data_nef_c19585_2mg4 save_entry_information _nef_nmr_meta_data.sf_category nef_nmr_meta_data _nef_nmr_meta_data.sf_framecode entry_information _nef_nmr_meta_data.format_name nmr_exchange_format _nef_nmr_meta_data.format_version 1.1 loop_ _nef_related_entries.database_name _nef_related_entries.database_accession_code PDB 2mg4 stop_ save_ save_assembly _nef_molecular_system.sf_category nef_molecular_system _nef_molecular_system.sf_framecode assembly loop_ _nef_sequence.index _nef_sequence.chain_code _nef_sequence.sequence_code _nef_sequence.residue_name _nef_sequence.linking _nef_sequence.residue_variant _nef_sequence.cis_peptide 1 A 1 MET start . . 2 A 2 GLU middle . . 3 A 3 LYS middle . . 4 A 4 ARG middle . . 5 A 5 PRO middle . false 6 A 6 ARG middle . . 7 A 7 THR middle . . 8 A 8 GLU middle . . 9 A 9 PHE middle . . 10 A 10 SER middle . . 11 A 11 GLU middle . . 12 A 12 GLU middle . . 13 A 13 GLN middle . . 14 A 14 LYS middle . . 15 A 15 LYS middle . . 16 A 16 ALA middle . . 17 A 17 LEU middle . . 18 A 18 ASP middle . . 19 A 19 LEU middle . . 20 A 20 ALA middle . . 21 A 21 PHE middle . . 22 A 22 TYR middle . . 23 A 23 PHE middle . . 24 A 24 ASP middle . . 25 A 25 ARG middle . . 26 A 26 ARG middle . . 27 A 27 LEU middle . . 28 A 28 THR middle . . 29 A 29 PRO middle . false 30 A 30 GLU middle . . 31 A 31 TRP middle . . 32 A 32 ARG middle . . 33 A 33 ARG middle . . 34 A 34 TYR middle . . 35 A 35 LEU middle . . 36 A 36 SER middle . . 37 A 37 GLN middle . . 38 A 38 ARG middle . . 39 A 39 LEU middle . . 40 A 40 GLY middle . false 41 A 41 LEU middle . . 42 A 42 ASN middle . . 43 A 43 GLU middle . . 44 A 44 GLU middle . . 45 A 45 GLN middle . . 46 A 46 ILE middle . . 47 A 47 GLU middle . . 48 A 48 ARG middle . . 49 A 49 TRP middle . . 50 A 50 PHE middle . . 51 A 51 ARG middle . . 52 A 52 ARG middle . . 53 A 53 LYS middle . . 54 A 54 GLU middle . . 55 A 55 GLN middle . . 56 A 56 GLN middle . . 57 A 57 ILE middle . . 58 A 58 GLY middle . false 59 A 59 TRP middle . . 60 A 60 SER middle . . 61 A 61 HIS middle . . 62 A 62 PRO middle . false 63 A 63 GLN middle . . 64 A 64 PHE middle . . 65 A 65 GLU middle . . 66 A 66 LYS end . . 67 B 1 MET start . . 68 B 2 GLU middle . . 69 B 3 LYS middle . . 70 B 4 ARG middle . . 71 B 5 PRO middle . false 72 B 6 ARG middle . . 73 B 7 THR middle . . 74 B 8 GLU middle . . 75 B 9 PHE middle . . 76 B 10 SER middle . . 77 B 11 GLU middle . . 78 B 12 GLU middle . . 79 B 13 GLN middle . . 80 B 14 LYS middle . . 81 B 15 LYS middle . . 82 B 16 ALA middle . . 83 B 17 LEU middle . . 84 B 18 ASP middle . . 85 B 19 LEU middle . . 86 B 20 ALA middle . . 87 B 21 PHE middle . . 88 B 22 TYR middle . . 89 B 23 PHE middle . . 90 B 24 ASP middle . . 91 B 25 ARG middle . . 92 B 26 ARG middle . . 93 B 27 LEU middle . . 94 B 28 THR middle . . 95 B 29 PRO middle . false 96 B 30 GLU middle . . 97 B 31 TRP middle . . 98 B 32 ARG middle . . 99 B 33 ARG middle . . 100 B 34 TYR middle . . 101 B 35 LEU middle . . 102 B 36 SER middle . . 103 B 37 GLN middle . . 104 B 38 ARG middle . . 105 B 39 LEU middle . . 106 B 40 GLY middle . false 107 B 41 LEU middle . . 108 B 42 ASN middle . . 109 B 43 GLU middle . . 110 B 44 GLU middle . . 111 B 45 GLN middle . . 112 B 46 ILE middle . . 113 B 47 GLU middle . . 114 B 48 ARG middle . . 115 B 49 TRP middle . . 116 B 50 PHE middle . . 117 B 51 ARG middle . . 118 B 52 ARG middle . . 119 B 53 LYS middle . . 120 B 54 GLU middle . . 121 B 55 GLN middle . . 122 B 56 GLN middle . . 123 B 57 ILE middle . . 124 B 58 GLY middle . false 125 B 59 TRP middle . . 126 B 60 SER middle . . 127 B 61 HIS middle . . 128 B 62 PRO middle . false 129 B 63 GLN middle . . 130 B 64 PHE middle . . 131 B 65 GLU middle . . 132 B 66 LYS end . . stop_ save_ save_assigned_chem_shift_list_1 _nef_chemical_shift_list.sf_category nef_chemical_shift_list _nef_chemical_shift_list.sf_framecode assigned_chem_shift_list_1 loop_ _nef_chemical_shift.chain_code _nef_chemical_shift.sequence_code _nef_chemical_shift.residue_name _nef_chemical_shift.atom_name _nef_chemical_shift.element _nef_chemical_shift.isotope_number _nef_chemical_shift.value _nef_chemical_shift.value_uncertainty A 1 MET HA H 1 4.139 0.003 A 1 MET HBy H 1 2.151 0.000 A 1 MET C C 13 172.003 0.003 A 1 MET CA C 13 54.770 0.044 A 1 MET CB C 13 32.556 0.072 A 1 MET CG C 13 30.427 0.000 A 2 GLU H H 1 8.763 0.003 A 2 GLU HA H 1 4.370 0.010 A 2 GLU HBy H 1 2.029 0.008 A 2 GLU HBx H 1 1.930 0.009 A 2 GLU HGy H 1 2.287 0.022 A 2 GLU C C 13 175.591 0.057 A 2 GLU CA C 13 55.941 0.034 A 2 GLU CB C 13 30.008 0.070 A 2 GLU CG C 13 35.425 0.047 A 2 GLU N N 15 124.541 0.010 A 3 LYS H H 1 8.455 0.002 A 3 LYS HA H 1 4.289 0.005 A 3 LYS HBx H 1 1.726 0.013 A 3 LYS HBy H 1 1.775 0.020 A 3 LYS HDy H 1 1.664 0.011 A 3 LYS HEx H 1 2.974 0.007 A 3 LYS HEy H 1 2.994 0.000 A 3 LYS HGy H 1 1.444 0.006 A 3 LYS HGx H 1 1.376 0.006 A 3 LYS C C 13 176.040 0.019 A 3 LYS CA C 13 55.997 0.041 A 3 LYS CB C 13 32.657 0.050 A 3 LYS CD C 13 28.833 0.037 A 3 LYS CE C 13 41.845 0.040 A 3 LYS CG C 13 24.414 0.048 A 3 LYS N N 15 123.564 0.024 A 4 ARG H H 1 8.294 0.003 A 4 ARG HA H 1 4.623 0.008 A 4 ARG HBy H 1 1.829 0.016 A 4 ARG HBx H 1 1.700 0.010 A 4 ARG HDy H 1 3.197 0.003 A 4 ARG HGy H 1 1.661 0.007 A 4 ARG C C 13 174.021 0.005 A 4 ARG CA C 13 53.459 0.040 A 4 ARG CB C 13 29.919 0.000 A 4 ARG N N 15 123.374 0.034 A 5 PRO HA H 1 4.418 0.004 A 5 PRO HBy H 1 2.283 0.004 A 5 PRO HBx H 1 1.874 0.004 A 5 PRO C C 13 176.696 0.006 A 5 PRO CA C 13 62.686 0.039 A 5 PRO CB C 13 31.882 0.058 A 5 PRO CD C 13 50.433 0.000 A 5 PRO CG C 13 26.988 0.000 A 5 PRO N N 15 136.738 0.000 A 6 ARG H H 1 8.419 0.002 A 6 ARG HA H 1 4.341 0.006 A 6 ARG HBx H 1 1.815 0.009 A 6 ARG HBy H 1 1.839 0.015 A 6 ARG HDy H 1 3.199 0.005 A 6 ARG HGy H 1 1.648 0.014 A 6 ARG C C 13 176.424 0.010 A 6 ARG CA C 13 56.006 0.037 A 6 ARG CB C 13 30.430 0.024 A 6 ARG CD C 13 43.130 0.047 A 6 ARG CG C 13 26.827 0.094 A 6 ARG N N 15 121.552 0.027 A 7 THR H H 1 8.074 0.005 A 7 THR HA H 1 4.324 0.004 A 7 THR HB H 1 4.190 0.003 A 7 THR HG1 H 1 4.472 0.000 A 7 THR HG2% H 1 1.152 0.003 A 7 THR C C 13 174.013 0.004 A 7 THR CA C 13 61.136 0.042 A 7 THR CB C 13 69.546 0.045 A 7 THR CG2 C 13 21.221 0.000 A 7 THR N N 15 115.248 0.020 A 8 GLU H H 1 8.277 0.007 A 8 GLU HA H 1 4.125 0.006 A 8 GLU HBy H 1 1.805 0.008 A 8 GLU HGy H 1 2.045 0.007 A 8 GLU C C 13 175.398 0.007 A 8 GLU CA C 13 56.663 0.069 A 8 GLU CB C 13 30.203 0.055 A 8 GLU CG C 13 35.203 0.039 A 8 GLU N N 15 124.006 0.015 A 9 PHE H H 1 7.995 0.005 A 9 PHE HA H 1 4.955 0.005 A 9 PHE HBy H 1 3.056 0.012 A 9 PHE HBx H 1 2.814 0.007 A 9 PHE HDx H 1 7.093 0.007 A 9 PHE HDy H 1 7.093 0.007 A 9 PHE HEx H 1 7.096 0.009 A 9 PHE HEy H 1 7.096 0.009 A 9 PHE HZ H 1 7.096 0.009 A 9 PHE C C 13 175.936 0.004 A 9 PHE CA C 13 55.393 0.057 A 9 PHE CB C 13 40.366 0.070 A 9 PHE CDx C 13 131.422 0.059 A 9 PHE CDy C 13 131.422 0.059 A 9 PHE N N 15 118.514 0.027 A 10 SER H H 1 9.115 0.004 A 10 SER HA H 1 4.571 0.010 A 10 SER HBy H 1 4.424 0.016 A 10 SER HBx H 1 3.971 0.005 A 10 SER C C 13 174.977 0.010 A 10 SER CA C 13 56.762 0.052 A 10 SER CB C 13 65.096 0.057 A 10 SER N N 15 119.578 0.026 A 11 GLU H H 1 9.034 0.005 A 11 GLU HA H 1 4.020 0.018 A 11 GLU HBy H 1 2.084 0.008 A 11 GLU C C 13 178.918 0.003 A 11 GLU CA C 13 59.612 0.096 A 11 GLU CB C 13 28.450 0.079 A 11 GLU CG C 13 35.451 0.000 A 11 GLU N N 15 121.401 0.031 A 12 GLU H H 1 8.554 0.009 A 12 GLU HA H 1 3.993 0.015 A 12 GLU HBy H 1 2.002 0.011 A 12 GLU HBx H 1 1.935 0.003 A 12 GLU HGy H 1 2.326 0.008 A 12 GLU C C 13 179.489 0.009 A 12 GLU CA C 13 59.448 0.095 A 12 GLU CB C 13 28.574 0.068 A 12 GLU CG C 13 35.848 0.042 A 12 GLU N N 15 117.977 0.016 A 13 GLN H H 1 7.781 0.004 A 13 GLN HA H 1 3.805 0.007 A 13 GLN HBx H 1 1.997 0.002 A 13 GLN HBy H 1 2.511 0.006 A 13 GLN HGx H 1 2.260 0.020 A 13 GLN HGy H 1 2.399 0.000 A 13 GLN C C 13 177.230 0.003 A 13 GLN CA C 13 58.867 0.064 A 13 GLN CB C 13 27.840 0.087 A 13 GLN CG C 13 34.696 0.082 A 13 GLN N N 15 119.707 0.044 A 14 LYS H H 1 8.225 0.009 A 14 LYS HA H 1 3.295 0.004 A 14 LYS HBy H 1 1.885 0.015 A 14 LYS HBx H 1 1.859 0.010 A 14 LYS HDy H 1 1.609 0.012 A 14 LYS HEy H 1 2.984 0.025 A 14 LYS HGy H 1 1.229 0.003 A 14 LYS C C 13 178.112 0.014 A 14 LYS CA C 13 60.137 0.033 A 14 LYS CB C 13 32.002 0.052 A 14 LYS CD C 13 28.657 0.000 A 14 LYS CE C 13 41.807 0.000 A 14 LYS CG C 13 25.560 0.000 A 14 LYS N N 15 118.090 0.034 A 15 LYS H H 1 7.782 0.007 A 15 LYS HA H 1 4.067 0.017 A 15 LYS HBy H 1 1.841 0.006 A 15 LYS HDy H 1 1.608 0.012 A 15 LYS HEy H 1 2.962 0.010 A 15 LYS HGy H 1 1.445 0.005 A 15 LYS C C 13 178.895 0.008 A 15 LYS CA C 13 58.979 0.037 A 15 LYS CB C 13 32.140 0.026 A 15 LYS CD C 13 29.153 0.000 A 15 LYS CE C 13 41.530 0.000 A 15 LYS CG C 13 25.007 0.065 A 15 LYS N N 15 117.469 0.040 A 16 ALA H H 1 7.624 0.005 A 16 ALA HA H 1 4.109 0.015 A 16 ALA HB% H 1 1.405 0.007 A 16 ALA C C 13 179.645 0.012 A 16 ALA CA C 13 54.699 0.062 A 16 ALA CB C 13 18.931 0.068 A 16 ALA N N 15 121.158 0.024 A 17 LEU H H 1 8.106 0.008 A 17 LEU HA H 1 3.569 0.012 A 17 LEU HBy H 1 0.666 0.016 A 17 LEU HBx H 1 -0.433 0.012 A 17 LEU HDx% H 1 0.388 0.018 A 17 LEU HDy% H 1 -0.426 0.009 A 17 LEU HG H 1 1.042 0.012 A 17 LEU C C 13 178.076 0.004 A 17 LEU CA C 13 57.555 0.056 A 17 LEU CB C 13 38.604 0.059 A 17 LEU CDy C 13 26.080 0.086 A 17 LEU CDx C 13 23.844 0.045 A 17 LEU N N 15 119.559 0.049 A 18 ASP H H 1 7.793 0.009 A 18 ASP HA H 1 4.530 0.007 A 18 ASP HBy H 1 2.927 0.008 A 18 ASP HBx H 1 2.707 0.003 A 18 ASP C C 13 178.373 0.023 A 18 ASP CA C 13 57.560 0.048 A 18 ASP CB C 13 40.147 0.013 A 18 ASP N N 15 119.158 0.087 A 19 LEU H H 1 7.760 0.004 A 19 LEU HA H 1 4.282 0.008 A 19 LEU HBy H 1 1.770 0.008 A 19 LEU HDy% H 1 0.984 0.009 A 19 LEU C C 13 179.010 0.000 A 19 LEU CA C 13 58.028 0.027 A 19 LEU CB C 13 41.953 0.065 A 19 LEU CDy C 13 23.656 0.053 A 19 LEU CG C 13 26.871 0.015 A 19 LEU N N 15 118.661 0.043 A 20 ALA H H 1 7.010 0.020 A 20 ALA HA H 1 4.034 0.016 A 20 ALA HB% H 1 1.521 0.005 A 20 ALA C C 13 178.016 0.000 A 20 ALA CA C 13 55.402 0.044 A 20 ALA CB C 13 18.754 0.033 A 21 PHE H H 1 8.579 0.007 A 21 PHE HA H 1 4.698 0.008 A 21 PHE HBy H 1 3.271 0.000 A 21 PHE HDx H 1 6.868 0.022 A 21 PHE HDy H 1 6.868 0.022 A 21 PHE HEx H 1 6.871 0.023 A 21 PHE HEy H 1 6.871 0.023 A 21 PHE HZ H 1 7.077 0.012 A 21 PHE C C 13 175.561 0.000 A 21 PHE CA C 13 56.915 0.059 A 21 PHE N N 15 119.009 0.045 A 23 PHE HA H 1 4.355 0.008 A 23 PHE HBy H 1 2.974 0.000 A 23 PHE N N 15 115.672 0.005 A 24 ASP H H 1 8.286 0.002 A 24 ASP HA H 1 4.945 0.010 A 24 ASP HBx H 1 1.926 0.002 A 24 ASP HBy H 1 2.022 0.000 A 24 ASP C C 13 175.424 0.006 A 24 ASP CA C 13 55.794 0.000 A 24 ASP N N 15 119.725 0.055 A 25 ARG H H 1 8.398 0.002 A 25 ARG HA H 1 4.261 0.006 A 25 ARG HBy H 1 1.760 0.008 A 25 ARG C C 13 175.296 0.021 A 25 ARG CA C 13 56.053 0.012 A 25 ARG CB C 13 32.743 0.011 A 25 ARG N N 15 124.145 0.053 A 26 ARG H H 1 8.110 0.002 A 26 ARG HA H 1 4.404 0.005 A 26 ARG HBy H 1 1.744 0.000 A 26 ARG HBx H 1 1.673 0.011 A 26 ARG HDy H 1 3.175 0.002 A 26 ARG C C 13 174.287 0.000 A 26 ARG CA C 13 53.127 0.087 A 26 ARG CB C 13 31.506 0.050 A 26 ARG N N 15 122.273 0.019 A 27 LEU H H 1 8.506 0.002 A 27 LEU HA H 1 4.428 0.011 A 27 LEU HBy H 1 1.735 0.006 A 27 LEU HBx H 1 1.242 0.007 A 27 LEU HDx% H 1 0.188 0.007 A 27 LEU HDy% H 1 0.410 0.007 A 27 LEU HG H 1 1.321 0.010 A 27 LEU C C 13 176.021 0.019 A 27 LEU CA C 13 54.345 0.047 A 27 LEU CB C 13 40.002 0.088 A 27 LEU CDx C 13 23.381 0.072 A 27 LEU CDy C 13 24.928 0.072 A 27 LEU CG C 13 26.374 0.000 A 27 LEU N N 15 123.602 0.008 A 28 THR H H 1 7.542 0.006 A 28 THR HA H 1 4.688 0.013 A 28 THR HB H 1 4.773 0.006 A 28 THR HG2% H 1 1.324 0.015 A 28 THR C C 13 173.074 0.010 A 28 THR CA C 13 59.395 0.027 A 28 THR CB C 13 68.448 0.072 A 28 THR N N 15 117.302 0.034 A 29 PRO HA H 1 4.123 0.010 A 29 PRO HBy H 1 2.404 0.011 A 29 PRO HBx H 1 1.966 0.016 A 29 PRO HDy H 1 3.938 0.009 A 29 PRO C C 13 179.121 0.008 A 29 PRO CA C 13 65.848 0.041 A 29 PRO CB C 13 31.539 0.028 A 29 PRO N N 15 135.661 0.000 A 30 GLU H H 1 9.126 0.005 A 30 GLU HA H 1 4.140 0.008 A 30 GLU HBy H 1 2.338 0.007 A 30 GLU HBx H 1 2.067 0.013 A 30 GLU HGy H 1 2.580 0.000 A 30 GLU CA C 13 60.175 0.002 A 30 GLU CB C 13 28.432 0.000 A 30 GLU N N 15 116.125 0.028 A 31 TRP H H 1 7.900 0.008 A 31 TRP HA H 1 4.654 0.018 A 31 TRP HBx H 1 3.224 0.004 A 31 TRP HBy H 1 3.536 0.017 A 31 TRP C C 13 176.957 0.000 A 31 TRP CA C 13 56.284 0.000 A 31 TRP CB C 13 30.397 0.000 A 31 TRP N N 15 124.774 0.049 A 32 ARG H H 1 8.629 0.005 A 32 ARG HA H 1 3.503 0.004 A 32 ARG HBy H 1 2.032 0.008 A 32 ARG HBx H 1 1.529 0.019 A 32 ARG HDx H 1 3.110 0.002 A 32 ARG HDy H 1 3.115 0.003 A 32 ARG HE H 1 7.254 0.011 A 32 ARG HGy H 1 1.412 0.000 A 32 ARG C C 13 177.825 0.005 A 32 ARG CA C 13 59.947 0.036 A 32 ARG CB C 13 30.754 0.030 A 32 ARG CD C 13 43.665 0.000 A 32 ARG CG C 13 27.490 0.000 A 32 ARG N N 15 118.306 0.020 A 33 ARG H H 1 8.164 0.009 A 33 ARG HA H 1 3.942 0.008 A 33 ARG HBx H 1 1.936 0.015 A 33 ARG HBy H 1 2.009 0.000 A 33 ARG HDy H 1 3.261 0.007 A 33 ARG HE H 1 7.479 0.000 A 33 ARG HGy H 1 1.707 0.002 A 33 ARG C C 13 178.329 0.003 A 33 ARG CA C 13 59.220 0.061 A 33 ARG CB C 13 29.737 0.068 A 33 ARG CD C 13 43.025 0.000 A 33 ARG CG C 13 26.991 0.000 A 33 ARG N N 15 118.366 0.054 A 34 TYR H H 1 7.983 0.005 A 34 TYR HA H 1 4.087 0.010 A 34 TYR HBy H 1 3.236 0.009 A 34 TYR HBx H 1 3.064 0.006 A 34 TYR HDx H 1 6.968 0.017 A 34 TYR HDy H 1 6.968 0.017 A 34 TYR C C 13 177.395 0.012 A 34 TYR CA C 13 61.817 0.028 A 34 TYR CB C 13 38.026 0.037 A 34 TYR CDx C 13 133.201 0.057 A 34 TYR CDy C 13 133.201 0.057 A 34 TYR N N 15 120.565 0.012 A 35 LEU H H 1 8.376 0.002 A 35 LEU HA H 1 3.430 0.017 A 35 LEU HBx H 1 0.738 0.007 A 35 LEU HBy H 1 1.531 0.009 A 35 LEU HDx% H 1 -0.198 0.017 A 35 LEU HDy% H 1 0.195 0.008 A 35 LEU C C 13 178.458 0.018 A 35 LEU CA C 13 57.288 0.042 A 35 LEU CB C 13 42.089 0.081 A 35 LEU CDy C 13 24.696 0.000 A 35 LEU CDx C 13 22.170 0.045 A 35 LEU N N 15 118.260 0.064 A 36 SER H H 1 7.860 0.002 A 36 SER HA H 1 4.069 0.010 A 36 SER HBx H 1 3.898 0.013 A 36 SER HBy H 1 3.927 0.004 A 36 SER HG H 1 4.673 0.000 A 36 SER C C 13 178.481 0.000 A 36 SER CA C 13 60.901 0.020 A 36 SER CB C 13 63.222 0.035 A 36 SER N N 15 113.787 0.011 A 37 GLN H H 1 7.744 0.002 A 37 GLN HA H 1 4.225 0.020 A 37 GLN HBy H 1 1.998 0.016 A 37 GLN HBx H 1 1.864 0.002 A 37 GLN C C 13 174.789 0.003 A 37 GLN CA C 13 55.821 0.055 A 37 GLN CB C 13 29.728 0.049 A 37 GLN CG C 13 34.614 0.000 A 37 GLN N N 