 . B 93 GLN HGx H 1 2.360 . B 93 GLN HGy H 1 2.362 . B 93 GLN CA C 13 52.640 . B 93 GLN CB C 13 29.200 . B 93 GLN CG C 13 33.400 . B 93 GLN N N 15 125.250 . B 93 GLN NE2 N 15 112.200 . B 94 PRO HA H 1 4.366 . B 94 PRO HBy H 1 2.436 . B 94 PRO HBx H 1 2.042 . B 94 PRO HDy H 1 3.993 . B 94 PRO HDx H 1 3.667 . B 94 PRO HGx H 1 1.930 . B 94 PRO HGy H 1 2.156 . B 94 PRO C C 13 176.619 . B 94 PRO CA C 13 63.175 . B 94 PRO CB C 13 32.413 . B 94 PRO CD C 13 50.609 . B 94 PRO CG C 13 28.086 . B 95 ALA H H 1 8.540 . B 95 ALA HA H 1 4.246 . B 95 ALA HB% H 1 1.448 . B 95 ALA C C 13 178.222 . B 95 ALA CA C 13 53.460 . B 95 ALA CB C 13 19.229 . B 95 ALA N N 15 126.050 . B 96 ARG H H 1 8.490 . B 96 ARG HA H 1 4.323 . B 96 ARG HBy H 1 1.803 . B 96 ARG HBx H 1 1.679 . B 96 ARG HDy H 1 3.226 . B 96 ARG HDx H 1 3.162 . B 96 ARG HGy H 1 1.612 . B 96 ARG HGx H 1 1.566 . B 96 ARG C C 13 175.611 . B 96 ARG CA C 13 56.020 . B 96 ARG CB C 13 31.110 . B 96 ARG CD C 13 43.463 . B 96 ARG CG C 13 27.254 . B 96 ARG N N 15 118.400 . B 97 ASN H H 1 8.380 . B 97 ASN HA H 1 4.682 . B 97 ASN HBx H 1 2.787 . B 97 ASN HBy H 1 2.916 . B 97 ASN HD2y H 1 7.620 . B 97 ASN HD2x H 1 6.920 . B 97 ASN C C 13 175.525 . B 97 ASN CA C 13 53.110 . B 97 ASN CB C 13 38.540 . B 97 ASN N N 15 119.200 . B 97 ASN ND2 N 15 112.100 . B 98 MET H H 1 8.360 . B 98 MET HA H 1 4.456 . B 98 MET HBy H 1 2.159 . B 98 MET HBx H 1 2.009 . B 98 MET HE% H 1 2.100 . B 98 MET HGy H 1 2.651 . B 98 MET HGx H 1 2.530 . B 98 MET C C 13 176.262 . B 98 MET CA C 13 55.520 . B 98 MET CB C 13 32.140 . B 98 MET CE C 13 16.649 . B 98 MET CG C 13 32.140 . B 98 MET N N 15 121.730 . B 99 ALA H H 1 8.190 . B 99 ALA HA H 1 4.315 . B 99 ALA HB% H 1 1.410 . B 99 ALA C C 13 177.658 . B 99 ALA CA C 13 52.810 . B 99 ALA CB C 13 19.160 . B 99 ALA N N 15 123.930 . B 100 GLU H H 1 8.170 . B 100 GLU HA H 1 4.237 . B 100 GLU HBx H 1 1.907 . B 100 GLU HBy H 1 1.987 . B 100 GLU HGy H 1 2.232 . B 100 GLU HGx H 1 2.171 . B 100 GLU C C 13 176.078 . B 100 GLU CA C 13 56.560 . B 100 GLU CB C 13 30.440 . B 100 GLU CG C 13 36.324 . B 100 GLU N N 15 118.880 . B 101 HIS H H 1 8.250 . B 101 HIS HA H 1 4.643 . B 101 HIS HBx H 1 3.109 . B 101 HIS HBy H 1 3.113 . B 101 HIS HD2 H 1 7.015 . B 101 HIS HE1 H 1 7.953 . B 101 HIS C C 13 174.587 . B 101 HIS CA C 13 55.850 . B 101 HIS CB C 13 30.510 . B 101 HIS CD2 C 13 119.819 . B 101 HIS CE1 C 13 137.959 . B 101 HIS N N 15 120.250 . B 102 ILE H H 1 8.090 . B 102 ILE HA H 1 4.436 . B 102 ILE HB H 1 1.818 . B 102 ILE HD1% H 1 0.846 . B 102 ILE HG12 H 1 1.475 . B 102 ILE HG13 H 1 1.127 . B 102 ILE HG21 H 1 0.925 . B 102 ILE HG22 H 1 0.925 . B 102 ILE HG23 H 1 0.925 . B 102 ILE CA C 13 58.470 . B 102 ILE CB C 13 38.630 . B 102 ILE CD1 C 13 12.708 . B 102 ILE CG1 C 13 26.907 . B 102 ILE CG2 C 13 17.086 . B 102 ILE N N 15 124.850 . B 103 PRO HA H 1 4.640 . B 103 PRO HBx H 1 1.906 . B 103 PRO HBy H 1 2.363 . B 103 PRO HDx H 1 3.663 . B 103 PRO HDy H 1 3.858 . B 103 PRO HGx H 1 2.008 . B 103 PRO HGy H 1 2.055 . B 103 PRO CA C 13 61.480 . B 103 PRO CB C 13 31.140 . B 103 PRO CD C 13 50.870 . B 103 PRO CG C 13 27.350 . B 104 PRO HA H 1 4.390 . B 104 PRO HBy H 1 2.268 . B 104 PRO HBx H 1 1.901 . B 104 PRO HDy H 1 3.828 . B 104 PRO HDx H 1 3.657 . B 104 PRO HGy H 1 2.023 . B 104 PRO HGx H 1 1.905 . B 104 PRO C C 13 176.170 . B 104 PRO CA C 13 62.727 . B 104 PRO CB C 13 32.053 . B 104 PRO CD C 13 50.528 . B 104 PRO CG C 13 26.908 . B 105 ALA H H 1 8.166 . B 105 ALA HA H 1 4.535 . B 105 ALA HB% H 1 1.320 . B 105 ALA CA C 13 50.218 . B 105 ALA CB C 13 18.249 . B 105 ALA N N 15 125.099 . B 106 PRO HA H 1 4.234 . B 106 PRO HBy H 1 1.955 . B 106 PRO HBx H 1 1.517 . B 106 PRO HDy H 1 3.735 . B 106 PRO HDx H 1 3.577 . B 106 PRO HGy H 1 1.908 . B 106 PRO HGx H 1 1.905 . B 106 PRO C C 13 176.299 . B 106 PRO CA C 13 63.012 . B 106 PRO CB C 13 31.825 . B 106 PRO CD C 13 50.376 . B 106 PRO CG C 13 26.925 . B 107 ASN H H 1 8.140 . B 107 ASN HA H 1 4.668 . B 107 ASN HBx H 1 2.670 . B 107 ASN HBy H 1 2.742 . B 107 ASN HD2y H 1 7.520 . B 107 ASN HD2x H 1 6.850 . B 107 ASN C C 13 173.759 . B 107 ASN CA C 13 52.980 . B 107 ASN CB C 13 38.910 . B 107 ASN N N 15 118.650 . B 107 ASN ND2 N 15 112.700 . B 108 TRP H H 1 7.510 . B 108 TRP HA H 1 4.530 . B 108 TRP HBy H 1 3.340 . B 108 TRP HBx H 1 3.195 . B 108 TRP HD1 H 1 7.220 . B 108 TRP HE1 H 1 10.074 . B 108 TRP HE3 H 1 7.695 . B 108 TRP HH2 H 1 7.230 . B 108 TRP HZ2 H 1 7.493 . B 108 TRP HZ3 H 1 7.170 . B 108 TRP CA C 13 58.660 . B 108 TRP CB C 13 30.050 . B 108 TRP CD1 C 13 126.600 . B 108 TRP CZ2 C 13 114.300 . B 108 TRP N N 15 125.850 . B 108 TRP NE1 N 15 128.777 . stop_ save_ save_CNS/XPLOR_distance_constraints_2 _nef_distance_restraint_list.sf_category nef_distance_restraint_list _nef_distance_restraint_list.sf_framecode CNS/XPLOR_distance_constraints_2 _nef_distance_restraint_list.restraint_origin noe _nef_distance_restraint_list.potential_type square-well-parabolic loop_ _nef_distance_restraint.index _nef_distance_restraint.restraint_id _nef_distance_restraint.chain_code_1 _nef_distance_restraint.sequence_code_1 _nef_distance_restraint.residue_name_1 _nef_distance_restraint.atom_name_1 _nef_distance_restraint.chain_code_2 _nef_distance_restraint.sequence_code_2 _nef_distance_restraint.residue_name_2 _nef_distance_restraint.atom_name_2 _nef_distance_restraint.weight _nef_distance_restraint.lower_limit _nef_distance_restraint.upper_limit 1 1 B 90 HIS HE1 B 89 GLU HGy 1.0 1.712 9.326 2 1 B 90 HIS HE1 A 55 PHE HBx 1.0 1.712 9.326 3 2 A 11 HIS HE1 A 12 VAL HGy% 1.0 1.902 7.870 4 2 A 11 HIS HE1 A 12 VAL HGx% 1.0 1.902 7.870 5 3 A 11 HIS HE1 A 9 VAL HGy% 1.0 1.997 5.709 6 3 A 11 HIS HE1 A 9 VAL HGx% 1.0 1.997 5.709 7 4 A 11 HIS HE1 A 13 GLY HAy 1.0 1.533 10.331 8 4 A 11 HIS HE1 A 9 VAL HA 1.0 1.533 10.331 9 5 B 86 HIS HE1 B 86 HIS HBy 1.0 1.967 7.073 10 5 B 86 HIS HE1 B 86 HIS HBx 1.0 1.967 7.073 11 6 B 86 HIS HE1 A 57 GLU HBy 1.0 1.673 9.561 12 6 B 86 HIS HE1 A 53 TYR HBx 1.0 1.673 9.561 13 6 B 86 HIS HE1 B 83 LEU HBy 1.0 1.673 9.561 14 6 B 86 HIS HE1 A 59 GLN HGy 1.0 1.673 9.561 15 7 B 86 HIS HE1 A 51 LEU HDx% 1.0 1.999 6.127 16 7 B 86 HIS HE1 B 87 LEU HDx% 1.0 1.999 6.127 17 8 B 86 HIS HE1 A 50 LYS HGx 1.0 1.257 11.617 18 8 B 86 HIS HE1 A 38 ILE HG13 1.0 1.257 11.617 19 9 A 8 HIS HE1 A 10 SER HBy 1.0 1.761 9.001 20 9 A 8 HIS HE1 A 10 SER HBx 1.0 1.761 9.001 21 10 B 101 HIS HE1 B 101 HIS HBy 1.0 1.871 8.161 22 10 A 8 HIS HE1 A 8 HIS HBx 1.0 1.871 8.161 23 10 B 101 HIS HE1 B 101 HIS HBx 1.0 1.871 8.161 24 11 A 8 HIS HE1 A 62 LEU HDx% 1.0 1.986 6.688 25 11 A 8 HIS HE1 A 62 LEU HDy% 1.0 1.986 6.688 26 11 A 9 VAL HGy% A 8 HIS HE1 1.0 1.986 6.688 27 11 A 9 VAL HGx% A 8 HIS HE1 1.0 1.986 6.688 28 12 A 20 PHE HDx A 53 TYR HDx 1.0 1.999 6.135 29 12 A 20 PHE HDy A 53 TYR HDy 1.0 1.999 6.135 30 12 A 20 PHE HDy A 53 TYR HDx 1.0 1.999 6.135 31 12 A 14 TRP HE3 A 20 PHE HDy 1.0 1.999 6.135 32 12 A 20 PHE HDx A 14 TRP HE3 1.0 1.999 6.135 33 12 A 20 PHE HDx A 53 TYR HDy 1.0 1.999 6.135 34 13 A 20 PHE HDy A 12 VAL HA 1.0 1.950 7.306 35 13 A 20 PHE HDx A 12 VAL HA 1.0 1.950 7.306 36 13 B 108 TRP HE3 B 106 PRO HA 1.0 1.950 7.306 37 14 A 20 PHE HDy A 32 LEU HA 1.0 1.800 8.724 38 14 A 20 PHE HDx A 32 LEU HA 1.0 1.800 8.724 39 14 A 10 SER HBx A 20 PHE HDx 1.0 1.800 8.724 40 14 A 20 PHE HDy A 55 PHE HA 1.0 1.800 8.724 41 14 A 10 SER HBx A 20 PHE HDy 1.0 1.800 8.724 42 14 A 10 SER HBy A 20 PHE HDy 1.0 1.800 8.724 43 14 A 20 PHE HDx A 55 PHE HA 1.0 1.800 8.724 44 14 A 10 SER HBy A 20 PHE HDx 1.0 1.800 8.724 45 15 A 20 PHE HDx A 53 TYR HA 1.0 2.000 6.030 46 15 A 20 PHE HDy A 53 TYR HA 1.0 2.000 6.030 47 15 A 20 PHE HDy A 40 GLU HA 1.0 2.000 6.030 48 15 A 20 PHE HDx A 40 GLU HA 1.0 2.000 6.030 49 16 A 20 PHE HDy A 30 ARG HA 1.0 1.987 6.639 50 16 A 20 PHE HDx A 30 ARG HA 1.0 1.987 6.639 51 16 A 20 PHE HDx A 22 VAL HA 1.0 1.987 6.639 52 16 A 20 PHE HDy A 50 LYS HA 1.0 1.987 6.639 53 16 A 20 PHE HDy A 22 VAL HA 1.0 1.987 6.639 54 16 A 20 PHE HDx A 50 LYS HA 1.0 1.987 6.639 55 17 A 20 PHE HDx A 50 LYS HA 1.0 1.672 9.570 56 17 A 20 PHE HDy A 50 LYS HA 1.0 1.672 9.570 57 17 A 20 PHE HDy A 30 ARG HA 1.0 1.672 9.570 58 17 A 20 PHE HDx A 30 ARG HA 1.0 1.672 9.570 59 18 A 20 PHE HDy A 52 ILE HB 1.0 1.847 3.941 60 18 A 20 PHE HDx A 52 ILE HB 1.0 1.847 3.941 61 18 A 20 PHE HDy A 43 LEU HBy 1.0 1.847 3.941 62 18 A 20 PHE HDx A 43 LEU HBy 1.0 1.847 3.941 63 19 A 20 PHE HDx A 43 LEU HBx 1.0 1.846 3.930 64 19 A 20 PHE HDy A 44 THR HG2% 1.0 1.846 3.930 65 19 A 20 PHE HDy A 43 LEU HBx 1.0 1.846 3.930 66 19 A 20 PHE HDx A 44 THR HG2% 1.0 1.846 3.930 67 20 A 12 VAL HGx% A 20 PHE HDy 1.0 1.908 4.380 68 20 A 12 VAL HGy% A 20 PHE HDx 1.0 1.908 4.380 69 20 A 12 VAL HGx% A 20 PHE HDx 1.0 1.908 4.380 70 20 A 12 VAL HGy% A 20 PHE HDy 1.0 1.908 4.380 71 21 A 20 PHE HDx A 25 LEU HD21 1.0 1.790 3.620 72 21 A 20 PHE HDy A 56 ILE HD1% 1.0 1.790 3.620 73 21 A 20 PHE HDy A 25 LEU HD21 1.0 1.790 3.620 74 21 A 20 PHE HDx A 56 ILE HD1% 1.0 1.790 3.620 75 22 A 20 PHE HDy B 92 ILE HG21 1.0 1.998 6.278 76 22 A 20 PHE HDx B 83 LEU HD21 1.0 1.998 6.278 77 22 A 20 PHE HDx B 92 ILE HG21 1.0 1.998 6.278 78 22 A 20 PHE HDy B 83 LEU HD21 1.0 1.998 6.278 79 23 A 20 PHE HDx A 43 LEU HD11 1.0 1.867 4.071 80 23 A 20 PHE HDx A 38 ILE HG21 1.0 1.867 4.071 81 23 A 20 PHE HDy A 43 LEU HD11 1.0 1.867 4.071 82 23 A 20 PHE HDy A 38 ILE HG21 1.0 1.867 4.071 83 24 A 12 VAL HA A 20 PHE HEy 1.0 1.972 6.974 84 24 A 12 VAL HA A 20 PHE HEx 1.0 1.972 6.974 85 24 A 51 LEU HA A 20 PHE HEy 1.0 1.972 6.974 86 24 A 20 PHE HEx A 51 LEU HA 1.0 1.972 6.974 87 25 A 12 VAL HGx% A 20 PHE HEy 1.0 1.740 3.372 88 25 A 12 VAL HGy% A 20 PHE HEy 1.0 1.740 3.372 89 25 A 12 VAL HGx% A 20 PHE HEx 1.0 1.740 3.372 90 25 A 12 VAL HGy% A 20 PHE HEx 1.0 1.740 3.372 91 26 A 20 PHE HEx A 52 ILE HG12 1.0 1.941 4.685 92 26 A 20 PHE HEy A 56 ILE HG21 1.0 1.941 4.685 93 26 A 20 PHE HEx A 56 ILE HG21 1.0 1.941 4.685 94 26 A 20 PHE HEy A 52 ILE HG12 1.0 1.941 4.685 95 27 B 87 LEU HDx% A 20 PHE HEx 1.0 1.903 4.335 96 27 A 38 ILE HG21 A 20 PHE HEy 1.0 1.903 4.335 97 27 A 43 LEU HD11 A 20 PHE HEy 1.0 1.903 4.335 98 27 A 38 ILE HG21 A 20 PHE HEx 1.0 1.903 4.335 99 27 A 43 LEU HD11 A 20 PHE HEx 1.0 1.903 4.335 100 27 B 87 LEU HDx% A 20 PHE HEy 1.0 1.903 4.335 101 28 A 20 PHE HEx A 29 LEU HDx% 1.0 1.911 4.395 102 28 A 20 PHE HEx A 38 ILE HD1% 1.0 1.911 4.395 103 28 A 20 PHE HEy A 38 ILE HD1% 1.0 1.911 4.395 104 28 A 20 PHE HEy A 29 LEU HDx% 1.0 1.911 4.395 105 29 A 53 TYR HDx A 6 PHE HEx 1.0 1.767 8.963 106 29 A 14 TRP HE3 A 6 PHE HEy 1.0 1.767 8.963 107 29 A 53 TYR HDy A 6 PHE HEy 1.0 1.767 8.963 108 29 A 53 TYR HDx A 6 PHE HEy 1.0 1.767 8.963 109 29 A 14 TRP HE3 A 6 PHE HEx 1.0 1.767 8.963 110 29 A 53 TYR HDy A 6 PHE HEx 1.0 1.767 8.963 111 30 A 9 VAL HGx% A 6 PHE HEx 1.0 1.972 6.970 112 30 A 62 LEU HDy% A 6 PHE HEy 1.0 1.972 6.970 113 30 A 9 VAL HGy% A 6 PHE HEx 1.0 1.972 6.970 114 30 A 62 LEU HDx% A 6 PHE HEy 1.0 1.972 6.970 115 30 A 9 VAL HGy% A 6 PHE HEy 1.0 1.972 6.970 116 30 A 62 LEU HDy% A 6 PHE HEx 1.0 1.972 6.970 117 30 A 9 VAL HGx% A 6 PHE HEy 1.0 1.972 6.970 118 30 A 62 LEU HDx% A 6 PHE HEx 1.0 1.972 6.970 119 31 A 6 PHE HDy A 7 LYS HGy 1.0 1.899 7.893 120 31 A 6 PHE HDx A 7 LYS HGy 1.0 1.899 7.893 121 31 A 7 LYS HGx A 6 PHE HDy 1.0 1.899 7.893 122 31 A 6 PHE HDx A 7 LYS HGx 1.0 1.899 7.893 123 32 A 10 SER HBy A 6 PHE HDy 1.0 0.470 14.526 124 32 A 10 SER HBx A 6 PHE HDy 1.0 0.470 14.526 125 33 A 62 LEU HDx% A 6 PHE HDy 1.0 1.341 11.249 126 33 A 9 VAL HGy% A 6 PHE HDy 1.0 1.341 11.249 127 33 A 9 VAL HGx% A 6 PHE HDy 1.0 1.341 11.249 128 34 A 14 TRP HZ2 A 47 GLU HA 1.0 1.999 6.155 129 34 A 14 TRP HZ2 A 15 ASP HA 1.0 1.999 6.155 130 35 A 14 TRP HZ2 A 50 LYS HGy 1.0 1.786 3.596 131 35 A 14 TRP HZ2 A 50 LYS HDx 1.0 1.786 3.596 132 36 A 11 HIS HD2 A 14 TRP HZ3 1.0 1.997 6.331 133 36 A 14 TRP HE3 A 11 HIS HD2 1.0 1.997 6.331 134 37 A 15 ASP HA A 11 HIS HD2 1.0 1.983 6.757 135 37 A 51 LEU HA B 90 HIS HD2 1.0 1.983 6.757 136 38 B 90 HIS HD2 B 88 ALA HA 1.0 1.962 4.946 137 38 A 55 PHE HZ B 82 ARG HA 1.0 1.962 4.946 138 39 B 90 HIS HD2 A 54 ASP HBx 1.0 1.773 8.921 139 39 A 55 PHE HZ A 58 ASP HBy 1.0 1.773 8.921 140 39 A 11 HIS HD2 A 14 TRP HBy 1.0 1.773 8.921 141 40 B 90 HIS HD2 B 87 LEU HBx 1.0 1.994 5.574 142 40 A 55 PHE HZ A 36 ALA HB% 1.0 1.994 5.574 143 41 A 55 PHE HZ A 64 ALA HB% 1.0 1.977 6.871 144 41 A 55 PHE HZ A 32 LEU HG 1.0 1.977 6.871 145 42 A 55 PHE HZ B 83 LEU HG 1.0 1.849 3.951 146 42 A 55 PHE HZ A 59 GLN HGx 1.0 1.849 3.951 147 43 A 12 VAL HGy% A 11 HIS HD2 1.0 1.817 3.763 148 43 B 90 HIS HD2 B 92 ILE HG12 1.0 1.817 3.763 149 43 B 90 HIS HD2 A 51 LEU HBx 1.0 1.817 3.763 150 44 A 55 PHE HZ A 59 GLN HE2x 1.0 1.996 6.386 151 44 B 90 HIS HD2 B 86 HIS HD2 1.0 1.996 6.386 152 45 B 90 HIS HD2 B 90 HIS HA 1.0 1.964 4.962 153 45 B 90 HIS HD2 B 86 HIS HA 1.0 1.964 4.962 154 46 A 11 HIS HD2 A 13 GLY HAx 1.0 1.984 6.712 155 46 B 90 HIS HD2 B 89 GLU HA 1.0 1.984 6.712 156 47 A 55 PHE HZ A 65 VAL HGx% 1.0 1.933 4.605 157 47 B 83 LEU HD21 A 55 PHE HZ 1.0 1.933 4.605 158 48 A 51 LEU HDx% B 90 HIS HD2 1.0 1.832 3.850 159 48 A 55 PHE HZ A 32 LEU HDx% 1.0 1.832 3.850 160 49 A 29 LEU HDx% A 55 PHE HZ 1.0 1.991 6.553 161 49 A 38 ILE HD1% A 55 PHE HZ 1.0 1.991 6.553 162 50 B 90 HIS HD2 A 51 LEU HDy% 1.0 1.853 3.975 163 50 A 55 PHE HZ B 83 LEU HD11 1.0 1.853 3.975 164 51 A 51 LEU HA A 20 PHE HZ 1.0 1.796 8.760 165 51 A 8 HIS HD2 A 7 LYS HA 1.0 1.796 8.760 166 52 A 10 SER HBy A 8 HIS HD2 1.0 1.985 6.691 167 52 A 10 SER HBx A 8 HIS HD2 1.0 1.985 6.691 168 53 B 74 HIS HD2 B 81 GLN HA 1.0 1.995 6.395 169 53 A 20 PHE HZ A 49 SER HA 1.0 1.995 6.395 170 54 A 12 VAL HGy% A 20 PHE HZ 1.0 1.852 3.976 171 54 A 12 VAL HGx% A 20 PHE HZ 1.0 1.852 3.976 172 54 A 12 VAL HGy% A 8 HIS HD2 1.0 1.852 3.976 173 54 A 12 VAL HGx% A 8 HIS HD2 1.0 1.852 3.976 174 55 A 56 ILE HG21 A 20 PHE HZ 1.0 1.934 4.618 175 55 A 56 ILE HG21 A 8 HIS HD2 1.0 1.934 4.618 176 55 A 52 ILE HG12 A 20 PHE HZ 1.0 1.934 4.618 177 56 A 29 LEU HDx% A 20 PHE HZ 1.0 2.000 5.996 178 56 A 38 ILE HD1% A 20 PHE HZ 1.0 2.000 5.996 179 57 B 83 LEU HD11 B 74 HIS HD2 1.0 1.849 8.349 180 57 B 83 LEU HD11 A 20 PHE HZ 1.0 1.849 8.349 181 58 A 23 ASN HD2x A 23 ASN HA 1.0 1.859 8.265 182 58 B 101 HIS HD2 B 101 HIS HA 1.0 1.859 8.265 183 59 B 101 HIS HD2 B 95 ALA HB% 1.0 1.993 6.475 184 59 A 44 THR HG2% B 101 HIS HD2 1.0 1.993 6.475 185 59 B 101 HIS HD2 B 102 ILE HG12 1.0 1.993 6.475 186 60 A 55 PHE HEx A 29 LEU HG 1.0 2.000 6.012 187 60 A 55 PHE HEy B 80 ALA HB% 1.0 2.000 6.012 188 60 A 29 LEU HG A 55 PHE HEy 1.0 2.000 6.012 189 60 A 55 PHE HEx B 80 ALA HB% 1.0 2.000 6.012 190 61 A 29 LEU HDx% A 55 PHE HEy 1.0 1.996 5.666 191 61 A 38 ILE HD1% A 55 PHE HEy 1.0 1.996 5.666 192 61 A 38 ILE HD1% A 55 PHE HEx 1.0 1.996 5.666 193 61 A 29 LEU HDx% A 55 PHE HEx 1.0 1.996 5.666 194 62 A 55 PHE HEx B 80 ALA HA 1.0 1.999 5.789 195 62 A 55 PHE HEy B 80 ALA HA 1.0 1.999 5.789 196 62 A 55 PHE HEy A 59 GLN HA 1.0 1.999 5.789 197 62 A 55 PHE HEx A 59 GLN HA 1.0 1.999 5.789 198 63 A 50 LYS HGy A 14 TRP HH2 1.0 1.891 4.241 199 63 A 50 LYS HDx A 14 TRP HH2 1.0 1.891 4.241 200 64 B 80 ALA HA A 33 PHE HDx 1.0 1.982 6.758 201 64 B 80 ALA HA A 33 PHE HDy 1.0 1.982 6.758 202 64 A 43 LEU HA A 33 