15 119.515 0.031 A 38 ARG H H 1 7.795 0.001 A 38 ARG HA H 1 4.101 0.014 A 38 ARG HBy H 1 1.764 0.007 A 38 ARG HBx H 1 1.672 0.007 A 38 ARG HDy H 1 3.201 0.000 A 38 ARG HGy H 1 1.344 0.021 A 38 ARG C C 13 180.785 0.000 A 38 ARG CA C 13 57.062 0.094 A 38 ARG CB C 13 29.668 0.074 A 38 ARG CD C 13 42.908 0.000 A 38 ARG CG C 13 26.854 0.000 A 38 ARG N N 15 126.791 0.028 A 39 LEU H H 1 8.080 0.008 A 39 LEU HA H 1 4.331 0.005 A 39 LEU HBy H 1 1.632 0.014 A 39 LEU HBx H 1 1.307 0.007 A 39 LEU HDx% H 1 0.665 0.013 A 39 LEU HDy% H 1 0.615 0.013 A 39 LEU HG H 1 1.588 0.016 A 39 LEU C C 13 177.373 0.003 A 39 LEU CA C 13 54.274 0.052 A 39 LEU CB C 13 42.469 0.037 A 39 LEU CDx C 13 22.651 0.013 A 39 LEU CDy C 13 25.566 0.000 A 39 LEU CG C 13 26.888 0.054 A 39 LEU N N 15 113.908 0.065 A 40 GLY H H 1 7.597 0.003 A 40 GLY HAx H 1 3.853 0.009 A 40 GLY C C 13 174.050 0.006 A 40 GLY CA C 13 46.540 0.057 A 40 GLY N N 15 109.188 0.011 A 41 LEU H H 1 7.118 0.004 A 41 LEU HA H 1 4.678 0.008 A 41 LEU HBy H 1 1.369 0.015 A 41 LEU HBx H 1 1.138 0.011 A 41 LEU HDx% H 1 0.714 0.007 A 41 LEU HDy% H 1 0.478 0.013 A 41 LEU HG H 1 1.334 0.017 A 41 LEU C C 13 175.741 0.010 A 41 LEU CA C 13 51.977 0.062 A 41 LEU CB C 13 46.181 0.074 A 41 LEU CDx C 13 23.205 0.023 A 41 LEU CG C 13 26.278 0.062 A 41 LEU N N 15 118.237 0.018 A 42 ASN H H 1 8.877 0.004 A 42 ASN HA H 1 4.712 0.007 A 42 ASN HBy H 1 3.055 0.005 A 42 ASN HBx H 1 2.850 0.003 A 42 ASN HD2y H 1 7.546 0.001 A 42 ASN HD2x H 1 7.128 0.000 A 42 ASN C C 13 176.294 0.005 A 42 ASN CA C 13 52.300 0.056 A 42 ASN CB C 13 38.684 0.041 A 42 ASN N N 15 119.260 0.014 A 43 GLU H H 1 8.953 0.005 A 43 GLU HA H 1 3.656 0.006 A 43 GLU HBy H 1 1.958 0.019 A 43 GLU HGy H 1 2.599 0.003 A 43 GLU C C 13 178.035 0.011 A 43 GLU CA C 13 61.358 0.043 A 43 GLU CB C 13 29.466 0.011 A 43 GLU CG C 13 37.940 0.028 A 43 GLU N N 15 120.734 0.027 A 44 GLU H H 1 8.577 0.009 A 44 GLU HA H 1 4.111 0.008 A 44 GLU HBy H 1 2.084 0.012 A 44 GLU HGx H 1 2.343 0.010 A 44 GLU HGy H 1 2.490 0.000 A 44 GLU C C 13 179.071 0.003 A 44 GLU CA C 13 59.336 0.021 A 44 GLU CB C 13 28.181 0.056 A 44 GLU CG C 13 35.385 0.000 A 44 GLU N N 15 119.055 0.024 A 45 GLN H H 1 7.941 0.010 A 45 GLN HA H 1 4.109 0.010 A 45 GLN HBx H 1 2.041 0.012 A 45 GLN HBy H 1 2.487 0.010 A 45 GLN HE2y H 1 7.218 0.000 A 45 GLN HE2x H 1 6.810 0.010 A 45 GLN HGx H 1 2.441 0.004 A 45 GLN HGy H 1 2.555 0.019 A 45 GLN C C 13 178.782 0.015 A 45 GLN CA C 13 58.887 0.056 A 45 GLN CB C 13 29.344 0.094 A 45 GLN CG C 13 34.880 0.045 A 45 GLN N N 15 118.627 0.013 A 46 ILE H H 1 7.473 0.006 A 46 ILE HA H 1 3.640 0.005 A 46 ILE HB H 1 1.930 0.004 A 46 ILE HD1% H 1 0.539 0.008 A 46 ILE HG1y H 1 1.458 0.010 A 46 ILE HG1x H 1 1.039 0.014 A 46 ILE HG2% H 1 0.653 0.006 A 46 ILE C C 13 177.392 0.008 A 46 ILE CA C 13 64.251 0.065 A 46 ILE CB C 13 36.949 0.046 A 46 ILE CD1 C 13 12.639 0.044 A 46 ILE CG1 C 13 27.917 0.000 A 46 ILE CG2 C 13 18.352 0.067 A 46 ILE N N 15 118.838 0.018 A 47 GLU H H 1 8.169 0.005 A 47 GLU HA H 1 3.855 0.007 A 47 GLU HBx H 1 2.148 0.003 A 47 GLU HBy H 1 2.157 0.007 A 47 GLU HGx H 1 2.310 0.006 A 47 GLU HGy H 1 2.313 0.004 A 47 GLU C C 13 178.674 0.022 A 47 GLU CA C 13 59.641 0.036 A 47 GLU CB C 13 28.924 0.051 A 47 GLU CG C 13 34.937 0.000 A 47 GLU N N 15 119.007 0.033 A 48 ARG H H 1 8.299 0.005 A 48 ARG HA H 1 4.024 0.013 A 48 ARG HBy H 1 2.123 0.000 A 48 ARG HBx H 1 2.037 0.017 A 48 ARG HDy H 1 3.293 0.013 A 48 ARG HDx H 1 3.276 0.008 A 48 ARG HE H 1 7.474 0.009 A 48 ARG HGy H 1 1.937 0.000 A 48 ARG HGx H 1 1.880 0.005 A 48 ARG C C 13 178.682 0.026 A 48 ARG CA C 13 59.590 0.033 A 48 ARG CB C 13 29.969 0.058 A 48 ARG CD C 13 43.357 0.048 A 48 ARG CG C 13 27.396 0.091 A 48 ARG N N 15 118.349 0.022 A 49 TRP H H 1 8.265 0.002 A 49 TRP HA H 1 3.976 0.011 A 49 TRP HBy H 1 3.531 0.015 A 49 TRP HBx H 1 3.305 0.007 A 49 TRP HD1 H 1 6.524 0.005 A 49 TRP HE1 H 1 9.585 0.010 A 49 TRP C C 13 178.736 0.023 A 49 TRP CA C 13 61.963 0.037 A 49 TRP CB C 13 29.001 0.053 A 49 TRP CD1 C 13 125.910 0.055 A 49 TRP N N 15 120.853 0.019 A 50 PHE H H 1 8.919 0.006 A 50 PHE HA H 1 4.016 0.005 A 50 PHE HBy H 1 3.551 0.015 A 50 PHE HBx H 1 3.303 0.008 A 50 PHE HDx H 1 7.754 0.002 A 50 PHE HDy H 1 7.754 0.002 A 50 PHE HEx H 1 7.439 0.004 A 50 PHE HEy H 1 7.439 0.004 A 50 PHE HZ H 1 7.079 0.012 A 50 PHE C C 13 177.941 0.036 A 50 PHE CA C 13 62.076 0.059 A 50 PHE CB C 13 38.790 0.061 A 50 PHE CDx C 13 131.825 0.032 A 50 PHE CDy C 13 131.825 0.032 A 50 PHE N N 15 120.046 0.033 A 51 ARG H H 1 8.382 0.007 A 51 ARG HA H 1 4.137 0.014 A 51 ARG HBx H 1 1.897 0.006 A 51 ARG HBy H 1 2.002 0.006 A 51 ARG HDy H 1 3.250 0.008 A 51 ARG HDx H 1 3.234 0.017 A 51 ARG HE H 1 6.952 0.000 A 51 ARG HGx H 1 1.731 0.009 A 51 ARG HGy H 1 1.731 0.009 A 51 ARG C C 13 179.065 0.011 A 51 ARG CA C 13 58.977 0.042 A 51 ARG CB C 13 29.601 0.062 A 51 ARG CD C 13 43.217 0.037 A 51 ARG CG C 13 27.180 0.000 A 51 ARG N N 15 117.863 0.027 A 52 ARG H H 1 7.753 0.004 A 52 ARG HA H 1 3.949 0.006 A 52 ARG HBy H 1 1.661 0.014 A 52 ARG HBx H 1 1.633 0.015 A 52 ARG HDx H 1 2.988 0.001 A 52 ARG HDy H 1 2.991 0.026 A 52 ARG HE H 1 7.090 0.015 A 52 ARG HGy H 1 1.448 0.000 A 52 ARG HGx H 1 1.395 0.006 A 52 ARG C C 13 178.452 0.022 A 52 ARG CA C 13 58.404 0.070 A 52 ARG CB C 13 29.139 0.059 A 52 ARG CD C 13 43.001 0.068 A 52 ARG CG C 13 26.647 0.076 A 52 ARG N N 15 119.300 0.011 A 53 LYS H H 1 7.725 0.006 A 53 LYS HA H 1 3.462 0.009 A 53 LYS HBy H 1 0.795 0.006 A 53 LYS HBx H 1 0.357 0.006 A 53 LYS HDy H 1 1.020 0.014 A 53 LYS HDx H 1 0.620 0.003 A 53 LYS HEx H 1 2.252 0.004 A 53 LYS HEy H 1 2.262 0.005 A 53 LYS HGx H 1 -0.123 0.009 A 53 LYS HGy H 1 0.045 0.005 A 53 LYS C C 13 178.518 0.014 A 53 LYS CA C 13 57.235 0.042 A 53 LYS CB C 13 30.299 0.059 A 53 LYS CG C 13 22.317 0.073 A 53 LYS N N 15 121.061 0.016 A 54 GLU H H 1 8.017 0.004 A 54 GLU HA H 1 4.013 0.014 A 54 GLU HBx H 1 2.149 0.006 A 54 GLU HBy H 1 2.300 0.005 A 54 GLU HGy H 1 2.632 0.007 A 54 GLU HGx H 1 2.564 0.007 A 54 GLU C C 13 178.377 0.008 A 54 GLU CA C 13 58.478 0.048 A 54 GLU CB C 13 28.780 0.065 A 54 GLU CG C 13 34.973 0.065 A 54 GLU N N 15 117.038 0.018 A 55 GLN H H 1 7.567 0.008 A 55 GLN HA H 1 4.066 0.010 A 55 GLN HBy H 1 2.098 0.007 A 55 GLN HBx H 1 2.092 0.007 A 55 GLN HGy H 1 2.484 0.004 A 55 GLN HGx H 1 2.307 0.011 A 55 GLN C C 13 177.422 0.007 A 55 GLN CA C 13 57.349 0.031 A 55 GLN CB C 13 28.325 0.048 A 55 GLN CG C 13 33.732 0.000 A 55 GLN N N 15 117.416 0.012 A 56 GLN H H 1 7.767 0.003 A 56 GLN HA H 1 3.988 0.007 A 56 GLN HBy H 1 2.000 0.005 A 56 GLN HBx H 1 1.990 0.000 A 56 GLN HGy H 1 2.365 0.002 A 56 GLN HGx H 1 2.339 0.019 A 56 GLN C C 13 177.429 0.011 A 56 GLN CA C 13 57.106 0.035 A 56 GLN CB C 13 28.433 0.029 A 56 GLN CG C 13 33.438 0.000 A 56 GLN N N 15 118.686 0.013 A 57 ILE H H 1 7.794 0.002 A 57 ILE HA H 1 4.095 0.013 A 57 ILE HB H 1 1.925 0.007 A 57 ILE HD1% H 1 0.918 0.000 A 57 ILE HG1y H 1 1.452 0.003 A 57 ILE HG1x H 1 1.260 0.005 A 57 ILE HG2% H 1 0.849 0.006 A 57 ILE C C 13 177.112 0.024 A 57 ILE CA C 13 61.911 0.047 A 57 ILE CB C 13 38.074 0.070 A 57 ILE CD1 C 13 13.213 0.000 A 57 ILE CG1 C 13 27.127 0.000 A 57 ILE CG2 C 13 17.000 0.000 A 57 ILE N N 15 117.370 0.040 A 58 GLY H H 1 7.969 0.005 A 58 GLY HAx H 1 3.927 0.008 A 58 GLY C C 13 174.218 0.005 A 58 GLY CA C 13 45.456 0.033 A 58 GLY N N 15 110.313 0.009 A 59 TRP H H 1 7.906 0.006 A 59 TRP HA H 1 4.697 0.006 A 59 TRP HBy H 1 3.291 0.014 A 59 TRP HBx H 1 3.205 0.005 A 59 TRP HD1 H 1 7.201 0.003 A 59 TRP HE1 H 1 10.055 0.000 A 59 TRP C C 13 176.145 0.003 A 59 TRP CA C 13 56.824 0.035 A 59 TRP CB C 13 29.329 0.061 A 59 TRP CD1 C 13 127.018 0.059 A 59 TRP N N 15 120.682 0.007 A 60 SER H H 1 7.942 0.004 A 60 SER HA H 1 4.319 0.007 A 60 SER HBy H 1 3.698 0.008 A 60 SER HBx H 1 3.668 0.010 A 60 SER HG H 1 4.663 0.020 A 60 SER C C 13 173.518 0.010 A 60 SER CA C 13 57.965 0.041 A 60 SER CB C 13 63.521 0.056 A 60 SER N N 15 116.397 0.008 A 61 HIS H H 1 8.113 0.003 A 61 HIS HA H 1 4.847 0.015 A 61 HIS HBy H 1 3.148 0.007 A 61 HIS HBx H 1 3.044 0.005 A 61 HIS HD1 H 1 7.201 0.004 A 61 HIS CA C 13 53.092 0.015 A 61 HIS CB C 13 28.289 0.056 A 61 HIS CD2 C 13 121.486 0.000 A 61 HIS N N 15 119.966 0.008 A 62 PRO HA H 1 4.329 0.006 A 62 PRO HBy H 1 2.179 0.005 A 62 PRO HBx H 1 1.715 0.004 A 62 PRO HDx H 1 3.498 0.006 A 62 PRO HDy H 1 3.668 0.005 A 62 PRO HGx H 1 1.923 0.006 A 62 PRO HGy H 1 1.929 0.000 A 62 PRO C C 13 176.637 0.009 A 62 PRO CA C 13 62.974 0.060 A 62 PRO CB C 13 31.745 0.055 A 62 PRO CD C 13 50.306 0.030 A 62 PRO CG C 13 27.189 0.000 A 62 PRO N N 15 137.018 0.000 A 63 GLN H H 1 8.396 0.002 A 63 GLN HA H 1 4.210 0.005 A 63 GLN HBx H 1 1.869 0.012 A 63 GLN HBy H 1 1.918 0.009 A 63 GLN HE2x H 1 7.391 0.000 A 63 GLN HE2y H 1 7.391 0.000 A 63 GLN HGx H 1 2.181 0.004 A 63 GLN HGy H 1 2.221 0.000 A 63 GLN C C 13 175.415 0.044 A 63 GLN CA C 13 55.754 0.036 A 63 GLN CB C 13 29.063 0.031 A 63 GLN CG C 13 33.328 0.000 A 63 GLN N N 15 120.593 0.005 A 64 PHE H H 1 8.060 0.004 A 64 PHE HA H 1 4.655 0.009 A 64 PHE HBx H 1 2.984 0.004 A 64 PHE HBy H 1 3.153 0.009 A 64 PHE HDx H 1 7.216 0.004 A 64 PHE HDy H 1 7.216 0.004 A 64 PHE C C 13 175.287 0.008 A 64 PHE CA C 13 57.044 0.038 A 64 PHE CB C 13 39.216 0.039 A 64 PHE N N 15 120.113 0.008 A 65 GLU H H 1 8.184 0.003 A 65 GLU HA H 1 4.293 0.005 A 65 GLU HBx H 1 1.875 0.014 A 65 GLU HBy H 1 2.043 0.007 A 65 GLU HGx H 1 2.259 0.011 A 65 GLU HGy H 1 2.264 0.000 A 65 GLU C C 13 174.854 0.004 A 65 GLU CA C 13 55.907 0.015 A 65 GLU CB C 13 29.748 0.015 A 65 GLU CG C 13 34.690 0.000 A 65 GLU N N 15 122.245 0.015 A 66 LYS H H 1 7.834 0.002 A 66 LYS HA H 1 4.113 0.005 A 66 LYS HBy H 1 1.796 0.005 A 66 LYS HBx H 1 1.690 0.004 A 66 LYS HDx H 1 1.450 0.000 A 66 LYS HDy H 1 1.451 0.000 A 66 LYS HEy H 1 2.979 0.001 A 66 LYS HEx H 1 2.977 0.002 A 66 LYS HGy H 1 1.367 0.007 A 66 LYS HGx H 1 1.364 0.007 A 66 LYS HZ1 H 1 7.271 0.000 A 66 LYS HZ2 H 1 7.271 0.000 A 66 LYS HZ3 H 1 7.271 0.000 A 66 LYS C C 13 180.811 0.002 A 66 LYS CA C 13 57.297 0.009 A 66 LYS CB C 13 33.347 0.063 A 66 LYS N N 15 126.897 0.036 stop_ save_ save_CNS/XPLOR_distance_constraints_4 _nef_distance_restraint_list.sf_category nef_distance_restraint_list _nef_distance_restraint_list.sf_framecode CNS/XPLOR_distance_constraints_4 _nef_distance_restraint_list.restraint_origin noe _nef_distance_restraint_list.potential_type square-well-parabolic loop_ _nef_distance_restraint.index _nef_distance_restraint.restraint_id _nef_distance_restraint.chain_code_1 _nef_distance_restraint.sequence_code_1 _nef_distance_restraint.residue_name_1 _nef_distance_restraint.atom_name_1 _nef_distance_restraint.chain_code_2 _nef_distance_restraint.sequence_code_2 _nef_distance_restraint.residue_name_2 _nef_distance_restraint.atom_name_2 _nef_distance_restraint.weight _nef_distance_restraint.lower_limit _nef_distance_restraint.upper_limit 1 1 A 34 TYR HDx A 20 ALA HB% 1.0 0.000 6.000 2 1 A 34 TYR HDx A 32 ARG HBy 1.0 0.000 6.000 3 1 A 34 TYR HDy A 32 ARG HBy 1.0 0.000 6.000 4 1 A 20 ALA HB% A 34 TYR HDy 1.0 0.000 6.000 5 2 B 34 TYR HDx B 32 ARG HBx 1.0 0.000 6.000 6 2 B 34 TYR HDx B 20 ALA HB1 1.0 0.000 6.000 7 2 B 34 TYR HDy B 32 ARG HBx 1.0 0.000 6.000 8 2 B 20 ALA HB1 B 34 TYR HDy 1.0 0.000 6.000 9 3 A 9 PHE HDx A 48 ARG HDy 1.0 0.000 6.000 10 3 A 48 ARG HDx A 9 PHE HDy 1.0 0.000 6.000 11 3 A 9 PHE HDx A 48 ARG HDx 1.0 0.000 6.000 12 3 A 9 PHE HDy A 48 ARG HDy 1.0 0.000 6.000 13 4 B 9 PHE HDx B 48 ARG HDx 1.0 0.000 6.000 14 4 B 48 ARG HDy B 9 PHE HDy 1.0 0.000 6.000 15 4 B 9 PHE HDx B 48 ARG HDy 1.0 0.000 6.000 16 4 B 9 PHE HDy B 48 ARG HDx 1.0 0.000 6.000 17 5 A 49 TRP HD1 A 52 ARG H 1.0 0.000 6.000 18 5 A 49 TRP HD1 A 53 LYS H 1.0 0.000 6.000 19 5 A 49 TRP HD1 A 50 PHE HDy 1.0 0.000 6.000 20 5 A 49 TRP HD1 A 50 PHE HDx 1.0 0.000 6.000 21 6 B 49 TRP HD1 B 53 LYS H 1.0 0.000 6.000 22 6 B 49 TRP HD1 B 52 ARG H 1.0 0.000 6.000 23 6 B 49 TRP HD1 B 50 PHE HDy 1.0 0.000 6.000 24 6 B 49 TRP HD1 B 50 PHE HDx 1.0 0.000 6.000 25 7 A 49 TRP HD1 A 17 LEU HBy 1.0 1.920 4.482 26 7 A 49 TRP HD1 A 17 LEU HDy% 1.0 1.920 4.482 27 8 B 49 TRP HD1 B 17 LEU HBx 1.0 1.920 4.482 28 8 B 49 TRP HD1 B 17 LEU HD21 1.0 1.920 4.482 29 9 B 39 LEU HBy A 16 ALA HB% 1.0 0.000 6.000 30 9 A 16 ALA HB% B 15 LYS HDx 1.0 0.000 6.000 31 10 A 39 LEU HBx B 16 ALA HB1 1.0 0.000 6.000 32 10 B 16 ALA HB1 A 15 LYS HDx 1.0 0.000 6.000 33 11 A 36 SER HBx A 45 GLN HBy 1.0 0.000 6.000 34 11 A 36 SER HBy A 32 ARG HBx 1.0 0.000 6.000 35 12 B 36 SER HBx B 45 GLN HBy 1.0 0.000 6.000 36 12 B 36 SER HBy B 32 ARG HBy 1.0 0.000 6.000 37 13 A 36 SER HBy A 45 GLN HBy 1.0 0.000 6.000 38 13 A 36 SER HBy A 32 ARG HBx 1.0 0.000 6.000 39 14 B 36 SER HBy B 45 GLN HBy 1.0 0.000 6.000 40 14 B 36 SER HBy B 32 ARG HBy 1.0 0.000 6.000 41 15 A 36 SER HBy A 46 ILE HD1% 1.0 1.773 3.535 42 15 A 36 SER HBx A 46 ILE HD1% 1.0 1.773 3.535 43 16 B 36 SER HBy B 46 ILE HD11 1.0 1.773 3.535 44 16 B 36 SER HBx B 46 ILE HD11 1.0 1.773 3.535 45 17 A 57 ILE HA A 60 SER HBy 1.0 0.000 6.000 46 17 A 60 SER HBx A 57 ILE HA 1.0 0.000 6.000 47 18 B 57 ILE HA B 60 SER HBx 1.0 0.000 6.000 48 18 B 60 SER HBy B 57 ILE HA 1.0 0.000 6.000 49 19 A 5 PRO HA A 6 ARG HGx 1.0 1.851 3.967 50 19 A 5 PRO HA A 4 ARG HGx 1.0 1.851 3.967 51 20 B 5 PRO HA B 6 ARG HGx 1.0 1.851 3.967 52 20 B 5 PRO HA B 4 ARG HGx 1.0 1.851 3.967 53 21 A 7 THR HA A 41 LEU HBy 1.0 1.543 2.631 54 21 A 7 THR HA A 7 THR HG2% 1.0 1.543 2.631 55 22 B 7 THR HA B 41 LEU HBx 1.0 1.543 2.631 56 22 B 7 THR HA B 7 THR HG21 1.0 1.543 2.631 57 23 A 11 GLU HA A 14 LYS HBy 1.0 1.520 2.562 58 23 A 48 ARG HA A 48 ARG HGy 1.0 1.520 2.562 59 24 B 11 GLU HA B 14 LYS HBx 1.0 1.520 2.562 60 24 B 48 ARG HA B 48 ARG HGx 1.0 1.520 2.562 61 25 A 44 GLU HGy A 45 GLN HA 1.0 0.000 6.000 62 25 A 44 GLU HA A 44 GLU HGy 1.0 0.000 6.000 63 26 B 44 GLU HGy B 45 GLN HA 1.0 0.000 6.000 64 26 B 44 GLU HA B 44 GLU HGy 1.0 0.000 6.000 65 27 A 7 THR HA A 8 GLU HBx 1.0 0.000 6.000 66 27 A 7 THR HA A 6 ARG HBy 1.0 0.000 6.000 67 27 A 7 THR HA A 4 ARG HBx 1.0 0.000 6.000 68 28 B 7 THR HA B 8 GLU HBx 1.0 0.000 6.000 69 28 B 7 THR HA B 6 ARG HBy 1.0 0.000 6.000 70 28 B 7 THR HA B 4 ARG HBy 1.0 0.000 6.000 71 29 A 53 LYS HA A 56 GLN HBy 1.0 1.794 3.642 72 29 A 53 LYS HA A 56 GLN HBx 1.0 1.794 3.642 73 29 A 35 LEU HA A 37 GLN HBx 1.0 1.794 3.642 74 30 B 53 LYS HA B 56 GLN HBx 1.0 1.794 3.642 75 30 B 53 LYS HA B 56 GLN HBy 1.0 1.794 3.642 76 30 B 35 LEU HA B 37 GLN HBy 1.0 1.794 3.642 77 31 A 53 LYS HA A 54 GLU HA 1.0 0.000 6.000 78 31 A 53 LYS HA A 50 PHE HA 1.0 0.000 6.000 79 32 B 53 LYS