PHE HDy 1.0 1.982 6.758 203 64 A 33 PHE HDx A 43 LEU HA 1.0 1.982 6.758 204 65 B 85 GLN HE2x B 84 MET HA 1.0 1.974 5.120 205 65 A 32 LEU HA A 33 PHE HDy 1.0 1.974 5.120 206 65 A 32 LEU HA A 33 PHE HDx 1.0 1.974 5.120 207 66 A 53 TYR HA A 33 PHE HDy 1.0 1.964 7.108 208 66 A 53 TYR HA A 33 PHE HDx 1.0 1.964 7.108 209 66 A 40 GLU HA A 33 PHE HDy 1.0 1.964 7.108 210 66 A 40 GLU HA A 33 PHE HDx 1.0 1.964 7.108 211 67 A 33 PHE HDx A 56 ILE HG12 1.0 1.993 5.545 212 67 A 33 PHE HDx A 48 THR HG2% 1.0 1.993 5.545 213 67 A 33 PHE HDy A 56 ILE HG12 1.0 1.993 5.545 214 67 A 12 VAL HGx% A 33 PHE HDx 1.0 1.993 5.545 215 67 A 33 PHE HDy A 48 THR HG2% 1.0 1.993 5.545 216 67 A 12 VAL HGx% A 33 PHE HDy 1.0 1.993 5.545 217 68 A 56 ILE HG21 A 55 PHE HDx 1.0 1.752 3.430 218 68 A 52 ILE HG12 A 55 PHE HDx 1.0 1.752 3.430 219 68 A 56 ILE HG21 A 55 PHE HDy 1.0 1.752 3.430 220 68 A 52 ILE HG12 A 55 PHE HDy 1.0 1.752 3.430 221 68 A 32 LEU HDx% A 55 PHE HDy 1.0 1.752 3.430 222 68 A 32 LEU HDx% A 55 PHE HDx 1.0 1.752 3.430 223 69 A 57 GLU HA A 53 TYR HEy 1.0 1.992 6.516 224 69 A 55 PHE HDy B 87 LEU HA 1.0 1.992 6.516 225 69 A 55 PHE HDy B 79 VAL HA 1.0 1.992 6.516 226 69 A 53 TYR HEx A 57 GLU HA 1.0 1.992 6.516 227 69 A 55 PHE HDx B 79 VAL HA 1.0 1.992 6.516 228 69 A 55 PHE HDx B 87 LEU HA 1.0 1.992 6.516 229 69 A 55 PHE HDx A 57 GLU HA 1.0 1.992 6.516 230 69 A 55 PHE HDy A 57 GLU HA 1.0 1.992 6.516 231 70 A 15 ASP HA A 53 TYR HEy 1.0 1.989 6.599 232 70 A 15 ASP HA A 53 TYR HEx 1.0 1.989 6.599 233 70 A 12 VAL HA A 53 TYR HEy 1.0 1.989 6.599 234 70 A 12 VAL HA A 53 TYR HEx 1.0 1.989 6.599 235 71 A 9 VAL HA A 53 TYR HEx 1.0 1.978 6.866 236 71 A 9 VAL HA A 53 TYR HEy 1.0 1.978 6.866 237 71 A 15 ASP HA A 53 TYR HEx 1.0 1.978 6.866 238 71 A 15 ASP HA A 53 TYR HEy 1.0 1.978 6.866 239 71 A 13 GLY HAy A 53 TYR HEy 1.0 1.978 6.866 240 71 A 13 GLY HAy A 53 TYR HEx 1.0 1.978 6.866 241 72 A 53 TYR HEy A 62 LEU HA 1.0 1.997 6.289 242 72 A 53 TYR HEx A 62 LEU HA 1.0 1.997 6.289 243 72 A 50 LYS HA A 53 TYR HEy 1.0 1.997 6.289 244 72 A 50 LYS HA A 53 TYR HEx 1.0 1.997 6.289 245 73 A 55 PHE HA A 33 PHE HEx 1.0 1.972 6.984 246 73 A 55 PHE HA A 33 PHE HEy 1.0 1.972 6.984 247 73 A 32 LEU HA A 33 PHE HEy 1.0 1.972 6.984 248 73 A 32 LEU HA A 33 PHE HEx 1.0 1.972 6.984 249 74 B 80 ALA HA A 33 PHE HEx 1.0 1.942 7.412 250 74 A 43 LEU HA A 33 PHE HEy 1.0 1.942 7.412 251 74 A 43 LEU HA A 33 PHE HEx 1.0 1.942 7.412 252 74 B 80 ALA HA A 33 PHE HEy 1.0 1.942 7.412 253 75 A 30 ARG HA A 33 PHE HEx 1.0 1.989 5.403 254 75 A 30 ARG HA A 33 PHE HEy 1.0 1.989 5.403 255 75 A 22 VAL HA A 33 PHE HEy 1.0 1.989 5.403 256 75 A 22 VAL HA A 33 PHE HEx 1.0 1.989 5.403 257 76 A 56 ILE HG12 A 33 PHE HEx 1.0 1.871 4.093 258 76 A 12 VAL HGx% A 33 PHE HEy 1.0 1.871 4.093 259 76 A 12 VAL HGx% A 33 PHE HEx 1.0 1.871 4.093 260 76 A 56 ILE HG12 A 33 PHE HEy 1.0 1.871 4.093 261 77 A 56 ILE HD1% A 33 PHE HEx 1.0 1.599 2.821 262 77 A 25 LEU HD21 A 33 PHE HEy 1.0 1.599 2.821 263 77 A 25 LEU HD21 A 33 PHE HEx 1.0 1.599 2.821 264 77 A 56 ILE HD1% A 33 PHE HEy 1.0 1.599 2.821 265 78 A 29 LEU HDx% A 33 PHE HEx 1.0 1.724 3.306 266 78 A 29 LEU HDx% A 33 PHE HEy 1.0 1.724 3.306 267 78 A 38 ILE HD1% A 33 PHE HEy 1.0 1.724 3.306 268 78 A 38 ILE HD1% A 33 PHE HEx 1.0 1.724 3.306 269 79 A 14 TRP HE3 A 16 PRO HDx 1.0 1.904 4.344 270 79 A 14 TRP HZ3 A 16 PRO HDx 1.0 1.904 4.344 271 80 B 87 LEU HDx% A 53 TYR HDx 1.0 1.938 7.462 272 80 A 53 TYR HDx A 38 ILE HG21 1.0 1.938 7.462 273 80 A 53 TYR HDy A 38 ILE HG21 1.0 1.938 7.462 274 80 A 53 TYR HDy A 43 LEU HD11 1.0 1.938 7.462 275 80 B 87 LEU HDx% A 53 TYR HDy 1.0 1.938 7.462 276 80 B 87 LEU HDx% A 14 TRP HE3 1.0 1.938 7.462 277 80 A 53 TYR HDx B 87 LEU HDy% 1.0 1.938 7.462 278 80 A 53 TYR HDy B 87 LEU HDy% 1.0 1.938 7.462 279 80 A 53 TYR HDx A 43 LEU HD11 1.0 1.938 7.462 280 80 A 14 TRP HE3 A 43 LEU HD11 1.0 1.938 7.462 281 81 A 53 TYR HDx A 55 PHE HA 1.0 1.941 7.441 282 81 A 10 SER HBx A 53 TYR HDx 1.0 1.941 7.441 283 81 A 10 SER HBy A 53 TYR HDx 1.0 1.941 7.441 284 81 A 53 TYR HDy A 55 PHE HA 1.0 1.941 7.441 285 81 A 10 SER HBx A 53 TYR HDy 1.0 1.941 7.441 286 81 A 10 SER HBy A 53 TYR HDy 1.0 1.941 7.441 287 82 A 53 TYR HDy A 50 LYS HGy 1.0 1.933 4.607 288 82 A 53 TYR HDy A 62 LEU HG 1.0 1.933 4.607 289 82 A 53 TYR HDx A 62 LEU HG 1.0 1.933 4.607 290 82 A 53 TYR HDx A 50 LYS HGy 1.0 1.933 4.607 291 82 A 14 TRP HE3 A 50 LYS HGy 1.0 1.933 4.607 292 83 A 62 LEU HDy% A 53 TYR HDx 1.0 1.813 3.739 293 83 A 62 LEU HDx% A 53 TYR HDy 1.0 1.813 3.739 294 83 A 53 TYR HDx A 29 LEU HDy% 1.0 1.813 3.739 295 83 A 62 LEU HDx% A 53 TYR HDx 1.0 1.813 3.739 296 83 A 53 TYR HDy A 29 LEU HDy% 1.0 1.813 3.739 297 83 A 62 LEU HDy% A 53 TYR HDy 1.0 1.813 3.739 298 84 A 56 ILE HG12 A 33 PHE HZ 1.0 1.940 4.674 299 84 A 12 VAL HGx% A 33 PHE HZ 1.0 1.940 4.674 300 85 A 32 LEU HDx% A 33 PHE HZ 1.0 1.863 4.043 301 85 A 56 ILE HG21 A 33 PHE HZ 1.0 1.863 4.043 302 86 A 55 PHE HA B 86 HIS HD2 1.0 1.992 5.492 303 86 B 86 HIS HD2 B 84 MET HA 1.0 1.992 5.492 304 87 B 87 LEU HBx B 86 HIS HD2 1.0 1.972 6.970 305 87 A 36 ALA HB% B 86 HIS HD2 1.0 1.972 6.970 306 88 B 86 HIS HD2 B 87 LEU HDy% 1.0 1.731 3.335 307 88 B 87 LEU HDx% B 86 HIS HD2 1.0 1.731 3.335 308 89 A 43 LEU HA A 14 TRP HD1 1.0 1.891 7.979 309 89 A 13 GLY HAx A 14 TRP HD1 1.0 1.891 7.979 310 90 A 52 ILE HB A 14 TRP HD1 1.0 1.942 7.422 311 90 A 43 LEU HBy A 14 TRP HD1 1.0 1.942 7.422 312 91 A 12 VAL HGy% A 14 TRP HD1 1.0 1.985 6.721 313 91 A 12 VAL HGx% A 14 TRP HD1 1.0 1.985 6.721 314 92 A 56 ILE HD1% A 14 TRP HD1 1.0 1.659 9.643 315 92 A 25 LEU HD21 A 14 TRP HD1 1.0 1.659 9.643 316 92 A 14 TRP HD1 A 22 VAL HGx% 1.0 1.659 9.643 317 93 A 62 LEU HDy% A 14 TRP HD1 1.0 1.257 11.617 318 93 A 29 LEU HDy% A 14 TRP HD1 1.0 1.257 11.617 319 93 A 14 TRP HD1 A 25 LEU HD11 1.0 1.257 11.617 320 94 B 101 HIS HE1 B 101 HIS HBx 1.0 1.844 8.392 321 94 B 101 HIS HE1 B 101 HIS HBy 1.0 1.844 8.392 322 94 A 8 HIS HE1 A 8 HIS HBy 1.0 1.844 8.392 323 95 A 20 PHE HDy B 87 LEU HDy% 1.0 1.992 5.502 324 95 A 20 PHE HDy A 56 ILE HG21 1.0 1.992 5.502 325 95 A 20 PHE HDx B 87 LEU HDy% 1.0 1.992 5.502 326 95 A 20 PHE HDy A 52 ILE HG12 1.0 1.992 5.502 327 95 A 20 PHE HDx A 52 ILE HG12 1.0 1.992 5.502 328 95 A 20 PHE HDx A 56 ILE HG21 1.0 1.992 5.502 329 96 A 53 TYR HDx B 83 LEU HD21 1.0 1.949 7.337 330 96 A 53 TYR HDy B 83 LEU HD21 1.0 1.949 7.337 331 96 A 53 TYR HDx A 65 VAL HGx% 1.0 1.949 7.337 332 96 A 53 TYR HDy A 65 VAL HGx% 1.0 1.949 7.337 333 97 B 86 HIS HBy B 83 LEU HA 1.0 1.771 3.525 334 97 B 86 HIS HBx B 83 LEU HA 1.0 1.771 3.525 335 98 B 93 GLN HA B 94 PRO HDx 1.0 1.494 2.482 336 98 B 76 LEU HA B 77 PRO HDx 1.0 1.494 2.482 337 99 B 93 GLN HA B 93 GLN HGy 1.0 1.693 3.175 338 99 B 93 GLN HA B 93 GLN HGx 1.0 1.693 3.175 339 100 B 80 ALA HB% A 35 ARG HBx 1.0 1.716 3.270 340 100 B 80 ALA HB% A 35 ARG HBy 1.0 1.716 3.270 341 101 A 30 ARG HA A 30 ARG HBx 1.0 1.658 3.032 342 101 A 66 ARG HBx A 66 ARG HA 1.0 1.658 3.032 343 102 B 93 GLN HGx B 93 GLN HBx 1.0 1.479 2.439 344 102 B 93 GLN HGy B 93 GLN HBx 1.0 1.479 2.439 345 103 B 77 PRO HDy B 76 LEU HBx 1.0 1.863 4.045 346 103 B 77 PRO HDy B 76 LEU HBy 1.0 1.863 4.045 347 104 B 77 PRO HDx B 76 LEU HBx 1.0 1.726 3.312 348 104 B 77 PRO HDx B 76 LEU HBy 1.0 1.726 3.312 349 105 B 106 PRO HDy B 106 PRO HGy 1.0 1.593 2.799 350 105 B 106 PRO HDy B 106 PRO HGx 1.0 1.593 2.799 351 106 A 16 PRO HDy A 16 PRO HGx 1.0 1.627 2.917 352 106 A 16 PRO HDy A 16 PRO HGy 1.0 1.627 2.917 353 107 A 16 PRO HDx A 16 PRO HGx 1.0 1.638 2.956 354 107 A 16 PRO HDx A 16 PRO HGy 1.0 1.638 2.956 355 108 A 32 LEU HG A 32 LEU HDx% 1.0 1.506 2.516 356 108 A 38 ILE HG13 B 87 LEU HDy% 1.0 1.506 2.516 357 109 A 35 ARG HGy A 35 ARG HDx 1.0 1.514 2.542 358 109 A 35 ARG HGy A 35 ARG HDy 1.0 1.514 2.542 359 110 B 77 PRO HA B 77 PRO HGy 1.0 1.757 3.453 360 110 B 77 PRO HGx B 77 PRO HA 1.0 1.757 3.453 361 111 B 106 PRO HGy B 106 PRO HDx 1.0 1.657 3.029 362 111 B 106 PRO HGx B 106 PRO HDx 1.0 1.657 3.029 363 112 A 71 ARG HA A 71 ARG HGx 1.0 1.585 2.771 364 112 A 71 ARG HGy A 71 ARG HA 1.0 1.585 2.771 365 113 A 15 ASP HA A 16 PRO HGx 1.0 1.856 3.994 366 113 A 15 ASP HA A 16 PRO HGy 1.0 1.856 3.994 367 114 A 25 LEU HD21 A 25 LEU HG 1.0 1.631 2.933 368 114 A 25 LEU HD11 A 25 LEU HG 1.0 1.631 2.933 369 115 A 25 LEU HD11 A 43 LEU HD21 1.0 1.955 4.855 370 115 A 25 LEU HD21 A 43 LEU HD21 1.0 1.955 4.855 371 116 A 22 VAL HGx% A 40 GLU HBx 1.0 1.797 3.659 372 116 A 22 VAL HGx% A 40 GLU HBy 1.0 1.797 3.659 373 117 A 32 LEU HDx% B 79 VAL HG21 1.0 1.753 3.435 374 117 A 48 THR HG2% B 87 LEU HDy% 1.0 1.753 3.435 375 118 B 79 VAL HG21 A 68 GLU HGx 1.0 1.733 3.343 376 118 B 79 VAL HG21 A 68 GLU HGy 1.0 1.733 3.343 377 118 A 48 THR HG2% A 42 GLN HGx 1.0 1.733 3.343 378 119 A 25 LEU HD21 A 25 LEU HBx 1.0 1.559 2.685 379 119 A 25 LEU HD11 A 25 LEU HBx 1.0 1.559 2.685 380 120 A 12 VAL HGy% A 10 SER HBx 1.0 1.829 3.835 381 120 A 12 VAL HGy% A 10 SER HBy 1.0 1.829 3.835 382 120 A 12 VAL HGx% A 10 SER HBy 1.0 1.829 3.835 383 121 A 71 ARG HDx A 68 GLU HA 1.0 1.782 3.576 384 121 A 66 ARG HDy A 63 GLU HA 1.0 1.782 3.576 385 122 A 71 ARG HA A 71 ARG HDy 1.0 1.910 4.392 386 122 A 71 ARG HA A 71 ARG HDx 1.0 1.910 4.392 387 123 B 79 VAL HB B 79 VAL HG11 1.0 1.398 2.212 388 123 A 22 VAL HB A 22 VAL HGy% 1.0 1.398 2.212 389 124 A 7 LYS HDy A 7 LYS HEx 1.0 1.707 3.229 390 124 A 7 LYS HEy A 7 LYS HDy 1.0 1.707 3.229 391 124 A 7 LYS HEy A 7 LYS HDx 1.0 1.707 3.229 392 125 A 7 LYS HGy A 7 LYS HEx 1.0 1.755 3.445 393 125 A 7 LYS HGx A 7 LYS HEx 1.0 1.755 3.445 394 125 A 7 LYS HGy A 7 LYS HEy 1.0 1.755 3.445 395 126 A 16 PRO HGx A 16 PRO HA 1.0 1.760 3.466 396 126 A 16 PRO HGy A 16 PRO HA 1.0 1.760 3.466 397 127 B 106 PRO HA B 106 PRO HGy 1.0 1.941 4.681 398 127 B 106 PRO HA B 106 PRO HGx 1.0 1.941 4.681 399 128 A 12 VAL HA A 29 LEU HDy% 1.0 1.737 3.361 400 128 A 62 LEU HDx% A 12 VAL HA 1.0 1.737 3.361 401 129 B 80 ALA HB% A 35 ARG HDx 1.0 1.753 3.433 402 129 B 80 ALA HB% A 35 ARG HDy 1.0 1.753 3.433 403 130 B 103 PRO HA B 103 PRO HGy 1.0 1.872 4.106 404 130 B 103 PRO HGx B 103 PRO HA 1.0 1.872 4.106 405 131 A 40 GLU HA A 40 GLU HBx 1.0 1.531 2.595 406 131 A 40 GLU HA A 40 GLU HBy 1.0 1.531 2.595 407 132 A 62 LEU HDy% A 56 ILE HG21 1.0 1.603 2.835 408 132 A 56 ILE HG21 A 65 VAL HGy% 1.0 1.603 2.835 409 133 A 12 VAL HGy% A 56 ILE HG21 1.0 1.747 3.405 410 133 A 12 VAL HGx% A 56 ILE HG21 1.0 1.747 3.405 411 134 A 35 ARG HDx A 69 MET HE% 1.0 1.782 3.574 412 134 A 35 ARG HDy A 69 MET HE% 1.0 1.782 3.574 413 135 B 86 HIS HBy B 86 HIS HA 1.0 1.658 3.034 414 135 B 86 HIS HBx B 86 HIS HA 1.0 1.658 3.034 415 136 A 42 GLN HA A 45 ASP HBy 1.0 1.875 4.121 416 136 A 42 GLN HA A 45 ASP HBx 1.0 1.875 4.121 417 137 A 20 PHE HA A 20 PHE HBx 1.0 1.676 3.102 418 137 A 20 PHE HBy A 20 PHE HA 1.0 1.676 3.102 419 138 A 67 GLN HA A 70 ARG HDy 1.0 1.796 3.650 420 138 A 67 GLN HA A 70 ARG HDx 1.0 1.796 3.650 421 139 A 67 GLN HA A 67 GLN HBx 1.0 1.425 2.285 422 139 A 67 GLN HA A 67 GLN HBy 1.0 1.425 2.285 423 140 A 67 GLN HA A 67 GLN HGy 1.0 1.615 2.875 424 140 A 67 GLN HA A 67 GLN HGx 1.0 1.615 2.875 425 141 A 12 VAL HGx% A 56 ILE HD1% 1.0 1.809 3.719 426 141 A 12 VAL HGy% A 56 ILE HD1% 1.0 1.809 3.719 427 142 A 17 GLN HA A 17 GLN HBx 1.0 1.399 2.215 428 142 A 17 GLN HBy A 17 GLN HA 1.0 1.399 2.215 429 143 A 17 GLN HA A 17 GLN HGx 1.0 1.610 2.858 430 143 A 17 GLN HA A 17 GLN HGy 1.0 1.610 2.858 431 144 A 29 LEU HA A 29 LEU HBy 1.0 1.662 3.050 432 144 A 29 LEU HA A 32 LEU HBy 1.0 1.662 3.050 433 145 B 96 ARG HA B 96 ARG HDy 1.0 1.682 3.128 434 145 B 96 ARG HDx B 96 ARG HA 1.0 1.682 3.128 435 146 B 101 HIS HBx B 101 HIS HA 1.0 1.426 2.288 436 146 B 101 HIS HBy B 101 HIS HA 1.0 1.426 2.288 437 146 A 8 HIS HBy A 8 HIS HA 1.0 1.426 2.288 438 147 B 96 ARG HA B 96 ARG HGy 1.0 1.614 2.870 439 147 B 96 ARG HA B 96 ARG HGx 1.0 1.614 2.870 440 148 A 7 LYS HGy A 7 LYS HA 1.0 1.762 3.480 441 148 A 7 LYS HGx A 7 LYS HA 1.0 1.762 3.480 442 149 A 32 LEU HDx% B 80 ALA HA 1.0 1.849 3.951 443 149 B 83 LEU HD21 B 80 ALA HA 1.0 1.849 3.951 444 150 A 9 VAL HGx% A 9 VAL HB 1.0 1.428 2.294 445 150 A 9 VAL HGy% A 9 VAL HB 1.0 1.428 2.294 446 151 A 23 ASN HA A 23 ASN HBx 1.0 1.510 2.530 447 151 A 23 ASN HA A 23 ASN HBy 1.0 1.510 2.530 448 152 A 67 GLN HBx A 64 ALA HA 1.0 1.670 3.078 449 152 A 67 GLN HBy A 64 ALA HA 1.0 1.670 3.078 450 153 A 29 LEU HDy% A 12 VAL HB 1.0 1.885 4.191 451 153 A 62 LEU HDx% A 12 VAL HB 1.0 1.885 4.191 452 154 A 12 VAL HGy% A 12 VAL HB 1.0 1.452 2.360 453 154 A 12 VAL HGx% A 12 VAL HB 1.0 1.452 2.360 454 155 B 107 ASN HBy B 107 ASN HA 1.0 1.583 2.765 455 155 B 97 ASN HBx B 97 ASN HA 1.0 1.583 2.765 456 156 B 80 ALA HB% A 35 ARG HA 1.0 1.776 3.546 457 156 B 81 GLN HA B 80 ALA HB% 1.0 1.776 3.546 458 157 B 103 PRO HBy B 104 PRO HDx 1.0 1.852 3.972 459 157 B 103 PRO HBy B 103 PRO HDx 1.0 1.852 3.972 460 158 B 96 ARG HA B 96 ARG HBy 1.0 1.446 2.344 461 158 A 70 ARG HA A 70 ARG HBx 1.0 1.446 2.344 462 159 B 79 VAL HG21 B 82 ARG HBy 1.0 1.547 2.645 463 159 B 79 VAL HG21 A 68 GLU HBy 1.0 1.547 2.645 464 160 A 66 ARG HDx A 66 ARG HGy 1.0 1.398 2.214 465 160 A 35 ARG HGy A 35 ARG HDx 1.0 1.398 2.214 466 160 A 35 ARG HGy A 35 ARG HDy 1.0 1.398 2.214 467 161 A 66 ARG HA A 66 ARG HGx 1.0 1.559 2.687 468 161 A 30 ARG HA A 30 ARG HGx 1.0 1.559 2.687 469 162 A 51 LEU HDx% A 51 LEU HBy 1.0 1.689 3.157 470 162 A 43 LEU HBy A 43 LEU HD11 1.0 1.689 3.157 471 163 A 30 ARG HA A 25 LEU HD11 1.0 1.649 2.999 472 163 A 30 ARG HA A 25 LEU HD21 1.0 1.649 2.999 473 164 A 56 ILE HG21 A 29 LEU HDy% 1.0 1.860 4.024 474 164 A 62 LEU HDx% A 56 ILE HG21 1.0 1.860 4.024 475 165 A 65 VAL HGy% A 29 LEU HA 1.0 1.978 5.188 476 165 A 29 LEU HA A 32 LEU HDy% 1.0 1.978 5.188 477 166 B 79 VAL HG21 A 68 GLU HGx 1.0 1.798 3.662 478 166 B 79 VAL HG21 A 68 GLU HGy 1.0 1.798 3.662 479 167 B 86 HIS HBx B 83 LEU HD11 1.0 1.857 4.001 480 167 B 86 HIS HBy B 83 LEU HD11 1.0 1.857 4.001 481 168 A 12 VAL HGx% A 62 LEU HDx% 1.0 1.563 2.695 482 168 A 12 VAL HGx% A 29 LEU HDy% 1.0 1.563 2.695 483 169 B 76 LEU HA B 76 LEU HBx 1.0 1.642 2.974 484 169 B 76 LEU HA B 76 LEU HBy 1.0 1.642 2.974 485 170 A 68 GLU HGy B 79 VAL HG11 1.0 1.861 4.033 486 170 A 68 GLU HGx B 79 VAL HG11 1.0 1.861 4.033 487 171 A 7 LYS HDy A 7 LYS HEx 1.0 1.724 3.302 488 171 A 7 LYS HDx A 7 LYS HEx 1.0 1.724 3.302 489 172 A 32 LEU HDy% B 84 MET HE% 1.0 1.956 4.856 490 172 B 84 MET HE% B 76 LEU HDx% 1.0 1.956 4.856 491 173 A 47 GLU HGy B 92 ILE HA 1.0 1.602 2.830 492 173 A 47 GLU HA A 47 GLU HGy 1.0 1.602 2.830 493 174 B 92 ILE HA A 47 GLU HGx 1.0 1.575 2.739 494 174 A 47 GLU HA A 47 GLU HGx 1.0 1.575 2.739 495 175 A 63 GLU HGy A 63 GLU HBy 1.0 1.315 2.003 496 175 A 63 GLU HBx A 63 GLU HGy 1.0 1.315 2.003 497 175 A 63 GLU HGx A 63 GLU HBx 1.0 1.315 2.003 498 176 B 101 HIS HBx B 101 HIS HA 1.0 1.386 2.182 499 176 B 101 HIS HBy B 101 HIS HA 1.0 1.386 2.182 500 176 A 8 HIS HBx A 8 HIS HA 1.0 1.386 2.182 501 177 A 7 LYS HA A 7 LYS HDy 1.0 1.953 4.819 502 177 A 7 LYS HA A 7 LYS HDx 1.0 1.953 4.819 503 178 A 7 LYS HA A 7 LYS HBy 1.0 1.609 2.855 504 178 A 7 LYS HA A 7 LYS HBx 1.0 1.609 2.855 505 179 B 94 PRO HDx B 93 GLN HGx 1.0 1.951 4.803 506 179 B 94 PRO HDx B 93 GLN HGy 1.0 1.951 4.803 507 180 B 83 LEU HD11 A 55 PHE HDx 1.0 1.959 4.891 508 180 B 83 LEU HD11 A 55 PHE HDy 1.0 1.959 4.891 509 181 A 55 PHE HEx B 79 VAL HG11 1.0 1.989 5.415 510 181 A 55 PHE HEy B 79 VAL HG11 1.0 1.989 5.415 511 182 A 55 PHE HEx B 79 VAL HG21 1.0 1.921 4.493 512 182 A 55 PHE HEy B 79 VAL HG21 1.0 1.921 4.493 513 183 B 83 LEU HD21 A 33 PHE HDx 1.0 1.986 5.354 514 183 B 83 LEU HD21 A 33 PHE HDy 1.0 1.986 5.354 515 184 B 83 LEU HD21 A 33 PHE HEy 1.0 1.982 6.788 516 184 B 83 LEU HD21 A 33 PHE HEx 1.0 1.982 6.788 517 185 A 55 PHE HZ B 82 ARG HGy 1.0 1.985 6.715 518 185 A 55 PHE HZ B 82 ARG HBx 1.0 1.985 6.715 519 186 A 36 ALA HA B 83 LEU HBx 1.0 1.969 7.037 520 187 B 92 ILE HG21 A 48 THR HA 1.0 1.903 4.333 521 187 A 48 THR HA B 92 ILE HD1% 1.0 1.903 4.333 522 188 B 87 LEU HDx% A 52 ILE HA 1.0 1.943 4.709 523 188 B 87 LEU HDy% A 52 ILE HA 1.0 1.943 4.709 524 189 B 87 LEU HDx% A 52 ILE HG13 1.0 1.902 4.330 525 189 B 87 LEU HDy% A 52 ILE HG13 1.0 1.902 4.330 526 190 B 80 ALA HB% A 35 ARG HDx 1.0 1.905 4.353 527 190 B 80 ALA HB% A 35 ARG HDy 1.0 1.905 4.353 528 191 B 87 LEU HDx% A 51 LEU HBy 1.0 1.897 4.291 529 192 A 52 ILE HG12 B 87 LEU HDy% 1.0 1.918 4.462 530 193 A 38 ILE HG13 B 87 LEU HDy% 1.0 1.996 5.640 531 194 B 87 LEU HDy% A 38 ILE HG12 1.0 1.932 4.596 532 195 B 83 LEU HD21 A 32 LEU HG 1.0 1.860 4.024 533 195 A 38 ILE HG13 B 83 LEU HD21 1.0 1.860 4.024 534 196 A 51 LEU HDx% B 87 LEU HDx% 1.0 1.732 3.340 535 197 B 79 VAL HG21 A 65 VAL HGy% 1.0 1.662 3.046 536 198 B 79 VAL HB A 65 VAL HGy% 1.0 1.923 4.513 537 198 B 79 VAL HB A 32 LEU HDy% 1.0 1.923 4.513 538 199 B 87 LEU HDx% A 51 LEU HDy% 1.0 1.923 4.511 539 200 A 51 LEU HDy% B 92 ILE HD1% 1.0 1.980 5.214 540 201 B 87 LEU HDx% A 51 LEU HBx 1.0 1.857 4.001 541 202 A 38 ILE HD1% B 87 LEU HDy% 1.0 1.657 3.033 542 203 B 86 HIS HBx A 55 PHE HDx 1.0 1.999 6.221 543 203 B 86 HIS HBy A 55 PHE HDx 1.0 1.999 6.221 544 203 B 86 HIS HBy A 55 PHE HDy 1.0 1.999 6.221 545 204 B 87 LEU HDy% A 52 ILE HD1% 1.0 1.733 3.341 546 205 B 87 LEU HDx% A 48 THR HG2% 1.0 1.721 3.293 547 205 A 48 THR HG2% B 87 LEU HDy% 1.0 1.721 3.293 548 206 A 55 PHE HEy B 82 ARG HBx 1.0 1.989 5.421 549 206 A 55 PHE HEy B 82 ARG HGy 1.0 1.989 5.421 550 206 A 55 PHE HEx B 82 ARG HGy 1.0 1.989 5.421 551 206 A 55 PHE HEx B 82 ARG HBx 1.0 1.989 5.421 552 207 A 55 PHE HZ B 82 ARG HBy 1.0 1.999 5.913 553 208 A 55 PHE HEy B 79 VAL HB 1.0 1.903 7.859 554 208 A 55 PHE HEy B 82 ARG HBy 1.0 1.903 7.859 555 208 A 55 PHE HEx B 82 ARG HBy 1.0 1.903 7.859 556 209 B 92 ILE HG21 A 48 THR HB 1.0 1.994 6.428 557 210 B 83 LEU HD11 A 55 PHE HEx 1.0 1.817 8.599 558 210 B 83 LEU HD11 A 55 PHE HEy 1.0 1.817 8.599 559 211 A 55 PHE HEy B 83 LEU HBx 1.0 1.998 5.710 560 211 A 55 PHE HEx B 83 LEU HBx 1.0 1.998 5.710 561 212 B 96 ARG HA A 37 GLY HAy 1.0 1.953 7.271 562 212 A 37 GLY HAy B 94 PRO HA 1.0 1.953 7.271 563 213 B 86 HIS HD2 A 55 PHE HDy 1.0 1.889 7.997 564 213 B 86 HIS HD2 A 55 PHE HDx 1.0 1.889 7.997 565 214 A 20 PHE HBy A 15 ASP H 1.0 1.940 7.446 566 214 A 16 PRO HDx A 15 ASP H 1.0 1.940 7.446 567 215 A 14 TRP HE1 A 53 TYR H 1.0 2.000 6.062 568 215 A 14 TRP HE1 A 49 SER H 1.0 2.000 6.062 569 216 A 49 SER HA A 14 TRP HE1 1.0 1.812 3.738 570 216 A 14 TRP HE1 A 19 GLY HAy 1.0 1.812 3.738 571 217 A 26 ASP H A 27 PRO HDx 1.0 1.999 6.019 572 217 A 22 VAL HA A 26 ASP H 1.0 1.999 6.019 573 218 A 68 GLU HGx A 72 GLN H 1.0 1.914 4.434 574 218 A 68 GLU HGy A 72 GLN H 1.0 1.914 4.434 575 219 A 72 GLN H A 68 GLU HBx 1.0 1.924 4.518 576 219 A 68 GLU HBy A 72 GLN H 1.0 1.924 4.518 577 220 B 92 ILE HG12 B 93 GLN H 1.0 1.998 6.236 578 220 A 48 THR HG2% B 93 GLN H 1.0 1.998 6.236 579 221 B 76 LEU HBx B 76 LEU H 1.0 1.724 3.302 580 221 B 76 LEU HBy B 76 LEU H 1.0 1.724 3.302 581 222 B 76 LEU HDx% B 76 LEU H 1.0 1.970 5.060 582 222 B 76 LEU H B 76 LEU HDy% 1.0 1.970 5.060 583 223 B 93 GLN HGx B 93 GLN H 1.0 1.868 4.076 584 223 B 93 GLN HGy B 93 GLN H 1.0 1.868 4.076 585 224 B 101 HIS HBx B 102 ILE H 1.0 1.986 5.346 586 224 B 101 HIS HBy B 102 ILE H 1.0 1.986 5.346 587 225 B 88 ALA HA B 88 ALA H 1.0 1.676 3.102 588 225 B 88 ALA H B 85 GLN HA 1.0 1.676 3.102 589 225 B 82 ARG HA B 83 LEU H 1.0 1.676 3.102 590 226 B 82 ARG HBy B 83 LEU H 1.0 1.777 3.553 591 226 B 88 ALA H B 89 GLU HBy 1.0 1.777 3.553 592 226 B 83 LEU H B 84 MET HBx 1.0 1.777 3.553 593 227 B 88 ALA H B 87 LEU HBy 1.0 1.666 3.064 594 227 B 83 LEU HBy B 83 LEU H 1.0 1.666 3.064 595 228 A 32 LEU HDx% B 83 LEU H 1.0 1.789 3.611 596 228 B 87 LEU HDx% B 88 ALA H 1.0 1.789 3.611 597 228 B 87 LEU HDy% B 88 ALA H 1.0 1.789 3.611 598 229 A 35 ARG HDx A 32 LEU H 1.0 1.888 8.006 599 229 A 32 LEU H A 33 PHE HBy 1.0 1.888 8.006 600 230 A 43 LEU HA A 45 ASP H 1.0 1.877 4.137 601 230 A 42 GLN HA A 45 ASP H 1.0 1.877 4.137 602 231 A 45 ASP H A 41 ALA HB% 1.0 1.955 4.843 603 231 A 44 THR HG2% A 45 ASP H 1.0 1.955 4.843 604 232 B 82 ARG HBy B 80 ALA H 1.0 1.956 4.854 605 232 B 79 VAL HB B 80 ALA H 1.0 1.956 4.854 606 233 A 35 ARG HBy B 80 ALA H 1.0 1.994 5.550 607 233 B 83 LEU HBy B 80 ALA H 1.0 1.994 5.550 608 234 A 35 ARG H A 33 PHE HA 1.0 1.657 3.027 609 234 B 77 PRO HA B 78 ASP H 1.0 1.657 3.027 610 235 A 35 ARG HDx A 35 ARG H 1.0 1.912 4.410 611 235 A 35 ARG HDy A 35 ARG H 1.0 1.912 4.410 612 235 A 33 PHE HBy A 35 ARG H 1.0 1.912 4.410 613 236 A 35 ARG HBy A 35 ARG H 1.0 1.628 2.924 614 236 A 35 ARG HBx A 35 ARG H 1.0 1.628 2.924 615 237 B 78 ASP H B 76 LEU HG 1.0 1.804 3.690 616 237 A 35 ARG H A 35 ARG HGx 1.0 1.804 3.690 617 237 A 32 LEU HBy A 35 ARG H 1.0 1.804 3.690 618 238 B 92 ILE H B 91 GLY HAy 1.0 1.694 3.174 619 238 B 88 ALA HA B 92 ILE H 1.0 1.694 3.174 620 239 A 51 LEU HDx% B 92 ILE H 1.0 1.805 3.695 621 239 B 92 ILE HG21 B 92 ILE H 1.0 1.805 3.695 622 240 A 53 TYR H A 54 ASP HA 1.0 2.000 5.964 623 240 A 49 SER HA A 53 TYR H 1.0 2.000 5.964 624 241 A 51 LEU HDx% A 53 TYR H 1.0 1.953 4.821 625 241 B 87 LEU HDx% A 53 TYR H 1.0 1.953 4.821 626 241 A 52 ILE HG12 A 53 TYR H 1.0 1.953 4.821 627 242 A 51 LEU HDy% A 53 TYR H 1.0 1.999 6.117 628 242 A 52 ILE HD1% A 53 TYR H 1.0 1.999 6.117 629 243 A 58 ASP H A 60 GLY H 1.0 1.978 5.180 630 243 A 58 ASP H A 55 PHE H 1.0 1.978 5.180 631 244 A 64 ALA HA A 64 ALA H 1.0 1.774 3.540 632 244 A 63 GLU HA A 64 ALA H 1.0 1.774 3.540 633 245 A 63 GLU HGx A 64 ALA H 1.0 1.952 4.806 634 245 A 25 LEU H A 24 ASN HBx 1.0 1.952 4.806 635 246 A 62 LEU HDy% A 64 ALA H 1.0 1.853 3.977 636 246 A 65 VAL HGy% A 64 ALA H 1.0 1.853 3.977 637 247 A 38 ILE HG21 A 38 ILE H 1.0 1.791 3.625 638 247 A 38 ILE HD1% A 38 ILE H 1.0 1.791 3.625 639 248 A 40 GLU HA A 40 GLU H 1.0 1.880 4.162 640 248 A 40 GLU H A 39 SER HBx 1.0 1.880 4.162 641 249 A 40 GLU HBx A 40 GLU H 1.0 1.818 3.772 642 249 A 40 GLU HBy A 40 GLU H 1.0 1.818 3.772 643 250 B 86 HIS HBy B 86 HIS H 1.0 1.595 2.803 644 250 B 86 HIS HBx B 86 HIS H 1.0 1.595 2.803 645 251 B 89 GLU HGy B 86 HIS H 1.0 1.894 4.262 646 251 B 86 HIS H B 85 GLN HGx 1.0 1.894 4.262 647 252 B 87 LEU HDy% B 86 HIS H 1.0 1.980 5.234 648 252 B 87 LEU HDx% B 86 HIS H 1.0 1.980 5.234 649 253 A 71 ARG HA A 71 ARG H 1.0 1.756 3.448 650 253 A 70 ARG HA A 71 ARG H 1.0 1.756 3.448 651 254 A 12 VAL HGx% A 12 VAL H 1.0 1.879 4.155 652 254 A 12 VAL HGy% A 12 VAL H 1.0 1.879 4.155 653 255 B 83 LEU HD11 A 55 PHE H 1.0 2.000 6.066 654 255 A 51 LEU HDy% A 55 PHE H 1.0 2.000 6.066 655 256 B 86 HIS HE1 A 55 PHE H 1.0 1.921 4.495 656 256 A 55 PHE H A 57 GLU H 1.0 1.921 4.495 657 257 B 85 GLN H B 85 GLN HBx 1.0 1.553 2.667 658 257 B 84 MET HBx B 85 GLN H 1.0 1.553 2.667 659 258 A 36 ALA HB% B 85 GLN H 1.0 1.933 4.605 660 258 B 85 GLN H B 88 ALA HB% 1.0 1.933 4.605 661 259 A 40 GLU HA A 41 ALA H 1.0 1.866 4.060 662 259 A 39 SER HBx A 41 ALA H 1.0 1.866 4.060 663 260 A 12 VAL HGy% A 57 GLU H 1.0 1.993 5.537 664 260 A 56 ILE HG12 A 57 GLU H 1.0 1.993 5.537 665 260 A 12 VAL HGx% A 57 GLU H 1.0 1.993 5.537 666 261 A 55 PHE H A 56 ILE HG13 1.0 1.958 4.886 667 261 A 52 ILE HB A 55 PHE H 1.0 1.958 4.886 668 262 B 87 LEU HDx% A 55 PHE H 1.0 1.999 5.845 669 262 A 52 ILE HG12 A 55 PHE H 1.0 1.999 5.845 670 262 A 56 ILE HG21 A 55 PHE H 1.0 1.999 5.845 671 262 A 51 LEU HDx% A 55 PHE H 1.0 1.999 5.845 672 263 A 62 LEU HG A 62 LEU H 1.0 1.744 3.392 673 263 A 62 LEU H A 62 LEU HBx 1.0 1.744 3.392 674 264 A 12 VAL HGy% A 62 LEU H 1.0 1.999 5.795 675 264 A 12 VAL HGx% A 62 LEU H 1.0 1.999 5.795 676 265 A 21 ASP H A 14 TRP H 1.0 1.940 4.670 677 265 B 89 GLU H B 91 GLY H 1.0 1.940 4.670 678 266 A 21 ASP H A 21 ASP HBy 1.0 1.682 3.128 679 266 A 20 PHE HBy A 21 ASP H 1.0 1.682 3.128 680 267 A 25 LEU HD11 A 21 ASP H 1.0 1.973 5.089 681 267 A 29 LEU HDy% A 21 ASP H 1.0 1.973 5.089 682 268 A 55 PHE H A 52 ILE H 1.0 1.866 4.066 683 268 A 52 ILE H A 50 LYS H 1.0 1.866 4.066 684 269 A 52 ILE HG13 A 52 ILE H 1.0 1.614 2.870 685 269 A 51 LEU HBy A 52 ILE H 1.0 1.614 2.870 686 270 A 44 THR HG2% A 52 ILE H 1.0 1.997 6.329 687 270 A 43 LEU HBx A 52 ILE H 1.0 1.997 6.329 688 270 A 38 ILE HG13 A 52 ILE H 1.0 1.997 6.329 689 271 A 66 ARG HDy A 28 ASP H 1.0 2.000 6.004 690 271 B 86 HIS HBx B 82 ARG H 1.0 2.000 6.004 691 271 B 82 ARG H B 82 ARG HDx 1.0 2.000 6.004 692 272 B 82 ARG H B 82 ARG HGx 1.0 1.795 3.643 693 272 B 76 LEU HBy B 82 ARG H 1.0 1.795 3.643 694 273 B 79 VAL HA B 82 ARG H 1.0 1.772 3.526 695 273 A 27 PRO HDx A 28 ASP H 1.0 1.772 3.526 696 274 A 29 LEU HG A 28 ASP H 1.0 1.851 3.967 697 274 B 80 ALA HB% B 82 ARG H 1.0 1.851 3.967 698 275 A 32 LEU HDy% B 82 ARG H 1.0 1.885 4.197 699 275 B 83 LEU HBx B 82 ARG H 1.0 1.885 4.197 700 275 A 29 LEU HDy% A 28 ASP H 1.0 1.885 4.197 701 275 B 76 LEU HDy% B 82 ARG H 1.0 1.885 4.197 702 276 A 35 ARG HDx A 36 ALA H 1.0 1.998 6.240 703 276 A 33 PHE HBy A 36 ALA H 1.0 1.998 6.240 704 276 A 36 ALA H A 33 PHE HBx 1.0 1.998 6.240 705 277 A 36 ALA HA A 36 ALA H 1.0 1.791 3.619 706 277 A 33 PHE HA A 36 ALA H 1.0 1.791 3.619 707 278 A 35 ARG HA A 36 ALA H 1.0 1.746 3.406 708 278 A 37 GLY HAy A 36 ALA H 1.0 1.746 3.406 709 279 A 66 ARG HBx A 65 VAL H 1.0 1.897 4.285 710 279 A 66 ARG HGy A 65 VAL H 1.0 1.897 4.285 711 279 A 65 VAL H A 62 LEU HBy 1.0 1.897 4.285 712 280 A 68 GLU HBy A 68 GLU H 1.0 1.565 2.703 713 280 A 67 GLN HBx A 68 GLU H 1.0 1.565 2.703 714 281 A 68 GLU H A 71 ARG HBx 1.0 1.854 3.986 715 281 A 68 GLU H A 66 ARG HBy 1.0 1.854 3.986 716 282 A 28 ASP H A 27 PRO HBy 1.0 1.657 3.031 717 282 A 28 ASP H A 26 ASP HBx 1.0 1.657 3.031 718 283 A 42 GLN HA B 96 ARG H 1.0 1.996 5.674 719 283 A 37 GLY HAy B 96 ARG H 1.0 1.996 5.674 720 284 A 32 LEU HDy% B 81 GLN H 1.0 1.964 4.968 721 284 B 76 LEU HDy% B 81 GLN H 1.0 1.964 4.968 722 285 B 86 HIS HBx B 87 LEU H 1.0 1.764 3.492 723 285 B 86 HIS HBy B 87 LEU H 1.0 1.764 3.492 724 286 B 83 LEU HD11 B 84 MET H 1.0 1.956 4.858 725 286 B 83 LEU HD11 B 87 LEU H 1.0 1.956 4.858 726 287 A 48 THR H A 47 GLU HBx 1.0 1.754 3.442 727 287 A 48 THR H A 47 GLU HBy 1.0 1.754 3.442 728 288 A 30 ARG H A 31 SER H 1.0 1.700 3.198 729 288 A 30 ARG H A 29 LEU H 1.0 1.700 3.198 730 289 A 30 ARG H A 29 LEU HBx 1.0 1.838 3.886 731 289 A 25 LEU HD11 A 30 ARG H 1.0 1.838 3.886 732 290 A 70 ARG HA A 70 ARG H 1.0 1.760 3.468 733 290 A 70 ARG H A 69 MET HA 1.0 1.760 3.468 734 291 A 70 ARG HDy A 70 ARG H 1.0 1.998 5.782 735 291 A 70 ARG HDx A 70 ARG H 1.0 1.998 5.782 736 292 A 70 ARG H A 69 MET HBx 1.0 1.779 3.563 737 292 A 70 ARG H A 69 MET HBy 1.0 1.779 3.563 738 293 A 70 ARG H A 71 ARG HBy 1.0 1.738 3.366 739 293 A 70 ARG H A 70 ARG HBy 1.0 1.738 3.366 740 294 A 72 GLN H A 70 ARG H 1.0 1.918 4.464 741 294 A 70 ARG H A 67 GLN H 1.0 1.918 4.464 742 295 A 23 ASN HBx A 23 ASN H 1.0 1.668 3.074 743 295 A 23 ASN HBy A 23 ASN H 1.0 1.668 3.074 744 296 A 69 MET HBx A 69 MET H 1.0 1.618 2.888 745 296 A 69 MET HBy A 69 MET H 1.0 1.618 2.888 746 296 A 68 GLU HBy A 69 MET H 1.0 1.618 2.888 747 297 A 25 LEU HD11 A 24 ASN H 1.0 1.982 5.256 748 297 A 22 VAL HGy% A 24 ASN H 1.0 1.982 5.256 749 298 A 43 LEU HBy A 42 GLN H 1.0 1.964 4.970 750 298 A 40 GLU HBx A 42 GLN H 1.0 1.964 4.970 751 298 A 40 GLU HBy A 42 GLN H 1.0 1.964 4.970 752 299 A 48 THR H A 51 LEU H 1.0 1.993 5.547 753 299 A 53 TYR H A 51 LEU H 1.0 1.993 5.547 754 299 A 49 SER H A 51 LEU H 1.0 1.993 5.547 755 300 A 51 LEU HDx% A 51 LEU H 1.0 1.880 4.160 756 300 B 87 LEU HDx% A 51 LEU H 1.0 1.880 4.160 757 301 A 59 GLN HA A 59 GLN HE2y 1.0 1.842 8.404 758 301 A 55 PHE HA A 59 GLN HE2y 1.0 1.842 8.404 759 302 A 59 GLN HE2x B 82 ARG HGy 1.0 1.955 7.253 760 302 A 59 GLN HE2x A 59 GLN HBy 1.0 1.955 7.253 761 303 A 18 ASN H A 19 GLY HAx 1.0 2.000 5.940 762 303 A 16 PRO HA A 18 ASN H 1.0 2.000 5.940 763 304 A 17 GLN HBx A 18 ASN H 1.0 1.796 3.652 764 304 A 17 GLN HBy A 18 ASN H 1.0 1.796 3.652 765 305 A 62 LEU HDy% A 63 GLU H 1.0 1.947 4.745 766 305 A 62 LEU HDx% A 63 GLU H 1.0 1.947 4.745 767 306 A 36 ALA HB% A 33 PHE H 1.0 1.764 3.484 768 306 A 33 PHE H A 32 LEU HBx 1.0 1.764 3.484 769 307 A 70 ARG HDx A 67 GLN H 1.0 1.957 7.223 770 307 A 66 ARG HDx A 67 GLN H 1.0 1.957 7.223 771 308 A 67 GLN HBx A 67 GLN H 1.0 1.659 3.039 772 308 A 67 GLN HBy A 67 GLN H 1.0 1.659 3.039 773 309 B 90 HIS H B 91 GLY HAx 1.0 1.902 4.324 774 309 B 87 LEU HA B 90 HIS H 1.0 1.902 4.324 775 310 B 88 ALA HB% B 90 HIS H 1.0 1.962 4.946 776 310 B 87 LEU HBx B 90 HIS H 1.0 1.962 4.946 777 311 A 51 LEU HDx% B 90 HIS H 1.0 1.966 4.986 778 311 B 87 LEU HDx% B 90 HIS H 1.0 1.966 4.986 779 312 A 17 GLN HGy A 17 GLN H 1.0 1.861 4.033 780 312 A 17 GLN HGx A 17 GLN H 1.0 1.861 4.033 781 313 A 17 GLN HBx A 17 GLN H 1.0 1.691 3.163 782 313 A 17 GLN HBy A 17 GLN H 1.0 1.691 3.163 783 314 A 17 GLN HBx A 18 ASN HD2x 1.0 1.996 6.338 784 314 A 17 GLN HBy A 18 ASN HD2x 1.0 1.996 6.338 785 315 A 43 LEU HA A 43 LEU H 1.0 1.809 3.719 786 315 A 42 GLN HA A 43 LEU H 1.0 1.809 3.719 787 316 A 45 ASP HBx A 43 LEU H 1.0 1.988 6.644 788 316 A 20 PHE HBx A 43 LEU H 1.0 1.988 6.644 789 317 A 43 LEU H A 42 GLN HBy 1.0 1.890 4.234 790 317 A 43 LEU H A 42 GLN HGy 1.0 1.890 4.234 791 318 A 42 GLN HGx A 43 LEU H 1.0 1.977 5.179 792 318 A 43 LEU H A 40 GLU HGy 1.0 1.977 5.179 793 319 A 43 LEU H A 43 LEU HG 1.0 1.742 3.384 794 319 A 43 LEU H A 42 GLN HBx 1.0 1.742 3.384 795 320 A 44 THR HG2% A 43 LEU H 1.0 1.813 3.739 796 320 A 43 LEU HBx A 43 LEU H 1.0 1.813 3.739 797 321 A 25 LEU HD11 A 43 LEU H 1.0 1.996 5.638 798 321 A 22 VAL HGy% A 43 LEU H 1.0 1.996 5.638 799 321 A 25 LEU HD21 A 43 LEU H 1.0 1.996 5.638 800 322 A 35 ARG H A 34 SER H 1.0 1.597 2.813 801 322 A 33 PHE H A 34 SER H 1.0 1.597 2.813 802 323 A 32 LEU H A 34 SER H 1.0 1.987 5.367 803 323 A 31 SER H A 34 SER H 1.0 1.987 5.367 804 324 A 35 ARG HBy A 34 SER H 1.0 1.969 5.027 805 324 A 35 ARG HBx A 34 SER H 1.0 1.969 5.027 806 324 A 35 ARG HGy A 34 SER H 1.0 1.969 5.027 807 325 A 32 LEU HBy A 34 SER H 1.0 1.966 4.990 808 325 A 34 SER H A 30 ARG HGy 1.0 1.966 4.990 809 326 A 34 SER H A 38 ILE HB 1.0 1.960 4.910 810 326 A 36 ALA HB% A 34 SER H 1.0 1.960 4.910 811 326 A 30 ARG HGx A 34 SER H 1.0 1.960 4.910 812 327 A 23 ASN HBx A 23 ASN HD2y 1.0 1.858 4.012 813 327 A 23 ASN HBy A 23 ASN HD2y 1.0 1.858 4.012 814 328 A 23 ASN HD2x A 23 ASN HBx 1.0 1.922 4.496 815 328 A 23 ASN HD2x A 23 ASN HBy 1.0 1.922 4.496 816 329 A 31 SER H A 31 SER HBy 1.0 1.679 3.119 817 329 A 31 SER H A 31 SER HBx 1.0 1.679 3.119 818 330 A 33 PHE HBy A 31 SER H 1.0 1.975 6.919 819 330 A 31 SER H