HA B 54 GLU HA 1.0 0.000 6.000 80 32 B 53 LYS HA B 50 PHE HA 1.0 0.000 6.000 81 33 A 28 THR HA A 47 GLU HGx 1.0 0.000 6.000 82 33 A 28 THR HA A 47 GLU HGy 1.0 0.000 6.000 83 34 B 28 THR HA B 47 GLU HGx 1.0 0.000 6.000 84 34 B 28 THR HA B 47 GLU HGy 1.0 0.000 6.000 85 35 A 54 GLU HA A 57 ILE HG1x 1.0 1.698 3.194 86 35 A 15 LYS HA A 15 LYS HGx 1.0 1.698 3.194 87 36 B 54 GLU HA B 57 ILE HG1y 1.0 1.698 3.194 88 36 B 15 LYS HA B 15 LYS HGx 1.0 1.698 3.194 89 37 A 48 ARG HA A 52 ARG HBy 1.0 0.000 6.000 90 37 A 48 ARG HA A 52 ARG HBx 1.0 0.000 6.000 91 38 B 48 ARG HA B 52 ARG HBx 1.0 0.000 6.000 92 38 B 48 ARG HA B 52 ARG HBy 1.0 0.000 6.000 93 39 A 11 GLU HA A 14 LYS HBy 1.0 1.534 2.606 94 39 A 15 LYS HA A 15 LYS HBx 1.0 1.534 2.606 95 40 B 11 GLU HA B 14 LYS HBx 1.0 1.534 2.606 96 40 B 15 LYS HA B 15 LYS HBx 1.0 1.534 2.606 97 41 A 6 ARG HA A 6 ARG HBx 1.0 1.541 2.627 98 41 A 6 ARG HBy A 6 ARG HA 1.0 1.541 2.627 99 42 B 6 ARG HA B 6 ARG HBx 1.0 1.541 2.627 100 42 B 6 ARG HBy B 6 ARG HA 1.0 1.541 2.627 101 43 A 35 LEU HA A 39 LEU HDy% 1.0 1.823 3.795 102 43 A 53 LYS HA A 53 LYS HDy 1.0 1.823 3.795 103 44 B 35 LEU HA B 39 LEU HD21 1.0 1.823 3.795 104 44 B 53 LYS HA B 53 LYS HDx 1.0 1.823 3.795 105 45 A 64 PHE HA A 64 PHE HDy 1.0 1.761 3.471 106 45 A 64 PHE HA A 64 PHE HDx 1.0 1.761 3.471 107 45 A 59 TRP HA A 59 TRP HD1 1.0 1.761 3.471 108 46 B 64 PHE HA B 64 PHE HDy 1.0 1.761 3.471 109 46 B 64 PHE HA B 64 PHE HDx 1.0 1.761 3.471 110 46 B 59 TRP HA B 59 TRP HD1 1.0 1.761 3.471 111 47 A 56 GLN HA A 57 ILE H 1.0 1.624 2.908 112 47 A 56 GLN HA A 56 GLN H 1.0 1.624 2.908 113 48 B 56 GLN HA B 57 ILE H 1.0 1.624 2.908 114 48 B 56 GLN HA B 56 GLN H 1.0 1.624 2.908 115 49 A 49 TRP HA A 9 PHE HZ 1.0 1.793 3.631 116 49 A 49 TRP HA A 9 PHE HEy 1.0 1.793 3.631 117 49 A 49 TRP HA A 9 PHE HEx 1.0 1.793 3.631 118 50 B 49 TRP HA B 9 PHE HZ 1.0 1.793 3.631 119 50 B 49 TRP HA B 9 PHE HEy 1.0 1.793 3.631 120 50 B 49 TRP HA B 9 PHE HEx 1.0 1.793 3.631 121 51 A 34 TYR HA A 34 TYR H 1.0 1.635 2.945 122 51 A 57 ILE HA A 58 GLY H 1.0 1.635 2.945 123 52 B 34 TYR HA B 34 TYR H 1.0 1.635 2.945 124 52 B 57 ILE HA B 58 GLY H 1.0 1.635 2.945 125 53 A 50 PHE HDy A 50 PHE HA 1.0 1.736 3.360 126 53 A 50 PHE HDx A 50 PHE HA 1.0 1.736 3.360 127 53 A 53 LYS H A 49 TRP HA 1.0 1.736 3.360 128 53 A 52 ARG H A 49 TRP HA 1.0 1.736 3.360 129 54 B 50 PHE HDx B 50 PHE HA 1.0 1.736 3.360 130 54 B 50 PHE HDy B 50 PHE HA 1.0 1.736 3.360 131 54 B 53 LYS H B 49 TRP HA 1.0 1.736 3.360 132 54 B 52 ARG H B 49 TRP HA 1.0 1.736 3.360 133 55 A 60 SER HBy A 61 HIS H 1.0 1.841 3.899 134 55 A 60 SER HBx A 61 HIS H 1.0 1.841 3.899 135 56 B 60 SER HBx B 61 HIS H 1.0 1.841 3.899 136 56 B 60 SER HBy B 61 HIS H 1.0 1.841 3.899 137 57 A 46 ILE HA A 50 PHE HBy 1.0 1.901 4.315 138 57 A 46 ILE HA A 49 TRP HBy 1.0 1.901 4.315 139 58 B 46 ILE HA B 50 PHE HBx 1.0 1.901 4.315 140 58 B 46 ILE HA B 49 TRP HBx 1.0 1.901 4.315 141 59 A 56 GLN H A 52 ARG HA 1.0 1.665 3.059 142 59 A 52 ARG H A 52 ARG HA 1.0 1.665 3.059 143 60 B 56 GLN H B 52 ARG HA 1.0 1.665 3.059 144 60 B 52 ARG H B 52 ARG HA 1.0 1.665 3.059 145 61 A 45 GLN HA A 45 GLN H 1.0 1.760 3.466 146 61 A 44 GLU HA A 45 GLN H 1.0 1.760 3.466 147 62 B 45 GLN HA B 45 GLN H 1.0 1.760 3.466 148 62 B 44 GLU HA B 45 GLN H 1.0 1.760 3.466 149 63 A 24 ASP HA A 23 PHE HA 1.0 1.879 4.149 150 63 A 7 THR HA A 9 PHE HA 1.0 1.879 4.149 151 64 B 24 ASP HA B 23 PHE HA 1.0 1.879 4.149 152 64 B 7 THR HA B 9 PHE HA 1.0 1.879 4.149 153 65 A 20 ALA HB% A 24 ASP HA 1.0 0.000 6.000 154 65 A 9 PHE HA A 35 LEU HBx 1.0 0.000 6.000 155 66 B 20 ALA HB1 B 24 ASP HA 1.0 0.000 6.000 156 66 B 9 PHE HA B 35 LEU HBx 1.0 0.000 6.000 157 67 A 65 GLU HA A 53 LYS HDx 1.0 0.000 6.000 158 67 A 25 ARG HA B 19 LEU HD21 1.0 0.000 6.000 159 67 A 65 GLU HA A 19 LEU HDy% 1.0 0.000 6.000 160 67 B 19 LEU HD21 A 37 GLN HA 1.0 0.000 6.000 161 68 A 19 LEU HDy% B 25 ARG HA 1.0 0.000 6.000 162 68 B 19 LEU HD21 B 65 GLU HA 1.0 0.000 6.000 163 68 B 65 GLU HA B 53 LYS HDy 1.0 0.000 6.000 164 68 A 19 LEU HDy% B 37 GLN HA 1.0 0.000 6.000 165 69 A 61 HIS HA A 62 PRO HGx 1.0 1.844 3.918 166 69 A 61 HIS HA A 62 PRO HGy 1.0 1.844 3.918 167 70 B 61 HIS HA B 62 PRO HGx 1.0 1.844 3.918 168 70 B 61 HIS HA B 62 PRO HGy 1.0 1.844 3.918 169 71 B 19 LEU HD21 A 16 ALA HA 1.0 1.763 3.483 170 71 A 19 LEU HDy% A 16 ALA HA 1.0 1.763 3.483 171 72 B 19 LEU HD21 B 16 ALA HA 1.0 1.763 3.483 172 72 A 19 LEU HDy% B 16 ALA HA 1.0 1.763 3.483 173 73 A 16 ALA HB% A 16 ALA HA 1.0 1.595 2.807 174 73 B 16 ALA HB1 A 16 ALA HA 1.0 1.595 2.807 175 74 B 16 ALA HB1 B 16 ALA HA 1.0 1.595 2.807 176 74 A 16 ALA HB% B 16 ALA HA 1.0 1.595 2.807 177 75 A 15 LYS HA A 65 GLU HA 1.0 0.000 6.000 178 75 A 25 ARG HA A 20 ALA HA 1.0 0.000 6.000 179 75 A 11 GLU HA A 3 LYS HA 1.0 0.000 6.000 180 76 B 15 LYS HA B 65 GLU HA 1.0 0.000 6.000 181 76 B 25 ARG HA B 20 ALA HA 1.0 0.000 6.000 182 76 B 11 GLU HA B 3 LYS HA 1.0 0.000 6.000 183 77 A 45 GLN HBy A 42 ASN HA 1.0 0.000 6.000 184 77 A 45 GLN HBy A 41 LEU HA 1.0 0.000 6.000 185 78 B 45 GLN HBy B 42 ASN HA 1.0 0.000 6.000 186 78 B 45 GLN HBy B 41 LEU HA 1.0 0.000 6.000 187 79 A 62 PRO HDx A 63 GLN HGy 1.0 1.822 3.788 188 79 A 62 PRO HDx A 62 PRO HBx 1.0 1.822 3.788 189 80 B 62 PRO HDx B 63 GLN HGy 1.0 1.822 3.788 190 80 B 62 PRO HDx B 62 PRO HBy 1.0 1.822 3.788 191 81 A 43 GLU HBx A 32 ARG HDy 1.0 1.829 3.829 192 81 A 32 ARG HDx A 43 GLU HBx 1.0 1.829 3.829 193 82 B 43 GLU HBx B 32 ARG HDy 1.0 1.829 3.829 194 82 B 32 ARG HDx B 43 GLU HBx 1.0 1.829 3.829 195 83 A 32 ARG HBy A 32 ARG HDy 1.0 0.000 6.000 196 83 A 32 ARG HBy A 32 ARG HDx 1.0 0.000 6.000 197 84 B 32 ARG HBx B 32 ARG HDy 1.0 0.000 6.000 198 84 B 32 ARG HBx B 32 ARG HDx 1.0 0.000 6.000 199 85 B 64 PHE HA A 38 ARG HDx 1.0 0.000 6.000 200 85 A 6 ARG HDx A 4 ARG HA 1.0 0.000 6.000 201 86 A 64 PHE HA B 38 ARG HDx 1.0 0.000 6.000 202 86 B 6 ARG HDx B 4 ARG HA 1.0 0.000 6.000 203 87 A 59 TRP HD1 A 51 ARG HDx 1.0 0.000 6.000 204 87 A 59 TRP HD1 A 51 ARG HDy 1.0 0.000 6.000 205 87 A 48 ARG HDy A 45 GLN HE2y 1.0 0.000 6.000 206 87 A 48 ARG HDx A 45 GLN HE2y 1.0 0.000 6.000 207 88 B 59 TRP HD1 B 51 ARG HDy 1.0 0.000 6.000 208 88 B 48 ARG HDx B 45 GLN HE2x 1.0 0.000 6.000 209 88 B 48 ARG HDy B 45 GLN HE2x 1.0 0.000 6.000 210 88 B 59 TRP HD1 B 51 ARG HDx 1.0 0.000 6.000 211 89 A 59 TRP HD1 A 51 ARG HDy 1.0 0.000 6.000 212 89 B 64 PHE HDy A 38 ARG HDx 1.0 0.000 6.000 213 89 B 64 PHE HDx A 38 ARG HDx 1.0 0.000 6.000 214 90 A 64 PHE HDy B 38 ARG HDx 1.0 0.000 6.000 215 90 A 64 PHE HDx B 38 ARG HDx 1.0 0.000 6.000 216 90 B 59 TRP HD1 B 51 ARG HDx 1.0 0.000 6.000 217 91 A 52 ARG H A 51 ARG HDy 1.0 1.696 3.186 218 91 A 52 ARG H A 51 ARG HDx 1.0 1.696 3.186 219 92 B 52 ARG H B 51 ARG HDx 1.0 1.696 3.186 220 92 B 52 ARG H B 51 ARG HDy 1.0 1.696 3.186 221 93 A 34 TYR H A 32 ARG HDx 1.0 0.000 6.000 222 93 A 45 GLN H A 32 ARG HDy 1.0 0.000 6.000 223 93 A 34 TYR H A 32 ARG HDy 1.0 0.000 6.000 224 93 A 45 GLN H A 32 ARG HDx 1.0 0.000 6.000 225 94 B 34 TYR H B 32 ARG HDx 1.0 0.000 6.000 226 94 B 45 GLN H B 32 ARG HDy 1.0 0.000 6.000 227 94 B 34 TYR H B 32 ARG HDy 1.0 0.000 6.000 228 94 B 45 GLN H B 32 ARG HDx 1.0 0.000 6.000 229 95 A 52 ARG HE A 52 ARG HDx 1.0 1.868 4.080 230 95 A 52 ARG HDy A 52 ARG HE 1.0 1.868 4.080 231 96 B 52 ARG HE B 52 ARG HDx 1.0 1.868 4.080 232 96 B 52 ARG HDy B 52 ARG HE 1.0 1.868 4.080 233 97 A 52 ARG HDx A 52 ARG HGy 1.0 1.633 2.937 234 97 A 52 ARG HDy A 52 ARG HGy 1.0 1.633 2.937 235 98 B 52 ARG HDx B 52 ARG HGx 1.0 1.633 2.937 236 98 B 52 ARG HDy B 52 ARG HGx 1.0 1.633 2.937 237 99 A 51 ARG HDy A 55 GLN HGy 1.0 1.678 3.110 238 99 A 51 ARG HDx A 55 GLN HGy 1.0 1.678 3.110 239 100 B 51 ARG HDx B 55 GLN HGx 1.0 1.678 3.110 240 100 B 51 ARG HDy B 55 GLN HGx 1.0 1.678 3.110 241 101 B 16 ALA HA A 19 LEU HBx 1.0 1.945 4.727 242 101 A 16 ALA HA A 19 LEU HBx 1.0 1.945 4.727 243 102 A 16 ALA HA B 19 LEU HBx 1.0 1.945 4.727 244 102 B 16 ALA HA B 19 LEU HBx 1.0 1.945 4.727 245 103 A 3 LYS HEy A 12 GLU HGx 1.0 0.000 6.000 246 103 B 12 GLU HGx A 3 LYS HEx 1.0 0.000 6.000 247 103 A 3 LYS HEy B 12 GLU HGx 1.0 0.000 6.000 248 104 B 12 GLU HGx B 3 LYS HEy 1.0 0.000 6.000 249 104 A 12 GLU HGx B 3 LYS HEx 1.0 0.000 6.000 250 104 A 12 GLU HGx B 3 LYS HEy 1.0 0.000 6.000 251 105 A 4 ARG HBx A 9 PHE HBy 1.0 0.000 6.000 252 105 A 8 GLU HBx A 9 PHE HBy 1.0 0.000 6.000 253 106 B 4 ARG HBy B 9 PHE HBx 1.0 0.000 6.000 254 106 B 8 GLU HBx B 9 PHE HBx 1.0 0.000 6.000 255 107 A 8 GLU HBx A 9 PHE HBx 1.0 0.000 6.000 256 107 A 4 ARG HBx A 9 PHE HBx 1.0 0.000 6.000 257 108 B 8 GLU HBx B 9 PHE HBy 1.0 0.000 6.000 258 108 B 4 ARG HBy B 9 PHE HBy 1.0 0.000 6.000 259 109 A 4 ARG HA A 3 LYS HEx 1.0 0.000 6.000 260 109 A 4 ARG HA A 3 LYS HEy 1.0 0.000 6.000 261 110 B 4 ARG HA B 3 LYS HEx 1.0 0.000 6.000 262 110 B 4 ARG HA B 3 LYS HEy 1.0 0.000 6.000 263 111 A 18 ASP HBx A 19 LEU H 1.0 1.716 3.268 264 111 A 18 ASP HBx A 18 ASP H 1.0 1.716 3.268 265 112 B 18 ASP HBy B 19 LEU H 1.0 1.716 3.268 266 112 B 18 ASP HBy B 18 ASP H 1.0 1.716 3.268 267 113 A 57 ILE HB A 60 SER H 1.0 1.824 3.802 268 113 A 58 GLY H A 57 ILE HB 1.0 1.824 3.802 269 114 B 57 ILE HB B 60 SER H 1.0 1.824 3.802 270 114 B 58 GLY H B 57 ILE HB 1.0 1.824 3.802 271 115 A 54 GLU HGy A 21 PHE HEy 1.0 1.828 3.824 272 115 A 54 GLU HGy A 21 PHE HEx 1.0 1.828 3.824 273 115 A 45 GLN HGx A 45 GLN HE2x 1.0 1.828 3.824 274 116 B 54 GLU HGx B 21 PHE HEy 1.0 1.828 3.824 275 116 B 54 GLU HGx B 21 PHE HEx 1.0 1.828 3.824 276 116 B 45 GLN HGx B 45 GLN HE2y 1.0 1.828 3.824 277 117 A 56 GLN H A 55 GLN HGx 1.0 0.000 6.000 278 117 A 52 ARG H A 55 GLN HGx 1.0 0.000 6.000 279 118 B 56 GLN H B 55 GLN HGy 1.0 0.000 6.000 280 118 B 52 ARG H B 55 GLN HGy 1.0 0.000 6.000 281 119 A 47 GLU HGy A 27 LEU HDy% 1.0 1.705 3.221 282 119 A 47 GLU HGx A 27 LEU HDy% 1.0 1.705 3.221 283 120 B 47 GLU HGy B 27 LEU HD21 1.0 1.705 3.221 284 120 B 47 GLU HGx B 27 LEU HD21 1.0 1.705 3.221 285 121 A 47 GLU HGx A 27 LEU HA 1.0 0.000 6.000 286 121 A 47 GLU HGy A 27 LEU HA 1.0 0.000 6.000 287 122 B 47 GLU HGx B 27 LEU HA 1.0 0.000 6.000 288 122 B 47 GLU HGy B 27 LEU HA 1.0 0.000 6.000 289 123 A 15 LYS HBx A 15 LYS HEx 1.0 1.752 3.434 290 123 A 14 LYS HBx A 14 LYS HEx 1.0 1.752 3.434 291 124 B 15 LYS HBx B 15 LYS HEx 1.0 1.752 3.434 292 124 B 14 LYS HBy B 14 LYS HEx 1.0 1.752 3.434 293 125 A 51 ARG HDy A 51 ARG HBx 1.0 1.629 2.923 294 125 A 48 ARG HDy A 48 ARG HBy 1.0 1.629 2.923 295 125 A 48 ARG HDx A 48 ARG HBy 1.0 1.629 2.923 296 126 B 48 ARG HDx B 48 ARG HBx 1.0 1.629 2.923 297 126 B 48 ARG HDy B 48 ARG HBx 1.0 1.629 2.923 298 126 B 51 ARG HDx B 51 ARG HBx 1.0 1.629 2.923 299 127 B 15 LYS HEx A 38 ARG HBx 1.0 1.689 3.157 300 127 A 4 ARG HBx A 3 LYS HEy 1.0 1.689 3.157 301 128 A 15 LYS HEx B 38 ARG HBy 1.0 1.689 3.157 302 128 B 4 ARG HBy B 3 LYS HEy 1.0 1.689 3.157 303 129 A 65 GLU HBy A 65 GLU H 1.0 1.712 3.256 304 129 A 33 ARG HBy A 33 ARG H 1.0 1.712 3.256 305 130 B 65 GLU HBy B 65 GLU H 1.0 1.712 3.256 306 130 B 33 ARG HBy B 33 ARG H 1.0 1.712 3.256 307 131 A 8 GLU HBx A 9 PHE H 1.0 0.000 6.000 308 131 A 4 ARG HBx A 9 PHE H 1.0 0.000 6.000 309 132 B 8 GLU HBx B 9 PHE H 1.0 0.000 6.000 310 132 B 4 ARG HBy B 9 PHE H 1.0 0.000 6.000 311 133 A 43 GLU HBx A 44 GLU H 1.0 1.683 3.135 312 133 A 12 GLU HBx A 12 GLU H 1.0 1.683 3.135 313 134 B 43 GLU HBx B 44 GLU H 1.0 1.683 3.135 314 134 B 12 GLU HBy B 12 GLU H 1.0 1.683 3.135 315 135 A 51 ARG HBx A 51 ARG H 1.0 1.689 3.159 316 135 A 24 ASP HBx A 25 ARG H 1.0 1.689 3.159 317 136 B 51 ARG HBx B 51 ARG H 1.0 1.689 3.159 318 136 B 24 ASP HBx B 25 ARG H 1.0 1.689 3.159 319 137 A 53 LYS H A 52 ARG HBx 1.0 1.667 3.071 320 137 A 52 ARG H A 52 ARG HBx 1.0 1.667 3.071 321 138 B 53 LYS H B 52 ARG HBy 1.0 1.667 3.071 322 138 B 52 ARG H B 52 ARG HBy 1.0 1.667 3.071 323 139 A 56 GLN H A 55 GLN HBy 1.0 1.615 2.875 324 139 A 56 GLN H A 55 GLN HBx 1.0 1.615 2.875 325 140 B 56 GLN H B 55 GLN HBx 1.0 1.615 2.875 326 140 B 56 GLN H B 55 GLN HBy 1.0 1.615 2.875 327 141 A 27 LEU HDy% A 47 GLU HBy 1.0 0.000 6.000 328 141 A 27 LEU HDy% A 47 GLU HBx 1.0 0.000 6.000 329 142 B 27 LEU HD21 B 47 GLU HBy 1.0 0.000 6.000 330 142 B 27 LEU HD21 B 47 GLU HBx 1.0 0.000 6.000 331 143 A 39 LEU HDy% A 39 LEU HG 1.0 1.648 2.998 332 143 A 39 LEU HG A 39 LEU HDx% 1.0 1.648 2.998 333 144 B 39 LEU HD21 B 39 LEU HG 1.0 1.648 2.998 334 144 B 39 LEU HG B 39 LEU HD11 1.0 1.648 2.998 335 145 A 62 PRO HGx A 62 PRO HDy 1.0 1.580 2.754 336 145 A 62 PRO HGy A 62 PRO HDy 1.0 1.580 2.754 337 146 B 62 PRO HGx B 62 PRO HDy 1.0 1.580 2.754 338 146 B 62 PRO HGy B 62 PRO HDy 1.0 1.580 2.754 339 147 A 53 LYS HA A 56 GLN HBy 1.0 0.000 6.000 340 147 A 53 LYS HA A 56 GLN HBx 1.0 0.000 6.000 341 148 B 53 LYS HA B 56 GLN HBx 1.0 0.000 6.000 342 148 B 53 LYS HA B 56 GLN HBy 1.0 0.000 6.000 343 149 A 51 ARG HA A 51 ARG HGx 1.0 1.671 3.085 344 149 A 51 ARG HGy A 51 ARG HA 1.0 1.671 3.085 345 149 A 34 TYR HA A 33 ARG HGx 1.0 1.671 3.085 346 150 B 51 ARG HA B 51 ARG HGx 1.0 1.671 3.085 347 150 B 51 ARG HGy B 51 ARG HA 1.0 1.671 3.085 348 150 B 34 TYR HA B 33 ARG HGx 1.0 1.671 3.085 349 151 A 52 ARG HBy A 52 ARG HDx 1.0 1.549 2.653 350 151 A 3 LYS HEy A 3 LYS HDx 1.0 1.549 2.653 351 152 B 52 ARG HBx B 52 ARG HDx 1.0 1.549 2.653 352 152 B 3 LYS HEy B 3 LYS HDx 1.0 1.549 2.653 353 153 A 52 ARG HBx A 51 ARG HDy 1.0 0.000 6.000 354 153 A 52 ARG HBx A 51 ARG HDx 1.0 0.000 6.000 355 154 B 52 ARG HBy B 51 ARG HDx 1.0 0.000 6.000 356 154 B 52 ARG HBy B 51 ARG HDy 1.0 0.000 6.000 357 155 A 62 PRO HGx A 62 PRO HA 1.0 1.742 3.382 358 155 A 62 PRO HGy A 62 PRO HA 1.0 1.742 3.382 359 156 B 62 PRO HGx B 62 PRO HA 1.0 1.742 3.382 360 156 B 62 PRO HGy B 62 PRO HA 1.0 1.742 3.382 361 157 A 62 PRO HGx A 62 PRO HBx 1.0 1.522 2.566 362 157 A 62 PRO HGy A 62 PRO HBx 1.0 1.522 2.566 363 158 B 62 PRO HGx B 62 PRO HBy 1.0 1.522 2.566 364 158 B 62 PRO HGy B 62 PRO HBy 1.0 1.522 2.566 365 159 A 51 ARG HDy A 51 ARG HGy 1.0 1.465 2.395 366 159 A 51 ARG HDx A 51 ARG HGx 1.0 1.465 2.395 367 159 A 51 ARG HDx A 51 ARG HGy 1.0 1.465 2.395 368 159 A 33 ARG HGx A 33 ARG HDx 1.0 1.465 2.395 369 159 A 51 ARG HDy A 51 ARG HGx 1.0 1.465 2.395 370 160 B 51 ARG HDy B 51 ARG HGx 1.0 1.465 2.395 371 160 B 51 ARG HDx B 51 ARG HGx 1.0 1.465 2.395 372 160 B 51 ARG HDy B 51 ARG HGy 1.0 1.465 2.395 373 160 B 33 ARG HGx B 33 ARG HDx 1.0 1.465 2.395 374 160 B 51 ARG HDx B 51 ARG HGy 1.0 1.465 2.395 375 161 A 39 LEU HG A 37 GLN H 1.0 0.000 6.000 376 161 A 39 LEU HG A 15 LYS H 1.0 0.000 6.000 377 161 A 39 LEU HG A 13 GLN H 1.0 0.000 6.000 378 162 B 39 LEU HG B 37 GLN H 1.0 0.000 6.000 379 162 B 39 LEU HG B 15 