A 30 ARG HDx 1.0 1.975 6.919 820 331 A 31 SER H A 29 LEU HBx 1.0 1.993 5.507 821 331 A 25 LEU HD11 A 31 SER H 1.0 1.993 5.507 822 332 B 91 GLY HAy B 93 GLN HE2y 1.0 2.000 6.024 823 332 A 47 GLU HA B 93 GLN HE2y 1.0 2.000 6.024 824 333 B 76 LEU HBx B 81 GLN HE2y 1.0 1.980 6.824 825 333 A 17 GLN HE2y A 46 ALA HB% 1.0 1.980 6.824 826 334 B 85 GLN HE2y B 85 GLN HBy 1.0 1.999 6.235 827 334 B 85 GLN HBx B 85 GLN HE2y 1.0 1.999 6.235 828 335 B 81 GLN HE2x B 81 GLN HGy 1.0 1.826 3.818 829 335 A 67 GLN HGy A 67 GLN HE2x 1.0 1.826 3.818 830 335 A 67 GLN HGx A 67 GLN HE2x 1.0 1.826 3.818 831 336 B 93 GLN HGy B 93 GLN HE2x 1.0 1.806 3.702 832 336 B 81 GLN HE2x B 81 GLN HGx 1.0 1.806 3.702 833 337 B 85 GLN HE2x B 85 GLN HBy 1.0 1.997 5.687 834 337 A 17 GLN HGx A 17 GLN HE2x 1.0 1.997 5.687 835 337 A 17 GLN HGy A 17 GLN HE2x 1.0 1.997 5.687 836 338 A 13 GLY HAx A 13 GLY H 1.0 1.756 3.450 837 338 A 5 GLY H A 5 GLY HAy 1.0 1.756 3.450 838 339 A 13 GLY H A 14 TRP HBx 1.0 2.000 5.926 839 339 A 12 VAL HB A 13 GLY H 1.0 2.000 5.926 840 340 A 12 VAL HGy% A 13 GLY H 1.0 1.957 4.873 841 340 A 12 VAL HGx% A 13 GLY H 1.0 1.957 4.873 842 341 B 92 ILE HG21 A 42 GLN HE2x 1.0 1.919 4.467 843 341 B 87 LEU HDy% A 42 GLN HE2x 1.0 1.919 4.467 844 342 B 95 ALA HB% A 42 GLN HE2x 1.0 1.981 6.801 845 342 A 38 ILE HG13 A 42 GLN HE2x 1.0 1.981 6.801 846 343 A 59 GLN HGy A 61 GLY H 1.0 1.990 5.442 847 343 A 61 GLY H A 57 GLU HBx 1.0 1.990 5.442 848 343 A 61 GLY H A 57 GLU HGx 1.0 1.990 5.442 849 344 A 62 LEU HDy% A 61 GLY H 1.0 1.974 5.118 850 344 A 65 VAL HGy% A 61 GLY H 1.0 1.974 5.118 851 345 A 19 GLY H A 18 ASN HBx 1.0 1.893 4.263 852 345 A 19 GLY H A 15 ASP HBy 1.0 1.893 4.263 853 346 A 17 GLN HBx A 19 GLY H 1.0 1.999 5.815 854 346 A 17 GLN HBy A 19 GLY H 1.0 1.999 5.815 855 347 A 46 ALA HB% A 19 GLY H 1.0 1.960 4.914 856 347 B 88 ALA HB% B 91 GLY H 1.0 1.960 4.914 857 347 B 87 LEU HBx B 91 GLY H 1.0 1.960 4.914 858 348 A 51 LEU HDx% B 91 GLY H 1.0 1.945 7.377 859 348 B 87 LEU HDx% B 91 GLY H 1.0 1.945 7.377 860 349 A 43 LEU HG A 44 THR H 1.0 1.990 5.452 861 349 A 42 GLN HBx A 44 THR H 1.0 1.990 5.452 862 350 A 25 LEU HD11 A 44 THR H 1.0 1.971 6.989 863 350 A 22 VAL HGy% A 44 THR H 1.0 1.971 6.989 864 351 A 38 ILE HG21 A 44 THR H 1.0 1.986 6.664 865 351 A 43 LEU HD11 A 44 THR H 1.0 1.986 6.664 866 352 A 33 PHE HBy A 37 GLY H 1.0 1.970 7.016 867 352 A 33 PHE HBx A 37 GLY H 1.0 1.970 7.016 868 353 A 38 ILE HG21 A 37 GLY H 1.0 1.976 6.908 869 353 A 38 ILE HD1% A 37 GLY H 1.0 1.976 6.908 870 354 A 60 GLY H A 60 GLY HAy 1.0 1.749 3.419 871 354 A 60 GLY H A 58 ASP HA 1.0 1.749 3.419 872 355 A 59 GLN HGy A 60 GLY H 1.0 1.997 5.699 873 355 A 60 GLY H A 57 GLU HBx 1.0 1.997 5.699 874 355 A 60 GLY H A 57 GLU HGx 1.0 1.997 5.699 875 356 A 45 ASP H A 45 ASP HA 1.0 1.766 3.498 876 356 A 45 ASP H A 44 THR HA 1.0 1.766 3.498 877 357 A 9 VAL HGx% A 10 SER H 1.0 1.944 4.716 878 357 A 9 VAL HGy% A 10 SER H 1.0 1.944 4.716 879 358 A 64 ALA HA A 67 GLN H 1.0 1.901 4.323 880 358 A 63 GLU HA A 67 GLN H 1.0 1.901 4.323 881 359 A 23 ASN HBx A 24 ASN H 1.0 1.901 4.323 882 359 A 23 ASN HBy A 24 ASN H 1.0 1.901 4.323 883 360 A 32 LEU HDy% A 35 ARG H 1.0 2.000 6.084 884 360 B 76 LEU HDx% B 78 ASP H 1.0 2.000 6.084 885 360 B 76 LEU HDy% B 78 ASP H 1.0 2.000 6.084 886 361 A 9 VAL HGx% A 12 VAL H 1.0 1.937 7.481 887 361 A 62 LEU HDy% A 12 VAL H 1.0 1.937 7.481 888 362 B 87 LEU HDx% B 89 GLU H 1.0 1.937 7.481 889 362 A 51 LEU HDx% B 89 GLU H 1.0 1.937 7.481 890 362 B 87 LEU HDy% B 89 GLU H 1.0 1.937 7.481 891 363 A 30 ARG HA A 29 LEU H 1.0 1.995 6.395 892 363 A 27 PRO HDx A 29 LEU H 1.0 1.995 6.395 893 364 A 56 ILE HG12 A 55 PHE H 1.0 1.794 8.778 894 364 A 51 LEU HBx A 55 PHE H 1.0 1.794 8.778 895 365 B 90 HIS HA B 89 GLU H 1.0 1.921 4.495 896 365 B 86 HIS HA B 89 GLU H 1.0 1.921 4.495 897 366 B 92 ILE HA A 48 THR H 1.0 1.956 4.854 898 366 A 47 GLU HA A 48 THR H 1.0 1.956 4.854 899 367 A 51 LEU HDx% A 48 THR H 1.0 1.937 7.481 900 367 B 87 LEU HDx% A 48 THR H 1.0 1.937 7.481 901 368 A 49 SER H A 52 ILE H 1.0 1.937 7.481 902 368 A 20 PHE HDy A 49 SER H 1.0 1.937 7.481 903 368 A 20 PHE HDx A 49 SER H 1.0 1.937 7.481 904 369 A 17 GLN HGx A 18 ASN HD2x 1.0 1.724 9.248 905 369 A 17 GLN HGy A 18 ASN HD2x 1.0 1.724 9.248 906 370 B 108 TRP H B 107 ASN HBx 1.0 1.937 7.481 907 370 B 107 ASN HBy B 108 TRP H 1.0 1.937 7.481 908 371 B 90 HIS HE1 B 90 HIS HA 1.0 1.966 7.076 909 372 B 90 HIS HE1 B 89 GLU HGx 1.0 1.963 7.135 910 373 B 90 HIS HE1 B 89 GLU HBx 1.0 1.990 6.590 911 374 B 90 HIS HE1 A 51 LEU HDx% 1.0 1.999 6.153 912 375 B 90 HIS HE1 A 51 LEU HDy% 1.0 1.959 4.889 913 376 B 86 HIS HE1 A 55 PHE HDy 1.0 1.994 6.466 914 376 B 86 HIS HE1 A 55 PHE HDx 1.0 1.994 6.466 915 377 B 86 HIS HE1 B 86 HIS HA 1.0 1.679 9.523 916 378 B 86 HIS HE1 A 51 LEU HA 1.0 1.964 7.106 917 379 B 86 HIS HE1 A 55 PHE HA 1.0 1.981 6.791 918 380 B 86 HIS HE1 A 54 ASP HBy 1.0 1.949 7.327 919 381 B 86 HIS HE1 A 54 ASP HBx 1.0 1.996 6.374 920 382 A 55 PHE HBx B 86 HIS HE1 1.0 1.983 6.749 921 383 B 86 HIS HE1 A 51 LEU HBy 1.0 1.615 9.897 922 384 B 86 HIS HE1 A 51 LEU HG 1.0 1.503 10.485 923 385 B 86 HIS HE1 A 51 LEU HBx 1.0 1.911 7.775 924 386 B 86 HIS HE1 A 51 LEU HDy% 1.0 1.963 4.949 925 387 B 101 HIS HE1 B 99 ALA HB% 1.0 0.985 12.715 926 388 A 20 PHE HDy A 33 PHE HDy 1.0 1.927 7.605 927 388 A 20 PHE HDy A 33 PHE HDx 1.0 1.927 7.605 928 388 A 20 PHE HDx A 33 PHE HDy 1.0 1.927 7.605 929 388 A 20 PHE HDx A 33 PHE HDx 1.0 1.927 7.605 930 389 A 20 PHE HDy A 53 TYR HEx 1.0 1.832 8.484 931 389 A 20 PHE HDy A 53 TYR HEy 1.0 1.832 8.484 932 389 A 20 PHE HDx A 53 TYR HEy 1.0 1.832 8.484 933 389 A 20 PHE HDx A 53 TYR HEx 1.0 1.832 8.484 934 390 A 20 PHE HDy A 33 PHE HEy 1.0 1.990 5.438 935 390 A 20 PHE HDy A 33 PHE HEx 1.0 1.990 5.438 936 390 A 20 PHE HDx A 33 PHE HEy 1.0 1.990 5.438 937 390 A 20 PHE HDx A 33 PHE HEx 1.0 1.990 5.438 938 391 A 20 PHE HDy A 33 PHE HZ 1.0 1.994 6.450 939 391 A 20 PHE HDx A 33 PHE HZ 1.0 1.994 6.450 940 392 A 20 PHE HDy A 14 TRP HD1 1.0 1.977 5.157 941 392 A 20 PHE HDx A 14 TRP HD1 1.0 1.977 5.157 942 393 A 20 PHE HDy A 49 SER HBy 1.0 1.991 5.489 943 393 A 20 PHE HDx A 49 SER HBy 1.0 1.991 5.489 944 394 A 20 PHE HDy A 25 LEU HA 1.0 1.938 7.466 945 394 A 20 PHE HDx A 25 LEU HA 1.0 1.938 7.466 946 395 A 20 PHE HDy A 14 TRP HA 1.0 1.987 6.657 947 395 A 20 PHE HDx A 14 TRP HA 1.0 1.987 6.657 948 396 A 13 GLY HAy A 20 PHE HDy 1.0 1.980 6.820 949 396 A 13 GLY HAy A 20 PHE HDx 1.0 1.980 6.820 950 397 A 20 PHE HDy A 49 SER HA 1.0 1.820 3.780 951 397 A 20 PHE HDx A 49 SER HA 1.0 1.820 3.780 952 398 A 20 PHE HDy A 43 LEU HA 1.0 1.800 3.668 953 398 A 20 PHE HDx A 43 LEU HA 1.0 1.800 3.668 954 399 A 20 PHE HDy A 19 GLY HAx 1.0 1.730 9.204 955 399 A 20 PHE HDx A 19 GLY HAx 1.0 1.730 9.204 956 400 A 20 PHE HDy A 14 TRP HBy 1.0 1.997 5.687 957 400 A 20 PHE HDx A 14 TRP HBy 1.0 1.997 5.687 958 401 A 20 PHE HDy A 12 VAL HB 1.0 1.997 6.293 959 401 A 20 PHE HDx A 12 VAL HB 1.0 1.997 6.293 960 402 A 20 PHE HDx A 29 LEU HDy% 1.0 1.776 3.544 961 402 A 20 PHE HDy A 29 LEU HDy% 1.0 1.776 3.544 962 403 A 20 PHE HDx A 52 ILE HG21 1.0 1.937 4.639 963 403 A 20 PHE HDy A 52 ILE HG21 1.0 1.937 4.639 964 404 A 20 PHE HDy A 52 ILE HD1% 1.0 1.975 5.117 965 404 A 20 PHE HDx A 52 ILE HD1% 1.0 1.975 5.117 966 405 B 108 TRP HE3 B 108 TRP HA 1.0 1.998 6.268 967 406 A 20 PHE HEy A 33 PHE HDy 1.0 1.979 6.827 968 406 A 20 PHE HEy A 33 PHE HDx 1.0 1.979 6.827 969 406 A 20 PHE HEx A 33 PHE HDy 1.0 1.979 6.827 970 406 A 20 PHE HEx A 33 PHE HDx 1.0 1.979 6.827 971 407 A 20 PHE HEy A 55 PHE HDy 1.0 1.468 10.660 972 407 A 20 PHE HEy A 55 PHE HDx 1.0 1.468 10.660 973 407 A 20 PHE HEx A 55 PHE HDy 1.0 1.468 10.660 974 407 A 20 PHE HEx A 55 PHE HDx 1.0 1.468 10.660 975 408 A 20 PHE HEy A 33 PHE HEx 1.0 1.962 4.938 976 408 A 20 PHE HEy A 33 PHE HEy 1.0 1.962 4.938 977 408 A 20 PHE HEx A 33 PHE HEy 1.0 1.962 4.938 978 408 A 20 PHE HEx A 33 PHE HEx 1.0 1.962 4.938 979 409 A 53 TYR HDx A 20 PHE HEy 1.0 1.941 4.685 980 409 A 53 TYR HDy A 20 PHE HEy 1.0 1.941 4.685 981 409 A 53 TYR HDy A 20 PHE HEx 1.0 1.941 4.685 982 409 A 53 TYR HDx A 20 PHE HEx 1.0 1.941 4.685 983 410 A 20 PHE HEy A 33 PHE HZ 1.0 1.952 4.808 984 410 A 20 PHE HEx A 33 PHE HZ 1.0 1.952 4.808 985 411 A 20 PHE HEy A 14 TRP HD1 1.0 1.992 5.516 986 411 A 20 PHE HEx A 14 TRP HD1 1.0 1.992 5.516 987 412 A 20 PHE HEy A 14 TRP HA 1.0 1.842 8.402 988 412 A 20 PHE HEx A 14 TRP HA 1.0 1.842 8.402 989 413 A 20 PHE HEy A 43 LEU HA 1.0 1.966 4.992 990 413 A 20 PHE HEx A 43 LEU HA 1.0 1.966 4.992 991 414 A 53 TYR HA A 20 PHE HEy 1.0 1.950 4.788 992 414 A 53 TYR HA A 20 PHE HEx 1.0 1.950 4.788 993 415 A 50 LYS HA A 20 PHE HEy 1.0 1.928 7.598 994 415 A 50 LYS HA A 20 PHE HEx 1.0 1.928 7.598 995 416 A 20 PHE HEy A 14 TRP HBy 1.0 1.999 5.811 996 416 A 20 PHE HEx A 14 TRP HBy 1.0 1.999 5.811 997 417 A 20 PHE HEy A 12 VAL HB 1.0 1.955 4.843 998 417 A 20 PHE HEx A 12 VAL HB 1.0 1.955 4.843 999 418 A 53 TYR HBx A 20 PHE HEy 1.0 1.958 4.880 1000 418 A 53 TYR HBx A 20 PHE HEx 1.0 1.958 4.880 1001 419 A 56 ILE HD1% A 20 PHE HEy 1.0 1.814 3.748 1002 419 A 56 ILE HD1% A 20 PHE HEx 1.0 1.814 3.748 1003 420 A 20 PHE HEy A 29 LEU HDy% 1.0 1.815 3.755 1004 420 A 20 PHE HEx A 29 LEU HDy% 1.0 1.815 3.755 1005 421 A 20 PHE HEy A 52 ILE HG21 1.0 1.690 3.158 1006 421 A 20 PHE HEx A 52 ILE HG21 1.0 1.690 3.158 1007 422 A 20 PHE HEy A 52 ILE HD1% 1.0 1.847 3.937 1008 422 A 20 PHE HEx A 52 ILE HD1% 1.0 1.847 3.937 1009 423 A 20 PHE HEy B 83 LEU HD11 1.0 1.962 7.132 1010 423 A 20 PHE HEx B 83 LEU HD11 1.0 1.962 7.132 1011 424 A 20 PHE HEx A 43 LEU HD21 1.0 1.909 4.391 1012 424 A 20 PHE HEy A 43 LEU HD21 1.0 1.909 4.391 1013 425 A 6 PHE HEy A 6 PHE HBy 1.0 1.996 6.372 1014 425 A 6 PHE HEx A 6 PHE HBy 1.0 1.996 6.372 1015 426 B 108 TRP HA B 108 TRP HD1 1.0 1.960 7.178 1016 427 B 108 TRP HD1 B 108 TRP HBy 1.0 1.995 6.385 1017 428 B 108 TRP HD1 B 108 TRP HBx 1.0 1.995 5.615 1018 429 A 6 PHE HDx A 5 GLY HAx 1.0 0.551 14.259 1019 430 A 6 PHE HDy A 11 HIS HA 1.0 0.833 13.277 1020 431 A 6 PHE HDx A 6 PHE HA 1.0 1.589 10.041 1021 432 A 6 PHE HDy A 7 LYS HA 1.0 1.847 8.367 1022 432 A 6 PHE HDx A 7 LYS HA 1.0 1.847 8.367 1023 433 A 6 PHE HDy A 5 GLY HAx 1.0 1.984 6.748 1024 433 A 6 PHE HDx A 5 GLY HAx 1.0 1.984 6.748 1025 434 A 50 LYS HA A 14 TRP HZ2 1.0 1.782 3.576 1026 435 A 14 TRP HZ2 A 16 PRO HA 1.0 1.771 3.523 1027 436 A 50 LYS HGx A 14 TRP HZ2 1.0 1.903 4.339 1028 437 A 55 PHE HZ A 33 PHE HEy 1.0 1.963 7.125 1029 437 A 55 PHE HZ A 33 PHE HEx 1.0 1.963 7.125 1030 438 A 11 HIS HD2 A 14 TRP HZ3 1.0 1.936 7.498 1031 439 A 55 PHE HZ B 80 ALA HA 1.0 1.995 6.403 1032 440 A 55 PHE HZ B 79 VAL HA 1.0 1.894 4.262 1033 441 A 55 PHE HZ B 82 ARG HDy 1.0 1.997 5.721 1034 442 A 55 PHE HZ B 83 LEU HA 1.0 1.943 4.707 1035 443 A 55 PHE HZ B 82 ARG HGx 1.0 1.886 4.206 1036 444 A 55 PHE HZ B 79 VAL HG21 1.0 1.749 3.419 1037 445 A 55 PHE HZ B 79 VAL HG11 1.0 1.834 3.858 1038 446 B 90 HIS HD2 B 87 LEU HA 1.0 1.878 4.144 1039 447 A 8 HIS HD2 A 8 HIS HA 1.0 1.752 9.062 1040 448 A 9 VAL HA A 8 HIS HD2 1.0 1.869 8.181 1041 449 A 10 SER HBx A 8 HIS HD2 1.0 1.960 7.180 1042 450 A 20 PHE HZ A 33 PHE HEy 1.0 1.933 4.609 1043 450 A 20 PHE HZ A 33 PHE HEx 1.0 1.933 4.609 1044 451 A 53 TYR HDy A 20 PHE HZ 1.0 1.893 4.257 1045 451 A 53 TYR HDx A 20 PHE HZ 1.0 1.893 4.257 1046 452 A 20 PHE HZ A 33 PHE HZ 1.0 1.919 4.473 1047 453 A 20 PHE HZ A 14 TRP HD1 1.0 1.848 8.358 1048 454 A 56 ILE HD1% A 20 PHE HZ 1.0 1.783 3.585 1049 455 A 20 PHE HZ A 52 ILE HG21 1.0 1.711 3.249 1050 456 A 20 PHE HZ A 52 ILE HD1% 1.0 1.988 5.394 1051 457 A 20 PHE HZ A 43 LEU HD21 1.0 1.934 7.524 1052 458 B 101 HIS HD2 B 102 ILE HA 1.0 1.878 8.100 1053 459 B 101 HIS HD2 B 99 ALA HB% 1.0 0.252 15.228 1054 460 A 55 PHE HEy A 33 PHE HZ 1.0 1.754 9.052 1055 460 A 55 PHE HEx A 33 PHE HZ 1.0 1.754 9.052 1056 461 A 59 GLN HE2x A 55 PHE HEy 1.0 1.999 6.225 1057 461 A 59 GLN HE2x A 55 PHE HEx 1.0 1.999 6.225 1058 462 B 82 ARG HA A 55 PHE HEy 1.0 1.989 5.411 1059 462 B 82 ARG HA A 55 PHE HEx 1.0 1.989 5.411 1060 463 A 55 PHE HA A 55 PHE HEy 1.0 1.978 5.182 1061 463 A 55 PHE HA A 55 PHE HEx 1.0 1.978 5.182 1062 464 A 55 PHE HEy B 79 VAL HA 1.0 1.969 5.031 1063 464 A 55 PHE HEx B 79 VAL HA 1.0 1.969 5.031 1064 465 A 55 PHE HEy B 82 ARG HDy 1.0 1.997 5.703 1065 465 A 55 PHE HEx B 82 ARG HDy 1.0 1.997 5.703 1066 466 A 55 PHE HEy A 56 ILE HA 1.0 1.873 4.117 1067 466 A 55 PHE HEx A 56 ILE HA 1.0 1.873 4.117 1068 467 A 55 PHE HEy B 83 LEU HA 1.0 1.817 3.765 1069 467 A 55 PHE HEx B 83 LEU HA 1.0 1.817 3.765 1070 468 A 32 LEU HG A 55 PHE HEy 1.0 1.999 5.787 1071 468 A 32 LEU HG A 55 PHE HEx 1.0 1.999 5.787 1072 469 A 55 PHE HEy B 79 VAL HG21 1.0 1.690 3.158 1073 469 A 55 PHE HEx B 79 VAL HG21 1.0 1.690 3.158 1074 470 A 32 LEU HDx% A 55 PHE HEx 1.0 1.758 3.462 1075 470 A 32 LEU HDx% A 55 PHE HEy 1.0 1.758 3.462 1076 471 B 83 LEU HD11 A 55 PHE HEx 1.0 1.866 4.066 1077 471 B 83 LEU HD11 A 55 PHE HEy 1.0 1.866 4.066 1078 472 A 15 ASP HA A 14 TRP HH2 1.0 1.896 7.924 1079 473 A 50 LYS HA A 14 TRP HH2 1.0 1.975 5.135 1080 474 A 14 TRP HH2 A 16 PRO HDy 1.0 1.920 7.676 1081 475 A 14 TRP HH2 A 50 LYS HEy 1.0 1.936 4.624 1082 476 B 97 ASN HD2x B 97 ASN HBy 1.0 1.996 6.350 1083 477 A 50 LYS HGx A 14 TRP HH2 1.0 1.965 4.973 1084 478 A 30 ARG HA A 33 PHE HDy 1.0 1.840 3.898 1085 478 A 30 ARG HA A 33 PHE HDx 1.0 1.840 3.898 1086 479 A 33 PHE HDy A 52 ILE HD1% 1.0 1.812 3.738 1087 479 A 33 PHE HDx A 52 ILE HD1% 1.0 1.812 3.738 1088 480 A 36 ALA HB% A 33 PHE HDy 1.0 1.815 3.757 1089 480 A 36 ALA HB% A 33 PHE HDx 1.0 1.815 3.757 1090 481 A 33 PHE HDx B 79 VAL HG21 1.0 1.998 5.736 1091 481 A 33 PHE HDy B 79 VAL HG21 1.0 1.998 5.736 1092 482 A 25 LEU HD21 A 33 PHE HDx 1.0 1.597 2.813 1093 482 A 25 LEU HD21 A 33 PHE HDy 1.0 1.597 2.813 1094 483 A 33 PHE HDy A 25 LEU HD11 1.0 1.664 3.056 1095 483 A 33 PHE HDx A 25 LEU HD11 1.0 1.664 3.056 1096 484 B 83 LEU HD21 A 33 PHE HDx 1.0 1.586 2.772 1097 484 B 83 LEU HD21 A 33 PHE HDy 1.0 1.586 2.772 1098 485 A 32 LEU HDx% A 33 PHE HDy 1.0 1.708 3.238 1099 485 A 32 LEU HDx% A 33 PHE HDx 1.0 1.708 3.238 1100 486 A 43 LEU HD11 A 33 PHE HDx 1.0 1.638 2.958 1101 486 A 43 LEU HD11 A 33 PHE HDy 1.0 1.638 2.958 1102 487 A 38 ILE HD1% A 33 PHE HDx 1.0 1.678 3.112 1103 487 A 38 ILE HD1% A 33 PHE HDy 1.0 1.678 3.112 1104 488 B 83 LEU HD11 A 33 PHE HDx 1.0 1.928 4.556 1105 488 B 83 LEU HD11 A 33 PHE HDy 1.0 1.928 4.556 1106 489 A 33 PHE HDx A 43 LEU HD21 1.0 1.842 3.908 1107 489 A 33 PHE HDy A 43 LEU HD21 1.0 1.842 3.908 1108 490 B 86 HIS HA A 55 PHE HDy 1.0 1.799 8.739 1109 490 B 86 HIS HA A 55 PHE HDx 1.0 1.799 8.739 1110 491 A 55 PHE HA A 55 PHE HDy 1.0 1.707 3.229 1111 491 A 55 PHE HA A 55 PHE HDx 1.0 1.707 3.229 1112 492 A 55 PHE HDy B 83 LEU HA 1.0 1.868 4.080 1113 492 A 55 PHE HDx B 83 LEU HA 1.0 1.868 4.080 1114 493 A 55 PHE HDx A 52 ILE HG21 1.0 1.849 3.951 1115 493 A 55 PHE HDy A 52 ILE HG21 1.0 1.849 3.951 1116 494 B 83 LEU HD21 A 55 PHE HDy 1.0 1.728 3.320 1117 494 B 83 LEU HD21 A 55 PHE HDx 1.0 1.728 3.320 1118 495 B 83 LEU HD11 A 55 PHE HDy 1.0 1.745 3.397 1119 495 B 83 LEU HD11 A 55 PHE HDx 1.0 1.745 3.397 1120 496 A 56 ILE HD1% A 55 PHE HDx 1.0 1.780 3.564 1121 496 A 56 ILE HD1% A 55 PHE HDy 1.0 1.780 3.564 1122 497 A 53 TYR HEy A 14 TRP HD1 1.0 1.662 9.624 1123 497 A 53 TYR HEx A 14 TRP HD1 1.0 1.662 9.624 1124 498 A 53 TYR HEy A 54 ASP HA 1.0 1.998 5.814 1125 498 A 53 TYR HEx A 54 ASP HA 1.0 1.998 5.814 1126 499 A 53 TYR HA A 53 TYR HEy 1.0 1.953 4.819 1127 499 A 53 TYR HA A 53 TYR HEx 1.0 1.953 4.819 1128 500 A 33 PHE HEy A 33 PHE HA 1.0 1.918 4.464 1129 500 A 33 PHE HEx A 33 PHE HA 1.0 1.918 4.464 1130 501 A 33 PHE HEy A 29 LEU HDy% 1.0 1.613 2.867 1131 501 A 33 PHE HEx A 29 LEU HDy% 1.0 1.613 2.867 1132 502 A 33 PHE HEx A 52 ILE HG21 1.0 1.641 2.967 1133 502 A 33 PHE HEy A 52 ILE HG21 1.0 1.641 2.967 1134 503 B 83 LEU HD21 A 33 PHE HEy 1.0 1.698 3.192 1135 503 B 83 LEU HD21 A 33 PHE HEx 1.0 1.698 3.192 1136 504 A 32 LEU HDx% A 33 PHE HEx 1.0 1.710 3.242 1137 504 A 32 LEU HDx% A 33 PHE HEy 1.0 1.710 3.242 1138 505 A 43 LEU HD11 A 33 PHE HEy 1.0 1.775 3.541 1139 505 A 43 LEU HD11 A 33 PHE HEx 1.0 1.775 3.541 1140 506 A 33 PHE HEx A 52 ILE HD1% 1.0 1.874 4.116 1141 506 A 33 PHE HEy A 52 ILE HD1% 1.0 1.874 4.116 1142 507 B 83 LEU HD11 A 33 PHE HEx 1.0 1.951 4.795 1143 507 B 83 LEU HD11 A 33 PHE HEy 1.0 1.951 4.795 1144 508 A 33 PHE HEy A 43 LEU HD21 1.0 1.847 3.941 1145 508 A 33 PHE HEx A 43 LEU HD21 1.0 1.847 3.941 1146 509 A 14 TRP HE3 A 15 ASP HA 1.0 1.917 4.451 1147 510 A 53 TYR HDy A 54 ASP HA 1.0 1.930 4.576 1148 510 A 53 TYR HDx A 54 ASP HA 1.0 1.930 4.576 1149 511 A 53 TYR HDy A 50 LYS HA 1.0 1.914 4.426 1150 511 A 53 TYR HDx A 50 LYS HA 1.0 1.914 4.426 1151 512 A 12 VAL HGy% A 53 TYR HDy 1.0 1.745 3.399 1152 512 A 12 VAL HGy% A 53 TYR HDx 1.0 1.745 3.399 1153 513 A 53 TYR HDx A 56 ILE HD1% 1.0 1.889 4.227 1154 513 A 53 TYR HDy A 56 ILE HD1% 1.0 1.889 4.227 1155 514 A 53 TYR HDy A 56 ILE HG21 1.0 1.984 5.296 1156 514 A 53 TYR HDx A 56 ILE HG21 1.0 1.984 5.296 1157 515 A 53 TYR HDx A 29 LEU HDx% 1.0 1.941 7.439 1158 515 A 53 TYR HDy A 29 LEU HDx% 1.0 1.941 7.439 1159 516 A 14 TRP HE3 A 14 TRP HA 1.0 1.997 5.709 1160 517 A 53 TYR HDx A 52 ILE HG21 1.0 1.953 4.817 1161 517 A 53 TYR HDy A 52 ILE HG21 1.0 1.953 4.817 1162 518 A 56 ILE HD1% A 33 PHE HZ 1.0 1.714 3.260 1163 519 A 29 LEU HDy% A 33 PHE HZ 1.0 1.747 3.407 1164 520 A 33 PHE HZ A 52 ILE HG21 1.0 1.717 3.275 1165 521 A 29 LEU HDx% A 33 PHE HZ 1.0 1.775 3.543 1166 522 A 33 PHE HZ A 52 ILE HD1% 1.0 1.941 4.683 1167 523 B 83 LEU HD11 A 33 PHE HZ 1.0 2.000 5.972 1168 524 B 86 HIS HD2 A 52 ILE HG21 1.0 1.988 5.382 1169 525 B 86 HIS HD2 B 86 HIS HA 1.0 1.978 6.848 1170 526 A 51 LEU HA B 86 HIS HD2 1.0 1.989 6.621 1171 527 B 86 HIS HD2 B 87 LEU HA 1.0 1.981 5.235 1172 528 B 86 HIS HD2 B 83 LEU HA 1.0 1.983 5.285 1173 529 A 58 ASP HBy B 86 HIS HD2 1.0 1.863 8.231 1174 530 A 55 PHE HBx B 86 HIS HD2 1.0 1.857 3.999 1175 531 B 83 LEU HG B 86 HIS HD2 1.0 2.000 5.978 1176 532 B 86 HIS HD2 B 83 LEU HD11 1.0 1.783 3.585 1177 533 A 14 TRP HD1 A 52 ILE HG21 1.0 1.268 11.574 1178 534 A 14 TRP HD1 A 14 TRP HA 1.0 1.976 5.160 1179 535 A 14 TRP HD1 A 19 GLY HAy 1.0 1.889 4.223 1180 536 A 14 TRP HD1 A 20 PHE HBy 1.0 1.976 6.898 1181 537 A 14 TRP HBy A 14 TRP HD1 1.0 1.965 4.977 1182 538 A 14 TRP HD1 A 14 TRP HBx 1.0 1.923 4.507 1183 539 A 53 TYR HBx A 14 TRP HD1 1.0 1.983 6.749 1184 540 A 14 TRP HD1 A 43 LEU HD21 1.0 1.250 11.650 1185 541 A 6 PHE HDy A 6 PHE HBy 1.0 1.994 5.580 1186 541 A 6 PHE HDx A 6 PHE HBy 1.0 1.994 5.580 1187 542 A 6 PHE HEy A 6 PHE HBx 1.0 1.961 7.157 1188 542 A 6 PHE HEx A 6 PHE HBx 1.0 1.961 7.157 1189 543 A 50 LYS HGx A 53 TYR HDy 1.0 1.997 5.685 1190 543 A 50 LYS HGx A 53 TYR HDx 1.0 1.997 5.685 1191 544 A 33 PHE HZ A 43 LEU HD21 1.0 1.972 5.068 1192 545 A 14 TRP HD1 A 49 SER HBy 1.0 1.985 6.699 1193 546 A 14 TRP HD1 A 53 TYR HBy 1.0 1.997 6.343 1194 547 B 79 VAL HA B 79 VAL HB 1.0 1.481 2.443 1195 548 A 18 ASN HBx A 18 ASN HA 1.0 1.661 3.047 1196 549 A 14 TRP HBy A 14 TRP HA 1.0 1.976 5.154 1197 550 B 76 LEU HA B 76 LEU HDx% 1.0 1.623 2.907 1198 551 A 26 ASP HBx A 26 ASP HA 1.0 1.770 3.516 1199 552 B 99 ALA HB% B 99 ALA HA 1.0 1.407 2.237 1200 553 B 96 ARG HA B 96 ARG HBy 1.0 1.563 2.697 1201 554 B 93 GLN HA B 93 GLN HBy 1.0 1.621 2.897 1202 555 B 93 GLN HA B 93 GLN HBx 1.0 1.775 3.543 1203 556 A 11 HIS HA A 11 HIS HBx 1.0 1.649 2.997 1204 557 A 24 ASN HA A 24 ASN HBy 1.0 1.573 2.731 1205 558 A 24 ASN HBx A 24 ASN HA 1.0 1.669 3.077 1206 559 A 21 ASP HBy A 21 ASP HA 1.0 1.706 3.228 1207 560 A 36 ALA HA B 84 MET HGy 1.0 1.968 5.012 1208 561 A 52 ILE HG12 A 52 ILE HG13 1.0 1.701 3.207 1209 562 A 36 ALA HB% A 36 ALA HA 1.0 1.467 2.403 1210 563 A 52 ILE HG12 A 52 ILE HG21 1.0 1.959 4.891 1211 564 A 38 ILE HG21 A 42 GLN HBy 1.0 1.761 3.475 1212 565 A 38 ILE HG21 A 42 GLN HBx 1.0 1.811 3.733 1213 566 A 52 ILE HG12 A 52 ILE HD1% 1.0 1.633 2.939 1214 567 B 90 HIS HBy B 90 HIS HBx 1.0 1.510 2.530 1215 568 A 42 GLN HBy A 42 GLN HBx 1.0 1.651 3.009 1216 569 A 15 ASP HA A 16 PRO HDy 1.0 1.632 2.936 1217 570 A 15 ASP HA A 15 ASP HBy 1.0 1.642 2.974 1218 571 B 102 ILE HA B 103 PRO HDy 1.0 1.563 2.697 1219 572 A 54 ASP HA A 57 GLU HBx 1.0 1.938 4.644 1220 573 A 56 ILE HD1% A 56 ILE HG12 1.0 1.582 2.762 1221 574 B 94 PRO HDy B 94 PRO HGx 1.0 1.679 3.115 1222 575 B 77 PRO HDx B 76 LEU HDx% 1.0 1.866 4.062 1223 576 B 103 PRO HA B 104 PRO HDy 1.0 1.583 2.765 1224 577 A 15 ASP HA A 16 PRO HDx 1.0 1.582 2.762 1225 578 B 106 PRO HDy B 105 ALA HA 1.0 1.609 2.851 1226 579 B 106 PRO HDx B 105 ALA HA 1.0 1.640 2.966 1227 580 A 16 PRO HDx A 16 PRO HDy 1.0 1.479 2.439 1228 581 A 16 PRO HDx A 15 ASP HBy 1.0 1.976 5.142 1229 582 B 82 ARG HGy B 82 ARG HDy 1.0 1.755 3.449 1230 583 B 82 ARG HGx B 82 ARG HDy 1.0 1.612 2.862 1231 584 A 50 LYS HEy A 50 LYS HDy 1.0 1.639 2.959 1232 585 A 50 LYS HDx A 50 LYS HEy 1.0 1.596 2.810 1233 586 B 106 PRO HDy B 105 ALA HB% 1.0 1.931 4.583 1234 587 B 106 PRO HDx B 105 ALA HB% 1.0 1.750 3.422 1235 588 B 94 PRO HDy B 94 PRO HGy 1.0 1.678 3.112 1236 589 A 38 ILE HG13 A 38 ILE HG12 1.0 1.491 2.473 1237 590 A 38 ILE HG12 A 38 ILE HB 1.0 1.870 4.092 1238 591 A 38 ILE HG13 A 38 ILE HB 1.0 1.811 3.729 1239 592 B 80 ALA HB% A 35 ARG HGy 1.0 1.970 5.062 1240 593 A 30 ARG HA A 30 ARG HGx 1.0 1.710 3.246 1241 594 B 76 LEU HDy% B 76 LEU HG 1.0 1.559 2.683 1242 595 B 76 LEU HDx% B 76 LEU HG 1.0 1.565 2.705 1243 596 A 62 LEU HDy% A 62 LEU HG 1.0 1.557 2.679 1244 597 B 104 PRO HGy B 104 PRO HA 1.0 1.849 3.949 1245 598 A 66 ARG HA A 66 ARG HGx 1.0 1.751 3.423 1246 599 A 63 GLU HA A 66 ARG HGx 1.0 1.914 4.428 1247 600 A 62 LEU HA A 62 LEU HG 1.0 1.781 3.571 1248 601 B 87 LEU HDy% B 87 LEU HG 1.0 1.536 2.610 1249 602 A 51 LEU HDy% A 51 LEU HG 1.0 1.569 2.715 1250 603 B 92 ILE HG21 B 92 ILE HG13 1.0 1.819 3.771 1251 604 B 102 ILE HG13 B 102 ILE HB 1.0 1.936 4.628 1252 605 A 51 LEU HDx% B 90 HIS HBy 1.0 1.890 4.234 1253 606 A 51 LEU HDx% B 90 HIS HBx 1.0 1.864 4.050 1254 607 A 51 LEU HDx% A 51 LEU HG 1.0 1.550 2.654 1255 608 A 29 LEU HG A 29 LEU HDy% 1.0 1.572 2.728 1256 609 A 51 LEU HDx% A 51 LEU HDy% 1.0 1.438 2.320 1257 610 A 29 LEU HG A 29 LEU HBx 1.0 1.922 4.502 1258 611 A 51 LEU HDx% A 51 LEU HA 1.0 1.954 4.824 1259 612 B 83 LEU HD21 B 80 ALA HA 1.0 1.904 4.340 1260 613 A 43 LEU HD11 A 43 LEU HD21 1.0 1.571 2.725 1261 614 A 43 LEU HBy A 43 LEU HD11 1.0 1.671 3.085 1262 615 A 43 LEU HBx A 43 LEU HD11 1.0 1.762 3.478 1263 616 A 43 LEU HD11 A 22 VAL HGx% 1.0 1.660 3.042 1264 617 A 62 LEU HDx% A 62 LEU HBy 1.0 1.490 2.470 1265 618 B 87 LEU HDy% A 52 ILE HG13 1.0 1.926 4.536 1266 619 A 32 LEU HG A 32 LEU HDx% 1.0 1.506 2.516 1267 620 A 25 LEU HD21 A 25 LEU HG 1.0 1.644 2.982 1268 621 A 25 LEU HD11 A 25 LEU HG 1.0 1.683 3.133 1269 622 A 25 LEU HD21 A 43 LEU HD21 1.0 1.980 5.226 1270 623 A 25 LEU HD11 A 43 LEU HD21 1.0 1.969 5.039 1271 624 A 44 THR HG2% A 44 THR HB 1.0 1.468 2.406 1272 625 A 65 VAL HGx% A 32 LEU HDx% 1.0 1.635 2.949 1273 626 A 25 LEU HD21 A 25 LEU HBy 1.0 1.685 3.141 1274 627 A 25 LEU HD21 A 25 LEU HBx 1.0 1.728 3.320 1275 628 A 32 LEU HDx% A 32 LEU HBx 1.0 1.681 3.125 1276 629 B 87 LEU HBx B 87 LEU HDy% 1.0 1.726 3.312 1277 630 A 30 ARG HA A 25 LEU HD21 1.0 1.834 3.864 1278 631 A 29 LEU HDy% A 29 LEU HA 1.0 1.859 4.019 1279 632 B 76 LEU HA B 76 LEU HDy% 1.0 1.823 3.797 1280 633 A 30 ARG HA A 25 LEU HD11 1.0 1.796 3.646 1281 634 A 50 LYS HGx A 50 LYS HEy 1.0 1.741 3.379 1282 635 A 48 THR HG2% A 48 THR HB 1.0 1.569 2.719 1283 636 A 45 ASP HBy A 48 THR HB 1.0 1.707 3.231 1284 637 B 77 PRO HDy B 76 LEU HDx% 1.0 1.911 4.403 1285 638 A 65 VAL HGy% A 59 GLN HBy 1.0 1.761 3.475 1286 639 A 51 LEU HDx% A 48 THR HA 1.0 1.787 3.605 1287 640 A 32 LEU HDx% A 32 LEU HDy% 1.0 1.414 2.254 1288 641 A 48 THR HA B 92 ILE HD1% 1.0 1.904 4.342 1289 642 A 51 LEU HDy% B 90 HIS HBx 1.0 1.935 4.627 1290 643 A 43 LEU HD21 A 43 LEU HG 1.0 1.689 3.157 1291 644 A 51 LEU HDy% A 51 LEU HBy 1.0 1.804 3.694 1292 645 A 43 LEU HBy A 43 LEU HD21 1.0 1.894 4.266 1293 646 B 87 LEU HDx% A 52 ILE HG13 1.0 1.875 4.125 1294 647 A 29 LEU HDx% A 29 LEU HG 1.0 1.613 2.867 1295 648 A 29 LEU HDx% A 29 LEU HDy% 1.0 1.351 2.093 1296 649 A 12 VAL HGx% A 29 LEU HDx% 1.0 1.784 3.586 1297 650 B 87 LEU HDx% A 51 LEU HBy 1.0 1.760 3.472 1298 651 A 29 LEU HDx% A 29 LEU HBy 1.0 1.732 3.340 1299 652 A 29 LEU HDx% A 29 LEU HBx 1.0 1.735 3.355 1300 653 B 87 LEU HDx% B 87 LEU HBy 1.0 1.808 3.714 1301 654 B 87 LEU HDx% B 87 LEU HBx 1.0 1.788 3.608 1302 655 B 87 LEU HDx% B 92 ILE HB 1.0 1.824 3.798 1303 656 A 65 VAL HB A 65 VAL HA 1.0 1.741 3.381 1304 657 A 48 THR HG2% A 42 GLN HBy 1.0 1.883 4.187 1305 658 A 68 GLU HBy A 65 VAL HA 1.0 1.654 3.018 1306 659 A 16 PRO HDy A 15 ASP HBy 1.0 1.779 3.561 1307 660 A 48 THR HG2% B 87 LEU HDy% 1.0 1.728 3.324 1308 661 A 48 THR HG2% A 48 THR HA 1.0 1.609 2.853 1309 662 A 65 VAL HGy% A 65 VAL HA 1.0 1.528 2.584 1310 663 A 60 GLY HAy A 60 GLY HAx 1.0 1.452 2.360 1311 664 A 65 VAL HGx% A 65 VAL HA 1.0 1.689 3.159 1312 665 A 48 THR HG2% A 52 ILE HD1% 1.0 1.640 2.968 1313 666 A 48 THR HG2% A 42 GLN HGx 1.0 1.825 3.807 1314 667 A 52 ILE HA A 52 ILE HG13 1.0 1.826 3.816 1315 668 B 83 LEU HG B 83 LEU HD11 1.0 1.586 2.774 1316 669 B 83 LEU HD21 B 83 LEU HD11 1.0 1.526 2.580 1317 670 A 25 LEU HG A 25 LEU HBy 1.0 1.738 3.368 1318 671 A 25 LEU HG A 25 LEU HBx 1.0 1.840 3.896 1319 672 B 79 VAL HA B 79 VAL HG21 1.0 1.545 2.637 1320 673 A 43 LEU HBy A 22 VAL HGx% 1.0 1.921 4.487 1321 674 B 95 ALA HB% A 39 SER HBx 1.0 1.642 2.974 1322 675 B 83 LEU HBy B 83 LEU HD11 1.0 1.812 3.738 1323 676 A 22 VAL HGx% A 40 GLU HGy 1.0 1.846 3.934 1324 677 A 22 VAL HGx% A 40 GLU HGx 1.0 1.887 4.215 1325 678 A 39 SER HBy A 39 SER HA 1.0 1.554 2.668 1326 679 A 39 SER HBx A 39 SER HA 1.0 1.618 2.888 1327 680 A 30 ARG HBy A 27 PRO HA 1.0 1.656 3.024 1328 681 A 30 ARG HBx A 27 PRO HA 1.0 1.767 3.499 1329 682 A 27 PRO HA A 27 PRO HGx 1.0 1.719 3.279 1330 683 A 12 VAL HGx% A 62 LEU HG 1.0 1.940 4.670 1331 684 A 61 GLY HAy A 61 GLY HAx 1.0 1.509 2.527 1332 685 A 26 ASP HA A 26 ASP HBy 1.0 1.661 3.045 1333 686 A 56 ILE HG12 A 56 ILE HA 1.0 1.812 3.740 1334 687 A 22 VAL HA A 25 LEU HG 1.0 1.721 3.289 1335 688 A 29 LEU HDy% A 26 ASP HBy 1.0 1.769 3.515 1336 689 A 29 LEU HDy% A 26 ASP HBx 1.0 1.759 3.461 1337 690 A 22 VAL HA A 25 LEU HD21 1.0 1.694 3.178 1338 691 A 65 VAL HGy% A 56 ILE HA 1.0 1.876 4.132 1339 692 A 22 VAL HA A 22 VAL HGx% 1.0 1.572 2.728 1340 693 A 22 VAL HA A 25 LEU HBx 1.0 1.914 4.428 1341 694 A 22 VAL HA A 25 LEU HBy 1.0 1.705 3.225 1342 695 A 26 ASP HBx A 26 ASP HBy 1.0 1.436 2.314 1343 696 A 56 ILE HG21 A 56 ILE HA 1.0 1.650 3.004 1344 697 A 51 LEU HBx A 51 LEU HDy% 1.0 1.709 3.241 1345 698 A 51 LEU HBx A 51 LEU HBy 1.0 1.503 2.511 1346 699 B 79 VAL HG11 A 68 GLU HBy 1.0 1.636 2.948 1347 700 A 50 LYS HGy A 50 LYS HEy 1.0 1.691 3.161 1348 701 A 43 LEU HBx A 43 LEU HD21 1.0 1.796 3.650 1349 702 A 43 LEU HBy A 43 LEU HBx 1.0 1.580 2.754 1350 703 A 40 GLU HA A 22 VAL HGy% 1.0 1.933 4.609 1351 704 A 22 VAL HGy% A 40 GLU HGy 1.0 1.852 3.972 1352 705 A 68 GLU HGx B 79 VAL HG11 1.0 1.761 3.475 1353 706 A 62 LEU HG A 62 LEU HBy 1.0 1.598 2.816 1354 707 A 36 ALA HB% B 84 MET HGx 1.0 1.936 4.632 1355 708 A 36 ALA HB% A 38 ILE HG12 1.0 1.854 3.982 1356 709 B 83 LEU HD21 A 36 ALA HB% 1.0 1.662 3.050 1357 710 A 4 SER HBy A 4 SER HA 1.0 1.592 2.794 1358 711 A 36 ALA HB% B 80 ALA HA 1.0 1.809 3.721 1359 712 B 94 PRO HA B 94 PRO HGy 1.0 1.895 4.267 1360 713 B 94 PRO HA B 94 PRO HGx 1.0 1.856 4.000 1361 714 B 94 PRO HA B 94 PRO HBx 1.0 1.794 3.640 1362 715 B 95 ALA HB% B 95 ALA HA 1.0 1.403 2.227 1363 716 B 83 LEU HD21 A 52 ILE HG21 1.0 1.768 3.508 1364 717 A 32 LEU HDx% A 32 LEU HBy 1.0 1.664 3.056 1365 718 A 43 LEU HD21 A 52 ILE HG21 1.0 1.819 3.771 1366 719 A 52 ILE HA A 52 ILE HG21 1.0 1.667 3.071 1367 720 B 83 LEU HD11 A 52 ILE HG21 1.0 1.735 3.355 1368 721 A 20 PHE HEy A 49 SER HA 1.0 1.795 3.641 1369 721 A 20 PHE HEx A 49 SER HA 1.0 1.795 3.641 1370 722 A 53 TYR HA A 20 PHE HZ 1.0 1.798 3.658 1371 723 A 52 ILE HB A 49 SER HA 1.0 1.828 3.830 1372 724 A 53 TYR HBx A 53 TYR HA 1.0 1.804 3.688 1373 725 A 53 TYR HA A 53 TYR HBy 1.0 1.758 3.462 1374 726 A 49 SER HA A 52 ILE HD1% 1.0 1.699 3.199 1375 727 A 53 TYR HA A 56 ILE HB 1.0 1.793 3.633 1376 728 A 53 TYR HA A 56 ILE HD1% 1.0 1.758 3.460 1377 729 A 56 ILE HD1% A 52 ILE HG21 1.0 1.722 3.298 1378 730 A 12 VAL HGx% A 12 VAL HA 1.0 1.486 2.458 1379 731 B 80 ALA HB% A 35 ARG HBy 1.0 1.633 2.939 1380 732 B 80 ALA HB% A 35 ARG HGx 1.0 1.826 3.816 1381 733 A 29 LEU HDy% A 29 LEU HBy 1.0 1.603 2.831 1382 734 B 80 ALA HB% A 32 LEU HDy% 1.0 1.503 2.511 1383 735 A 9 VAL HGy% A 9 VAL HA 1.0 1.509 2.525 1384 736 A 29 LEU HBy A 29 LEU HBx 1.0 1.493 2.479 1385 737 A 32 LEU HA B 80 ALA HB% 1.0 1.882 4.174 1386 738 A 47 GLU HGy A 46 ALA HB% 1.0 1.908 4.382 1387 739 A 17 GLN HA A 46 ALA HB% 1.0 1.692 3.168 1388 740 B 105 ALA HA B 105 ALA HB% 1.0 1.628 2.920 1389 741 B 83 LEU HBy B 83 LEU HD21 1.0 1.696 3.186 1390 742 B 87 LEU HDy% B 87 LEU HBy 1.0 1.681 3.125 1391 743 B 83 LEU HBy B 83 LEU HBx 1.0 1.584 2.766 1392 744 B 103 PRO HA B 103 PRO HBx 1.0 1.800 3.672 1393 745 B 103 PRO HA B 103 PRO HBy 1.0 1.662 3.046 1394 746 B 103 PRO HA B 104 PRO HDx 1.0 1.594 2.802 1395 747 A 38 ILE HG13 A 38 ILE HG21 1.0 1.778 3.554 1396 748 A 38 ILE HG21 A 38 ILE HG12 1.0 1.768 3.504 1397 749 B 92 ILE HG21 B 92 ILE HG12 1.0 1.638 2.960 1398 750 A 38 ILE HG21 A 43 LEU HD21 1.0 1.577 2.743 1399 751 A 38 ILE HG21 A 48 THR HG2% 1.0 1.921 4.493 1400 752 A 34 SER HA A 34 SER HBy 1.0 1.439 2.323 1401 753 A 55 PHE HA A 58 ASP HBy 1.0 1.700 3.204 1402 754 A 55 PHE HA A 58 ASP HBx 1.0 1.784 3.590 1403 755 B 92 ILE HG21 B 87 LEU HBx 1.0 1.861 4.035 1404 756 A 55 PHE HBx A 55 PHE HA 1.0 1.713 3.259 1405 757 A 55 PHE HA A 55 PHE HBy 1.0 1.876 4.132 1406 758 B 92 ILE HG21 B 92 ILE HB 1.0 1.529 2.587 1407 759 B 85 GLN HA B 88 ALA HB% 1.0 1.555 2.671 1408 760 B 107 ASN HA B 107 ASN HBx 1.0 1.640 2.968 1409 761 B 103 PRO HDy B 102 ILE HG21 1.0 1.947 4.749 1410 762 B 103 PRO HDx B 102 ILE HG21 1.0 1.811 3.731 1411 763 B 102 ILE HG12 B 102 ILE HG21 1.0 1.842 3.908 1412 764 B 102 ILE HG13 B 102 ILE HG21 1.0 1.768 3.506 1413 765 A 40 GLU HA A 43 LEU HD11 1.0 1.665 3.061 1414 766 A 40 GLU HA A 22 VAL HGx% 1.0 1.831 3.843 1415 767 A 40 GLU HA A 43 LEU HBy 1.0 1.822 3.790 1416 768 A 40 GLU HA A 40 GLU HGy 1.0 1.796 3.650 1417 769 