LYS H 1.0 0.000 6.000 380 162 B 39 LEU HG B 13 GLN H 1.0 0.000 6.000 381 163 A 19 LEU HDy% B 43 GLU HBx 1.0 0.000 6.000 382 163 A 19 LEU HDy% B 33 ARG HBy 1.0 0.000 6.000 383 163 A 19 LEU HDy% B 46 ILE HB 1.0 0.000 6.000 384 163 A 19 LEU HDy% B 12 GLU HBx 1.0 0.000 6.000 385 163 A 19 LEU HDy% B 24 ASP HBy 1.0 0.000 6.000 386 164 B 19 LEU HD21 A 12 GLU HBy 1.0 0.000 6.000 387 164 B 19 LEU HD21 A 43 GLU HBx 1.0 0.000 6.000 388 164 B 19 LEU HD21 A 24 ASP HBy 1.0 0.000 6.000 389 164 B 19 LEU HD21 A 46 ILE HB 1.0 0.000 6.000 390 164 B 19 LEU HD21 A 33 ARG HBy 1.0 0.000 6.000 391 165 A 16 ALA HB% A 16 ALA HA 1.0 1.522 2.568 392 165 A 16 ALA HB% B 16 ALA HA 1.0 1.522 2.568 393 166 B 16 ALA HB1 A 16 ALA HA 1.0 1.522 2.568 394 166 B 16 ALA HB1 B 16 ALA HA 1.0 1.522 2.568 395 167 A 46 ILE HG2% A 27 LEU HDx% 1.0 0.000 6.000 396 167 A 35 LEU HDy% A 46 ILE HG2% 1.0 0.000 6.000 397 168 B 46 ILE HG21 B 27 LEU HD11 1.0 0.000 6.000 398 168 B 35 LEU HD21 B 46 ILE HG21 1.0 0.000 6.000 399 169 A 11 GLU HA A 13 GLN H 1.0 1.701 3.207 400 169 A 15 LYS H A 12 GLU HA 1.0 1.701 3.207 401 169 A 13 GLN H A 12 GLU HA 1.0 1.701 3.207 402 170 B 11 GLU HA B 13 GLN H 1.0 1.701 3.207 403 170 B 15 LYS H B 12 GLU HA 1.0 1.701 3.207 404 170 B 13 GLN H B 12 GLU HA 1.0 1.701 3.207 405 171 A 18 ASP H A 14 LYS HA 1.0 1.912 4.410 406 171 A 15 LYS H A 14 LYS HA 1.0 1.912 4.410 407 172 B 18 ASP H B 14 LYS HA 1.0 1.912 4.410 408 172 B 15 LYS H B 14 LYS HA 1.0 1.912 4.410 409 173 A 15 LYS HA A 18 ASP H 1.0 1.641 2.969 410 173 A 15 LYS HA A 15 LYS H 1.0 1.641 2.969 411 174 B 15 LYS HA B 18 ASP H 1.0 1.641 2.969 412 174 B 15 LYS HA B 15 LYS H 1.0 1.641 2.969 413 175 A 16 ALA HB% A 15 LYS H 1.0 0.000 6.000 414 175 A 16 ALA HB% B 15 LYS H 1.0 0.000 6.000 415 176 B 16 ALA HB1 A 15 LYS H 1.0 0.000 6.000 416 176 B 16 ALA HB1 B 15 LYS H 1.0 0.000 6.000 417 177 A 16 ALA HB% A 20 ALA H 1.0 0.000 6.000 418 177 A 16 ALA HB% B 20 ALA H 1.0 0.000 6.000 419 178 B 16 ALA HB1 B 20 ALA H 1.0 0.000 6.000 420 178 B 16 ALA HB1 A 20 ALA H 1.0 0.000 6.000 421 179 A 16 ALA HB% A 15 LYS HEx 1.0 1.911 4.395 422 179 A 16 ALA HB% B 15 LYS HEx 1.0 1.911 4.395 423 180 B 16 ALA HB1 A 15 LYS HEx 1.0 1.911 4.395 424 180 B 16 ALA HB1 B 15 LYS HEx 1.0 1.911 4.395 425 181 A 16 ALA HB% A 15 LYS HBx 1.0 1.717 3.275 426 181 A 16 ALA HB% B 15 LYS HBx 1.0 1.717 3.275 427 182 B 16 ALA HB1 B 15 LYS HBx 1.0 1.717 3.275 428 182 B 16 ALA HB1 A 15 LYS HBx 1.0 1.717 3.275 429 183 A 17 LEU HBy A 16 ALA HB% 1.0 0.000 6.000 430 183 A 17 LEU HDy% A 16 ALA HB% 1.0 0.000 6.000 431 184 B 17 LEU HD21 B 16 ALA HB1 1.0 0.000 6.000 432 184 B 17 LEU HBx B 16 ALA HB1 1.0 0.000 6.000 433 185 A 17 LEU HDy% A 48 ARG HA 1.0 1.972 5.092 434 185 A 17 LEU HDy% A 50 PHE HA 1.0 1.972 5.092 435 186 B 17 LEU HD21 B 48 ARG HA 1.0 1.972 5.092 436 186 B 17 LEU HD21 B 50 PHE HA 1.0 1.972 5.092 437 187 A 17 LEU HDy% A 45 GLN HBx 1.0 1.959 4.887 438 187 A 17 LEU HDy% A 13 GLN HBx 1.0 1.959 4.887 439 188 B 17 LEU HD21 B 13 GLN HBx 1.0 1.959 4.887 440 188 B 17 LEU HD21 B 45 GLN HBx 1.0 1.959 4.887 441 189 A 17 LEU HDy% A 13 GLN HGy 1.0 1.984 5.302 442 189 A 17 LEU HDy% A 53 LYS HEx 1.0 1.984 5.302 443 189 A 17 LEU HDy% A 53 LYS HEy 1.0 1.984 5.302 444 190 B 17 LEU HD21 B 53 LYS HEx 1.0 1.984 5.302 445 190 B 17 LEU HD21 B 53 LYS HEy 1.0 1.984 5.302 446 190 B 17 LEU HD21 B 13 GLN HGy 1.0 1.984 5.302 447 191 A 17 LEU HDy% A 14 LYS HBy 1.0 1.937 4.645 448 191 A 17 LEU HDy% A 14 LYS HBx 1.0 1.937 4.645 449 192 B 17 LEU HD21 B 14 LYS HBy 1.0 1.937 4.645 450 192 B 17 LEU HD21 B 14 LYS HBx 1.0 1.937 4.645 451 193 A 53 LYS HEx A 18 ASP HA 1.0 1.936 4.634 452 193 A 53 LYS HEy A 18 ASP HA 1.0 1.936 4.634 453 194 B 53 LYS HEx B 18 ASP HA 1.0 1.936 4.634 454 194 B 53 LYS HEy B 18 ASP HA 1.0 1.936 4.634 455 195 B 19 LEU HD21 A 18 ASP HA 1.0 1.960 4.910 456 195 A 53 LYS HDx A 18 ASP HA 1.0 1.960 4.910 457 196 A 19 LEU HDy% B 18 ASP HA 1.0 1.960 4.910 458 196 B 53 LYS HDy B 18 ASP HA 1.0 1.960 4.910 459 197 A 53 LYS HDy A 18 ASP HA 1.0 1.971 5.069 460 197 A 18 ASP HA A 17 LEU HBx 1.0 1.971 5.069 461 198 B 53 LYS HDx B 18 ASP HA 1.0 1.971 5.069 462 198 B 18 ASP HA B 17 LEU HBy 1.0 1.971 5.069 463 199 A 20 ALA HB% A 17 LEU HDy% 1.0 1.912 4.412 464 199 A 20 ALA HB% A 17 LEU HBy 1.0 1.912 4.412 465 200 B 20 ALA HB1 B 17 LEU HBx 1.0 1.912 4.412 466 200 B 20 ALA HB1 B 17 LEU HD21 1.0 1.912 4.412 467 201 A 60 SER HBy A 59 TRP HA 1.0 0.000 6.000 468 201 A 60 SER HBx A 59 TRP HA 1.0 0.000 6.000 469 202 B 60 SER HBx B 59 TRP HA 1.0 0.000 6.000 470 202 B 60 SER HBy B 59 TRP HA 1.0 0.000 6.000 471 203 A 32 ARG HBx A 28 THR HB 1.0 0.000 6.000 472 203 A 24 ASP HBx A 28 THR HB 1.0 0.000 6.000 473 204 B 32 ARG HBy B 28 THR HB 1.0 0.000 6.000 474 204 B 24 ASP HBx B 28 THR HB 1.0 0.000 6.000 475 205 A 53 LYS H A 49 TRP HBx 1.0 1.960 4.906 476 205 A 50 PHE HDy A 49 TRP HBx 1.0 1.960 4.906 477 205 A 50 PHE HDx A 49 TRP HBx 1.0 1.960 4.906 478 205 A 52 ARG H A 49 TRP HBx 1.0 1.960 4.906 479 206 B 52 ARG H B 49 TRP HBy 1.0 1.960 4.906 480 206 B 53 LYS H B 49 TRP HBy 1.0 1.960 4.906 481 206 B 50 PHE HDy B 49 TRP HBy 1.0 1.960 4.906 482 206 B 50 PHE HDx B 49 TRP HBy 1.0 1.960 4.906 483 207 A 32 ARG HBy A 47 GLU H 1.0 1.962 4.938 484 207 A 32 ARG HBy A 33 ARG H 1.0 1.962 4.938 485 208 B 32 ARG HBx B 47 GLU H 1.0 1.962 4.938 486 208 B 32 ARG HBx B 33 ARG H 1.0 1.962 4.938 487 209 A 32 ARG HBy A 44 GLU HA 1.0 1.970 5.052 488 209 A 32 ARG HBy A 29 PRO HA 1.0 1.970 5.052 489 210 B 32 ARG HBx B 44 GLU HA 1.0 1.970 5.052 490 210 B 32 ARG HBx B 29 PRO HA 1.0 1.970 5.052 491 211 A 56 GLN H A 54 GLU HBx 1.0 0.000 6.000 492 211 A 52 ARG H A 54 GLU HBx 1.0 0.000 6.000 493 212 B 56 GLN H B 54 GLU HBx 1.0 0.000 6.000 494 212 B 52 ARG H B 54 GLU HBx 1.0 0.000 6.000 495 213 A 40 GLY HAx A 41 LEU HG 1.0 0.000 6.000 496 213 A 40 GLY HAx A 41 LEU HBx 1.0 0.000 6.000 497 214 B 40 GLY HAx B 41 LEU HG 1.0 0.000 6.000 498 214 B 40 GLY HAx B 41 LEU HBy 1.0 0.000 6.000 499 215 A 27 LEU HDy% A 21 PHE HDx 1.0 1.970 5.056 500 215 A 21 PHE HEy A 27 LEU HDy% 1.0 1.970 5.056 501 215 A 27 LEU HDy% A 21 PHE HDy 1.0 1.970 5.056 502 215 A 21 PHE HEx A 27 LEU HDy% 1.0 1.970 5.056 503 216 B 21 PHE HEx B 27 LEU HD21 1.0 1.970 5.056 504 216 B 27 LEU HD21 B 21 PHE HDy 1.0 1.970 5.056 505 216 B 21 PHE HEy B 27 LEU HD21 1.0 1.970 5.056 506 216 B 27 LEU HD21 B 21 PHE HDx 1.0 1.970 5.056 507 217 A 45 GLN HA A 42 ASN HBy 1.0 1.953 4.831 508 217 A 44 GLU HA A 42 ASN HBy 1.0 1.953 4.831 509 218 B 45 GLN HA B 42 ASN HBx 1.0 1.953 4.831 510 218 B 44 GLU HA B 42 ASN HBx 1.0 1.953 4.831 511 219 A 47 GLU HGy A 43 GLU HA 1.0 1.962 4.932 512 219 A 44 GLU HGy A 43 GLU HA 1.0 1.962 4.932 513 220 B 47 GLU HGy B 43 GLU HA 1.0 1.962 4.932 514 220 B 44 GLU HGy B 43 GLU HA 1.0 1.962 4.932 515 221 A 47 GLU H A 43 GLU HA 1.0 1.959 4.893 516 221 A 33 ARG H A 43 GLU HA 1.0 1.959 4.893 517 222 B 47 GLU H B 43 GLU HA 1.0 1.959 4.893 518 222 B 33 ARG H B 43 GLU HA 1.0 1.959 4.893 519 223 A 41 LEU HA A 45 GLN HGx 1.0 1.906 4.360 520 223 A 45 GLN HGx A 36 SER HG 1.0 1.906 4.360 521 224 B 41 LEU HA B 45 GLN HGx 1.0 1.906 4.360 522 224 B 45 GLN HGx B 36 SER HG 1.0 1.906 4.360 523 225 A 46 ILE HD1% A 9 PHE HBx 1.0 1.940 4.672 524 225 A 46 ILE HD1% A 42 ASN HBx 1.0 1.940 4.672 525 225 A 46 ILE HD1% A 34 TYR HBy 1.0 1.940 4.672 526 226 B 46 ILE HD11 B 42 ASN HBy 1.0 1.940 4.672 527 226 B 46 ILE HD11 B 9 PHE HBy 1.0 1.940 4.672 528 226 B 46 ILE HD11 B 34 TYR HBx 1.0 1.940 4.672 529 227 A 46 ILE HD1% A 41 LEU H 1.0 0.000 6.000 530 227 A 46 ILE HD1% A 9 PHE HEx 1.0 0.000 6.000 531 227 A 46 ILE HD1% A 9 PHE HEy 1.0 0.000 6.000 532 228 B 46 ILE HD11 B 41 LEU H 1.0 0.000 6.000 533 228 B 46 ILE HD11 B 9 PHE HEx 1.0 0.000 6.000 534 228 B 46 ILE HD11 B 9 PHE HEy 1.0 0.000 6.000 535 229 A 46 ILE HD1% A 33 ARG H 1.0 0.000 6.000 536 229 A 46 ILE HD1% A 47 GLU H 1.0 0.000 6.000 537 230 B 46 ILE HD11 B 33 ARG H 1.0 0.000 6.000 538 230 B 46 ILE HD11 B 47 GLU H 1.0 0.000 6.000 539 231 A 32 ARG HDy A 46 ILE HG2% 1.0 1.958 4.890 540 231 A 32 ARG HDx A 46 ILE HG2% 1.0 1.958 4.890 541 232 B 32 ARG HDy B 46 ILE HG21 1.0 1.958 4.890 542 232 B 32 ARG HDx B 46 ILE HG21 1.0 1.958 4.890 543 233 A 46 ILE HG2% A 47 GLU HA 1.0 1.840 3.900 544 233 A 36 SER HBy A 46 ILE HG2% 1.0 1.840 3.900 545 234 B 36 SER HBy B 46 ILE HG21 1.0 1.840 3.900 546 234 B 46 ILE HG21 B 47 GLU HA 1.0 1.840 3.900 547 235 A 46 ILE HG2% A 50 PHE HZ 1.0 0.000 6.000 548 235 A 9 PHE HEy A 46 ILE HG2% 1.0 0.000 6.000 549 235 A 9 PHE HDy A 46 ILE HG2% 1.0 0.000 6.000 550 235 A 9 PHE HEx A 46 ILE HG2% 1.0 0.000 6.000 551 235 A 9 PHE HDx A 46 ILE HG2% 1.0 0.000 6.000 552 236 B 9 PHE HEx B 46 ILE HG21 1.0 0.000 6.000 553 236 B 9 PHE HDy B 46 ILE HG21 1.0 0.000 6.000 554 236 B 9 PHE HEy B 46 ILE HG21 1.0 0.000 6.000 555 236 B 46 ILE HG21 B 50 PHE HZ 1.0 0.000 6.000 556 236 B 9 PHE HDx B 46 ILE HG21 1.0 0.000 6.000 557 237 A 53 LYS H A 49 TRP HA 1.0 1.809 3.721 558 237 A 52 ARG H A 49 TRP HA 1.0 1.809 3.721 559 238 B 53 LYS H B 49 TRP HA 1.0 1.809 3.721 560 238 B 52 ARG H B 49 TRP HA 1.0 1.809 3.721 561 239 A 57 ILE HG1x A 59 TRP HBx 1.0 1.994 5.560 562 239 A 49 TRP HBy A 52 ARG HGx 1.0 1.994 5.560 563 239 A 49 TRP HBy A 46 ILE HG1x 1.0 1.994 5.560 564 240 B 57 ILE HG1y B 59 TRP HBy 1.0 1.994 5.560 565 240 B 49 TRP HBx B 52 ARG HGy 1.0 1.994 5.560 566 240 B 49 TRP HBx B 46 ILE HG1y 1.0 1.994 5.560 567 241 A 54 GLU HA A 53 LYS HGy 1.0 2.000 6.064 568 241 A 50 PHE HA A 53 LYS HGy 1.0 2.000 6.064 569 241 A 49 TRP HA A 53 LYS HGy 1.0 2.000 6.064 570 242 B 54 GLU HA B 53 LYS HGy 1.0 2.000 6.064 571 242 B 50 PHE HA B 53 LYS HGy 1.0 2.000 6.064 572 242 B 49 TRP HA B 53 LYS HGy 1.0 2.000 6.064 573 243 A 58 GLY HAx A 57 ILE HG2% 1.0 1.925 4.527 574 243 A 57 ILE HG2% A 58 GLY HAy 1.0 1.925 4.527 575 244 B 58 GLY HAx B 57 ILE HG21 1.0 1.925 4.527 576 244 B 57 ILE HG21 B 58 GLY HAy 1.0 1.925 4.527 577 245 B 15 LYS HDx A 40 GLY HAx 1.0 0.000 6.000 578 245 A 39 LEU HBx A 40 GLY HAx 1.0 0.000 6.000 579 246 A 15 LYS HDx B 40 GLY HAx 1.0 0.000 6.000 580 246 B 39 LEU HBy B 40 GLY HAx 1.0 0.000 6.000 581 247 A 57 ILE H A 63 GLN HGy 1.0 0.000 6.000 582 247 A 56 GLN H A 63 GLN HGy 1.0 0.000 6.000 583 248 B 57 ILE H B 63 GLN HGy 1.0 0.000 6.000 584 248 B 56 GLN H B 63 GLN HGy 1.0 0.000 6.000 585 249 A 13 GLN HBx A 41 LEU H 1.0 1.995 5.593 586 249 A 9 PHE HDy A 13 GLN HBx 1.0 1.995 5.593 587 249 A 9 PHE HDx A 13 GLN HBx 1.0 1.995 5.593 588 250 B 13 GLN HBx B 41 LEU H 1.0 1.995 5.593 589 250 B 9 PHE HDy B 13 GLN HBx 1.0 1.995 5.593 590 250 B 9 PHE HDx B 13 GLN HBx 1.0 1.995 5.593 591 251 A 44 GLU HA A 27 LEU HDx% 1.0 0.000 6.000 592 251 A 45 GLN HA A 27 LEU HDx% 1.0 0.000 6.000 593 252 B 44 GLU HA B 27 LEU HD11 1.0 0.000 6.000 594 252 B 45 GLN HA B 27 LEU HD11 1.0 0.000 6.000 595 253 A 32 ARG HBx A 27 LEU HDx% 1.0 1.939 4.671 596 253 A 51 ARG HBx A 27 LEU HDx% 1.0 1.939 4.671 597 254 B 32 ARG HBy B 27 LEU HD11 1.0 1.939 4.671 598 254 B 51 ARG HBx B 27 LEU HD11 1.0 1.939 4.671 599 255 A 21 PHE HDx A 53 LYS HGy 1.0 2.000 5.978 600 255 A 21 PHE HDy A 53 LYS HGy 1.0 2.000 5.978 601 255 A 21 PHE HEy A 53 LYS HGy 1.0 2.000 5.978 602 255 A 21 PHE HEx A 53 LYS HGy 1.0 2.000 5.978 603 256 B 21 PHE HDy B 53 LYS HGy 1.0 2.000 5.978 604 256 B 21 PHE HDx B 53 LYS HGy 1.0 2.000 5.978 605 256 B 21 PHE HEy B 53 LYS HGy 1.0 2.000 5.978 606 256 B 21 PHE HEx B 53 LYS HGy 1.0 2.000 5.978 607 257 A 59 TRP HBx A 54 GLU HGx 1.0 0.000 6.000 608 257 A 51 ARG HDx A 54 GLU HGx 1.0 0.000 6.000 609 257 A 54 GLU HGx A 21 PHE HBx 1.0 0.000 6.000 610 258 B 59 TRP HBy B 54 GLU HGy 1.0 0.000 6.000 611 258 B 51 ARG HDy B 54 GLU HGy 1.0 0.000 6.000 612 258 B 54 GLU HGy B 21 PHE HBx 1.0 0.000 6.000 613 259 A 54 GLU HGy A 59 TRP HBx 1.0 1.928 4.550 614 259 A 51 ARG HDx A 54 GLU HGy 1.0 1.928 4.550 615 259 A 48 ARG HDy A 45 GLN HGx 1.0 1.928 4.550 616 260 B 54 GLU HGx B 59 TRP HBy 1.0 1.928 4.550 617 260 B 51 ARG HDy B 54 GLU HGx 1.0 1.928 4.550 618 260 B 48 ARG HDx B 45 GLN HGx 1.0 1.928 4.550 619 261 A 39 LEU HDx% A 41 LEU H 1.0 0.000 6.000 620 261 A 9 PHE HDy A 39 LEU HDx% 1.0 0.000 6.000 621 261 A 9 PHE HDx A 39 LEU HDx% 1.0 0.000 6.000 622 262 B 39 LEU HD11 B 41 LEU H 1.0 0.000 6.000 623 262 B 9 PHE HDx B 39 LEU HD11 1.0 0.000 6.000 624 262 B 9 PHE HDy B 39 LEU HD11 1.0 0.000 6.000 625 263 A 39 LEU HDx% B 16 ALA H 1.0 1.836 3.870 626 263 A 39 LEU HDx% A 16 ALA H 1.0 1.836 3.870 627 264 B 39 LEU HD11 A 16 ALA H 1.0 1.836 3.870 628 264 B 39 LEU HD11 B 16 ALA H 1.0 1.836 3.870 629 265 A 39 LEU HDx% A 13 GLN HBy 1.0 2.000 6.122 630 265 A 39 LEU HDy% A 13 GLN HBy 1.0 2.000 6.122 631 266 B 39 LEU HD11 B 13 GLN HBy 1.0 2.000 6.122 632 266 B 39 LEU HD21 B 13 GLN HBy 1.0 2.000 6.122 633 267 A 15 LYS HGx A 19 LEU HDy% 1.0 0.000 6.000 634 267 A 15 LYS HGx B 19 LEU HD21 1.0 0.000 6.000 635 268 B 15 LYS HGx B 19 LEU HD21 1.0 0.000 6.000 636 268 B 15 LYS HGx A 19 LEU HDy% 1.0 0.000 6.000 637 269 A 14 LYS HBy A 14 LYS HA 1.0 1.797 3.657 638 269 A 14 LYS HBx A 14 LYS HA 1.0 1.797 3.657 639 270 B 14 LYS HBx B 14 LYS HA 1.0 1.797 3.657 640 270 B 14 LYS HBy B 14 LYS HA 1.0 1.797 3.657 641 271 A 14 LYS HBy A 14 LYS HGx 1.0 1.852 3.974 642 271 A 14 LYS HBx A 14 LYS HGx 1.0 1.852 3.974 643 272 B 14 LYS HBx B 14 LYS HGx 1.0 1.852 3.974 644 272 B 14 LYS HBy B 14 LYS HGx 1.0 1.852 3.974 645 273 A 48 ARG HDy A 44 GLU HA 1.0 1.870 4.090 646 273 A 33 ARG HDx A 30 GLU HA 1.0 1.870 4.090 647 274 B 48 ARG HDx B 44 GLU HA 1.0 1.870 4.090 648 274 B 33 ARG HDx B 30 GLU HA 1.0 1.870 4.090 649 275 A 39 LEU HG A 39 LEU HA 1.0 1.786 3.594 650 275 A 6 ARG HGx A 6 ARG HA 1.0 1.786 3.594 651 276 B 39 LEU HG B 39 LEU HA 1.0 1.786 3.594 652 276 B 6 ARG HGx B 6 ARG HA 1.0 1.786 3.594 653 277 A 36 SER HBx A 7 THR HB 1.0 0.000 6.000 654 277 A 36 SER HBy A 7 THR HB 1.0 0.000 6.000 655 278 B 36 SER HBx B 7 THR HB 1.0 0.000 6.000 656 278 B 36 SER HBy B 7 THR HB 1.0 0.000 6.000 657 279 A 8 GLU HBx A 7 THR HB 1.0 0.000 6.000 658 279 A 6 ARG HBx A 7 THR HB 1.0 0.000 6.000 659 279 A 6 ARG HBy A 7 THR HB 1.0 0.000 6.000 660 280 B 8 GLU HBx B 7 THR HB 1.0 0.000 6.000 661 280 B 6 ARG HBx B 7 THR HB 1.0 0.000 6.000 662 280 B 6 ARG HBy B 7 THR HB 1.0 0.000 6.000 663 281 A 7 THR HB A 42 ASN HD2x 1.0 1.992 5.494 664 281 A 41 LEU H A 7 THR HB 1.0 1.992 5.494 665 282 B 7 THR HB B 42 ASN HD2y 1.0 1.992 5.494 666 282 B 41 LEU H B 7 THR HB 1.0 1.992 5.494 667 283 A 19 LEU HDy% A 19 LEU H 1.0 1.869 4.079 668 283 A 19 LEU HDy% B 19 LEU H 1.0 1.869 4.079 669 284 B 19 LEU HD21 B 19 LEU H 1.0 1.869 4.079 670 284 B 19 LEU HD21 A 19 LEU H 1.0 1.869 4.079 671 285 A 9 PHE HZ A 50 PHE H 1.0 1.997 5.715 672 285 A 9 PHE HEx A 50 PHE H 1.0 1.997 5.715 673 285 A 9 PHE HEy A 50 PHE H 1.0 1.997 5.715 674 285 A 9 PHE HDy A 50 PHE H 1.0 1.997 5.715 675 285 A 9 PHE HDx A 50 PHE H 1.0 1.997 5.715 676 286 B 9 PHE HEx B 50 PHE H 1.0 1.997 5.715 677 286 B 9 PHE HZ B 50 PHE H 1.0 1.997 5.715 678 286 B 9 PHE HEy B 50 PHE H 1.0 1.997 5.715 679 286 B 9 PHE HDy B 50 PHE H 1.0 1.997 5.715 680 286 B 9 PHE HDx B 50 PHE H 1.0 1.997 5.715 681 287 A 42 ASN HD2x A 42 ASN H 1.0 1.977 5.165 682 287 A 41 LEU H A 42 ASN H 1.0 1.977 5.165 683 288 B 42 ASN HD2y B 42 ASN H 1.0 1.977 5.165 684 288 B 41 LEU H B 42 ASN H 1.0 1.977 5.165 685 289 A 27 LEU H A 27 LEU HBx 1.0 1.805 3.695 686 289 A 27 LEU H A 26 ARG HBx 1.0 1.805 3.695 687 290 B 27 LEU H B 27 LEU HBy 1.0 1.805 3.695 688 290 B 27 LEU H B 26 ARG HBy 1.0 1.805 3.695 689 291 A 65 GLU H A 66 LYS HGy 1.0 1.979 5.211 690 291 A 65 GLU H A 66 LYS HGx 1.0 1.979 5.211 691 292 B 65 GLU H B 66 LYS HGx 1.0 1.979 5.211 692 292 B 65 GLU H B 66 LYS HGy 1.0 1.979 5.211 693 293 A 53 LYS H A 54 GLU HBx 1.0 1.967 5.005 694 293 A 53 LYS H A 53 LYS HEx 1.0 1.967 5.005 695 293 A 53 LYS H A 55 GLN HGy 1.0 1.967 5.005 696 294 B 53 LYS H B 55 GLN HGx 1.0 1.967 5.005 697 294 B 53 LYS H B 54 GLU HBx 1.0 1.967 5.005 698 294 B 53 LYS H B 53 LYS HEx 1.0 1.967 5.005 699 295 A 53 LYS H A 62 PRO HGy 1.0 0.000 6.000 700 295 A 53 LYS H A 48 ARG HGx 1.0 0.000 6.000 701 295 A 53 LYS H A 63 GLN HBx 1.0 0.000 6.000 702 296 B 53 LYS H B 62 PRO HGy 1.0 0.000 6.000 703 296 B 53 LYS H B 48 ARG HGy 1.0 0.000 6.000 704 296 B 53 LYS H B 63 GLN HBx 1.0 0.000 6.000 705 297 B 39 LEU HBy A 16 ALA H 1.0 0.000 6.000 706 297 A 16 ALA H B 38 ARG HBx 1.0 0.000 6.000 707 297 A 39 LEU HBx A 16 ALA H 1.0 0.000 6.000 708 298 A 39 LEU HBx B 16 ALA H 1.0 0.000 6.000 709 298 B 16 ALA H A 38 ARG HBy 1.0 0.000 6.000 710 298 B 39 LEU HBy B 16 ALA H 1.0 0.000 6.000 711 299 A 45 GLN HBy A 43 GLU H 1.0 0.000 6.000 712 299 A 32 ARG HBx A 43 GLU H 1.0 0.000 6.000 713 300 B 45 GLN HBy B 43 GLU H 1.0 0.000 6.000 714 300 B 32 ARG HBy B 43 GLU H 1.0 0.000 6.000 715 301 A 64 PHE HA A 63 GLN H 1.0 0.000 6.000 716 301 A 63 GLN H A 60 SER HG 1.0 0.000 6.000 717 302 B 64 PHE HA B 63 GLN H 1.0 0.000 6.000 718 302 B 63 GLN H B 60 SER HG 1.0 0.000 6.000 719 303 A 62 PRO HDx A 59 TRP H 1.0 1.986 5.344 720 303 A 60 SER HBy A 59 TRP H 1.0 1.986 5.344 721 304 B 62 PRO HDx B 59 TRP H 1.0 1.986 5.344 722 304 B 60 SER HBx B 59 TRP H 1.0 1.986 5.344 723 305 A 49 TRP H A 53 LYS HBy 1.0 0.000 6.000 724 305 A 49 TRP H A 17 LEU HDx% 1.0 0.000 6.000 725 306 B 49 TRP H B 53 LYS HBx 1.0 0.000 6.000 726 306 B 49 TRP H B 17 LEU HD11 1.0 0.000 6.000 727 307 A 63 GLN HGy A 64 PHE H 1.0 0.000 6.000 728 307 A 62 PRO HBx A 64 PHE H 1.0 0.000 6.000 729 308 B 63 GLN HGy B 64 PHE H 1.0 0.000 6.000 730 308 B 62 PRO HBy B 64 PHE H 1.0 0.000 6.000 731 309 A 45 GLN HA A 42 ASN H 1.0 1.995 5.607 732 309 A 42 ASN H A 36 SER HA 1.0 1.995 5.607 733 310 B 45 GLN HA B 42 ASN H 1.0 1.995 5.607 734 310 B 42 ASN H B 36 SER HA 1.0 1.995 5.607 735 311 A 15 LYS HBx A 17 LEU H 1.0 1.979 5.197 736 311 A 14 LYS HBy A 17 LEU H 1.0 1.979 5.197 737 311 A 14 LYS HBx A 17 LEU H 1.0 1.979 5.197 738 312 B 15 LYS HBx B 17 LEU H 1.0 1.979 5.197 739 312 B 14 LYS HBx B 17 LEU H 1.0 1.979 5.197 740 312 B 14 LYS HBy B 17 LEU H 1.0 1.979 5.197 741 313 A 15 LYS H A 14 LYS H 1.0 1.763 3.479 742 313 A 13 GLN H A 14 LYS H 1.0 1.763 3.479 743 314 B 15 LYS H B 14 LYS H 1.0 1.763 3.479 744 314 B 13 GLN H B 14 LYS H 1.0 1.763 3.479 745 315 A 48 ARG HDy A 48 ARG H 1.0 1.896 4.284 746 315 A 48 ARG HDx A 48 ARG H 1.0 1.896 4.284 747 316 B 48 ARG HDx B 48 ARG H 1.0 1.896 4.284 748 316 B 48 ARG HDy B 48 ARG H 1.0 1.896 4.284 749 317 A 59 TRP HBx A 55 GLN H 1.0 0.000 6.000 750 317 A 50 PHE HBy A 55 GLN H 1.0 0.000 6.000 751 318 B 59 TRP HBy B 55 GLN H 1.0 0.000 6.000 752 318 B 50 PHE HBx B 55 GLN H 1.0 0.000 6.000 753 319 A 45 GLN HBy A 9 PHE H 1.0 1.882 4.176 754 319 A 9 PHE H A 8 GLU HGx 1.0 1.882 4.176 755 320 B 45 GLN HBy B 9 PHE H 1.0 1.882 4.176 756 320 B 9 PHE H B 8 GLU HGx 1.0 1.882 4.176 757 321 A 52 ARG HBx A 54 GLU H 1.0 1.963 4.945 758 321 A 52 ARG HBy A 54 GLU H 1.0 1.963 4.945 759 322 B 52 ARG HBy B 54 GLU H 1.0 1.963 4.945 760 322 B 52 ARG HBx B 54 GLU H 1.0 1.963 4.945 761 323 A 51 ARG HDy A 54 GLU H 1.0 1.998 5.794 762 323 A 51 ARG HDx A 54 GLU H 1.0 1.998 5.794 763 324 B 51 ARG HDx B 54 GLU H 1.0 1.998 5.794 764 324 B 51 ARG HDy B 54 GLU H 1.0 1.998 5.794 765 325 A 39 LEU HG A 41 LEU H 1.0 1.986 5.350 766 325 A 39 LEU HBx A 41 LEU H 1.0 1.986 5.350 767 326 B 39 LEU HG B 41 LEU H 1.0 1.986 5.350 768 326 B 39 LEU HBy B 41 LEU H 1.0 1.986 5.350 769 327 A 27 LEU HDy% A 35 LEU H 1.0 1.989 5.405 770 327 A 27 LEU HDy% A 51 ARG H 1.0 1.989 5.405 771 328 B 27 LEU HD21 B 35 LEU H 1.0 1.989 5.405 772 328 B 27 LEU HD21 B 51 ARG H 1.0 1.989 5.405 773 329 A 34 TYR HA A 33 ARG H 1.0 1.993 5.537 774 329 A 16 ALA HA A 14 LYS H 1.0 1.993 5.537 775 329 A 15 LYS HA A 14 LYS H 1.0 1.993 5.537 776 330 B 34 TYR HA B 33 ARG H 1.0 1.993 5.537 777 330 B 16 ALA HA B 14 LYS H 1.0 1.993 5.537 778 330 B 15 LYS HA B 14 LYS H 1.0 1.993 5.537 779 331 A 12 GLU HA A 14 LYS H 1.0 1.864 4.050 780 331 A 14 LYS H A 10 SER HBy 1.0 1.864 4.050 781 332 B 12 GLU HA B 14 LYS H 1.0 1.864 4.050 782 332 B 14 LYS H B 10 SER HBx 1.0 1.864 4.050 783 333 A 52 ARG HBx A 56 GLN H 1.0 1.989 5.423 784 333 A 19 LEU H B 26 ARG HBx 1.0 1.989 5.423 785 334 B 52 ARG HBy B 56 GLN H 1.0 1.989 5.423 786 334 B 19 LEU H A 26 ARG HBy 1.0 1.989 5.423 787 335 A 15 LYS HDx A 15 LYS H 1.0 1.844 3.922 788 335 A 15 LYS H A 14 LYS HDx 1.0 1.844 3.922 789 336 B 15 LYS HDx B 15 LYS H 1.0 1.844 3.922 790 336 B 15 LYS H B 14 LYS HDx 1.0 1.844 3.922 791 337 A 56 GLN H A 56 GLN HGy 1.0 0.000 6.000 792 337 A 56 GLN H A 56 GLN HGx 1.0 0.000 6.000 793 338 B 56 GLN H B 56 GLN HGx 1.0 0.000 6.000 794 338 B 56 GLN H B 56 GLN HGy 1.0 0.000 6.000 795 339 A 19 LEU HDy% A 19 LEU H 1.0 1.907 4.365 796 339 B 19 LEU HD21 A 19 LEU H 1.0 1.907 4.365 797 339 B 19 LEU HD21 A 18 ASP H 1.0 1.907 4.365 798 340 B 19 LEU HD21 B 19 LEU H 1.0 1.907 4.365 799 340 A 19 LEU HDy% B 18 ASP H 1.0 1.907 4.365 800 340 A 19 LEU HDy% B 19 LEU H 1.0 1.907 4.365 801 341 A 60 SER H A 60 SER HG 1.0 1.602 2.828 802 341 A 59 TRP HA A 60 SER H 1.0 1.602 2.828 803 342 B 60 SER H B 60 SER HG 1.0 1.602 2.828 804 342 B 59 TRP HA B 60 SER H 1.0 1.602 2.828 805 343 A 43 GLU HBx A 36 SER H 1.0 1.942 4.694 806 343 A 37 GLN HBx A 36 SER H 1.0 1.942 4.694 807 344 B 43 GLU HBx B 36 SER H 1.0 1.942 4.694 808 344 B 37 GLN HBy B 36 SER H 1.0 1.942 4.694 809 345 A 36 SER H A 41 LEU HDx% 1.0 0.000 6.000 810 345 A 39 LEU HDx% A 36 SER H 1.0 0.000 6.000 811 346 B 36 SER H B 41 LEU HD11 1.0 0.000 6.000 812 346 B 39 LEU HD11 B 36 SER H 1.0 0.000 6.000 813 347 A 40 GLY H A 38 ARG HA 1.0 1.959 4.903 814 347 A 36 SER HA A 40 GLY H 1.0 1.959 4.903 815 348 B 40 GLY H B 38 ARG HA 1.0 1.959 4.903 816 348 B 36 SER HA B 40 GLY H 1.0 1.959 4.903 817 349 A 32 ARG HBx A 27 LEU H 1.0 1.986 5.350 818 349 A 24 ASP HBx A 27 LEU H 1.0 1.986 5.350 819 350 B 32 ARG HBy B 27 LEU H 1.0 1.986 5.350 820 350 B 24 ASP HBx B 27 LEU H 1.0 1.986 5.350 821 351 B 12 GLU HGx A 4 ARG H 1.0 1.977 5.157 822 351 A 12 GLU HGx A 4 ARG H 1.0 1.977 5.157 823 351 A 4 ARG H A 5 PRO HBx 1.0 1.977 5.157 824 352 A 12 GLU HGx B 4 ARG H 1.0 1.977 5.157 825 352 B 12 GLU HGx B 4 ARG H 1.0 1.977 5.157 826 352 B 4 ARG H B 5 PRO HBy 1.0 1.977 5.157 827 353 A 47 GLU H A 44 GLU HGx 1.0 1.988 5.398 828 353 A 45 GLN HBx A 47 GLU H 1.0 1.988 5.398 829 354 B 47 GLU H B 44 GLU HGx 1.0 1.988 5.398 830 354 B 45 GLN HBx B 47 GLU H 1.0 1.988 5.398 831 355 A 32 ARG HDx A 47 GLU H 1.0 1.994 5.578 832 355 A 32 ARG HDy A 47 GLU H 1.0 1.994 5.578 833 356 B 32 ARG HDx B 47 GLU H 1.0 1.994 5.578 834 356 B 32 ARG HDy B 47 GLU H 1.0 1.994 5.578 835 357 A 39 LEU HDy% A 48 ARG H 1.0 2.000 5.956 836 357 A 46 ILE HG2% A 48 ARG H 1.0 2.000 5.956 837 358 B 46 ILE HG21 B 48 ARG H 1.0 2.000 5.956 838 358 B 39 LEU HD21 B 48 ARG H 1.0 2.000 5.956 839 359 A 48 ARG HDy A 45 GLN H 1.0 2.000 6.000 840 359 A 48 ARG HDx A 45 GLN H 1.0 2.000 6.000 841 360 B 48 ARG HDx B 45 GLN H 1.0 2.000 6.000 842 360 B 48 ARG HDy B 45 GLN H 1.0 2.000 6.000 843 361 A 58 GLY H A 55 GLN HBy 1.0 1.989 5.413 844 361 A 58 GLY H A 55 GLN HBx 1.0 1.989 5.413 845 362 B 58 GLY H B 55 GLN HBx 1.0 1.989 5.413 846 362 B 58 GLY H B 55 GLN HBy 1.0 1.989 5.413 847 363 A 10 SER H A 8 GLU H 1.0 1.992 5.486 848 363 A 4 ARG H A 10 SER H 1.0 1.992 5.486 849 364 B 10 SER H B 8 GLU H 1.0 1.992 5.486 850 364 B 4 ARG H B 10 SER H 1.0 1.992 5.486 851 365 A 39 LEU HDx% A 14 LYS H 1.0 1.991 5.461 852 365 A 17 LEU HBx A 14 LYS H 1.0 1.991 5.461 853 366 B 39 LEU HD11 B 14 LYS H 1.0 1.991 5.461 854 366 B 17 LEU HBy B 14 LYS H 1.0 1.991 5.461 855 367 A 17 LEU HBy A 17 LEU H 1.0 1.832 3.852 856 367 A 17 LEU HDy% A 17 LEU H 1.0 1.832 3.852 857 368 B 17 LEU HBx B 17 LEU H 1.0 1.832 3.852 858 368 B 17 LEU HD21 B 17 LEU H 1.0 1.832 3.852 859 369 A 47 GLU H A 50 PHE H 1.0 1.998 6.212 860 369 A 33 ARG H A 43 GLU H 1.0 1.998 6.212 861 370 B 47 GLU H B 50 PHE H 1.0 1.998 6.212 862 370 B 33 ARG H B 43 GLU H 1.0 1.998 6.212 863 371 A 51 ARG H A 54 GLU HBx 1.0 1.980 5.220 864 371 A 55 GLN HGy A 51 ARG H 1.0 1.980 5.220 865 371 A 47 GLU HGx A 51 ARG H 1.0 1.980 5.220 866 371 A 47 GLU HGy A 51 ARG H 1.0 1.980 5.220 867 372 B 51 ARG H B 54 GLU HBx 1.0 1.980 5.220 868 372 B 55 GLN HGx B 51 ARG H 1.0 1.980 5.220 869 372 B 47 GLU HGx B 51 ARG H 1.0 1.980 5.220 870 372 B 47 GLU HGy B 51 ARG H 1.0 1.980 5.220 871 373 A 18 ASP H A 14 LYS HGx 1.0 1.975 5.131 872 373 A 56 GLN H A 57 ILE HG1y 1.0 1.975 5.131 873 374 B 18 ASP H B 14 LYS HGx 1.0 1.975 5.131 874 374 B 56 GLN H B 57 ILE HG1x 1.0 1.975 5.131 875 375 A 34 TYR HDy A 35 LEU HA 1.0 1.934 4.614 876 375 A 34 TYR HDx A 35 LEU HA 1.0 1.934 4.614 877 376 B 34 TYR HDy B 35 LEU HA 1.0 1.934 4.614 878 376 B 34 TYR HDx B 35 LEU HA 1.0 1.934 4.614 879 377 A 34 TYR HDx A 34 TYR H 1.0 1.876 4.134 880 378 B 34 TYR HDx B 34 TYR H 1.0 1.876 4.134 881 379 A 34 TYR HDy A 35 LEU H 1.0 1.917 4.457 882 379 A 34 TYR HDx A 35 LEU H 1.0 1.917 4.457 883 380 B 34 TYR HDy B 35 LEU H 1.0 1.917 4.457 884 380 B 34 TYR HDx B 35 LEU H 1.0 1.917 4.457 885 381 A 34 TYR HDy B 64 PHE HDy 1.0 0.000 6.000 886 381 A 34 TYR HDy B 64 PHE HDx 1.0 0.000 6.000 887 381 A 34 TYR HDx B 64 PHE HDy 1.0 0.000 6.000 888 381 A 34 TYR HDx B 64 PHE HDx 1.0 0.000 6.000 889 382 B 34 TYR HDy A 64 PHE HDy 1.0 0.000 6.000 890 382 B 34 TYR HDy A 64 PHE HDx 1.0 0.000 6.000 891 382 B 34 TYR HDx A 64 PHE HDy 1.0 0.000 6.000 892 382 B 34 TYR HDx A 64 PHE HDx 1.0 0.000 6.000 893 383 A 34 TYR HDy A 31 TRP HA 1.0 1.958 4.874 894 383 A 34 TYR HDx A 31 TRP HA 1.0 1.958 4.874 895 384 B 34 TYR HDy B 31 TRP HA 1.0 1.958 4.874 896 384 B 34 TYR HDx B 31 TRP HA 1.0 1.958 4.874 897 385 A 34 TYR HDx A 34 TYR HA 1.0 1.831 3.843 898 386 B 34 TYR HDx B 34 TYR HA 1.0 1.831 3.843 899 387 A 34 TYR HDx A 34 TYR HBy 1.0 1.813 3.745 900 388 B 34 TYR HDx B 34 TYR HBx 1.0 1.813 3.745 901 389 A 34 TYR HDy A 34 TYR HBx 1.0 1.794 3.634 902 389 A 34 TYR HDx A 34 TYR HBx 1.0 1.794 3.634 903 390 B 34 TYR HDy B 34 TYR HBy 1.0 1.794 3.634 904 390 B 34 TYR HDx B 34 TYR HBy 1.0 1.794 3.634 905 391 A 34 TYR HDx A 35 LEU HDy% 1.0 1.874 4.114 906 391 A 34 TYR HDy A 35 LEU HDy% 1.0 1.874 4.114 907 392 B 34 TYR HDy B 35 LEU HD21 1.0 1.874 4.114 908 392 B 34 TYR HDx B 35 LEU HD21 1.0 1.874 4.114 909 393 A 50 PHE HDx A 50 PHE HZ 1.0 1.924 4.522 910 394 B 50 PHE HDx B 50 PHE HZ 1.0 1.924 4.522 911 395 A 50 PHE HDy A 50 PHE HA 1.0 1.958 4.888 912 395 A 50 PHE HDx A 50 PHE HA 1.0 1.958 4.888 913 396 B 50 PHE HDy B 50 PHE HA 1.0 1.958 4.888 914 396 B 50 PHE HDx B 50 PHE HA 1.0 1.958 4.888 915 397 A 9 PHE HDy A 9 PHE HBx 1.0 1.856 3.994 916 397 A 9 PHE HDx A 9 PHE HBx 1.0 1.856 3.994 917 398 B 9 PHE HDy B 9 PHE HBy 1.0 1.856 3.994 918 398 B 9 PHE HDx B 9 PHE HBy 1.0 1.856 3.994 919 399 A 9 PHE HDx A 9 PHE HBy 1.0 1.846 3.934 920 400 B 9 PHE HDx B 9 PHE HBx 1.0 1.846 3.934 921 401 A 9 PHE HDy A 45 GLN HGx 1.0 0.000 6.000 922 401 A 9 PHE HDx A 45 GLN HGx 1.0 0.000 6.000 923 402 B 9 PHE HDy B 45 GLN HGx 1.0 0.000 6.000 924 402 B 9 PHE HDx B 45 GLN HGx 1.0 0.000 6.000 925 403 A 9 PHE HDy A 8 GLU HBx 1.0 0.000 6.000 926 403 A 9 PHE HDx A 8 GLU HBx 1.0 0.000 6.000 927 404 B 9 PHE HDy B 8 GLU HBx 1.0 0.000 6.000 928 404 B 9 PHE HDx B 8 GLU HBx 1.0 0.000 6.000 929 405 A 9 PHE HDx A 41 LEU HDx% 1.0 1.799 3.667 930 406 B 9 PHE HDx B 41 LEU HD11 1.0 1.799 3.667 931 407 A 9 PHE HDx A 41 LEU HDy% 1.0 0.000 6.000 932 408 B 9 PHE HDx B 41 LEU HD21 1.0 0.000 6.000 933 409 A 9 PHE HDx A 17 LEU HDy% 1.0 1.868 4.076 934 409 A 9 PHE HDy A 17 LEU HDy% 1.0 1.868 4.076 935 410 B 9 PHE HDx B 17 LEU HD21 1.0 1.868 4.076 936 410 B 9 PHE HDy B 17 LEU HD21 1.0 1.868 4.076 937 411 A 50 PHE HZ A 50 PHE HEx 1.0 1.869 4.087 938 412 B 50 PHE HZ B 50 PHE HEx 1.0 1.869 4.087 939 413 A 50 PHE HDx A 50 PHE HEx 1.0 1.802 3.682 940 414 B 50 PHE HDx B 50 PHE HEx 1.0 1.802 3.682 941 415 A 59 TRP HD1 A 59 TRP H 1.0 0.000 6.000 942 416 B 59 TRP HD1 B 59 TRP H 1.0 0.000 6.000 943 417 A 59 TRP HA A 59 TRP HD1 1.0 1.740 3.374 944 418 B 59 TRP HA B 59 TRP HD1 1.0 1.740 3.374 945 419 A 59 TRP HD1 A 59 TRP HBx 1.0 0.000 6.000 946 420 B 59 TRP HD1 B 59 TRP HBy 1.0 0.000 6.000 947 421 A 49 TRP HD1 A 49 TRP HA 1.0 1.920 4.484 948 422 B 49 TRP HD1 B 49 TRP HA 1.0 1.920 4.484 949 423 A 49 TRP HD1 A 49 TRP HBx 1.0 1.909 4.391 950 424 B 49 TRP HD1 B 49 TRP HBy 1.0 1.909 4.391 951 425 A 49 TRP HD1 A 49 TRP HBy 1.0 1.902 4.326 952 426 B 49 TRP HD1 B 49 TRP HBx 1.0 1.902 4.326 953 427 A 49 TRP HD1 A 49 TRP HE1 1.0 1.771 3.523 954 428 B 49 TRP HD1 B 49 TRP HE1 1.0 1.771 3.523 955 429 A 59 TRP HD1 A 59 TRP HE1 1.0 1.600 2.820 956 430 B 59 TRP HD1 B 59 TRP HE1 1.0 1.600 2.820 957 431 A 61 HIS HA A 61 HIS HD1 1.0 1.916 4.448 958 432 B 61 HIS HA B 61 HIS HD1 1.0 1.916 4.448 959 433 A 16 ALA HB% B 16 ALA HA 1.0 1.937 4.639 960 434 B 16 ALA HB1 A 16 ALA HA 1.0 1.937 4.639 961 435 A 16 ALA HB% B 39 LEU HD11 1.0 0.000 6.000 962 436 B 16 ALA HB1 A 39 LEU HDx% 1.0 0.000 6.000 963 437 A 20 ALA HB% B 20 ALA H 1.0 0.000 6.000 964 438 B 20 ALA HB1 A 20 ALA H 1.0 0.000 6.000 965 439 A 20 ALA HB% B 20 ALA HB1 1.0 0.000 6.000 966 440 A 20 ALA HB% B 20 ALA HB1 1.0 0.000 6.000 967 441 A 16 ALA HB% B 20 ALA H 1.0 0.000 6.000 968 442 B 16 ALA HB1 A 20 ALA H 1.0 0.000 6.000 969 443 A 16 ALA HB% B 16 ALA H 1.0 1.919 4.473 970 444 B 16 ALA HB1 A 16 ALA H 1.0 1.919 4.473 971 445 A 9 PHE HDy A 9 PHE H 1.0 1.918 4.464 972 445 A 9 PHE HDx A 9 PHE H 