B 102 ILE HA B 102 ILE HG21 1.0 1.720 3.286 1418 770 B 84 MET HE% A 36 ALA HA 1.0 1.789 3.611 1419 771 B 102 ILE HG12 B 102 ILE HB 1.0 1.740 3.376 1420 772 B 84 MET HE% B 76 LEU HDy% 1.0 1.905 4.349 1421 773 A 36 ALA HB% B 84 MET HE% 1.0 1.790 3.620 1422 774 A 52 ILE HB A 52 ILE HG21 1.0 1.636 2.950 1423 775 B 80 ALA HB% B 84 MET HE% 1.0 1.722 3.298 1424 776 A 38 ILE HG21 A 38 ILE HB 1.0 1.559 2.687 1425 777 B 102 ILE HB B 102 ILE HG21 1.0 1.618 2.888 1426 778 B 81 GLN HA B 84 MET HE% 1.0 1.691 3.163 1427 779 A 52 ILE HB A 52 ILE HD1% 1.0 1.730 3.332 1428 780 A 33 PHE HBx A 38 ILE HB 1.0 1.727 3.317 1429 781 B 102 ILE HA B 102 ILE HB 1.0 1.799 3.665 1430 782 B 102 ILE HB B 102 ILE HD1% 1.0 1.833 3.853 1431 783 A 56 ILE HG21 A 65 VAL HB 1.0 1.955 4.845 1432 784 B 82 ARG HA B 82 ARG HGx 1.0 1.686 3.144 1433 785 A 56 ILE HG21 A 56 ILE HG13 1.0 1.771 3.521 1434 786 A 56 ILE HG21 A 56 ILE HG12 1.0 1.757 3.453 1435 787 A 38 ILE HG13 A 38 ILE HA 1.0 1.850 3.954 1436 788 A 66 ARG HA A 66 ARG HGy 1.0 1.632 2.938 1437 789 B 92 ILE HG13 B 92 ILE HB 1.0 1.758 3.460 1438 790 A 32 LEU HDx% A 69 MET HE% 1.0 1.840 3.900 1439 791 A 55 PHE HBx A 55 PHE HDy 1.0 1.768 3.504 1440 791 A 55 PHE HBx A 55 PHE HDx 1.0 1.768 3.504 1441 792 A 56 ILE HG21 A 61 GLY HAx 1.0 1.794 3.638 1442 793 A 30 ARG HA A 30 ARG HDx 1.0 1.805 3.701 1443 794 B 79 VAL HG11 A 69 MET HE% 1.0 1.837 3.875 1444 795 A 56 ILE HG21 A 62 LEU HBx 1.0 1.881 4.167 1445 796 A 69 MET HE% A 31 SER HBy 1.0 1.653 3.013 1446 797 A 69 MET HE% A 32 LEU HBx 1.0 1.891 4.247 1447 798 A 55 PHE HBx A 55 PHE HBy 1.0 1.604 2.836 1448 799 A 66 ARG HA A 69 MET HE% 1.0 1.937 4.639 1449 800 A 32 LEU HA A 69 MET HE% 1.0 1.775 3.541 1450 801 A 56 ILE HG21 A 62 LEU HA 1.0 1.705 3.223 1451 802 A 69 MET HE% A 28 ASP HA 1.0 1.852 3.976 1452 803 A 69 MET HE% A 69 MET HA 1.0 1.870 4.088 1453 804 B 86 HIS HA B 89 GLU HBy 1.0 1.880 4.156 1454 805 A 38 ILE HG12 A 38 ILE HA 1.0 1.773 3.535 1455 806 B 92 ILE HG12 B 92 ILE HB 1.0 1.774 3.538 1456 807 A 29 LEU HDx% A 69 MET HE% 1.0 1.959 4.889 1457 808 A 65 VAL HGx% A 69 MET HE% 1.0 1.842 3.910 1458 809 A 38 ILE HG21 A 38 ILE HA 1.0 1.585 2.773 1459 810 A 38 ILE HB A 38 ILE HA 1.0 1.837 3.881 1460 811 B 92 ILE HA B 92 ILE HG13 1.0 1.712 3.254 1461 812 B 92 ILE HG12 B 92 ILE HA 1.0 1.771 3.521 1462 813 A 53 TYR HBx A 53 TYR HDy 1.0 1.751 3.425 1463 813 A 53 TYR HBx A 53 TYR HDx 1.0 1.751 3.425 1464 814 A 57 GLU HA A 61 GLY HAy 1.0 1.883 4.177 1465 815 A 57 GLU HA A 61 GLY HAx 1.0 1.825 3.807 1466 816 B 92 ILE HG21 B 92 ILE HA 1.0 1.574 2.736 1467 817 A 40 GLU HA A 40 GLU HGx 1.0 1.781 3.571 1468 818 B 92 ILE HA B 92 ILE HB 1.0 1.838 3.888 1469 819 A 50 LYS HA A 53 TYR HBy 1.0 1.775 3.541 1470 820 A 53 TYR HBx A 50 LYS HA 1.0 1.957 4.867 1471 821 A 57 GLU HA A 57 GLU HGy 1.0 1.836 3.876 1472 822 A 57 GLU HA A 57 GLU HGx 1.0 1.845 3.925 1473 823 A 42 GLN HA A 42 GLN HBx 1.0 1.728 3.324 1474 824 A 42 GLN HA A 42 GLN HBy 1.0 1.854 3.990 1475 825 A 50 LYS HGx A 50 LYS HA 1.0 1.777 3.553 1476 826 A 20 PHE HDy A 20 PHE HA 1.0 1.842 3.910 1477 826 A 20 PHE HDx A 20 PHE HA 1.0 1.842 3.910 1478 827 A 48 THR HG2% A 42 GLN HA 1.0 1.830 3.838 1479 828 A 63 GLU HA A 66 ARG HDx 1.0 1.617 2.883 1480 829 A 32 LEU HA A 32 LEU HG 1.0 1.884 4.188 1481 830 A 32 LEU HA A 32 LEU HDy% 1.0 1.532 2.598 1482 831 A 32 LEU HA A 32 LEU HBy 1.0 1.668 3.074 1483 832 A 32 LEU HA A 32 LEU HBx 1.0 1.711 3.249 1484 833 A 56 ILE HG21 A 56 ILE HB 1.0 1.579 2.749 1485 834 A 56 ILE HD1% A 56 ILE HB 1.0 1.680 3.120 1486 835 A 43 LEU HA A 52 ILE HD1% 1.0 1.905 4.345 1487 836 B 108 TRP HA B 108 TRP HBy 1.0 1.793 3.635 1488 837 A 52 ILE HG13 A 52 ILE HD1% 1.0 1.650 3.002 1489 838 B 103 PRO HDx B 102 ILE HA 1.0 1.618 2.888 1490 839 A 62 LEU HDx% A 62 LEU HA 1.0 1.825 3.811 1491 840 A 62 LEU HDy% A 62 LEU HA 1.0 1.528 2.586 1492 841 A 43 LEU HD21 A 52 ILE HD1% 1.0 1.605 2.841 1493 842 B 87 LEU HDx% B 87 LEU HA 1.0 1.533 2.601 1494 843 A 52 ILE HA A 52 ILE HD1% 1.0 1.846 3.936 1495 844 B 83 LEU HD11 A 52 ILE HD1% 1.0 1.924 4.514 1496 845 A 62 LEU HA A 62 LEU HBy 1.0 1.738 3.366 1497 846 A 62 LEU HA A 62 LEU HBx 1.0 1.722 3.292 1498 847 A 52 ILE HD1% A 52 ILE HG21 1.0 1.563 2.699 1499 848 B 87 LEU HA B 87 LEU HBy 1.0 1.860 4.024 1500 849 B 87 LEU HBx B 87 LEU HA 1.0 1.851 3.965 1501 850 B 102 ILE HA B 102 ILE HD1% 1.0 1.957 4.867 1502 851 A 42 GLN HGx A 42 GLN HBx 1.0 1.800 3.672 1503 852 A 56 ILE HD1% A 56 ILE HG13 1.0 1.645 2.985 1504 853 A 51 LEU HA A 51 LEU HDy% 1.0 1.535 2.607 1505 854 B 83 LEU HD11 B 83 LEU HA 1.0 1.570 2.718 1506 855 A 56 ILE HD1% A 56 ILE HA 1.0 1.817 3.765 1507 856 A 51 LEU HA A 51 LEU HBy 1.0 1.755 3.445 1508 857 A 51 LEU HA A 51 LEU HBx 1.0 1.683 3.129 1509 858 A 28 ASP HA A 28 ASP HBy 1.0 1.724 3.304 1510 859 A 28 ASP HA A 28 ASP HBx 1.0 1.664 3.054 1511 860 B 83 LEU HA B 83 LEU HBx 1.0 1.808 3.712 1512 861 A 51 LEU HA A 54 ASP HBy 1.0 1.920 4.478 1513 862 A 14 TRP HBx A 14 TRP HA 1.0 1.689 3.159 1514 863 A 33 PHE HDy A 33 PHE HA 1.0 1.661 3.047 1515 863 A 33 PHE HDx A 33 PHE HA 1.0 1.661 3.047 1516 864 B 79 VAL HG11 A 69 MET HA 1.0 1.875 4.129 1517 865 A 36 ALA HB% A 33 PHE HA 1.0 1.743 3.389 1518 866 A 20 PHE HA A 14 TRP HA 1.0 1.613 2.869 1519 867 A 57 GLU HBy A 54 ASP HA 1.0 1.762 3.476 1520 868 A 38 ILE HG13 A 38 ILE HD1% 1.0 1.600 2.820 1521 869 A 38 ILE HD1% A 38 ILE HG12 1.0 1.616 2.878 1522 870 A 38 ILE HD1% B 83 LEU HD11 1.0 1.882 4.172 1523 871 A 38 ILE HD1% A 36 ALA HB% 1.0 1.609 2.851 1524 872 A 54 ASP HA A 54 ASP HBy 1.0 1.753 3.433 1525 873 A 54 ASP HBx A 54 ASP HA 1.0 1.706 3.226 1526 874 A 38 ILE HD1% A 38 ILE HB 1.0 1.701 3.203 1527 875 A 38 ILE HD1% A 33 PHE HA 1.0 1.777 3.551 1528 876 A 71 ARG HA A 71 ARG HGx 1.0 1.456 2.370 1529 877 A 43 LEU HA A 43 LEU HD21 1.0 1.545 2.641 1530 878 A 29 LEU HDx% A 29 LEU HA 1.0 1.586 2.776 1531 879 B 95 ALA HB% A 39 SER HA 1.0 1.900 4.304 1532 880 A 46 ALA HB% A 46 ALA HA 1.0 1.432 2.304 1533 881 A 58 ASP HBy A 58 ASP HA 1.0 1.648 2.996 1534 882 A 29 LEU HA A 29 LEU HBx 1.0 1.729 3.325 1535 883 A 11 HIS HA A 11 HIS HBy 1.0 1.545 2.639 1536 884 B 90 HIS HA B 90 HIS HBy 1.0 1.681 3.125 1537 885 B 90 HIS HA B 90 HIS HBx 1.0 1.725 3.307 1538 886 B 102 ILE HG12 B 102 ILE HD1% 1.0 1.742 3.388 1539 887 A 51 LEU HDy% B 92 ILE HD1% 1.0 1.837 3.877 1540 888 A 12 VAL HGy% A 11 HIS HA 1.0 1.935 4.625 1541 889 A 43 LEU HBx A 43 LEU HA 1.0 1.843 3.913 1542 890 B 92 ILE HD1% B 92 ILE HB 1.0 1.703 3.217 1543 891 B 92 ILE HA B 92 ILE HD1% 1.0 1.678 3.110 1544 892 B 100 GLU HGy B 100 GLU HA 1.0 1.712 3.252 1545 893 A 7 LYS HA A 7 LYS HBy 1.0 1.610 2.858 1546 894 B 80 ALA HA A 32 LEU HDy% 1.0 1.583 2.765 1547 895 B 83 LEU HBy B 80 ALA HA 1.0 1.856 4.000 1548 896 B 88 ALA HA B 88 ALA HB% 1.0 1.404 2.228 1549 897 A 59 GLN HGx A 59 GLN HBx 1.0 1.807 3.709 1550 898 A 9 VAL HA A 9 VAL HB 1.0 1.666 3.062 1551 899 A 25 LEU HD21 A 25 LEU HA 1.0 1.551 2.661 1552 900 A 25 LEU HA A 25 LEU HBy 1.0 1.681 3.125 1553 901 A 25 LEU HBx A 25 LEU HA 1.0 1.672 3.086 1554 902 B 78 ASP HBy B 78 ASP HA 1.0 1.639 2.959 1555 903 B 78 ASP HA B 78 ASP HBx 1.0 1.643 2.975 1556 904 A 12 VAL HA A 12 VAL HB 1.0 1.626 2.912 1557 905 A 27 PRO HDx A 26 ASP HA 1.0 1.558 2.680 1558 906 A 15 ASP HA A 15 ASP HBx 1.0 1.691 3.165 1559 907 B 79 VAL HG21 A 65 VAL HA 1.0 1.738 3.368 1560 908 A 42 GLN HA A 42 GLN HGy 1.0 1.663 3.053 1561 909 B 87 LEU HBx B 87 LEU HG 1.0 1.855 3.991 1562 910 A 26 ASP HA A 27 PRO HDy 1.0 1.480 2.442 1563 911 A 65 VAL HGx% A 65 VAL HB 1.0 1.504 2.514 1564 912 B 97 ASN HA B 97 ASN HBy 1.0 1.518 2.556 1565 913 B 93 GLN HA B 94 PRO HDx 1.0 1.487 2.463 1566 914 A 48 THR HG2% A 42 GLN HBx 1.0 1.736 3.356 1567 915 A 30 ARG HA A 30 ARG HBx 1.0 1.487 2.461 1568 916 B 89 GLU HA B 89 GLU HBx 1.0 1.450 2.354 1569 917 A 56 ILE HG12 A 56 ILE HG13 1.0 1.524 2.572 1570 918 B 93 GLN HA B 94 PRO HDy 1.0 1.375 2.153 1571 919 B 82 ARG HGy B 82 ARG HDx 1.0 1.628 2.922 1572 920 A 32 LEU HG A 32 LEU HBy 1.0 1.772 3.528 1573 921 A 32 LEU HG A 32 LEU HBx 1.0 1.696 3.188 1574 922 A 35 ARG HGy A 35 ARG HA 1.0 1.504 2.512 1575 923 A 35 ARG HA A 35 ARG HGx 1.0 1.593 2.799 1576 924 B 76 LEU HA B 76 LEU HG 1.0 1.861 4.027 1577 925 B 87 LEU HDx% B 87 LEU HG 1.0 1.551 2.659 1578 926 A 51 LEU HDx% A 51 LEU HBy 1.0 1.587 2.779 1579 927 A 29 LEU HG A 29 LEU HBy 1.0 1.692 3.170 1580 928 B 83 LEU HD21 A 38 ILE HD1% 1.0 1.542 2.632 1581 929 B 102 ILE HG13 B 102 ILE HD1% 1.0 1.448 2.350 1582 930 A 43 LEU HD11 A 43 LEU HG 1.0 1.459 2.379 1583 931 A 32 LEU HDx% B 79 VAL HG11 1.0 1.614 2.872 1584 932 A 43 LEU HBy A 43 LEU HG 1.0 1.792 3.628 1585 933 A 32 LEU HA A 32 LEU HDx% 1.0 1.854 3.984 1586 934 B 83 LEU HD11 B 87 LEU HDy% 1.0 1.470 2.412 1587 935 A 25 LEU HD11 A 25 LEU HBy 1.0 1.613 2.867 1588 936 A 44 THR HA A 44 THR HB 1.0 1.564 2.700 1589 937 A 32 LEU HDx% A 29 LEU HA 1.0 1.848 3.946 1590 938 B 77 PRO HDx B 76 LEU HDy% 1.0 1.937 4.643 1591 939 A 22 VAL HA A 25 LEU HD11 1.0 1.693 3.169 1592 940 A 51 LEU HDy% B 90 HIS HBy 1.0 1.922 4.498 1593 941 B 87 LEU HDx% A 48 THR HG2% 1.0 1.598 2.816 1594 942 B 79 VAL HG21 B 79 VAL HB 1.0 1.366 2.130 1595 943 A 22 VAL HGx% A 22 VAL HB 1.0 1.409 2.243 1596 944 A 64 ALA HB% A 60 GLY HAy 1.0 1.753 3.437 1597 945 A 39 SER HBx A 39 SER HBy 1.0 1.354 2.100 1598 946 B 83 LEU HD11 A 52 ILE HA 1.0 1.732 3.340 1599 947 B 83 LEU HD11 A 55 PHE HBy 1.0 1.908 4.380 1600 948 A 55 PHE HBx B 83 LEU HD11 1.0 1.948 4.764 1601 949 A 45 ASP HBx A 48 THR HB 1.0 1.726 3.314 1602 950 A 44 THR HG2% A 44 THR HA 1.0 1.552 2.664 1603 951 A 22 VAL HA A 22 VAL HB 1.0 1.476 2.430 1604 952 A 71 ARG HDx A 68 GLU HA 1.0 1.639 2.963 1605 953 A 56 ILE HA A 56 ILE HB 1.0 1.858 4.008 1606 954 B 87 LEU HDx% A 51 LEU HBx 1.0 1.807 3.705 1607 955 A 44 THR HG2% A 22 VAL HGy% 1.0 1.582 2.760 1608 956 B 80 ALA HA B 79 VAL HG11 1.0 1.942 4.692 1609 957 A 62 LEU HDy% A 62 LEU HBy 1.0 1.732 3.342 1610 958 A 36 ALA HB% B 84 MET HGy 1.0 1.890 4.228 1611 959 B 94 PRO HA B 94 PRO HBy 1.0 1.627 2.921 1612 960 B 95 ALA HB% A 39 SER HBy 1.0 1.847 3.935 1613 961 B 77 PRO HA B 77 PRO HBy 1.0 1.687 3.145 1614 962 B 77 PRO HA B 77 PRO HBx 1.0 1.800 3.672 1615 963 B 106 PRO HA B 106 PRO HBy 1.0 1.702 3.210 1616 964 A 53 TYR HDy A 53 TYR HA 1.0 1.768 3.510 1617 964 A 53 TYR HDx A 53 TYR HA 1.0 1.768 3.510 1618 965 A 53 TYR HA A 52 ILE HG21 1.0 1.931 4.581 1619 966 A 69 MET HE% A 31 SER HBx 1.0 1.701 3.205 1620 967 A 31 SER HBy A 28 ASP HA 1.0 1.643 2.979 1621 968 A 31 SER HBx A 28 ASP HA 1.0 1.646 2.986 1622 969 B 80 ALA HB% A 36 ALA HA 1.0 1.557 2.675 1623 970 B 80 ALA HB% B 77 PRO HDx 1.0 1.878 4.146 1624 971 A 20 PHE HBy A 20 PHE HA 1.0 1.710 3.246 1625 972 B 87 LEU HBx A 47 GLU HGy 1.0 1.973 6.963 1626 973 A 18 ASN HA A 18 ASN HBy 1.0 1.487 2.463 1627 974 B 83 LEU HBy B 83 LEU HG 1.0 1.854 3.984 1628 975 A 64 ALA HB% A 60 GLY HAx 1.0 1.898 4.296 1629 976 B 83 LEU HD11 B 83 LEU HBx 1.0 1.875 4.125 1630 977 B 92 ILE HG21 A 48 THR HG2% 1.0 1.612 2.866 1631 978 B 92 ILE HG21 B 87 LEU HBy 1.0 1.862 4.034 1632 979 A 6 PHE HA A 6 PHE HBx 1.0 1.689 3.159 1633 980 A 6 PHE HBy A 6 PHE HA 1.0 1.583 2.765 1634 981 A 69 MET HE% A 32 LEU HDy% 1.0 1.681 3.123 1635 982 A 56 ILE HG21 A 61 GLY HAy 1.0 1.898 4.294 1636 983 B 84 MET HA B 87 LEU HDy% 1.0 1.700 3.200 1637 984 A 53 TYR HDy A 53 TYR HBy 1.0 1.756 3.448 1638 984 A 53 TYR HDx A 53 TYR HBy 1.0 1.756 3.448 1639 985 A 42 GLN HA A 45 ASP HBx 1.0 1.886 4.206 1640 986 B 87 LEU HA B 92 ILE HB 1.0 1.941 4.681 1641 987 B 108 TRP HA B 108 TRP HBx 1.0 1.770 3.520 1642 988 B 100 GLU HA B 100 GLU HGx 1.0 1.717 3.273 1643 989 A 67 GLN HA A 67 GLN HGx 1.0 1.669 3.077 1644 990 A 42 GLN HGy A 42 GLN HBy 1.0 1.785 3.589 1645 991 A 42 GLN HGy A 42 GLN HBx 1.0 1.862 4.040 1646 992 A 51 LEU HA A 51 LEU HG 1.0 1.712 3.254 1647 993 A 12 VAL HGx% A 56 ILE HD1% 1.0 1.857 4.003 1648 994 A 29 LEU HA A 32 LEU HBy 1.0 1.674 3.096 1649 995 A 58 ASP HA A 58 ASP HBx 1.0 1.602 2.828 1650 996 A 48 THR HG2% B 92 ILE HD1% 1.0 1.836 3.874 1651 997 B 80 ALA HB% B 80 ALA HA 1.0 1.325 2.029 1652 998 A 59 GLN HGx A 59 GLN HBy 1.0 1.744 3.392 1653 999 B 84 MET HA B 84 MET HBy 1.0 1.617 2.883 1654 1000 A 59 GLN HGx A 65 VAL HGy% 1.0 1.924 4.510 1655 1001 B 97 ASN HBx B 97 ASN HA 1.0 1.517 2.553 1656 1002 A 33 PHE HBy A 33 PHE HA 1.0 1.725 3.309 1657 1003 A 33 PHE HA A 33 PHE HBx 1.0 1.751 3.429 1658 1004 B 79 VAL HA B 79 VAL HG11 1.0 1.689 3.159 1659 1005 A 12 VAL HGx% A 20 PHE HEy 1.0 1.782 3.576 1660 1005 A 12 VAL HGx% A 20 PHE HEx 1.0 1.782 3.576 1661 1006 A 20 PHE HDx A 43 LEU HD21 1.0 1.785 3.593 1662 1006 A 20 PHE HDy A 43 LEU HD21 1.0 1.785 3.593 1663 1007 B 80 ALA HB% B 79 VAL HG11 1.0 1.798 3.658 1664 1008 A 55 PHE HZ B 79 VAL HG21 1.0 1.999 5.793 1665 1009 B 95 ALA HB% A 38 ILE HA 1.0 1.997 6.347 1666 1010 B 80 ALA HB% A 35 ARG HA 1.0 1.995 6.387 1667 1011 A 32 LEU HA B 80 ALA HB% 1.0 1.979 5.207 1668 1012 B 83 LEU HD21 A 33 PHE HA 1.0 1.998 5.820 1669 1013 B 79 VAL HG11 A 69 MET HA 1.0 1.960 4.912 1670 1014 B 95 ALA HB% A 39 SER HA 1.0 2.000 5.894 1671 1015 A 36 ALA HA B 84 MET HGx 1.0 1.965 4.985 1672 1016 B 84 MET HE% A 36 ALA HA 1.0 1.980 5.236 1673 1017 B 80 ALA HB% A 36 ALA HA 1.0 1.875 4.125 1674 1018 B 79 VAL HG21 A 65 VAL HA 1.0 1.988 5.400 1675 1019 B 79 VAL HG11 A 65 VAL HA 1.0 1.988 5.396 1676 1020 B 95 ALA HB% A 39 SER HBy 1.0 1.849 3.953 1677 1021 B 95 ALA HB% A 39 SER HBx 1.0 1.793 3.631 1678 1022 B 83 LEU HD11 A 52 ILE HA 1.0 1.849 3.957 1679 1023 B 95 ALA HB% A 42 GLN HGy 1.0 1.994 6.426 1680 1024 B 79 VAL HG11 A 69 MET HGy 1.0 1.997 5.681 1681 1025 B 79 VAL HG11 A 69 MET HGx 1.0 1.966 4.998 1682 1026 B 79 VAL HG21 A 68 GLU HBy 1.0 1.909 4.391 1683 1027 B 79 VAL HG11 A 68 GLU HBy 1.0 1.817 3.765 1684 1028 B 80 ALA HB% A 35 ARG HGy 1.0 1.991 5.473 1685 1029 B 79 VAL HG11 A 69 MET HE% 1.0 1.913 4.415 1686 1030 B 83 LEU HD11 A 55 PHE HBy 1.0 1.976 5.152 1687 1031 A 55 PHE HBx B 83 LEU HD11 1.0 2.000 6.142 1688 1032 A 51 LEU HDx% B 87 LEU HA 1.0 2.000 5.950 1689 1033 A 51 LEU HDx% B 90 HIS HBy 1.0 1.943 4.711 1690 1034 A 32 LEU HDx% B 80 ALA HA 1.0 1.999 5.835 1691 1035 B 80 ALA HA A 32 LEU HDy% 1.0 1.689 3.157 1692 1036 A 51 LEU HDy% B 90 HIS HBy 1.0 1.988 5.390 1693 1037 A 51 LEU HDy% B 87 LEU HA 1.0 1.994 5.580 1694 1038 B 90 HIS HD2 A 51 LEU HDy% 1.0 1.984 5.302 1695 1039 A 36 ALA HB% B 80 ALA HA 1.0 1.823 3.799 1696 1040 B 86 HIS HD2 A 52 ILE HA 1.0 1.996 5.616 1697 1041 B 86 HIS HD2 A 55 PHE HBy 1.0 2.000 5.858 1698 1042 A 59 GLN HGx B 79 VAL HG21 1.0 1.997 5.681 1699 1043 A 52 ILE HG12 B 83 LEU HD11 1.0 1.999 6.233 1700 1044 B 80 ALA HB% A 35 ARG HGx 1.0 1.958 4.882 1701 1045 A 51 LEU HDx% B 90 HIS HBx 1.0 1.933 4.603 1702 1046 A 51 LEU HDx% B 92 ILE HG13 1.0 1.994 6.440 1703 1047 A 51 LEU HDx% B 92 ILE HG12 1.0 1.993 5.535 1704 1048 A 32 LEU HDx% B 80 ALA HB% 1.0 1.975 5.125 1705 1049 A 32 LEU HDx% B 79 VAL HG21 1.0 1.920 4.476 1706 1050 A 32 LEU HDx% B 79 VAL HG11 1.0 1.804 3.694 1707 1051 B 83 LEU HBy A 32 LEU HDy% 1.0 1.982 5.268 1708 1052 B 80 ALA HB% A 32 LEU HDy% 1.0 1.701 3.203 1709 1053 A 51 LEU HDy% B 90 HIS HBx 1.0 1.996 5.640 1710 1054 B 92 ILE HG21 A 48 THR HG2% 1.0 1.634 2.944 1711 1055 A 65 VAL HGx% B 79 VAL HG21 1.0 1.818 3.766 1712 1056 A 65 VAL HGx% B 79 VAL HG11 1.0 