1.0 1.918 4.464 973 446 B 9 PHE HDy B 9 PHE H 1.0 1.918 4.464 974 446 B 9 PHE HDx B 9 PHE H 1.0 1.918 4.464 975 447 A 9 PHE HDy A 45 GLN HBy 1.0 1.912 4.418 976 447 A 9 PHE HDx A 45 GLN HBy 1.0 1.912 4.418 977 448 B 9 PHE HDy B 45 GLN HBy 1.0 1.912 4.418 978 448 B 9 PHE HDx B 45 GLN HBy 1.0 1.912 4.418 979 449 A 9 PHE HDy A 10 SER H 1.0 1.915 4.433 980 449 A 9 PHE HDx A 10 SER H 1.0 1.915 4.433 981 450 B 9 PHE HDy B 10 SER H 1.0 1.915 4.433 982 450 B 9 PHE HDx B 10 SER H 1.0 1.915 4.433 983 451 A 39 LEU HDx% B 39 LEU HD11 1.0 0.000 6.000 984 452 A 39 LEU HDx% B 39 LEU HD11 1.0 0.000 6.000 985 453 B 16 ALA HB1 A 39 LEU HDx% 1.0 1.912 4.414 986 454 A 16 ALA HB% B 39 LEU HD11 1.0 1.912 4.414 987 455 B 15 LYS HEx A 39 LEU HDx% 1.0 1.929 4.565 988 456 A 15 LYS HEx B 39 LEU HD11 1.0 1.929 4.565 989 457 A 49 TRP HD1 A 17 LEU HDx% 1.0 1.978 5.198 990 458 B 49 TRP HD1 B 17 LEU HD11 1.0 1.978 5.198 991 459 A 49 TRP HD1 A 17 LEU HBx 1.0 1.962 4.938 992 460 B 49 TRP HD1 B 17 LEU HBy 1.0 1.962 4.938 993 461 A 49 TRP HD1 A 14 LYS HEx 1.0 1.986 5.334 994 462 B 49 TRP HD1 B 14 LYS HEx 1.0 1.986 5.334 995 463 A 49 TRP HD1 A 63 GLN HE2y 1.0 0.000 6.000 996 463 A 49 TRP HD1 A 63 GLN HE2x 1.0 0.000 6.000 997 464 B 49 TRP HD1 B 63 GLN HE2y 1.0 0.000 6.000 998 464 B 49 TRP HD1 B 63 GLN HE2x 1.0 0.000 6.000 999 465 B 19 LEU HD21 A 19 LEU HDy% 1.0 0.000 6.000 1000 466 B 19 LEU HD21 A 19 LEU HDy% 1.0 0.000 6.000 1001 467 A 19 LEU HDy% B 35 LEU HBy 1.0 1.923 4.505 1002 468 B 19 LEU HD21 A 35 LEU HBy 1.0 1.923 4.505 1003 469 B 16 ALA HB1 A 19 LEU HDy% 1.0 1.916 4.442 1004 470 A 16 ALA HB% B 19 LEU HD21 1.0 1.916 4.442 1005 471 A 19 LEU HDy% B 19 LEU HG 1.0 0.000 6.000 1006 472 B 19 LEU HD21 A 19 LEU HG 1.0 0.000 6.000 1007 473 A 19 LEU HDy% B 19 LEU HBx 1.0 1.969 5.037 1008 474 B 19 LEU HD21 A 19 LEU HBx 1.0 1.969 5.037 1009 475 A 19 LEU HDy% B 16 ALA HA 1.0 1.879 4.151 1010 476 B 19 LEU HD21 A 16 ALA HA 1.0 1.879 4.151 1011 477 A 19 LEU HDy% B 19 LEU HA 1.0 0.000 6.000 1012 478 B 19 LEU HD21 A 19 LEU HA 1.0 0.000 6.000 1013 479 A 19 LEU HDy% B 17 LEU HD11 1.0 1.933 4.601 1014 480 B 19 LEU HD21 A 17 LEU HDx% 1.0 1.933 4.601 1015 481 A 50 PHE HDy A 50 PHE H 1.0 1.966 4.994 1016 481 A 50 PHE HDx A 50 PHE H 1.0 1.966 4.994 1017 482 B 50 PHE HDy B 50 PHE H 1.0 1.966 4.994 1018 482 B 50 PHE HDx B 50 PHE H 1.0 1.966 4.994 1019 483 A 50 PHE HDy A 27 LEU HDx% 1.0 1.945 4.725 1020 483 A 50 PHE HDx A 27 LEU HDx% 1.0 1.945 4.725 1021 484 B 50 PHE HDy B 27 LEU HD11 1.0 1.945 4.725 1022 484 B 50 PHE HDx B 27 LEU HD11 1.0 1.945 4.725 1023 485 A 50 PHE HEx A 50 PHE HBx 1.0 1.969 5.035 1024 486 B 50 PHE HEx B 50 PHE HBy 1.0 1.969 5.035 1025 487 A 50 PHE HBy A 50 PHE HEx 1.0 1.981 5.231 1026 488 B 50 PHE HBx B 50 PHE HEx 1.0 1.981 5.231 1027 489 A 27 LEU HDx% A 50 PHE HEx 1.0 1.931 4.583 1028 490 B 27 LEU HD11 B 50 PHE HEx 1.0 1.931 4.583 1029 491 A 12 GLU HBx B 39 LEU HA 1.0 0.000 6.000 1030 492 B 12 GLU HBy A 39 LEU HA 1.0 0.000 6.000 1031 493 A 12 GLU HGx B 12 GLU HBy 1.0 0.000 6.000 1032 494 B 12 GLU HGx A 12 GLU HBx 1.0 0.000 6.000 1033 495 A 61 HIS H A 61 HIS HD1 1.0 1.919 4.479 1034 496 B 61 HIS H B 61 HIS HD1 1.0 1.919 4.479 1035 497 A 12 GLU HGx B 12 GLU HA 1.0 0.000 6.000 1036 498 B 12 GLU HGx A 12 GLU HA 1.0 0.000 6.000 1037 499 A 28 THR HB A 28 THR HG2% 1.0 1.677 3.107 1038 500 B 28 THR HB B 28 THR HG21 1.0 1.677 3.107 1039 501 A 28 THR HB A 29 PRO HDx 1.0 1.689 3.155 1040 502 B 28 THR HB B 29 PRO HDx 1.0 1.689 3.155 1041 503 A 29 PRO HA A 29 PRO HBx 1.0 1.702 3.210 1042 504 B 29 PRO HA B 29 PRO HBy 1.0 1.702 3.210 1043 505 A 29 PRO HA A 29 PRO HBy 1.0 1.673 3.093 1044 506 B 29 PRO HA B 29 PRO HBx 1.0 1.673 3.093 1045 507 A 32 ARG HBy A 29 PRO HA 1.0 0.000 6.000 1046 508 B 32 ARG HBx B 29 PRO HA 1.0 0.000 6.000 1047 509 A 10 SER HBy A 10 SER HBx 1.0 1.703 3.213 1048 510 B 10 SER HBx B 10 SER HBy 1.0 1.703 3.213 1049 511 A 39 LEU HDy% A 46 ILE HA 1.0 0.000 6.000 1050 512 B 39 LEU HD21 B 46 ILE HA 1.0 0.000 6.000 1051 513 A 46 ILE HA A 46 ILE HB 1.0 1.840 3.894 1052 514 B 46 ILE HA B 46 ILE HB 1.0 1.840 3.894 1053 515 A 46 ILE HA A 46 ILE HG1x 1.0 1.815 3.755 1054 516 B 46 ILE HA B 46 ILE HG1y 1.0 1.815 3.755 1055 517 A 46 ILE HA A 46 ILE HG1y 1.0 1.839 3.895 1056 518 B 46 ILE HA B 46 ILE HG1x 1.0 1.839 3.895 1057 519 A 46 ILE HA A 27 LEU HDy% 1.0 1.818 3.770 1058 520 B 46 ILE HA B 27 LEU HD21 1.0 1.818 3.770 1059 521 A 5 PRO HA A 5 PRO HBx 1.0 1.535 2.607 1060 522 B 5 PRO HA B 5 PRO HBy 1.0 1.535 2.607 1061 523 A 62 PRO HBx A 62 PRO HA 1.0 1.532 2.596 1062 524 B 62 PRO HBy B 62 PRO HA 1.0 1.532 2.596 1063 525 A 62 PRO HGy A 62 PRO HA 1.0 0.000 6.000 1064 526 B 62 PRO HGy B 62 PRO HA 1.0 0.000 6.000 1065 527 A 62 PRO HA A 62 PRO HBy 1.0 1.634 2.944 1066 528 B 62 PRO HA B 62 PRO HBx 1.0 1.634 2.944 1067 529 A 60 SER HBx A 60 SER HG 1.0 1.855 3.989 1068 530 B 60 SER HBy B 60 SER HG 1.0 1.855 3.989 1069 531 A 60 SER HBy A 60 SER HG 1.0 1.860 4.026 1070 532 B 60 SER HBx B 60 SER HG 1.0 1.860 4.026 1071 533 A 36 SER HBy A 46 ILE HG1x 1.0 1.871 4.097 1072 534 B 36 SER HBy B 46 ILE HG1y 1.0 1.871 4.097 1073 535 A 57 ILE HA A 57 ILE HG2% 1.0 1.553 2.667 1074 536 B 57 ILE HA B 57 ILE HG21 1.0 1.553 2.667 1075 537 A 50 PHE HA A 53 LYS HBx 1.0 1.864 4.052 1076 538 B 50 PHE HA B 53 LYS HBy 1.0 1.864 4.052 1077 539 A 50 PHE HA A 50 PHE HBx 1.0 1.809 3.717 1078 540 B 50 PHE HA B 50 PHE HBy 1.0 1.809 3.717 1079 541 A 49 TRP HA A 49 TRP HBx 1.0 1.799 3.665 1080 542 B 49 TRP HA B 49 TRP HBy 1.0 1.799 3.665 1081 543 A 50 PHE HA A 50 PHE HBy 1.0 1.772 3.524 1082 544 B 50 PHE HA B 50 PHE HBx 1.0 1.772 3.524 1083 545 A 49 TRP HA A 49 TRP HBy 1.0 1.759 3.465 1084 546 B 49 TRP HA B 49 TRP HBx 1.0 1.759 3.465 1085 547 A 34 TYR HA A 34 TYR HBx 1.0 1.817 3.763 1086 548 B 34 TYR HA B 34 TYR HBy 1.0 1.817 3.763 1087 549 A 34 TYR HA A 34 TYR HBy 1.0 1.882 4.178 1088 550 B 34 TYR HA B 34 TYR HBx 1.0 1.882 4.178 1089 551 A 57 ILE HA A 57 ILE HB 1.0 1.605 2.839 1090 552 B 57 ILE HA B 57 ILE HB 1.0 1.605 2.839 1091 553 A 57 ILE HA A 57 ILE HG1x 1.0 0.000 6.000 1092 554 B 57 ILE HA B 57 ILE HG1y 1.0 0.000 6.000 1093 555 A 57 ILE HA A 57 ILE HG1y 1.0 1.761 3.475 1094 556 B 57 ILE HA B 57 ILE HG1x 1.0 1.761 3.475 1095 557 A 52 ARG HBx A 49 TRP HA 1.0 1.791 3.621 1096 558 B 52 ARG HBy B 49 TRP HA 1.0 1.791 3.621 1097 559 A 5 PRO HA A 5 PRO HBy 1.0 1.593 2.797 1098 560 B 5 PRO HA B 5 PRO HBx 1.0 1.593 2.797 1099 561 A 43 GLU HBx A 43 GLU HA 1.0 1.711 3.249 1100 562 B 43 GLU HBx B 43 GLU HA 1.0 1.711 3.249 1101 563 A 43 GLU HA A 43 GLU HGx 1.0 1.842 3.908 1102 564 B 43 GLU HA B 43 GLU HGx 1.0 1.842 3.908 1103 565 A 43 GLU HA A 46 ILE HG1x 1.0 1.855 3.989 1104 566 B 43 GLU HA B 46 ILE HG1y 1.0 1.855 3.989 1105 567 A 36 SER HBy A 36 SER HG 1.0 1.833 3.855 1106 568 B 36 SER HBy B 36 SER HG 1.0 1.833 3.855 1107 569 A 14 LYS HBx A 14 LYS HA 1.0 1.775 3.545 1108 570 B 14 LYS HBy B 14 LYS HA 1.0 1.775 3.545 1109 571 A 46 ILE HD1% A 43 GLU HA 1.0 1.832 3.850 1110 572 B 46 ILE HD11 B 43 GLU HA 1.0 1.832 3.850 1111 573 A 28 THR HA A 28 THR HG2% 1.0 1.657 3.029 1112 574 B 28 THR HA B 28 THR HG21 1.0 1.657 3.029 1113 575 A 28 THR HA A 29 PRO HDx 1.0 1.630 2.926 1114 576 B 28 THR HA B 29 PRO HDx 1.0 1.630 2.926 1115 577 A 32 ARG HBx A 32 ARG HA 1.0 1.845 3.927 1116 578 B 32 ARG HBy B 32 ARG HA 1.0 1.845 3.927 1117 579 A 46 ILE HG2% A 32 ARG HA 1.0 1.833 3.857 1118 580 B 46 ILE HG21 B 32 ARG HA 1.0 1.833 3.857 1119 581 A 27 LEU HDy% A 32 ARG HA 1.0 1.831 3.845 1120 582 B 27 LEU HD21 B 32 ARG HA 1.0 1.831 3.845 1121 583 A 17 LEU HDy% A 14 LYS HA 1.0 1.858 4.010 1122 584 B 17 LEU HD21 B 14 LYS HA 1.0 1.858 4.010 1123 585 A 14 LYS HA A 14 LYS HGx 1.0 1.878 4.144 1124 586 B 14 LYS HA B 14 LYS HGx 1.0 1.878 4.144 1125 587 A 14 LYS HA A 14 LYS HDx 1.0 0.000 6.000 1126 588 B 14 LYS HA B 14 LYS HDx 1.0 0.000 6.000 1127 589 A 32 ARG HBy A 32 ARG HA 1.0 1.768 3.504 1128 590 B 32 ARG HBx B 32 ARG HA 1.0 1.768 3.504 1129 591 A 27 LEU HDx% A 32 ARG HA 1.0 0.000 6.000 1130 592 B 27 LEU HD11 B 32 ARG HA 1.0 0.000 6.000 1131 593 A 47 GLU HGy A 47 GLU HA 1.0 1.721 3.293 1132 594 B 47 GLU HGy B 47 GLU HA 1.0 1.721 3.293 1133 595 A 47 GLU HBy A 47 GLU HA 1.0 1.681 3.123 1134 596 B 47 GLU HBy B 47 GLU HA 1.0 1.681 3.123 1135 597 A 46 ILE HB A 47 GLU HA 1.0 1.850 3.962 1136 598 B 46 ILE HB B 47 GLU HA 1.0 1.850 3.962 1137 599 A 47 GLU HA A 50 PHE HBx 1.0 1.873 4.111 1138 600 B 47 GLU HA B 50 PHE HBy 1.0 1.873 4.111 1139 601 A 50 PHE HBy A 47 GLU HA 1.0 1.880 4.160 1140 602 B 50 PHE HBx B 47 GLU HA 1.0 1.880 4.160 1141 603 A 12 GLU HGx A 12 GLU HA 1.0 0.000 6.000 1142 604 B 12 GLU HGx B 12 GLU HA 1.0 0.000 6.000 1143 605 A 27 LEU HDx% A 47 GLU HA 1.0 1.699 3.197 1144 606 B 27 LEU HD11 B 47 GLU HA 1.0 1.699 3.197 1145 607 A 50 PHE HA A 53 LYS HBy 1.0 1.864 4.050 1146 608 B 50 PHE HA B 53 LYS HBx 1.0 1.864 4.050 1147 609 A 46 ILE HG2% A 47 GLU HA 1.0 1.885 4.199 1148 610 B 46 ILE HG21 B 47 GLU HA 1.0 1.885 4.199 1149 611 A 14 LYS HA A 17 LEU HBx 1.0 1.919 4.477 1150 612 B 14 LYS HA B 17 LEU HBy 1.0 1.919 4.477 1151 613 A 54 GLU HA A 57 ILE HG2% 1.0 1.784 3.584 1152 614 B 54 GLU HA B 57 ILE HG21 1.0 1.784 3.584 1153 615 A 52 ARG HA A 52 ARG HGy 1.0 1.765 3.493 1154 616 B 52 ARG HA B 52 ARG HGx 1.0 1.765 3.493 1155 617 A 44 GLU HA A 44 GLU HBx 1.0 0.000 6.000 1156 618 B 44 GLU HA B 44 GLU HBx 1.0 0.000 6.000 1157 619 A 18 ASP HBx A 18 ASP HA 1.0 1.782 3.574 1158 620 B 18 ASP HBy B 18 ASP HA 1.0 1.782 3.574 1159 621 A 18 ASP HA A 18 ASP HBy 1.0 1.729 3.327 1160 622 B 18 ASP HA B 18 ASP HBx 1.0 1.729 3.327 1161 623 A 15 LYS HA A 18 ASP HBx 1.0 1.748 3.414 1162 624 B 15 LYS HA B 18 ASP HBy 1.0 1.748 3.414 1163 625 A 15 LYS HEx A 12 GLU HA 1.0 1.763 3.483 1164 626 B 15 LYS HEx B 12 GLU HA 1.0 1.763 3.483 1165 627 A 52 ARG HA A 52 ARG HDy 1.0 1.844 3.924 1166 628 B 52 ARG HA B 52 ARG HDy 1.0 1.844 3.924 1167 629 A 15 LYS HA A 18 ASP HBy 1.0 1.793 3.635 1168 630 B 15 LYS HA B 18 ASP HBx 1.0 1.793 3.635 1169 631 A 13 GLN HBx A 13 GLN HA 1.0 1.735 3.355 1170 632 B 13 GLN HBx B 13 GLN HA 1.0 1.735 3.355 1171 633 A 13 GLN HGy A 13 GLN HA 1.0 1.786 3.598 1172 634 B 13 GLN HGy B 13 GLN HA 1.0 1.786 3.598 1173 635 A 19 LEU HDy% A 19 LEU HA 1.0 0.000 6.000 1174 636 B 19 LEU HD21 B 19 LEU HA 1.0 0.000 6.000 1175 637 A 17 LEU HA A 17 LEU HG 1.0 1.860 4.022 1176 638 B 17 LEU HA B 17 LEU HG 1.0 1.860 4.022 1177 639 A 17 LEU HBx A 17 LEU HA 1.0 1.812 3.734 1178 640 B 17 LEU HBy B 17 LEU HA 1.0 1.812 3.734 1179 641 A 17 LEU HBy A 17 LEU HA 1.0 1.831 3.845 1180 642 B 17 LEU HBx B 17 LEU HA 1.0 1.831 3.845 1181 643 A 53 LYS HA A 53 LYS HBx 1.0 1.800 3.674 1182 644 B 53 LYS HA B 53 LYS HBy 1.0 1.800 3.674 1183 645 A 53 LYS HA A 53 LYS HDx 1.0 1.778 3.558 1184 646 B 53 LYS HA B 53 LYS HDy 1.0 1.778 3.558 1185 647 A 53 LYS HA A 53 LYS HBy 1.0 1.831 3.843 1186 648 B 53 LYS HA B 53 LYS HBx 1.0 1.831 3.843 1187 649 A 48 ARG HDy A 48 ARG HA 1.0 1.727 3.319 1188 650 B 48 ARG HDx B 48 ARG HA 1.0 1.727 3.319 1189 651 A 33 ARG HDx A 33 ARG HA 1.0 0.000 6.000 1190 652 B 33 ARG HDx B 33 ARG HA 1.0 0.000 6.000 1191 653 A 11 GLU HA A 10 SER HA 1.0 0.000 6.000 1192 654 B 11 GLU HA B 10 SER HA 1.0 0.000 6.000 1193 655 A 32 ARG HBx A 28 THR HA 1.0 0.000 6.000 1194 656 B 32 ARG HBy B 28 THR HA 1.0 0.000 6.000 1195 657 A 17 LEU HDx% A 17 LEU HA 1.0 1.722 3.292 1196 658 B 17 LEU HD11 B 17 LEU HA 1.0 1.722 3.292 1197 659 A 53 LYS HA A 63 GLN HGx 1.0 1.878 4.144 1198 660 B 53 LYS HA B 63 GLN HGx 1.0 1.878 4.144 1199 661 A 10 SER HBy A 10 SER HA 1.0 1.679 3.113 1200 662 B 10 SER HBx B 10 SER HA 1.0 1.679 3.113 1201 663 A 64 PHE HA A 64 PHE HBx 1.0 1.612 2.864 1202 664 B 64 PHE HA B 64 PHE HBx 1.0 1.612 2.864 1203 665 A 64 PHE HA A 64 PHE HBy 1.0 1.652 3.012 1204 666 B 64 PHE HA B 64 PHE HBy 1.0 1.652 3.012 1205 667 A 10 SER HA A 11 GLU HBx 1.0 0.000 6.000 1206 668 B 10 SER HA B 11 GLU HBx 1.0 0.000 6.000 1207 669 A 35 LEU HA A 35 LEU HBx 1.0 1.894 4.264 1208 670 B 35 LEU HA B 35 LEU HBx 1.0 1.894 4.264 1209 671 A 52 ARG HA A 55 GLN HBy 1.0 1.661 3.045 1210 672 B 52 ARG HA B 55 GLN HBx 1.0 1.661 3.045 1211 673 A 33 ARG HBy A 33 ARG HA 1.0 1.619 2.889 1212 674 B 33 ARG HBy B 33 ARG HA 1.0 1.619 2.889 1213 675 A 52 ARG HA A 55 GLN HGx 1.0 1.838 3.882 1214 676 B 52 ARG HA B 55 GLN HGy 1.0 1.838 3.882 1215 677 A 52 ARG HBy A 52 ARG HA 1.0 1.573 2.729 1216 678 B 52 ARG HBx B 52 ARG HA 1.0 1.573 2.729 1217 679 A 48 ARG HA A 51 ARG HGx 1.0 1.609 2.857 1218 679 A 48 ARG HA A 51 ARG HGy 1.0 1.609 2.857 1219 680 B 48 ARG HA B 51 ARG HGx 1.0 1.609 2.857 1220 680 B 48 ARG HA B 51 ARG HGy 1.0 1.609 2.857 1221 681 A 8 GLU HBx A 8 GLU HA 1.0 0.000 6.000 1222 682 B 8 GLU HBx B 8 GLU HA 1.0 0.000 6.000 1223 683 A 4 ARG HBx A 3 LYS HA 1.0 0.000 6.000 1224 684 B 4 ARG HBy B 3 LYS HA 1.0 0.000 6.000 1225 685 A 55 GLN HGy A 55 GLN HA 1.0 0.000 6.000 1226 686 B 55 GLN HGx B 55 GLN HA 1.0 0.000 6.000 1227 687 A 51 ARG HA A 51 ARG HBy 1.0 1.583 2.765 1228 688 B 51 ARG HA B 51 ARG HBy 1.0 1.583 2.765 1229 689 A 41 LEU HBx A 8 GLU HA 1.0 1.834 3.856 1230 690 B 41 LEU HBy B 8 GLU HA 1.0 1.834 3.856 1231 691 A 58 GLY HAx A 60 SER HA 1.0 0.000 6.000 1232 692 B 58 GLY HAx B 60 SER HA 1.0 0.000 6.000 1233 693 A 9 PHE HA A 9 PHE HBx 1.0 1.732 3.342 1234 694 B 9 PHE HA B 9 PHE HBy 1.0 1.732 3.342 1235 695 A 9 PHE HA A 9 PHE HBy 1.0 1.762 3.478 1236 696 B 9 PHE HA B 9 PHE HBx 1.0 1.762 3.478 1237 697 A 9 PHE HA A 45 GLN HBx 1.0 0.000 6.000 1238 698 B 9 PHE HA B 45 GLN HBx 1.0 0.000 6.000 1239 699 A 3 LYS HA A 2 GLU HGx 1.0 0.000 6.000 1240 700 B 3 LYS HA B 2 GLU HGx 1.0 0.000 6.000 1241 701 A 63 GLN HGy A 63 GLN HA 1.0 1.691 3.163 1242 702 B 63 GLN HGy B 63 GLN HA 1.0 1.691 3.163 1243 703 A 9 PHE HBy A 8 GLU HA 1.0 0.000 6.000 1244 704 B 9 PHE HBx B 8 GLU HA 1.0 0.000 6.000 1245 705 A 2 GLU HA A 2 GLU HBx 1.0 1.765 3.493 1246 706 B 2 GLU HA B 2 GLU HBy 1.0 1.765 3.493 1247 707 A 3 LYS HA A 2 GLU HBx 1.0 0.000 6.000 1248 708 B 3 LYS HA B 2 GLU HBy 1.0 0.000 6.000 1249 709 A 3 LYS HA A 3 LYS HGy 1.0 1.848 3.944 1250 710 B 3 LYS HA B 3 LYS HGx 1.0 1.848 3.944 1251 711 A 6 ARG HGx A 6 ARG HA 1.0 1.663 3.053 1252 712 B 6 ARG HGx B 6 ARG HA 1.0 1.663 3.053 1253 713 A 55 GLN HBx A 55 GLN HA 1.0 1.530 2.592 1254 714 B 55 GLN HBy B 55 GLN HA 1.0 1.530 2.592 1255 715 A 63 GLN HBx A 63 GLN HA 1.0 1.533 2.599 1256 716 B 63 GLN HBx B 63 GLN HA 1.0 1.533 2.599 1257 717 A 10 SER HBx A 10 SER HA 1.0 1.671 3.085 1258 718 B 10 SER HBy B 10 SER HA 1.0 1.671 3.085 1259 719 A 7 THR HG2% A 8 GLU HA 1.0 0.000 6.000 1260 720 B 7 THR HG21 B 8 GLU HA 1.0 0.000 6.000 1261 721 A 9 PHE HA A 10 SER H 1.0 1.648 2.996 1262 722 B 9 PHE HA B 10 SER H 1.0 1.648 2.996 1263 723 A 9 PHE HA A 9 PHE H 1.0 1.763 3.485 1264 724 B 9 PHE HA B 9 PHE H 1.0 1.763 3.485 1265 725 A 9 PHE HDy A 9 PHE HA 1.0 0.000 6.000 1266 725 A 9 PHE HDx A 9 PHE HA 1.0 0.000 6.000 1267 726 B 9 PHE HDy B 9 PHE HA 1.0 0.000 6.000 1268 726 B 9 PHE HDx B 9 PHE HA 1.0 0.000 6.000 1269 727 A 10 SER HA A 11 GLU H 1.0 1.632 2.936 1270 728 B 10 SER HA B 11 GLU H 1.0 1.632 2.936 1271 729 A 64 PHE HA A 64 PHE HDy 1.0 1.667 3.071 1272 729 A 64 PHE HA A 64 PHE HDx 1.0 1.667 3.071 1273 730 B 64 PHE HA B 64 PHE HDy 1.0 1.667 3.071 1274 730 B 64 PHE HA B 64 PHE HDx 1.0 1.667 3.071 1275 731 A 59 TRP HA A 59 TRP H 1.0 1.550 2.656 1276 732 B 59 TRP HA B 59 TRP H 1.0 1.550 2.656 1277 733 A 59 TRP HA A 55 GLN H 1.0 1.847 3.945 1278 734 B 59 TRP HA B 55 GLN H 1.0 1.847 3.945 1279 735 A 18 ASP H A 18 ASP HA 1.0 1.775 3.541 1280 736 B 18 ASP H B 18 ASP HA 1.0 1.775 3.541 1281 737 A 53 LYS H A 53 LYS HA 1.0 1.746 3.404 1282 738 B 53 LYS H B 53 LYS HA 1.0 1.746 3.404 1283 739 A 12 GLU H A 2 GLU HA 1.0 0.000 6.000 1284 740 B 12 GLU H B 2 GLU HA 1.0 0.000 6.000 1285 741 A 3 LYS HA A 4 ARG H 1.0 1.506 2.520 1286 742 B 3 LYS HA B 4 ARG H 1.0 1.506 2.520 1287 743 A 64 PHE H A 63 GLN HA 1.0 0.000 6.000 1288 744 B 64 PHE H B 63 GLN HA 1.0 0.000 6.000 1289 745 A 54 GLU HA A 54 GLU H 1.0 1.745 3.395 1290 746 B 54 GLU HA B 54 GLU H 1.0 1.745 3.395 1291 747 A 9 PHE H A 8 GLU HA 1.0 0.000 6.000 1292 748 B 9 PHE H B 8 GLU HA 1.0 0.000 6.000 1293 749 A 60 SER H A 60 SER HA 1.0 1.668 3.072 1294 750 B 60 SER H B 60 SER HA 1.0 1.668 3.072 1295 751 A 65 GLU HA A 66 LYS H 1.0 0.000 6.000 1296 752 B 65 GLU HA B 66 LYS H 1.0 0.000 6.000 1297 753 A 55 GLN H A 55 GLN HA 1.0 1.690 3.160 1298 754 B 55 GLN H B 55 GLN HA 1.0 1.690 3.160 1299 755 A 38 ARG HA A 38 ARG H 1.0 1.690 3.160 1300 756 B 38 ARG HA B 38 ARG H 1.0 1.690 3.160 1301 757 A 10 SER HBx A 11 GLU H 1.0 1.790 3.620 1302 758 B 10 SER HBy B 11 GLU H 1.0 1.790 3.620 1303 759 A 46 ILE HA A 46 ILE H 1.0 1.850 3.962 1304 760 B 46 ILE HA B 46 ILE H 1.0 1.850 3.962 1305 761 A 36 SER HBx A 36 SER H 1.0 1.715 3.263 1306 762 B 36 SER HBx B 36 SER H 1.0 1.715 3.263 1307 763 A 62 PRO HA A 63 GLN H 1.0 0.000 6.000 1308 764 B 62 PRO HA B 63 GLN H 1.0 0.000 6.000 1309 765 A 34 TYR HDy A 34 TYR HA 1.0 1.828 3.826 1310 765 A 34 TYR HDx A 34 TYR HA 1.0 1.828 3.826 1311 766 B 34 TYR HDy B 34 TYR HA 1.0 1.828 3.826 1312 766 B 34 TYR HDx B 34 TYR HA 1.0 1.828 3.826 1313 767 A 57 ILE HA A 57 ILE H 1.0 1.645 2.983 1314 768 B 57 ILE HA B 57 ILE H 1.0 1.645 2.983 1315 769 A 43 GLU HA A 43 GLU H 1.0 1.830 3.838 1316 770 B 43 GLU HA B 43 GLU H 1.0 1.830 3.838 1317 771 A 50 PHE HA A 50 PHE H 1.0 1.844 3.920 1318 772 B 50 PHE HA B 50 PHE H 1.0 1.844 3.920 1319 773 A 60 SER HBy A 60 SER H 1.0 1.757 3.455 1320 774 B 60 SER HBx B 60 SER H 1.0 1.757 3.455 1321 775 A 5 PRO HA A 4 ARG HA 1.0 0.000 6.000 1322 776 B 5 PRO HA B 4 ARG HA 1.0 0.000 6.000 1323 777 A 41 LEU H A 36 SER HA 1.0 1.896 4.284 1324 778 B 41 LEU H B 36 SER HA 1.0 1.896 4.284 1325 779 A 7 THR HA A 41 LEU HA 1.0 1.879 4.151 1326 780 B 7 THR HA B 41 LEU HA 1.0 1.879 4.151 1327 781 A 44 GLU HA A 44 GLU H 1.0 1.700 3.202 1328 782 B 44 GLU HA B 44 GLU H 1.0 1.700 3.202 1329 783 A 11 GLU HA A 12 GLU H 1.0 1.873 4.113 1330 784 B 11 GLU HA B 12 GLU H 1.0 1.873 4.113 1331 785 A 33 ARG H A 33 ARG HA 1.0 1.789 3.615 1332 786 B 33 ARG H B 33 ARG HA 1.0 1.789 3.615 1333 787 A 14 LYS HA A 14 LYS H 1.0 1.892 4.250 1334 788 B 14 LYS HA B 14 LYS H 1.0 1.892 4.250 1335 789 A 32 ARG HA A 32 ARG H 1.0 1.882 4.172 1336 790 B 32 ARG HA B 32 ARG H 1.0 1.882 4.172 1337 791 A 30 GLU HA A 30 GLU H 1.0 1.879 4.153 1338 792 B 30 GLU HA B 30 GLU H 1.0 1.879 4.153 1339 793 A 36 SER HBy A 43 GLU HA 1.0 1.855 3.991 1340 794 B 36 SER HBy B 43 GLU HA 1.0 1.855 3.991 1341 795 A 7 THR HA A 8 GLU H 1.0 1.456 2.370 1342 796 B 7 THR HA B 8 GLU H 1.0 1.456 2.370 1343 797 A 13 GLN H A 13 GLN HA 1.0 1.802 3.680 1344 798 B 13 GLN H B 13 GLN HA 1.0 1.802 3.680 1345 799 A 51 ARG H A 51 ARG HA 1.0 1.731 3.337 1346 800 B 51 ARG H B 51 ARG HA 1.0 1.731 3.337 1347 801 A 19 LEU H A 19 LEU HA 1.0 1.854 3.982 1348 802 B 19 LEU H B 19 LEU HA 1.0 1.854 3.982 1349 803 A 17 LEU H A 17 LEU HA 1.0 1.875 4.129 1350 804 B 17 LEU H B 17 LEU HA 1.0 1.875 4.129 1351 805 A 28 THR HA A 28 THR H 1.0 1.894 4.264 1352 806 B 28 THR HA B 28 THR H 1.0 1.894 4.264 1353 807 A 11 GLU HA A 11 GLU H 1.0 1.763 3.481 1354 808 B 11 GLU HA B 11 GLU H 1.0 1.763 3.481 1355 809 A 54 GLU HA A 21 PHE HEy 1.0 0.000 6.000 1356 809 A 54 GLU HA A 21 PHE HEx 1.0 0.000 6.000 1357 810 B 54 GLU HA B 21 PHE HEy 1.0 0.000 6.000 1358 810 B 54 GLU HA B 21 PHE HEx 1.0 0.000 6.000 1359 811 A 27 LEU HA A 28 THR H 1.0 1.781 3.573 1360 812 B 27 LEU HA B 28 THR H 1.0 1.781 3.573 1361 813 A 27 LEU HA A 32 ARG HE 1.0 1.810 3.728 1362 814 B 27 LEU HA B 32 ARG HE 1.0 1.810 3.728 1363 815 A 4 ARG HBx A 9 PHE HA 1.0 1.898 4.292 1364 816 B 4 ARG HBy B 9 PHE HA 1.0 1.898 4.292 1365 817 A 27 LEU HA A 27 LEU HDx% 1.0 1.836 3.872 1366 818 B 27 LEU HA B 27 LEU HD11 1.0 1.836 3.872 1367 819 A 27 LEU HDy% A 27 LEU HA 1.0 1.805 3.699 1368 820 B 27 LEU HD21 B 27 LEU HA 1.0 1.805 3.699 1369 821 A 27 LEU HA A 27 LEU HG 1.0 1.788 3.606 1370 822 B 27 LEU HA B 27 LEU HG 1.0 1.788 3.606 1371 823 A 27 LEU HA A 27 LEU HBx 1.0 1.881 4.169 1372 824 B 27 LEU HA B 27 LEU HBy 1.0 1.881 4.169 1373 825 A 2 GLU HA A 1 MET HA 1.0 0.000 6.000 1374 826 B 2 GLU HA B 1 MET HA 1.0 0.000 6.000 1375 827 A 53 LYS HA A 54 GLU H 1.0 1.904 4.344 1376 828 B 53 LYS HA B 54 GLU H 1.0 1.904 4.344 1377 829 A 15 LYS HBx A 16 ALA HA 1.0 1.852 3.976 1378 830 B 15 LYS HBx B 16 ALA HA 1.0 1.852 3.976 1379 831 A 16 ALA HA A 16 ALA H 1.0 1.791 3.625 1380 832 B 16 ALA HA B 16 ALA H 1.0 1.791 3.625 1381 833 A 61 HIS HA A 60 SER HG 1.0 0.000 6.000 1382 834 B 61 HIS HA B 60 SER HG 1.0 0.000 6.000 1383 835 A 4 ARG HA A 10 SER HBx 1.0 1.686 3.146 1384 836 B 4 ARG HA B 10 SER HBy 1.0 1.686 3.146 1385 837 A 7 THR HG2% A 41 LEU HA 1.0 1.862 4.040 1386 838 B 7 THR HG21 B 41 LEU HA 1.0 1.862 4.040 1387 839 A 41 LEU HA A 41 LEU HBx 1.0 1.744 3.392 1388 840 B 41 LEU HA B 41 LEU HBy 1.0 1.744 3.392 1389 841 A 42 ASN HA A 43 GLU HGx 1.0 1.892 4.248 1390 842 B 42 ASN HA B 43 GLU HGx 1.0 1.892 4.248 1391 843 A 42 ASN HA A 43 GLU H 1.0 1.630 2.928 1392 844 B 42 ASN HA B 43 GLU H 1.0 1.630 2.928 1393 845 A 42 ASN HA A 42 ASN HBx 1.0 1.670 3.078 1394 846 B 42 ASN HA B 42 ASN HBy 1.0 1.670 3.078 1395 847 A 4 ARG HBx A 4 ARG HA 1.0 1.685 3.141 1396 848 B 4 ARG HBy B 4 ARG HA 1.0 1.685 3.141 1397 849 A 4 ARG HGx A 4 ARG HA 1.0 1.636 2.950 1398 850 B 4 ARG HGx B 4 ARG HA 1.0 1.636 2.950 1399 851 A 39 LEU HBx A 39 LEU HA 1.0 1.736 3.360 1400 852 B 39 LEU HBy B 39 LEU HA 1.0 1.736 3.360 1401 853 A 39 LEU HA A 39 LEU HBy 1.0 1.702 3.210 1402 854 B 39 LEU HA B 39 LEU HBx 1.0 1.702 3.210 1403 855 A 61 HIS HA A 62 PRO HDx 1.0 1.543 2.631 1404 856 B 61 HIS HA B 62 PRO HDx 1.0 1.543 2.631 1405 857 A 61 HIS HA A 62 PRO HDy 1.0 1.550 2.656 1406 858 B 61 HIS HA B 62 PRO HDy 1.0 1.550 2.656 1407 859 A 62 PRO HDy A 60 SER HG 1.0 1.931 4.583 1408 860 B 62 PRO HDy B 60 SER HG 1.0 1.931 4.583 1409 861 A 62 PRO HDx A 62 PRO HDy 1.0 1.323 2.023 1410 862 B 62 PRO HDx B 62 PRO HDy 1.0 1.323 2.023 1411 863 A 62 PRO HBx A 62 PRO HDy 1.0 1.874 4.122 1412 864 B 62 PRO HBy B 62 PRO HDy 1.0 1.874 4.122 1413 865 A 62 PRO HGx A 62 PRO HDx 1.0 1.536 2.610 1414 866 B 62 PRO HGx B 62 PRO HDx 1.0 1.536 2.610 1415 867 A 62 PRO HGy A 62 PRO HDy 1.0 1.531 2.597 1416 868 B 62 PRO HGy B 62 PRO HDy 1.0 1.531 2.597 1417 869 A 62 PRO HDx A 62 PRO HBy 1.0 1.828 3.824 1418 870 B 62 PRO HDx B 62 PRO HBx 1.0 1.828 3.824 1419 871 A 62 PRO HDy A 62 PRO HBy 1.0 0.000 6.000 1420 872 B 62 PRO HDy B 62 PRO HBx 1.0 0.000 6.000 1421 873 A 41 LEU HA A 42 ASN HBx 1.0 0.000 6.000 1422 874 B 41 LEU HA B 42 ASN HBy 1.0 0.000 6.000 1423 875 A 62 PRO HDx A 62 PRO HA 1.0 1.828 3.826 1424 876 B 62 PRO HDx B 62 PRO HA 1.0 1.828 3.826 1425 877 A 62 PRO HDy A 62 PRO HA 1.0 1.866 4.066 1426 878 B 62 PRO HDy B 62 PRO HA 1.0 1.866 4.066 1427 879 A 40 GLY HAx A 41 LEU H 1.0 1.805 3.701 1428 880 B 40 GLY HAx B 41 LEU H 1.0 1.805 3.701 1429 881 A 41 LEU HBy A 41 LEU HBx 1.0 1.793 3.629 1430 882 B 41 LEU HBx B 41 LEU HBy 1.0 1.793 3.629 1431 883 A 58 GLY H A 58 GLY HAy 1.0 1.612 2.862 1432 884 B 58 GLY H B 58 GLY HAy 1.0 1.612 2.862 1433 885 A 6 ARG HDx A 8 GLU HGx 1.0 0.000 6.000 1434 886 B 6 ARG HDx B 8 GLU HGx 1.0 0.000 6.000 1435 887 A 48 ARG HDy A 48 ARG HGy 1.0 1.450 2.356 1436 888 B 48 ARG HDx B 48 ARG HGx 1.0 1.450 2.356 1437 889 A 33 ARG HGx A 33 ARG HDx 1.0 0.000 6.000 1438 890 B 33 ARG HGx B 33 ARG HDx 1.0 0.000 6.000 1439 891 A 51 ARG HDx A 51 ARG HA 1.0 0.000 6.000 1440 892 B 51 ARG HDy B 51 ARG HA 1.0 0.000 6.000 1441 893 A 52 ARG HA A 51 ARG HDx 1.0 1.653 3.017 1442 894 B 52 ARG HA B 51 ARG HDy 1.0 1.653 3.017 1443 895 A 33 ARG HDx A 31 TRP HA 1.0 0.000 6.000 1444 896 B 33 ARG HDx B 31 TRP HA 1.0 0.000 6.000 1445 897 A 34 TYR HDy A 33 ARG HDx 1.0 0.000 6.000 1446 897 A 34 TYR HDx A 33 ARG HDx 1.0 0.000 6.000 1447 898 B 34 TYR HDy B 33 ARG HDx 1.0 0.000 6.000 1448 898 B 34 TYR HDx B 33 ARG HDx 1.0 0.000 6.000 1449 899 A 48 ARG HDy A 48 ARG H 1.0 1.784 3.588 1450 900 B 48 ARG HDx B 48 ARG H 1.0 1.784 3.588 1451 901 A 52 ARG H A 52 ARG HDx 1.0 0.000 6.000 1452 902 B 52 ARG H B 52 ARG HDx 1.0 0.000 6.000 1453 903 A 6 ARG HGx A 6 ARG HDx 1.0 1.476 2.430 1454 904 B 6 ARG HGx B 6 ARG HDx 1.0 1.476 2.430 1455 905 A 40 GLY HAx A 40 GLY H 1.0 1.656 3.026 1456 906 B 40 GLY HAx B 40 GLY H 1.0 1.656 3.026 1457 907 A 41 LEU HBy A 41 LEU HA 1.0 1.929 4.561 1458 908 B 41 LEU HBx B 41 LEU HA 1.0 1.929 4.561 1459 909 A 35 LEU HBx A 35 LEU HBy 1.0 0.000 6.000 1460 910 B 35 LEU HBx B 35 LEU HBy 1.0 0.000 6.000 1461 911 A 39 LEU HDy% A 35 LEU HBx 1.0 1.910 4.398 1462 912 B 39 LEU HD21 B 35 LEU HBx 1.0 1.910 4.398 1463 913 A 19 LEU HDy% A 19 LEU HBx 1.0 1.767 3.505 1464 914 B 19 LEU HD21 B 19 LEU HBx 1.0 1.767 3.505 1465 915 A 39 LEU HBx A 39 LEU HBy 1.0 1.798 3.660 1466 916 B 39 LEU HBy B 39 LEU HBx 1.0 1.798 3.660 1467 917 A 52 ARG HA A 52 ARG HDx 1.0 1.778 3.556 1468 918 B 52 ARG HA B 52 ARG HDx 1.0 1.778 3.556 1469 919 A 19 LEU HBx A 19 LEU HA 1.0 1.893 4.251 1470 920 B 19 LEU HBx B 19 LEU HA 1.0 1.893 4.251 1471 921 A 14 LYS HEx A 14 LYS HGx 1.0 1.713 3.259 1472 922 B 14 LYS HEx B 14 LYS HGx 1.0 1.713 3.259 1473 923 A 39 LEU HBx B 15 LYS HEx 1.0 0.000 6.000 1474 924 B 39 LEU HBy A 15 LYS HEx 1.0 0.000 6.000 1475 925 A 27 LEU HBx A 27 LEU HBy 1.0 1.732 3.338 1476 926 B 27 LEU HBy B 27 LEU HBx 1.0 1.732 3.338 1477 927 A 27 LEU HDx% A 27 LEU HBx 1.0 1.819 3.775 1478 928 B 27 LEU HD11 B 27 LEU HBy 1.0 1.819 3.775 1479 929 A 27 LEU HDx% A 27 LEU HBy 1.0 1.829 3.829 1480 930 B 27 LEU HD11 B 27 LEU HBx 1.0 1.829 3.829 1481 931 A 27 LEU HDy% A 27 LEU HBy 1.0 1.896 4.276 1482 932 B 27 LEU HD21 B 27 LEU HBx 1.0 1.896 4.276 1483 933 A 9 PHE HBy A 39 LEU HG 1.0 1.859 4.019 1484 934 B 9 PHE HBx B 39 LEU HG 1.0 1.859 4.019 1485 935 A 18 ASP H A 18 ASP HBy 1.0 1.720 3.288 1486 936 B 18 ASP H B 18 ASP HBx 1.0 1.720 3.288 1487 937 A 9 PHE HDy A 9 PHE HBy 1.0 1.838 3.882 1488 937 A 9 PHE HDx A 9 PHE HBy 1.0 1.838 3.882 1489 938 B 9 PHE HDy B 9 PHE HBx 1.0 1.838 3.882 1490 938 B 9 PHE HDx B 9 PHE HBx 1.0 1.838 3.882 1491 939 A 19 LEU HBx A 19 LEU H 1.0 1.886 4.208 1492 940 B 19 LEU HBx B 19 LEU H 1.0 1.886 4.208 1493 941 A 27 LEU HA A 27 LEU HBy 1.0 1.903 4.337 1494 942 B 27 LEU HA B 27 LEU HBx 1.0 1.903 4.337 1495 943 A 50 PHE HBy A 50 PHE HBx 1.0 1.784 3.588 1496 944 B 50 PHE HBx B 50 PHE HBy 1.0 1.784 3.588 1497 945 A 42 ASN HBy A 44 GLU HBx 1.0 1.847 3.941 1498 946 B 42 ASN HBx B 44 GLU HBx 1.0 1.847 3.941 1499 947 A 45 GLN HBy A 42 ASN HBx 1.0 0.000 6.000 1500 948 B 45 GLN HBy B 42 ASN HBy 1.0 0.000 6.000 1501 949 A 9 PHE HBx A 39 LEU HG 1.0 0.000 6.000 1502 950 B 9 PHE HBy B 39 LEU HG 1.0 0.000 6.000 1503 951 A 42 ASN HA A 42 ASN HBy 1.0 1.659 3.037 1504 952 B 42 ASN HA B 42 ASN HBx 1.0 1.659 3.037 1505 953 A 64 PHE HDy A 64 PHE HBx 1.0 1.694 3.176 1506 953 A 64 PHE HDx A 64 PHE HBx 1.0 1.694 3.176 1507 954 B 64 PHE HDy B 64 PHE HBx 1.0 1.694 3.176 1508 954 B 64 PHE HDx B 64 PHE HBx 1.0 1.694 3.176 1509 955 A 42 ASN HBx A 42 ASN HD2y 1.0 1.812 3.734 1510 956 B 42 ASN HBy B 42 ASN HD2x 1.0 1.812 3.734 1511 957 A 42 ASN HBy A 42 ASN HD2y 1.0 1.717 3.273 1512 958 B 42 ASN HBx B 42 ASN HD2x 1.0 1.717 3.273 1513 959 A 18 ASP HBx A 19 LEU H 1.0 1.880 4.156 1514 960 B 18 ASP HBy B 19 LEU H 1.0 1.880 4.156 1515 961 A 50 PHE HDy A 50 PHE HBy 1.0 1.816 3.756 1516 961 A 50 PHE HDx A 50 PHE HBy 1.0 1.816 3.756 1517 962 B 50 PHE HDy B 50 PHE HBx 1.0 1.816 3.756 1518 962 B 50 PHE HDx B 50 PHE HBx 1.0 1.816 3.756 1519 963 A 44 GLU H A 42 ASN HBy 1.0 1.865 4.053 1520 964 B 44 GLU H B 42 ASN HBx 1.0 1.865 4.053 1521 965 A 44 GLU H A 42 ASN HBx 1.0 1.814 3.742 1522 966 B 44 GLU H B 42 ASN HBy 1.0 1.814 3.742 1523 967 A 50 PHE H A 50 PHE HBx 1.0 1.897 4.287 1524 968 B 50 PHE H B 50 PHE HBy 1.0 1.897 4.287 1525 969 A 50 PHE HBy A 50 PHE H 1.0 1.887 4.211 1526 970 B 50 PHE HBx B 50 PHE H 1.0 1.887 4.211 1527 971 A 50 PHE HDy A 50 PHE HBx 1.0 1.868 4.076 1528 971 A 50 PHE HDx A 50 PHE HBx 1.0 1.868 4.076 1529 972 B 50 PHE HDy B 50 PHE HBy 1.0 1.868 4.076 1530 972 B 50 PHE HDx B 50 PHE HBy 1.0 1.868 4.076 1531 973 A 50 PHE HBy A 51 ARG H 1.0 1.920 4.484 1532 974 B 50 PHE HBx B 51 ARG H 1.0 1.920 4.484 1533 975 A 32 ARG HBx A 43 GLU HGx 1.0 1.691 3.165 1534 976 B 32 ARG HBy B 43 GLU HGx 1.0 1.691 3.165 1535 977 A 57 ILE HG1x A 57 ILE HB 1.0 1.773 3.529 1536 978 B 57 ILE HG1y B 57 ILE HB 1.0 1.773 3.529 1537 979 A 57 ILE HB A 58 GLY HAy 1.0 0.000 6.000 1538 980 B 57 ILE HB B 58 GLY HAy 1.0 0.000 6.000 1539 981 A 36 SER HBy A 43 GLU HGx 1.0 1.848 3.946 1540 982 B 36 SER HBy B 43 GLU HGx 1.0 1.848 3.946 1541 983 A 64 PHE HDy A 64 PHE HBy 1.0 1.686 3.146 1542 983 A 64 PHE HDx A 64 PHE HBy 1.0 1.686 3.146 1543 984 B 64 PHE HDy B 64 PHE HBy 1.0 1.686 3.146 1544 984 B 64 PHE HDx B 64 PHE HBy 1.0 1.686 3.146 1545 985 A 34 TYR HBx A 31 TRP H 1.0 0.000 6.000 1546 986 B 34 TYR HBy B 31 TRP H 1.0 0.000 6.000 1547 987 A 34 TYR HBy A 31 TRP H 1.0 0.000 6.000 1548 988 B 34 TYR HBx B 31 TRP H 1.0 0.000 6.000 1549 989 A 43 GLU H A 43 GLU HGx 1.0 1.824 3.800 1550 990 B 43 GLU H B 43 GLU HGx 1.0 1.824 3.800 1551 991 A 27 LEU HBx A 21 PHE H 1.0 0.000 6.000 1552 992 B 27 LEU HBy B 21 PHE H 1.0 0.000 6.000 1553 993 A 18 ASP HBx A 18 ASP HBy 1.0 1.586 2.774 1554 994 B 18 ASP HBy B 18 ASP HBx 1.0 1.586 