1.788 3.608 1713 1057 A 36 ALA HB% B 83 LEU HD11 1.0 1.999 5.793 1714 1058 A 36 ALA HB% B 84 MET HGy 1.0 1.840 3.898 1715 1059 A 36 ALA HB% B 84 MET HGx 1.0 1.852 3.974 1716 1060 A 36 ALA HB% B 84 MET HBy 1.0 1.998 5.746 1717 1061 A 36 ALA HB% B 84 MET HE% 1.0 1.988 5.390 1718 1062 B 83 LEU HBy A 36 ALA HB% 1.0 1.932 4.594 1719 1063 A 36 ALA HB% B 83 LEU HG 1.0 1.900 4.312 1720 1064 A 36 ALA HB% B 83 LEU HBx 1.0 1.873 4.113 1721 1065 B 83 LEU HD21 A 36 ALA HB% 1.0 1.707 3.233 1722 1066 B 83 LEU HBy A 38 ILE HD1% 1.0 1.975 5.145 1723 1067 A 38 ILE HD1% B 83 LEU HG 1.0 1.877 4.139 1724 1068 B 83 LEU HD21 A 52 ILE HD1% 1.0 1.832 3.854 1725 1069 B 80 ALA HA A 36 ALA HA 1.0 1.996 6.342 1726 1070 A 55 PHE HZ B 79 VAL HG11 1.0 1.996 5.668 1727 1071 A 51 LEU HDx% B 90 HIS HD2 1.0 2.000 6.144 1728 1072 B 83 LEU HD11 A 52 ILE HG13 1.0 2.000 5.956 1729 1073 B 94 PRO HBy A 37 GLY HAx 1.0 1.888 8.006 1730 1074 B 108 TRP HD1 B 108 TRP HE1 1.0 1.945 4.729 1731 1075 A 15 ASP H A 19 GLY H 1.0 1.852 3.976 1732 1076 A 15 ASP H A 14 TRP HA 1.0 1.696 3.184 1733 1077 A 15 ASP H A 19 GLY HAx 1.0 1.999 6.243 1734 1078 A 15 ASP H A 15 ASP HBy 1.0 1.921 4.495 1735 1079 A 14 TRP HE1 A 19 GLY H 1.0 1.999 6.081 1736 1080 A 14 TRP HE1 A 50 LYS H 1.0 1.989 5.407 1737 1081 A 14 TRP HZ2 A 14 TRP HE1 1.0 1.894 4.264 1738 1082 A 14 TRP HD1 A 14 TRP HE1 1.0 1.834 3.858 1739 1083 A 14 TRP HE1 A 49 SER HBy 1.0 1.973 5.103 1740 1084 A 50 LYS HA A 14 TRP HE1 1.0 1.935 4.615 1741 1085 A 14 TRP HE1 A 19 GLY HAx 1.0 1.871 4.097 1742 1086 A 14 TRP HE1 A 50 LYS HBy 1.0 1.982 5.276 1743 1087 A 20 PHE HA A 15 ASP H 1.0 1.955 4.839 1744 1088 A 26 ASP H A 25 LEU H 1.0 1.976 6.896 1745 1089 A 26 ASP H A 26 ASP HA 1.0 1.876 4.128 1746 1090 A 26 ASP H A 25 LEU HA 1.0 1.664 3.058 1747 1091 A 26 ASP H A 27 PRO HDy 1.0 2.000 5.884 1748 1092 A 26 ASP H A 26 ASP HBy 1.0 1.786 3.598 1749 1093 A 26 ASP H A 26 ASP HBx 1.0 1.814 3.746 1750 1094 A 25 LEU HG A 26 ASP H 1.0 1.981 5.237 1751 1095 A 29 LEU HBy A 26 ASP H 1.0 1.912 4.406 1752 1096 A 25 LEU HBx A 26 ASP H 1.0 1.896 4.284 1753 1097 A 29 LEU HDy% A 26 ASP H 1.0 1.812 3.736 1754 1098 A 38 ILE HG21 B 95 ALA H 1.0 1.999 6.207 1755 1099 A 72 GLN H A 71 ARG HBy 1.0 1.795 3.645 1756 1100 A 71 ARG HGx A 72 GLN H 1.0 1.886 4.202 1757 1101 B 95 ALA H A 42 GLN HE2y 1.0 2.000 5.880 1758 1102 A 42 GLN HE2x B 95 ALA H 1.0 1.954 4.834 1759 1103 B 94 PRO HA B 95 ALA H 1.0 1.725 3.307 1760 1104 B 94 PRO HBy B 95 ALA H 1.0 1.908 4.376 1761 1105 B 95 ALA HB% B 95 ALA H 1.0 1.725 3.307 1762 1106 B 107 ASN HA B 108 TRP H 1.0 1.853 3.977 1763 1107 B 108 TRP H B 108 TRP HBy 1.0 1.985 5.321 1764 1108 B 93 GLN H B 93 GLN HBy 1.0 1.827 3.817 1765 1109 B 92 ILE HG21 B 93 GLN H 1.0 1.763 3.481 1766 1110 B 105 ALA H B 104 PRO HBy 1.0 1.918 7.700 1767 1111 B 76 LEU HA B 76 LEU H 1.0 1.864 4.044 1768 1112 B 76 LEU H B 75 MET HA 1.0 1.720 3.286 1769 1113 B 77 PRO HDx B 76 LEU H 1.0 1.946 7.366 1770 1114 B 76 LEU H B 75 MET HBy 1.0 1.944 4.712 1771 1115 B 92 ILE HA B 93 GLN H 1.0 1.607 2.847 1772 1116 B 93 GLN HBx B 93 GLN H 1.0 1.724 3.306 1773 1117 B 105 ALA HA B 105 ALA H 1.0 1.818 3.770 1774 1118 B 105 ALA H B 104 PRO HBx 1.0 1.950 4.782 1775 1119 B 105 ALA HB% B 105 ALA H 1.0 1.818 3.766 1776 1120 B 102 ILE H B 102 ILE HA 1.0 1.934 4.616 1777 1121 B 102 ILE H B 102 ILE HB 1.0 1.902 4.330 1778 1122 B 102 ILE HG12 B 102 ILE H 1.0 1.983 5.277 1779 1123 B 102 ILE H B 102 ILE HG13 1.0 1.986 5.338 1780 1124 B 101 HIS HA B 102 ILE H 1.0 1.732 3.342 1781 1125 B 102 ILE H B 102 ILE HG21 1.0 1.998 5.786 1782 1126 A 49 SER H A 50 LYS H 1.0 1.856 3.998 1783 1127 A 49 SER HA A 50 LYS H 1.0 1.867 4.067 1784 1128 A 50 LYS HA A 50 LYS H 1.0 1.837 3.877 1785 1129 A 38 ILE HA A 39 SER H 1.0 1.662 3.048 1786 1130 A 39 SER HBx A 39 SER H 1.0 1.840 3.896 1787 1131 A 42 GLN HBy A 39 SER H 1.0 1.850 3.958 1788 1132 A 42 GLN HGx A 39 SER H 1.0 1.955 4.843 1789 1133 A 42 GLN HBx A 39 SER H 1.0 1.902 4.326 1790 1134 B 95 ALA HB% A 39 SER H 1.0 1.880 4.160 1791 1135 A 38 ILE HG21 A 39 SER H 1.0 1.795 3.641 1792 1136 B 99 ALA H B 98 MET HA 1.0 1.732 3.338 1793 1137 B 99 ALA HB% B 99 ALA H 1.0 1.754 3.444 1794 1138 B 87 LEU HA B 88 ALA H 1.0 1.904 4.344 1795 1139 B 88 ALA H B 87 LEU HBy 1.0 1.670 3.080 1796 1140 B 88 ALA H B 88 ALA HB% 1.0 1.610 2.858 1797 1141 B 74 HIS HD2 B 83 LEU H 1.0 1.954 4.838 1798 1142 B 83 LEU HG B 83 LEU H 1.0 1.902 4.332 1799 1143 B 83 LEU HD11 B 83 LEU H 1.0 1.981 5.239 1800 1144 B 83 LEU HA B 83 LEU H 1.0 1.869 4.083 1801 1145 B 83 LEU HBx B 83 LEU H 1.0 1.761 3.473 1802 1146 B 99 ALA H B 98 MET HBy 1.0 2.000 5.950 1803 1147 B 99 ALA HA B 99 ALA H 1.0 1.797 3.657 1804 1148 B 99 ALA H B 98 MET HBx 1.0 1.981 5.251 1805 1149 A 32 LEU HA A 32 LEU H 1.0 1.673 3.093 1806 1150 A 29 LEU HA A 32 LEU H 1.0 1.888 4.220 1807 1151 A 69 MET HE% A 32 LEU H 1.0 1.901 4.317 1808 1152 A 32 LEU HBy A 32 LEU H 1.0 1.697 3.189 1809 1153 A 32 LEU H A 32 LEU HBx 1.0 1.676 3.106 1810 1154 A 32 LEU HG A 32 LEU H 1.0 1.907 4.363 1811 1155 A 32 LEU HDy% A 32 LEU H 1.0 1.877 4.139 1812 1156 A 32 LEU HDx% A 32 LEU H 1.0 1.912 4.404 1813 1157 A 49 SER H A 45 ASP H 1.0 1.993 5.527 1814 1158 A 48 THR HB A 45 ASP H 1.0 1.885 4.201 1815 1159 A 6 PHE HA A 7 LYS H 1.0 1.820 3.780 1816 1160 A 7 LYS HBx A 7 LYS H 1.0 1.966 4.998 1817 1161 A 45 ASP HBx A 45 ASP H 1.0 1.663 3.053 1818 1162 B 80 ALA H B 79 VAL H 1.0 1.884 4.194 1819 1163 B 80 ALA HA B 80 ALA H 1.0 1.845 3.927 1820 1164 B 79 VAL HA B 80 ALA H 1.0 1.996 5.642 1821 1165 B 80 ALA HB% B 80 ALA H 1.0 1.650 3.002 1822 1166 B 79 VAL HG11 B 80 ALA H 1.0 1.787 3.599 1823 1167 B 78 ASP H B 79 VAL H 1.0 1.889 4.229 1824 1168 A 35 ARG H A 34 SER H 1.0 1.562 2.694 1825 1169 A 35 ARG H A 36 ALA H 1.0 1.691 3.161 1826 1170 B 78 ASP H B 78 ASP HBy 1.0 1.895 4.267 1827 1171 B 78 ASP H B 78 ASP HBx 1.0 1.816 3.756 1828 1172 A 21 ASP HA A 22 VAL H 1.0 1.559 2.683 1829 1173 A 22 VAL H A 21 ASP HBx 1.0 1.971 5.061 1830 1174 A 22 VAL HGy% A 22 VAL H 1.0 1.640 2.966 1831 1175 A 22 VAL HA A 22 VAL H 1.0 1.857 4.003 1832 1176 A 22 VAL HB A 22 VAL H 1.0 1.805 3.697 1833 1177 B 92 ILE H B 91 GLY HAx 1.0 1.857 4.003 1834 1178 B 92 ILE H B 92 ILE HB 1.0 1.684 3.138 1835 1179 B 92 ILE H B 92 ILE HG13 1.0 1.773 3.535 1836 1180 A 15 ASP H A 14 TRP H 1.0 1.999 5.897 1837 1181 A 14 TRP H A 13 GLY H 1.0 1.853 3.981 1838 1182 A 14 TRP HE3 A 14 TRP H 1.0 1.996 5.608 1839 1183 A 13 GLY HAy A 14 TRP H 1.0 1.837 3.879 1840 1184 A 13 GLY HAx A 14 TRP H 1.0 1.669 3.075 1841 1185 A 14 TRP HBy A 14 TRP H 1.0 1.833 3.857 1842 1186 A 14 TRP H A 14 TRP HBx 1.0 1.833 3.859 1843 1187 A 12 VAL HGy% A 14 TRP H 1.0 1.914 4.428 1844 1188 A 52 ILE HA A 53 TYR H 1.0 1.996 6.370 1845 1189 A 53 TYR H A 52 ILE HG21 1.0 1.953 4.827 1846 1190 A 20 PHE HEy A 53 TYR H 1.0 1.982 5.256 1847 1190 A 20 PHE HEx A 53 TYR H 1.0 1.982 5.256 1848 1191 A 53 TYR H A 51 LEU H 1.0 2.000 5.896 1849 1192 A 53 TYR HDy A 53 TYR H 1.0 1.993 5.519 1850 1192 A 53 TYR HDx A 53 TYR H 1.0 1.993 5.519 1851 1193 A 58 ASP H A 57 GLU H 1.0 1.790 3.616 1852 1194 A 58 ASP H A 59 GLN H 1.0 1.865 4.057 1853 1195 A 58 ASP H A 58 ASP HA 1.0 1.775 3.541 1854 1196 A 55 PHE HA A 58 ASP H 1.0 1.870 4.092 1855 1197 A 57 GLU HA A 58 ASP H 1.0 1.894 4.264 1856 1198 A 58 ASP HBy A 58 ASP H 1.0 1.722 3.294 1857 1199 A 58 ASP H A 58 ASP HBx 1.0 1.767 3.499 1858 1200 A 58 ASP H A 57 GLU HBx 1.0 1.673 3.093 1859 1201 B 98 MET HA B 98 MET H 1.0 1.912 4.412 1860 1202 A 8 HIS HA A 9 VAL H 1.0 1.562 2.692 1861 1203 A 9 VAL HA A 9 VAL H 1.0 1.869 4.085 1862 1204 A 9 VAL HB A 9 VAL H 1.0 1.779 3.559 1863 1205 A 9 VAL HGx% A 9 VAL H 1.0 1.741 3.379 1864 1206 A 64 ALA H A 63 GLU H 1.0 1.785 3.591 1865 1207 A 64 ALA H A 65 VAL H 1.0 1.679 3.117 1866 1208 A 63 GLU HBx A 64 ALA H 1.0 1.720 3.288 1867 1209 A 64 ALA HB% A 64 ALA H 1.0 1.619 2.891 1868 1210 B 98 MET H B 98 MET HGx 1.0 1.998 6.258 1869 1211 B 98 MET HBy B 98 MET H 1.0 1.971 5.059 1870 1212 A 25 LEU H A 24 ASN HBx 1.0 1.946 4.736 1871 1213 A 25 LEU H A 23 ASN H 1.0 1.999 6.135 1872 1214 A 25 LEU H A 24 ASN H 1.0 1.701 3.205 1873 1215 A 25 LEU H A 24 ASN HA 1.0 1.836 3.876 1874 1216 A 23 ASN HA A 25 LEU H 1.0 1.987 5.367 1875 1217 A 25 LEU H A 25 LEU HA 1.0 1.855 3.995 1876 1218 A 22 VAL HA A 25 LEU H 1.0 1.919 4.473 1877 1219 A 25 LEU H A 25 LEU HBy 1.0 1.720 3.286 1878 1220 B 86 HIS HA B 86 HIS H 1.0 1.743 3.391 1879 1221 B 83 LEU HA B 86 HIS H 1.0 1.737 3.361 1880 1222 A 38 ILE H A 37 GLY H 1.0 1.653 3.017 1881 1223 A 38 ILE H A 34 SER HA 1.0 1.912 4.404 1882 1224 A 38 ILE H A 33 PHE HBx 1.0 1.924 4.516 1883 1225 A 38 ILE H A 38 ILE HB 1.0 1.641 2.969 1884 1226 A 38 ILE HG13 A 38 ILE H 1.0 1.682 3.128 1885 1227 A 37 GLY HAy A 38 ILE H 1.0 1.852 3.974 1886 1228 A 38 ILE H A 37 GLY HAx 1.0 1.888 4.220 1887 1229 A 40 GLU H A 39 SER HA 1.0 1.874 4.122 1888 1230 A 40 GLU H A 39 SER HBy 1.0 1.890 4.236 1889 1231 A 20 PHE HDy A 20 PHE H 1.0 1.921 4.495 1890 1231 A 20 PHE HDx A 20 PHE H 1.0 1.921 4.495 1891 1232 A 49 SER HBy A 20 PHE H 1.0 1.999 5.843 1892 1233 A 19 GLY HAy A 20 PHE H 1.0 1.743 3.387 1893 1234 A 19 GLY HAx A 20 PHE H 1.0 1.843 3.915 1894 1235 A 20 PHE HBx A 20 PHE H 1.0 1.724 3.304 1895 1236 A 44 THR HG2% A 20 PHE H 1.0 1.922 4.496 1896 1237 B 86 HIS H B 85 GLN HBx 1.0 1.624 2.906 1897 1238 A 68 GLU HA A 71 ARG H 1.0 1.924 4.510 1898 1239 A 71 ARG H A 69 MET H 1.0 1.837 3.879 1899 1240 B 78 ASP HA B 79 VAL H 1.0 1.749 3.417 1900 1241 B 78 ASP HBy B 79 VAL H 1.0 1.831 3.843 1901 1242 B 78 ASP HBx B 79 VAL H 1.0 1.906 4.360 1902 1243 B 79 VAL HG11 B 79 VAL H 1.0 1.812 3.734 1903 1244 A 63 GLU HA A 66 ARG H 1.0 1.843 3.919 1904 1245 A 12 VAL H A 9 VAL H 1.0 1.935 4.619 1905 1246 A 12 VAL HA A 12 VAL H 1.0 1.874 4.120 1906 1247 A 12 VAL HB A 12 VAL H 1.0 1.916 4.448 1907 1248 A 29 LEU H A 26 ASP HBy 1.0 1.988 5.390 1908 1249 A 29 LEU HBy A 29 LEU H 1.0 1.677 3.107 1909 1250 A 72 GLN H A 71 ARG H 1.0 1.805 3.699 1910 1251 A 55 PHE HA A 55 PHE H 1.0 1.862 4.042 1911 1252 A 55 PHE H A 55 PHE HBy 1.0 1.769 3.513 1912 1253 A 55 PHE H A 54 ASP HBy 1.0 1.876 4.132 1913 1254 A 55 PHE HBx A 55 PHE H 1.0 1.789 3.613 1914 1255 A 62 LEU H A 61 GLY H 1.0 1.968 5.018 1915 1256 A 66 ARG HDx A 66 ARG H 1.0 1.999 5.787 1916 1257 B 89 GLU HA B 89 GLU H 1.0 1.795 3.643 1917 1258 B 87 LEU HA B 89 GLU H 1.0 1.992 5.502 1918 1259 B 89 GLU HGy B 89 GLU H 1.0 1.725 3.307 1919 1260 B 88 ALA HB% B 89 GLU H 1.0 1.731 3.333 1920 1261 B 85 GLN HA B 85 GLN H 1.0 1.686 3.144 1921 1262 B 84 MET HA B 85 GLN H 1.0 1.815 3.749 1922 1263 B 86 HIS HBx B 85 GLN H 1.0 1.966 4.994 1923 1264 B 85 GLN H B 84 MET HGy 1.0 1.996 5.614 1924 1265 B 85 GLN H B 85 GLN HGy 1.0 1.799 3.661 1925 1266 A 41 ALA H A 42 GLN H 1.0 1.771 3.523 1926 1267 A 41 ALA HB% A 41 ALA H 1.0 1.682 3.128 1927 1268 A 55 PHE H A 56 ILE H 1.0 1.850 3.956 1928 1269 A 53 TYR HA A 56 ILE H 1.0 1.893 4.261 1929 1270 A 52 ILE HA A 56 ILE H 1.0 1.999 6.235 1930 1271 A 55 PHE HBy A 56 ILE H 1.0 1.787 3.601 1931 1272 A 56 ILE HA A 56 ILE H 1.0 1.778 3.558 1932 1273 A 56 ILE HG13 A 56 ILE H 1.0 1.582 2.762 1933 1274 A 56 ILE HG12 A 56 ILE H 1.0 1.835 3.867 1934 1275 A 56 ILE HG21 A 56 ILE H 1.0 1.876 4.132 1935 1276 A 6 PHE HA A 6 PHE H 1.0 1.991 6.559 1936 1277 A 5 GLY HAx A 6 PHE H 1.0 1.912 4.408 1937 1278 A 6 PHE HBx A 6 PHE H 1.0 1.930 4.576 1938 1279 A 57 GLU H A 56 ILE HA 1.0 1.996 5.682 1939 1280 A 56 ILE HG21 A 57 GLU H 1.0 1.881 4.165 1940 1281 A 29 LEU H A 28 ASP HA 1.0 1.979 5.201 1941 1282 A 29 LEU H A 28 ASP HBy 1.0 1.866 4.062 1942 1283 A 29 LEU HDy% A 29 LEU H 1.0 1.761 3.473 1943 1284 A 29 LEU HDx% A 29 LEU H 1.0 1.924 4.522 1944 1285 A 55 PHE HDy A 55 PHE H 1.0 1.982 5.256 1945 1285 A 55 PHE HDx A 55 PHE H 1.0 1.982 5.256 1946 1286 A 54 ASP HBx A 55 PHE H 1.0 1.799 3.665 1947 1287 A 54 ASP HA A 55 PHE H 1.0 1.970 5.040 1948 1288 A 52 ILE HA A 55 PHE H 1.0 1.966 4.984 1949 1289 A 55 PHE H A 57 GLU HBx 1.0 1.998 6.298 1950 1290 A 53 TYR HA A 54 ASP H 1.0 1.994 5.546 1951 1291 A 62 LEU H A 61 GLY HAy 1.0 1.819 3.773 1952 1292 A 62 LEU HA A 62 LEU H 1.0 1.807 3.713 1953 1293 A 62 LEU H A 61 GLY HAx 1.0 1.804 3.694 1954 1294 A 62 LEU H A 62 LEU HBy 1.0 1.800 3.670 1955 1295 A 62 LEU HDy% A 62 LEU H 1.0 1.870 4.086 1956 1296 A 56 ILE HG21 A 62 LEU H 1.0 1.875 4.121 1957 1297 B 89 GLU HBy B 89 GLU H 1.0 1.629 2.925 1958 1298 B 89 GLU H B 89 GLU HBx 1.0 1.789 3.613 1959 1299 A 20 PHE HA A 21 ASP H 1.0 1.598 2.816 1960 1300 A 21 ASP H A 14 TRP HA 1.0 1.834 3.862 1961 1301 A 21 ASP H A 21 ASP HBx 1.0 1.723 3.301 1962 1302 A 49 SER HA A 52 ILE H 1.0 1.947 4.755 1963 1303 A 48 THR HA A 52 ILE H 1.0 1.988 5.390 1964 1304 A 52 ILE HA A 52 ILE H 1.0 1.853 3.983 1965 1305 A 51 LEU HBx A 52 ILE H 1.0 1.902 4.322 1966 1306 B 87 LEU HDx% A 52 ILE H 1.0 1.734 3.348 1967 1307 A 52 ILE HD1% A 52 ILE H 1.0 1.825 3.811 1968 1308 A 53 TYR HDy A 54 ASP H 1.0 1.971 5.069 1969 1308 A 53 TYR HDx A 54 ASP H 1.0 1.971 5.069 1970 1309 A 53 TYR HBy A 54 ASP H 1.0 1.810 3.728 1971 1310 A 55 PHE H A 54 ASP H 1.0 1.892 4.246 1972 1311 A 51 LEU HA A 54 ASP H 1.0 1.896 4.284 1973 1312 A 54 ASP HBy A 54 ASP H 1.0 1.775 3.539 1974 1313 A 54 ASP HBx A 54 ASP H 1.0 1.797 3.653 1975 1314 B 82 ARG H B 82 ARG HDy 1.0 1.996 6.362 1976 1315 B 83 LEU H B 82 ARG H 1.0 1.735 3.353 1977 1316 B 74 HIS HD2 B 82 ARG H 1.0 1.980 6.838 1978 1317 A 55 PHE HEy B 82 ARG H 1.0 2.000 6.116 1979 1317 A 55 PHE HEx B 82 ARG H 1.0 2.000 6.116 1980 1318 B 82 ARG HA B 82 ARG H 1.0 1.702 3.210 1981 1319 B 82 ARG HBy B 82 ARG H 1.0 1.585 2.771 1982 1320 B 82 ARG HBx B 82 ARG H 1.0 1.594 2.800 1983 1321 A 28 ASP H A 27 PRO HDy 1.0 1.779 3.557 1984 1322 B 96 ARG HA B 97 ASN H 1.0 1.823 3.801 1985 1323 B 97 ASN HBx B 97 ASN H 1.0 1.815 3.755 1986 1324 B 100 GLU HA B 100 GLU H 1.0 1.687 3.147 1987 1325 A 36 ALA H A 37 GLY H 1.0 1.764 3.486 1988 1326 A 36 ALA HB% A 36 ALA H 1.0 1.607 2.847 1989 1327 A 32 LEU HDy% A 36 ALA H 1.0 1.952 4.808 1990 1328 A 65 VAL H A 65 VAL HA 1.0 1.733 3.345 1991 1329 A 68 GLU H A 69 MET H 1.0 1.700 3.202 1992 1330 A 68 GLU HA A 68 GLU H 1.0 1.732 3.338 1993 1331 A 68 GLU HGx A 68 GLU H 1.0 1.659 3.037 1994 1332 A 28 ASP H A 28 ASP HA 1.0 1.802 3.682 1995 1333 A 28 ASP H A 28 ASP HBy 1.0 1.723 3.299 1996 1334 A 28 ASP H A 29 LEU H 1.0 1.724 3.304 1997 1335 B 96 ARG H B 95 ALA HA 1.0 1.688 3.156 1998 1336 B 96 ARG H B 94 PRO HBy 1.0 1.999 5.799 1999 1337 B 96 ARG H B 94 PRO HBx 1.0 1.876 4.134 2000 1338 B 95 ALA HB% B 96 ARG H 1.0 1.781 3.571 2001 1339 B 94 PRO HDx B 96 ARG H 1.0 1.937 7.485 2002 1340 B 83 LEU HD11 B 84 MET H 1.0 1.964 4.968 2003 1341 B 82 ARG H B 84 MET H 1.0 2.000 5.986 2004 1342 B 81 GLN HA B 84 MET H 1.0 1.734 3.346 2005 1343 B 84 MET HA B 84 MET H 1.0 1.725 3.307 2006 1344 B 84 MET H B 84 MET HGy 1.0 1.783 3.579 2007 1345 B 84 MET H B 84 MET HGx 1.0 1.840 3.894 2008 1346 B 83 LEU HBx B 84 MET H 1.0 1.851 3.967 2009 1347 B 106 PRO HA B 107 ASN H 1.0 1.776 3.548 2010 1348 B 82 ARG H B 81 GLN H 1.0 1.763 3.485 2011 1349 B 81 GLN HA B 81 GLN H 1.0 1.792 3.630 2012 1350 B 79 VAL HA B 81 GLN H 1.0 1.974 6.938 2013 1351 B 81 GLN H B 78 ASP HBy 1.0 1.895 7.935 2014 1352 B 81 GLN H B 81 GLN HGy 1.0 1.803 3.685 2015 1353 B 81 GLN H B 81 GLN HBx 1.0 1.637 2.953 2016 1354 B 80 ALA HB% B 81 GLN H 1.0 1.774 3.536 2017 1355 A 65 VAL H A 66 ARG H 1.0 1.800 3.672 2018 1356 A 64 ALA HB% A 65 VAL H 1.0 1.758 3.456 2019 1357 B 86 HIS HA B 87 LEU H 1.0 1.969 5.039 2020 1358 B 87 LEU HA B 87 LEU H 1.0 1.775 3.539 2021 1359 B 87 LEU HDy% B 87 LEU H 1.0 1.780 3.562 2022 1360 B 81 GLN H B 78 ASP HA 1.0 1.998 6.272 2023 1361 B 81 GLN H B 78 ASP HBx 1.0 1.983 6.743 2024 1362 B 93 GLN H A 48 THR H 1.0 1.885 4.199 2025 1363 A 48 THR HB A 48 THR H 1.0 1.778 3.556 2026 1364 A 48 THR HG2% A 48 THR H 1.0 1.929 4.569 2027 1365 A 46 ALA HB% A 47 GLU H 1.0 1.686 3.146 2028 1366 A 47 GLU H A 46 ALA H 1.0 1.960 4.904 2029 1367 A 48 THR H A 47 GLU H 1.0 1.748 3.410 2030 1368 A 47 GLU HA A 47 GLU H 1.0 1.736 3.358 2031 1369 A 45 ASP HBx A 47 GLU H 1.0 1.900 7.886 2032 1370 A 30 ARG HA A 30 ARG H 1.0 1.801 3.677 2033 1371 A 30 ARG H A 27 PRO HA 1.0 1.924 4.510 2034 1372 A 67 GLN HA A 70 ARG H 1.0 1.935 4.623 2035 1373 A 70 ARG HBx A 70 ARG H 1.0 1.645 2.985 2036 1374 A 24 ASN H A 25 LEU HA 1.0 1.908 7.802 2037 1375 A 48 THR HA A 48 THR H 1.0 1.848 3.946 2038 1376 A 45 ASP HBx A 48 THR H 1.0 1.888 4.222 2039 1377 A 23 ASN H A 22 VAL H 1.0 1.671 3.085 2040 1378 A 23 ASN H A 24 ASN H 1.0 1.717 3.271 2041 1379 A 23 ASN HD2x A 23 ASN H 1.0 1.949 7.321 2042 1380 A 23 ASN H A 24 ASN HA 1.0 1.771 8.941 2043 1381 A 22 VAL HA A 23 ASN H 1.0 1.895 4.269 2044 1382 A 22 VAL HB A 23 ASN H 1.0 1.880 4.160 2045 1383 A 22 VAL HGy% A 23 ASN H 1.0 1.808 3.710 2046 1384 A 29 LEU HDx% A 30 ARG H 1.0 1.950 7.320 2047 1385 A 69 MET HA A 69 MET H 1.0 1.786 3.596 2048 1386 A 68 GLU HA A 69 MET H 1.0 1.853 3.977 2049 1387 A 66 ARG HA A 69 MET H 1.0 1.928 4.554 2050 1388 A 69 MET H A 69 MET HGy 1.0 1.806 3.702 2051 1389 A 69 MET H A 69 MET HGx 1.0 1.812 3.732 2052 1390 A 68 GLU HGx A 69 MET H 1.0 1.915 4.437 2053 1391 A 65 VAL HGx% A 69 MET H 1.0 1.978 6.864 2054 1392 A 24 ASN H A 24 ASN HD2x 1.0 1.954 7.260 2055 1393 A 24 ASN H A 24 ASN HA 1.0 1.853 3.981 2056 1394 A 23 ASN HA A 24 ASN H 1.0 1.911 4.401 2057 1395 A 22 VAL HA A 24 ASN H 1.0 1.997 5.695 2058 1396 A 24 ASN H A 24 ASN HBy 1.0 1.806 3.702 2059 1397 A 24 ASN H A 21 ASP HBx 1.0 1.915 4.429 2060 1398 A 24 ASN HBx A 24 ASN H 1.0 1.753 3.435 2061 1399 A 25 LEU HG A 24 ASN H 1.0 2.000 5.866 2062 1400 A 24 ASN H A 25 LEU HBy 1.0 1.964 4.960 2063 1401 A 44 THR HG2% A 24 ASN H 1.0 1.975 6.919 2064 1402 A 42 GLN H A 39 SER H 1.0 2.000 6.066 2065 1403 B 101 HIS HE1 A 42 GLN H 1.0 1.920 4.472 2066 1404 A 42 GLN H A 39 SER HBy 1.0 1.998 5.740 2067 1405 A 42 GLN HA A 42 GLN H 1.0 1.821 3.791 2068 1406 A 42 GLN H A 42 GLN HBx 1.0 1.844 3.922 2069 1407 A 41 ALA HB% A 42 GLN H 1.0 1.814 3.748 2070 1408 A 48 THR HG2% A 42 GLN H 1.0 1.879 8.089 2071 1409 A 38 ILE HG21 A 42 GLN H 1.0 1.948 4.762 2072 1410 A 52 ILE H A 51 LEU H 1.0 1.802 3.682 2073 1411 A 50 LYS H A 51 LEU H 1.0 1.794 3.636 2074 1412 A 51 LEU HA A 51 LEU H 1.0 1.844 3.922 2075 1413 A 50 LYS HA A 51 LEU H 1.0 1.913 4.425 2076 1414 A 50 LYS HGy A 51 LEU H 1.0 1.959 4.895 2077 1415 A 51 LEU HBx A 51 LEU H 1.0 1.863 4.047 2078 1416 A 51 LEU HDy% A 51 LEU H 1.0 1.938 4.658 2079 1417 A 55 PHE HZ A 59 GLN HE2y 1.0 1.960 4.906 2080 1418 A 58 ASP HBy A 59 GLN HE2y 1.0 1.975 6.927 2081 1419 A 59 GLN HE2y A 58 ASP HBx 1.0 1.993 6.459 2082 1420 A 59 GLN HGy A 59 GLN HE2y 1.0 1.954 4.828 2083 1421 A 59 GLN HGx A 59 GLN HE2y 1.0 1.996 6.362 2084 1422 A 59 GLN HE2x A 58 ASP HBx 1.0 1.939 7.457 2085 1423 B 79 VAL HG11 A 69 MET H 1.0 1.996 5.664 2086 1424 A 39 SER HBx A 42 GLN H 1.0 1.987 5.383 2087 1425 A 55 PHE HZ A 59 GLN HE2x 1.0 1.962 4.936 2088 1426 A 59 GLN HE2x A 59 GLN HA 1.0 1.955 7.249 2089 1427 A 58 ASP HBy A 59 GLN HE2x 1.0 1.992 6.538 2090 1428 A 59 GLN HGy A 59 GLN HE2x 1.0 1.899 4.305 2091 1429 A 59 GLN HGx A 59 GLN HE2x 1.0 1.984 5.310 2092 1430 A 18 ASN H A 17 GLN H 1.0 1.660 3.040 2093 1431 A 18 ASN H A 18 ASN HD2x 1.0 1.975 6.909 2094 1432 A 18 ASN H A 18 ASN HA 1.0 1.878 4.148 2095 1433 A 17 GLN HA A 18 ASN H 1.0 1.918 4.458 2096 1434 A 18 ASN H A 18 ASN HBy 1.0 1.889 4.231 2097 1435 A 18 ASN H A 18 ASN HBx 1.0 1.811 3.729 2098 1436 A 49 SER HA A 49 SER H 1.0 1.761 3.473 2099 1437 A 48 THR HA A 49 SER H 1.0 1.913 4.417 2100 1438 A 45 ASP HBx A 49 SER H 1.0 1.934 4.616 2101 1439 A 48 THR HG2% A 49 SER H 1.0 1.961 4.915 2102 1440 A 49 SER H A 49 SER HBy 1.0 1.752 3.432 2103 1441 A 63 GLU H A 61 GLY HAx 1.0 1.936 7.484 2104 1442 A 65 VAL H A 63 GLU H 1.0 1.977 5.159 2105 1443 A 63 GLU H A 61 GLY HAy 1.0 2.000 6.116 2106 1444 A 63 GLU HA A 63 GLU H 1.0 1.834 3.864 2107 1445 A 62 LEU HA A 63 GLU H 1.0 1.962 4.936 2108 1446 A 63 GLU HGx A 63 GLU H 1.0 1.795 3.647 2109 1447 A 63 GLU HBx A 63 GLU H 1.0 1.691 3.165 2110 1448 A 62 LEU HBy A 63 GLU H 1.0 1.814 3.742 2111 1449 A 62 LEU HBx A 63 GLU H 1.0 1.842 3.910 2112 1450 A 32 LEU HG A 33 PHE H 1.0 1.912 4.412 2113 1451 A 32 LEU HDy% A 33 PHE H 1.0 1.892 4.250 2114 1452 A 32 LEU H A 33 PHE H 1.0 1.732 3.342 2115 1453 A 33 PHE HDy A 33 PHE H 1.0 1.909 4.389 2116 1453 A 33 PHE HDx A 33 PHE H 1.0 1.909 4.389 2117 1454 A 33 PHE HA A 33 PHE H 1.0 1.869 4.083 2118 1455 A 33 PHE H A 34 SER HBx 1.0 1.948 4.762 2119 1456 A 29 LEU HA A 33 PHE H 1.0 1.942 4.688 2120 1457 A 33 PHE HBy A 33 PHE H 1.0 1.754 3.438 2121 1458 A 32 LEU HBy A 33 PHE H 1.0 1.778 3.558 2122 1459 A 32 LEU HDx% A 33 PHE H 1.0 1.894 4.268 2123 1460 A 64 ALA HB% A 67 GLN H 1.0 1.981 6.805 2124 1461 A 67 GLN H A 69 MET H 1.0 1.855 3.991 2125 1462 A 67 GLN HA A 67 GLN H 1.0 1.799 3.665 2126 1463 A 66 ARG HA A 67 GLN H 1.0 1.938 4.652 2127 1464 A 67 GLN HGx A 67 GLN H 1.0 1.742 3.382 2128 1465 A 66 ARG HBx A 67 GLN H 1.0 1.740 3.376 2129 1466 A 66 ARG HGx A 67 GLN H 1.0 1.982 5.258 2130 1467 A 23 ASN HD2y A 24 ASN HD2x 1.0 1.841 3.899 2131 1468 A 24 ASN HBx A 24 ASN HD2x 1.0 1.931 4.579 2132 1469 A 23 ASN HD2y A 24 ASN HD2y 1.0 1.933 4.605 2133 1470 A 24 ASN H A 24 ASN HD2y 1.0 1.990 6.588 2134 1471 A 24 ASN HBy A 24 ASN HD2y 1.0 1.922 4.500 2135 1472 A 24 ASN HBx A 24 ASN HD2y 1.0 1.885 4.197 2136 1473 A 17 GLN H A 18 ASN HA 1.0 1.987 6.655 2137 1474 B 89 GLU H B 90 HIS H 1.0 1.771 3.523 2138 1475 B 92 ILE H B 90 HIS H 1.0 1.908 4.382 2139 1476 B 90 HIS HD2 B 90 HIS H 1.0 1.957 4.869 2140 1477 B 90 HIS HA B 90 HIS H 1.0 1.860 4.022 2141 1478 B 89 GLU HA B 90 HIS H 1.0 1.881 4.169 2142 1479 B 90 HIS H B 90 HIS HBy 1.0 1.848 3.948 2143 1480 B 90 HIS H B 90 HIS HBx 1.0 1.750 3.422 2144 1481 B 89 GLU HBy B 90 HIS H 1.0 1.898 4.298 2145 1482 B 90 HIS H B 89 GLU HBx 1.0 1.955 4.843 2146 1483 A 17 GLN HA A 17 GLN H 1.0 1.821 3.783 2147 1484 A 16 PRO HA A 17 GLN H 1.0 1.966 4.984 2148 1485 A 16 PRO HDy A 17 GLN H 1.0 1.953 4.819 2149 1486 A 16 PRO HDx A 17 GLN H 1.0 1.966 7.082 2150 1487 A 17 GLN H A 15 ASP HBy 1.0 1.951 4.793 2151 1488 A 18 ASN H A 18 ASN HD2y 1.0 1.992 6.508 2152 1489 A 18 ASN HBy A 18 ASN HD2y 1.0 1.892 4.248 2153 1490 A 60 GLY H A 59 GLN H 1.0 1.676 3.106 2154 1491 A 56 ILE HA A 59 GLN H 1.0 1.994 5.574 2155 1492 A 58 ASP HBx A 59 GLN H 1.0 1.954 4.830 2156 1493 A 59 GLN HGy A 59 GLN H 1.0 1.805 3.699 2157 1494 A 59 GLN HGx A 59 GLN H 1.0 1.902 4.328 2158 1495 A 18 ASN HD2x A 18 ASN HBy 1.0 1.985 5.329 2159 1496 A 18 ASN HD2x A 18 ASN HBx 1.0 1.923 4.505 2160 1497 A 40 GLU HA A 43 LEU H 1.0 1.840 3.902 2161 1498 A 43 LEU HBy A 43 LEU H 1.0 1.791 3.625 2162 1499 A 38 ILE HG21 A 43 LEU H 1.0 1.834 3.858 2163 1500 A 43 LEU HD21 A 43 LEU H 1.0 1.953 4.819 2164 1501 A 57 GLU H A 59 GLN H 1.0 1.892 4.256 2165 1502 A 59 GLN HE2y A 59 GLN H 1.0 1.999 5.883 2166 1503 A 59 GLN HE2x A 59 GLN H 1.0 1.972 5.072 2167 1504 A 58 ASP HA A 59 GLN H 1.0 1.954 4.838 2168 1505 A 59 GLN HA A 59 GLN H 1.0 1.861 4.029 2169 1506 A 60 GLY HAx A 59 GLN H 1.0 2.000 6.026 2170 1507 A 58 ASP HBy A 59 GLN H 1.0 1.956 4.854 2171 1508 A 59 GLN HBy A 59 GLN H 1.0 1.851 3.969 2172 1509 A 59 GLN HBx A 59 GLN H 1.0 1.837 3.883 2173 1510 A 65 VAL HGy% A 59 GLN H 1.0 1.993 5.529 2174 1511 A 33 PHE HDy A 34 SER H 1.0 1.966 7.080 2175 1511 A 33 PHE HDx A 34 SER H 1.0 1.966 7.080 2176 1512 A 34 SER H A 34 SER HA 1.0 1.775 3.539 2177 1513 A 34 SER H A 34 SER HBx 1.0 1.670 3.080 2178 1514 A 30 ARG HA A 34 SER H 1.0 1.980 5.216 2179 1515 A 33 PHE HBy A 34 SER H 1.0 1.800 3.672 2180 1516 A 43 LEU HD11 A 34 SER H 1.0 1.985 6.707 2181 1517 B 108 TRP HZ2 B 108 TRP HH2 1.0 1.985 5.333 2182 1518 A 30 ARG H A 31 SER H 1.0 1.819 3.775 2183 1519 A 31 SER H A 28 ASP HA 1.0 1.939 4.661 2184 1520 A 31 SER H A 31 SER HA 1.0 1.768 3.508 2185 1521 A 30 ARG HA A 31 SER H 1.0 1.906 4.356 2186 1522 A 31 SER H A 30 ARG HBy 1.0 1.794 3.634 2187 1523 B 97 ASN HBx B 97 ASN HD2y 1.0 1.931 4.585 2188 1524 A 67 GLN HGx A 67 GLN HE2y 1.0 1.967 5.005 2189 1525 B 76 LEU HBx B 81 GLN HE2x 1.0 1.993 5.535 2190 1526 B 85 GLN HGx B 85 GLN HE2y 1.0 1.910 4.396 2191 1527 B 85 GLN HE2x B 85 GLN HGx 1.0 1.935 4.623 2192 1528 A 13 GLY HAy A 13 GLY H 1.0 1.714 3.260 2193 1529 A 42 GLN HGy A 42 GLN HE2y 1.0 1.843 3.915 2194 1530 A 48 THR HG2% A 42 GLN HE2y 1.0 1.966 7.084 2195 1531 B 92 ILE HG21 A 42 GLN HE2y 1.0 1.923 4.505 2196 1532 B 94 PRO HA A 42 GLN HE2y 1.0 1.968 7.042 2197 1533 A 42 GLN HGx A 42 GLN HE2y 1.0 1.793 3.633 2198 1534 B 94 PRO HA A 42 GLN HE2x 1.0 1.949 4.781 2199 1535 A 59 GLN HBy A 61 GLY H 1.0 1.995 5.605 2200 1536 A 61 GLY H A 59 GLN HBx 1.0 1.992 5.510 2201 1537 A 64 ALA HB% A 61 GLY H 1.0 1.970 5.060 2202 1538 A 61 GLY H A 59 GLN H 1.0 1.920 4.478 2203 1539 A 61 GLY H A 61 GLY HAy 1.0 1.816 3.754 2204 1540 A 61 GLY H A 60 GLY HAy 1.0 1.910 4.396 2205 1541 A 57 GLU HA A 61 GLY H 1.0 1.808 3.712 2206 1542 A 61 GLY H A 61 GLY HAx 1.0 1.721 3.293 2207 1543 A 56 ILE HG21 A 61 GLY H 1.0 1.940 4.670 2208 1544 A 19 GLY H A 18 ASN HA 1.0 1.873 4.109 2209 1545 A 19 GLY HAx A 19 GLY H 1.0 1.702 3.208 2210 1546 A 19 GLY H A 15 ASP HBx 1.0 1.956 4.856 2211 1547 B 91 GLY H B 90 HIS HBx 1.0 1.928 4.562 2212 1548 B 92 ILE H B 91 GLY H 1.0 1.659 3.037 2213 1549 B 91 GLY H B 90 HIS H 1.0 1.732 3.342 2214 1550 B 90 HIS HA B 91 GLY H 1.0 1.866 4.064 2215 1551 B 91 GLY HAy B 91 GLY H 1.0 1.763 3.483 2216 1552 B 91 GLY H B 91 GLY HAx 1.0 1.692 3.170 2217 1553 B 101 HIS HE1 A 44 THR H 1.0 1.870 4.094 2218 1554 A 44 THR H A 44 THR HA 1.0 1.907 4.371 2219 1555 A 42 GLN HA A 44 THR H 1.0 1.817 3.763 2220 1556 A 45 ASP HBx A 44 THR H 1.0 1.965 4.989 2221 1557 A 43 LEU HBy A 44 THR H 1.0 1.924 4.518 2222 1558 A 44 THR HG2% A 44 THR H 1.0 1.754 3.440 2223 1559 A 45 ASP HA A 46 ALA H 1.0 1.837 3.879 2224 1560 A 46 ALA HA A 46 ALA H 1.0 1.948 4.768 2225 1561 A 45 ASP HBx A 46 ALA H 1.0 1.998 5.778 2226 1562 A 46 ALA HB% A 46 ALA H 1.0 1.803 3.687 2227 1563 A 35 ARG H A 37 GLY H 1.0 2.000 6.082 2228 1564 A 37 GLY H A 34 SER HA 1.0 1.787 3.603 2229 1565 A 37 GLY HAy A 37 GLY H 1.0 1.713 3.253 2230 1566 A 37 GLY H A 37 GLY HAx 1.0 1.671 3.083 2231 1567 A 36 ALA HB% A 37 GLY H 1.0 1.817 3.761 2232 1568 A 60 GLY H A 61 GLY H 1.0 1.734 3.346 2233 1569 A 59 GLN HA A 60 GLY H 1.0 1.862 4.032 2234 1570 A 60 GLY H A 60 GLY HAx 1.0 1.677 3.107 2235 1571 A 60 GLY H A 59 GLN HBy 1.0 1.988 5.372 2236 1572 A 60 GLY H A 59 GLN HBx 1.0 2.000 5.920 2237 1573 A 64 ALA HB% A 60 GLY H 1.0 1.989 5.421 2238 1574 A 14 TRP HBy A 15 ASP H 1.0 1.983 5.281 2239 1575 A 68 GLU HA A 72 GLN H 1.0 1.933 4.597 2240 1576 A 71 ARG HA A 72 GLN H 1.0 1.757 3.451 2241 1577 A 32 LEU H A 31 SER HA 1.0 1.935 4.623 2242 1578 B 108 TRP H B 108 TRP HBx 1.0 1.936 4.638 2243 1579 B 108 TRP H B 108 TRP HA 1.0 1.962 4.932 2244 1580 B 93 GLN HA B 93 GLN H 1.0 1.871 4.099 2245 1581 B 104 PRO HA B 105 ALA H 1.0 1.684 3.136 2246 1582 A 39 SER HA A 39 SER H 1.0 1.902 4.328 2247 1583 A 45 ASP H A 49 SER HBy 1.0 1.957 4.875 2248 1584 A 25 LEU HG A 25 LEU H 1.0 1.730 3.328 2249 1585 B 97 ASN HA B 98 MET H 1.0 1.921 4.495 2250 1586 A 25 LEU HD11 A 25 LEU H 1.0 1.854 3.988 2251 1587 A 19 GLY H A 20 PHE H 1.0 1.921 4.495 2252 1588 A 65 VAL HGx% A 66 ARG H 1.0 1.824 3.802 2253 1589 A 62 LEU H A 8 HIS H 1.0 1.980 5.222 2254 1590 A 29 LEU HG A 29 LEU H 1.0 1.804 3.692 2255 1591 A 50 LYS HA A 54 ASP H 1.0 1.991 5.483 2256 1592 A 51 LEU HA A 52 ILE H 1.0 1.988 5.370 2257 1593 A 54 ASP HA A 54 ASP H 1.0 1.824 3.806 2258 1594 A 38 ILE H A 38 ILE HA 1.0 1.980 5.222 2259 1595 A 64 ALA HA A 65 VAL H 1.0 1.805 3.697 2260 1596 A 68 GLU H A 65 VAL HA 1.0 1.799 3.667 2261 1597 A 68 GLU HA A 70 ARG H 1.0 1.970 5.060 2262 1598 A 23 ASN HA A 23 ASN H 1.0 1.747 3.409 2263 1599 A 70 ARG H A 69 MET H 1.0 1.700 3.202 2264 1600 A 18 ASN H A 19 GLY H 1.0 1.711 3.247 2265 1601 A 48 THR HB A 49 SER H 1.0 1.759 3.465 2266 1602 A 32 LEU HA A 33 PHE H 1.0 1.920 4.478 2267 1603 A 30 ARG HA A 33 PHE H 1.0 1.940 4.672 2268 1604 A 45 ASP H A 44 THR H 1.0 1.672 3.088 2269 1605 A 25 LEU H A 24 ASN HBy 1.0 1.986 5.344 2270 1606 A 40 GLU H A 41 ALA H 1.0 1.986 5.344 2271 1607 B 108 TRP HE1 B 108 TRP HZ2 1.0 2.000 6.084 2272 1608 B 92 ILE H B 90 HIS HBx 1.0 1.980 5.222 2273 1609 B 92 ILE H B 90 HIS HBy 1.0 1.980 5.222 2274 1610 A 8 HIS HBx A 9 VAL H 1.0 1.956 4.854 2275 1611 A 35 ARG H A 34 SER HBx 1.0 1.701 3.205 2276 1612 A 44 THR HG2% A 22 VAL H 1.0 1.999 5.843 2277 1613 A 20 PHE HZ A 53 TYR H 1.0 2.000 6.084 2278 1614 A 53 TYR H A 52 ILE H 1.0 1.851 3.967 2279 1615 B 98 MET HBx B 98 MET H 1.0 1.912 4.404 2280 1616 A 50 LYS HA A 53 TYR H 1.0 1.991 5.483 2281 1617 A 53 TYR HA A 53 TYR H 1.0 1.937 7.481 2282 1618 A 66 ARG HA A 66 ARG H 1.0 1.779 3.563 2283 1619 A 67 GLN H A 66 ARG H 1.0 1.779 3.563 2284 1620 A 64 ALA H A 66 ARG H 1.0 1.991 5.483 2285 1621 A 55 PHE HDy A 56 ILE H 1.0 1.980 5.222 2286 1621 A 55 PHE HDx A 56 ILE H 1.0 1.980 5.222 2287 1622 A 23 ASN H A 23 ASN HD2y 1.0 1.950 4.782 2288 1623 A 16 PRO HDy A 15 ASP H 1.0 1.794 8.778 2289 1624 A 20 PHE HDy A 14 TRP HE1 1.0 1.794 8.778 2290 1624 A 20 PHE HDx A 14 TRP HE1 1.0 1.794 8.778 2291 1625 A 29 LEU HDx% A 26 ASP H 1.0 1.794 8.778 2292 1626 B 95 ALA HA B 95 ALA H 1.0 1.725 3.307 2293 1627 A 45 ASP H A 46 ALA H 1.0 1.937 7.481 2294 1628 A 48 THR HG2% A 45 ASP H 1.0 1.937 7.481 2295 1629 A 32 LEU H A 35 ARG H 1.0 1.937 7.481 2296 1630 A 24 ASN H A 22 VAL H 1.0 1.999 5.843 2297 1631 A 14 TRP H A 14 TRP HA 1.0 1.921 4.495 2298 1632 A 51 LEU HA A 53 TYR H 1.0 1.937 7.481 2299 1633 A 54 ASP HA A 58 ASP H 1.0 1.980 5.222 2300 1634 A 21 ASP H A 20 PHE H 1.0 2.000 6.084 2301 1635 B 83 LEU HD11 B 86 HIS H 1.0 1.995 6.395 2302 1636 A 30 ARG H A 29 LEU H 1.0 1.806 3.702 2303 1637 A 55 PHE HBx A 56 ILE H 1.0 1.921 4.495 2304 1638 A 56 ILE HD1% A 56 ILE H 1.0 1.912 4.404 2305 1639 A 29 LEU HA A 29 LEU H 1.0 1.901 4.323 2306 1640 A 55 PHE H A 52 ILE HG21 1.0 1.794 8.778 2307 1641 A 52 ILE H A 52 ILE HG21 1.0 1.883 4.183 2308 1642 A 56 ILE H A 54 ASP H 1.0 1.937 7.481 2309 1643 A 32 LEU HA A 36 ALA H 1.0 1.999 5.843 2310 1644 A 36 ALA H A 37 GLY HAx 1.0 1.995 6.395 2311 1645 A 46 ALA HA A 47 GLU H 1.0 1.944 4.716 2312 1646 A 66 ARG HA A 70 ARG H 1.0 1.937 7.481 2313 1647 A 67 GLN HA A 69 MET H 1.0 1.937 7.481 2314 1648 A 49 SER H A 51 LEU H 1.0 1.937 7.481 2315 1649 A 56 ILE HG21 A 59 GLN H 1.0 1.937 7.481 2316 1650 A 19 GLY HAy A 19 GLY H 1.0 1.763 3.483 2317 1651 A 38 ILE HG12 A 37 GLY H 1.0 1.937 7.481 2318 1652 A 60 GLY H A 61 GLY HAy 1.0 1.937 7.481 stop_ save_