2.774 1555 995 A 12 GLU HGx A 12 GLU H 1.0 0.000 6.000 1556 996 B 12 GLU HGx B 12 GLU H 1.0 0.000 6.000 1557 997 A 44 GLU HGy A 44 GLU HBx 1.0 0.000 6.000 1558 998 B 44 GLU HGy B 44 GLU HBx 1.0 0.000 6.000 1559 999 A 2 GLU HGx A 2 GLU HBx 1.0 1.699 3.199 1560 1000 B 2 GLU HGx B 2 GLU HBy 1.0 1.699 3.199 1561 1001 A 8 GLU HBx A 8 GLU HGx 1.0 0.000 6.000 1562 1002 B 8 GLU HBx B 8 GLU HGx 1.0 0.000 6.000 1563 1003 A 8 GLU HGx A 8 GLU HA 1.0 0.000 6.000 1564 1004 B 8 GLU HGx B 8 GLU HA 1.0 0.000 6.000 1565 1005 A 54 GLU HGx A 21 PHE HZ 1.0 1.854 3.984 1566 1006 B 54 GLU HGy B 21 PHE HZ 1.0 1.854 3.984 1567 1007 A 54 GLU HGy A 21 PHE HZ 1.0 1.816 3.758 1568 1008 B 54 GLU HGx B 21 PHE HZ 1.0 1.816 3.758 1569 1009 A 21 PHE HEy A 54 GLU HGx 1.0 1.897 4.289 1570 1009 A 21 PHE HEx A 54 GLU HGx 1.0 1.897 4.289 1571 1010 B 21 PHE HEy B 54 GLU HGy 1.0 1.897 4.289 1572 1010 B 21 PHE HEx B 54 GLU HGy 1.0 1.897 4.289 1573 1011 A 54 GLU HGx A 54 GLU H 1.0 1.774 3.536 1574 1012 B 54 GLU HGy B 54 GLU H 1.0 1.774 3.536 1575 1013 A 45 GLN H A 45 GLN HGx 1.0 1.725 3.309 1576 1014 B 45 GLN H B 45 GLN HGx 1.0 1.725 3.309 1577 1015 A 53 LYS H A 54 GLU HGy 1.0 1.817 3.767 1578 1016 B 53 LYS H B 54 GLU HGx 1.0 1.817 3.767 1579 1017 A 9 PHE H A 8 GLU HGx 1.0 1.917 4.453 1580 1018 B 9 PHE H B 8 GLU HGx 1.0 1.917 4.453 1581 1019 A 45 GLN HE2x A 8 GLU HGx 1.0 0.000 6.000 1582 1020 B 45 GLN HE2y B 8 GLU HGx 1.0 0.000 6.000 1583 1021 A 54 GLU HA A 54 GLU HGx 1.0 1.778 3.554 1584 1022 B 54 GLU HA B 54 GLU HGy 1.0 1.778 3.554 1585 1023 A 45 GLN HA A 45 GLN HGx 1.0 1.726 3.312 1586 1024 B 45 GLN HA B 45 GLN HGx 1.0 1.726 3.312 1587 1025 A 54 GLU HA A 55 GLN HGx 1.0 0.000 6.000 1588 1026 B 54 GLU HA B 55 GLN HGy 1.0 0.000 6.000 1589 1027 A 45 GLN HE2x A 45 GLN HGy 1.0 1.800 3.670 1590 1028 B 45 GLN HE2y B 45 GLN HGy 1.0 1.800 3.670 1591 1029 A 55 GLN HGx A 55 GLN H 1.0 1.731 3.335 1592 1030 B 55 GLN HGy B 55 GLN H 1.0 1.731 3.335 1593 1031 A 54 GLU HA A 63 GLN HGy 1.0 0.000 6.000 1594 1032 B 54 GLU HA B 63 GLN HGy 1.0 0.000 6.000 1595 1033 A 55 GLN HGx A 51 ARG HGx 1.0 1.829 3.833 1596 1033 A 55 GLN HGx A 51 ARG HGy 1.0 1.829 3.833 1597 1034 B 55 GLN HGy B 51 ARG HGx 1.0 1.829 3.833 1598 1034 B 55 GLN HGy B 51 ARG HGy 1.0 1.829 3.833 1599 1035 A 62 PRO HBx A 62 PRO HBy 1.0 1.394 2.202 1600 1036 B 62 PRO HBy B 62 PRO HBx 1.0 1.394 2.202 1601 1037 A 55 GLN HGx A 55 GLN HBy 1.0 1.488 2.462 1602 1038 B 55 GLN HGy B 55 GLN HBx 1.0 1.488 2.462 1603 1039 A 5 PRO HBx A 5 PRO HBy 1.0 1.399 2.215 1604 1040 B 5 PRO HBy B 5 PRO HBx 1.0 1.399 2.215 1605 1041 A 56 GLN HA A 56 GLN HGy 1.0 1.594 2.804 1606 1042 B 56 GLN HA B 56 GLN HGx 1.0 1.594 2.804 1607 1043 A 66 LYS HBx A 66 LYS HA 1.0 1.798 3.660 1608 1044 B 66 LYS HBy B 66 LYS HA 1.0 1.798 3.660 1609 1045 A 55 GLN HGy A 55 GLN HGx 1.0 1.313 1.999 1610 1046 B 55 GLN HGx B 55 GLN HGy 1.0 1.313 1.999 1611 1047 A 29 PRO HBx A 29 PRO HBy 1.0 1.610 2.858 1612 1048 B 29 PRO HBy B 29 PRO HBx 1.0 1.610 2.858 1613 1049 A 33 ARG HBy A 33 ARG HDx 1.0 1.636 2.950 1614 1050 B 33 ARG HBy B 33 ARG HDx 1.0 1.636 2.950 1615 1051 A 59 TRP HBx A 59 TRP H 1.0 0.000 6.000 1616 1052 B 59 TRP HBy B 59 TRP H 1.0 0.000 6.000 1617 1053 A 51 ARG H A 51 ARG HBy 1.0 1.681 3.123 1618 1054 B 51 ARG H B 51 ARG HBy 1.0 1.681 3.123 1619 1055 A 4 ARG HBx A 4 ARG H 1.0 1.646 2.988 1620 1056 B 4 ARG HBy B 4 ARG H 1.0 1.646 2.988 1621 1057 A 48 ARG HBy A 48 ARG H 1.0 1.638 2.958 1622 1058 B 48 ARG HBx B 48 ARG H 1.0 1.638 2.958 1623 1059 A 11 GLU HBx A 11 GLU H 1.0 1.636 2.948 1624 1060 B 11 GLU HBx B 11 GLU H 1.0 1.636 2.948 1625 1061 A 12 GLU H A 12 GLU HBy 1.0 1.701 3.205 1626 1062 B 12 GLU H B 12 GLU HBx 1.0 1.701 3.205 1627 1063 A 34 TYR H A 33 ARG HBy 1.0 1.741 3.379 1628 1064 B 34 TYR H B 33 ARG HBy 1.0 1.741 3.379 1629 1065 A 52 ARG H A 52 ARG HBx 1.0 1.648 2.996 1630 1066 B 52 ARG H B 52 ARG HBy 1.0 1.648 2.996 1631 1067 A 47 GLU HBy A 47 GLU H 1.0 1.662 3.050 1632 1068 B 47 GLU HBy B 47 GLU H 1.0 1.662 3.050 1633 1069 A 12 GLU H A 11 GLU HBx 1.0 0.000 6.000 1634 1070 B 12 GLU H B 11 GLU HBx 1.0 0.000 6.000 1635 1071 A 45 GLN H A 44 GLU HBx 1.0 1.667 3.067 1636 1072 B 45 GLN H B 44 GLU HBx 1.0 1.667 3.067 1637 1073 A 55 GLN HBx A 55 GLN H 1.0 0.000 6.000 1638 1074 B 55 GLN HBy B 55 GLN H 1.0 0.000 6.000 1639 1075 A 54 GLU HBx A 55 GLN HA 1.0 0.000 6.000 1640 1076 B 54 GLU HBx B 55 GLN HA 1.0 0.000 6.000 1641 1077 A 48 ARG HA A 48 ARG HBy 1.0 1.664 3.056 1642 1078 B 48 ARG HA B 48 ARG HBx 1.0 1.664 3.056 1643 1079 A 65 GLU HA A 65 GLU HBx 1.0 1.694 3.176 1644 1080 B 65 GLU HA B 65 GLU HBx 1.0 1.694 3.176 1645 1081 A 54 GLU HGy A 54 GLU HBx 1.0 1.711 3.247 1646 1082 B 54 GLU HGx B 54 GLU HBx 1.0 1.711 3.247 1647 1083 A 46 ILE HG1x A 46 ILE HG1y 1.0 1.735 3.355 1648 1084 B 46 ILE HG1y B 46 ILE HG1x 1.0 1.735 3.355 1649 1085 A 39 LEU HDy% A 46 ILE HG1x 1.0 0.000 6.000 1650 1086 B 39 LEU HD21 B 46 ILE HG1y 1.0 0.000 6.000 1651 1087 A 49 TRP HBy A 49 TRP HBx 1.0 1.779 3.559 1652 1088 B 49 TRP HBx B 49 TRP HBy 1.0 1.779 3.559 1653 1089 A 57 ILE HG2% A 57 ILE HG1y 1.0 1.631 2.935 1654 1090 B 57 ILE HG21 B 57 ILE HG1x 1.0 1.631 2.935 1655 1091 A 57 ILE HG1x A 57 ILE HG2% 1.0 1.582 2.758 1656 1092 B 57 ILE HG1y B 57 ILE HG21 1.0 1.582 2.758 1657 1093 A 57 ILE HG1x A 57 ILE HG1y 1.0 1.503 2.511 1658 1094 B 57 ILE HG1y B 57 ILE HG1x 1.0 1.503 2.511 1659 1095 A 12 GLU HBx A 12 GLU HA 1.0 1.478 2.436 1660 1096 B 12 GLU HBy B 12 GLU HA 1.0 1.478 2.436 1661 1097 A 52 ARG HDy A 52 ARG HGy 1.0 1.619 2.891 1662 1098 B 52 ARG HDy B 52 ARG HGx 1.0 1.619 2.891 1663 1099 B 15 LYS HEx A 39 LEU HG 1.0 0.000 6.000 1664 1100 A 15 LYS HEx B 39 LEU HG 1.0 0.000 6.000 1665 1101 A 57 ILE HB A 57 ILE HG1y 1.0 1.790 3.616 1666 1102 B 57 ILE HB B 57 ILE HG1x 1.0 1.790 3.616 1667 1103 A 41 LEU HG A 41 LEU HDy% 1.0 1.692 3.168 1668 1104 B 41 LEU HG B 41 LEU HD21 1.0 1.692 3.168 1669 1105 A 27 LEU HDx% A 27 LEU HG 1.0 1.792 3.626 1670 1106 B 27 LEU HD11 B 27 LEU HG 1.0 1.792 3.626 1671 1107 A 41 LEU HBx A 41 LEU HDy% 1.0 1.585 2.771 1672 1108 B 41 LEU HBy B 41 LEU HD21 1.0 1.585 2.771 1673 1109 A 41 LEU HBy A 41 LEU HDy% 1.0 1.717 3.271 1674 1110 B 41 LEU HBx B 41 LEU HD21 1.0 1.717 3.271 1675 1111 A 57 ILE HG1x A 61 HIS HBx 1.0 0.000 6.000 1676 1112 B 57 ILE HG1y B 61 HIS HBy 1.0 0.000 6.000 1677 1113 A 34 TYR HBx A 37 GLN HBy 1.0 0.000 6.000 1678 1114 B 34 TYR HBy B 37 GLN HBx 1.0 0.000 6.000 1679 1115 A 52 ARG HA A 51 ARG HGx 1.0 1.675 3.101 1680 1115 A 52 ARG HA A 51 ARG HGy 1.0 1.675 3.101 1681 1116 B 52 ARG HA B 51 ARG HGx 1.0 1.675 3.101 1682 1116 B 52 ARG HA B 51 ARG HGy 1.0 1.675 3.101 1683 1117 A 48 ARG HA A 48 ARG HGy 1.0 0.000 6.000 1684 1118 B 48 ARG HA B 48 ARG HGx 1.0 0.000 6.000 1685 1119 A 48 ARG HA A 51 ARG HBy 1.0 0.000 6.000 1686 1120 B 48 ARG HA B 51 ARG HBy 1.0 0.000 6.000 1687 1121 A 11 GLU HA A 11 GLU HBx 1.0 0.000 6.000 1688 1122 B 11 GLU HA B 11 GLU HBx 1.0 0.000 6.000 1689 1123 A 48 ARG HGy A 48 ARG H 1.0 0.000 6.000 1690 1124 B 48 ARG HGx B 48 ARG H 1.0 0.000 6.000 1691 1125 A 57 ILE HG1x A 57 ILE H 1.0 0.000 6.000 1692 1126 B 57 ILE HG1y B 57 ILE H 1.0 0.000 6.000 1693 1127 A 57 ILE H A 57 ILE HG1y 1.0 1.741 3.379 1694 1128 B 57 ILE H B 57 ILE HG1x 1.0 1.741 3.379 1695 1129 A 41 LEU H A 41 LEU HDy% 1.0 1.729 3.323 1696 1130 B 41 LEU H B 41 LEU HD21 1.0 1.729 3.323 1697 1131 A 30 GLU HBy A 30 GLU HBx 1.0 1.343 2.071 1698 1132 B 30 GLU HBx B 30 GLU HBy 1.0 1.343 2.071 1699 1133 A 12 GLU HGx A 12 GLU HBy 1.0 1.581 2.759 1700 1134 B 12 GLU HGx B 12 GLU HBx 1.0 1.581 2.759 1701 1135 A 39 LEU HG A 39 LEU HA 1.0 1.754 3.440 1702 1136 B 39 LEU HG B 39 LEU HA 1.0 1.754 3.440 1703 1137 A 36 SER HBx A 39 LEU HG 1.0 0.000 6.000 1704 1138 B 36 SER HBx B 39 LEU HG 1.0 0.000 6.000 1705 1139 A 27 LEU HDy% A 47 GLU HA 1.0 1.670 3.080 1706 1140 B 27 LEU HD21 B 47 GLU HA 1.0 1.670 3.080 1707 1141 A 27 LEU HDy% A 50 PHE HBx 1.0 1.768 3.504 1708 1142 B 27 LEU HD21 B 50 PHE HBy 1.0 1.768 3.504 1709 1143 A 50 PHE HBy A 27 LEU HDy% 1.0 1.754 3.442 1710 1144 B 50 PHE HBx B 27 LEU HD21 1.0 1.754 3.442 1711 1145 A 43 GLU HBx A 27 LEU HDy% 1.0 0.000 6.000 1712 1146 B 43 GLU HBx B 27 LEU HD21 1.0 0.000 6.000 1713 1147 A 27 LEU HDy% A 27 LEU HBx 1.0 1.711 3.249 1714 1148 B 27 LEU HD21 B 27 LEU HBy 1.0 1.711 3.249 1715 1149 A 32 ARG HBy A 27 LEU HDy% 1.0 1.742 3.386 1716 1150 B 32 ARG HBx B 27 LEU HD21 1.0 1.742 3.386 1717 1151 A 27 LEU HDy% A 27 LEU HG 1.0 1.617 2.885 1718 1152 B 27 LEU HD21 B 27 LEU HG 1.0 1.617 2.885 1719 1153 A 17 LEU HDy% A 17 LEU HG 1.0 1.734 3.352 1720 1154 B 17 LEU HD21 B 17 LEU HG 1.0 1.734 3.352 1721 1155 A 17 LEU HDy% A 17 LEU HBx 1.0 1.705 3.223 1722 1156 B 17 LEU HD21 B 17 LEU HBy 1.0 1.705 3.223 1723 1157 A 17 LEU HDy% A 17 LEU HDx% 1.0 1.633 2.941 1724 1158 B 17 LEU HD21 B 17 LEU HD11 1.0 1.633 2.941 1725 1159 A 52 ARG HBx A 52 ARG HGy 1.0 1.539 2.621 1726 1160 B 52 ARG HBy B 52 ARG HGx 1.0 1.539 2.621 1727 1161 A 13 GLN HGy A 13 GLN HBy 1.0 1.620 2.894 1728 1162 B 13 GLN HGy B 13 GLN HBy 1.0 1.620 2.894 1729 1163 A 3 LYS HDx A 3 LYS HGx 1.0 0.000 6.000 1730 1164 B 3 LYS HDx B 3 LYS HGy 1.0 0.000 6.000 1731 1165 A 15 LYS HGx A 15 LYS HBx 1.0 1.587 2.775 1732 1166 B 15 LYS HGx B 15 LYS HBx 1.0 1.587 2.775 1733 1167 A 3 LYS HDx A 3 LYS HGy 1.0 1.562 2.692 1734 1168 B 3 LYS HDx B 3 LYS HGx 1.0 1.562 2.692 1735 1169 A 15 LYS HGx A 15 LYS HEx 1.0 1.762 3.476 1736 1170 B 15 LYS HGx B 15 LYS HEx 1.0 1.762 3.476 1737 1171 A 39 LEU HDy% A 17 LEU HDx% 1.0 1.561 2.689 1738 1172 B 39 LEU HD21 B 17 LEU HD11 1.0 1.561 2.689 1739 1173 A 39 LEU HDy% A 27 LEU HDy% 1.0 0.000 6.000 1740 1174 B 39 LEU HD21 B 27 LEU HD21 1.0 0.000 6.000 1741 1175 A 41 LEU HA A 41 LEU HDx% 1.0 0.000 6.000 1742 1176 B 41 LEU HA B 41 LEU HD11 1.0 0.000 6.000 1743 1177 A 41 LEU H A 41 LEU HDx% 1.0 1.625 2.913 1744 1178 B 41 LEU H B 41 LEU HD11 1.0 1.625 2.913 1745 1179 A 45 GLN HBx A 41 LEU HDx% 1.0 0.000 6.000 1746 1180 B 45 GLN HBx B 41 LEU HD11 1.0 0.000 6.000 1747 1181 A 45 GLN HBy A 41 LEU HDx% 1.0 0.000 6.000 1748 1182 B 45 GLN HBy B 41 LEU HD11 1.0 0.000 6.000 1749 1183 A 41 LEU HG A 41 LEU HDx% 1.0 1.477 2.431 1750 1184 B 41 LEU HG B 41 LEU HD11 1.0 1.477 2.431 1751 1185 A 39 LEU HG A 39 LEU HDx% 1.0 1.522 2.568 1752 1186 B 39 LEU HG B 39 LEU HD11 1.0 1.522 2.568 1753 1187 A 41 LEU HBy A 41 LEU HDx% 1.0 1.619 2.887 1754 1188 B 41 LEU HBx B 41 LEU HD11 1.0 1.619 2.887 1755 1189 A 39 LEU HDy% A 17 LEU HG 1.0 1.691 3.163 1756 1190 B 39 LEU HD21 B 17 LEU HG 1.0 1.691 3.163 1757 1191 A 41 LEU HDx% A 41 LEU HDy% 1.0 1.438 2.322 1758 1192 B 41 LEU HD11 B 41 LEU HD21 1.0 1.438 2.322 1759 1193 A 7 THR HA A 7 THR HG2% 1.0 1.528 2.584 1760 1194 B 7 THR HA B 7 THR HG21 1.0 1.528 2.584 1761 1195 A 7 THR HG2% A 7 THR HB 1.0 1.453 2.363 1762 1196 B 7 THR HG21 B 7 THR HB 1.0 1.453 2.363 1763 1197 A 7 THR HG2% A 8 GLU H 1.0 0.000 6.000 1764 1198 B 7 THR HG21 B 8 GLU H 1.0 0.000 6.000 1765 1199 A 7 THR HG2% A 7 THR H 1.0 1.676 3.104 1766 1200 B 7 THR HG21 B 7 THR H 1.0 1.676 3.104 1767 1201 A 39 LEU HDx% A 39 LEU H 1.0 0.000 6.000 1768 1202 B 39 LEU HD11 B 39 LEU H 1.0 0.000 6.000 1769 1203 A 42 ASN H A 41 LEU HDx% 1.0 0.000 6.000 1770 1204 B 42 ASN H B 41 LEU HD11 1.0 0.000 6.000 1771 1205 A 20 ALA HB% A 21 PHE H 1.0 1.680 3.118 1772 1206 B 20 ALA HB1 B 21 PHE H 1.0 1.680 3.118 1773 1207 A 16 ALA HB% A 17 LEU H 1.0 1.674 3.094 1774 1208 B 16 ALA HB1 B 17 LEU H 1.0 1.674 3.094 1775 1209 A 16 ALA HB% A 16 ALA H 1.0 1.550 2.656 1776 1210 B 16 ALA HB1 B 16 ALA H 1.0 1.550 2.656 1777 1211 A 20 ALA HB% A 20 ALA H 1.0 1.708 3.234 1778 1212 B 20 ALA HB1 B 20 ALA H 1.0 1.708 3.234 1779 1213 A 46 ILE HG2% A 46 ILE H 1.0 0.000 6.000 1780 1214 B 46 ILE HG21 B 46 ILE H 1.0 0.000 6.000 1781 1215 A 20 ALA HB% A 20 ALA HA 1.0 1.673 3.093 1782 1216 B 20 ALA HB1 B 20 ALA HA 1.0 1.673 3.093 1783 1217 A 16 ALA HB% A 13 GLN HA 1.0 1.680 3.122 1784 1218 B 16 ALA HB1 B 13 GLN HA 1.0 1.680 3.122 1785 1219 A 20 ALA HB% A 17 LEU HA 1.0 1.744 3.392 1786 1220 B 20 ALA HB1 B 17 LEU HA 1.0 1.744 3.392 1787 1221 A 46 ILE HA A 46 ILE HG2% 1.0 1.673 3.093 1788 1222 B 46 ILE HA B 46 ILE HG21 1.0 1.673 3.093 1789 1223 A 46 ILE HB A 46 ILE HG2% 1.0 1.654 3.020 1790 1224 B 46 ILE HB B 46 ILE HG21 1.0 1.654 3.020 1791 1225 A 46 ILE HG2% A 46 ILE HG1x 1.0 1.671 3.085 1792 1226 B 46 ILE HG21 B 46 ILE HG1y 1.0 1.671 3.085 1793 1227 A 16 ALA HB% A 39 LEU HDx% 1.0 1.464 2.394 1794 1228 B 16 ALA HB1 B 39 LEU HD11 1.0 1.464 2.394 1795 1229 A 16 ALA HB% B 19 LEU HD21 1.0 1.650 3.002 1796 1230 B 16 ALA HB1 A 19 LEU HDy% 1.0 1.650 3.002 1797 1231 A 20 ALA HB% A 35 LEU HDy% 1.0 1.717 3.273 1798 1232 B 20 ALA HB1 B 35 LEU HD21 1.0 1.717 3.273 1799 1233 A 27 LEU HDy% A 46 ILE HG2% 1.0 1.606 2.844 1800 1234 B 27 LEU HD21 B 46 ILE HG21 1.0 1.606 2.844 1801 1235 A 57 ILE HB A 57 ILE HG2% 1.0 1.486 2.458 1802 1236 B 57 ILE HB B 57 ILE HG21 1.0 1.486 2.458 1803 1237 A 58 GLY H A 57 ILE HG2% 1.0 1.733 3.345 1804 1238 B 58 GLY H B 57 ILE HG21 1.0 1.733 3.345 1805 1239 A 57 ILE H A 57 ILE HG2% 1.0 1.648 2.994 1806 1240 B 57 ILE H B 57 ILE HG21 1.0 1.648 2.994 1807 1241 A 46 ILE HD1% A 36 SER HA 1.0 1.660 3.040 1808 1242 B 46 ILE HD11 B 36 SER HA 1.0 1.660 3.040 1809 1243 A 36 SER HBy A 46 ILE HD1% 1.0 1.659 3.039 1810 1244 B 36 SER HBy B 46 ILE HD11 1.0 1.659 3.039 1811 1245 A 46 ILE HD1% A 46 ILE HA 1.0 1.665 3.061 1812 1246 B 46 ILE HD11 B 46 ILE HA 1.0 1.665 3.061 1813 1247 A 46 ILE HD1% A 36 SER H 1.0 1.750 3.420 1814 1248 B 46 ILE HD11 B 36 SER H 1.0 1.750 3.420 1815 1249 A 46 ILE HD1% A 46 ILE HB 1.0 1.700 3.202 1816 1250 B 46 ILE HD11 B 46 ILE HB 1.0 1.700 3.202 1817 1251 A 46 ILE HD1% A 46 ILE HG1x 1.0 1.581 2.757 1818 1252 B 46 ILE HD11 B 46 ILE HG1y 1.0 1.581 2.757 1819 1253 A 46 ILE HD1% A 46 ILE HG1y 1.0 1.637 2.953 1820 1254 B 46 ILE HD11 B 46 ILE HG1x 1.0 1.637 2.953 1821 1255 A 3 LYS HDx A 3 LYS HBx 1.0 1.643 2.977 1822 1256 B 3 LYS HDx B 3 LYS HBx 1.0 1.643 2.977 1823 1257 A 3 LYS HEy A 3 LYS HBx 1.0 1.498 2.496 1824 1258 B 3 LYS HEy B 3 LYS HBx 1.0 1.498 2.496 1825 1259 A 3 LYS HEy A 3 LYS HDx 1.0 0.000 6.000 1826 1260 B 3 LYS HEy B 3 LYS HDx 1.0 0.000 6.000 1827 1261 A 6 ARG HA A 6 ARG HDx 1.0 0.000 6.000 1828 1262 B 6 ARG HA B 6 ARG HDx 1.0 0.000 6.000 1829 1263 A 6 ARG HBy A 6 ARG HDx 1.0 1.551 2.657 1830 1264 B 6 ARG HBy B 6 ARG HDx 1.0 1.551 2.657 1831 1265 A 7 THR HA A 7 THR HB 1.0 1.507 2.519 1832 1266 B 7 THR HA B 7 THR HB 1.0 1.507 2.519 1833 1267 A 12 GLU HBx A 13 GLN H 1.0 0.000 6.000 1834 1268 B 12 GLU HBy B 13 GLN H 1.0 0.000 6.000 1835 1269 A 45 GLN HBy A 45 GLN HBx 1.0 1.712 3.250 1836 1270 B 45 GLN HBy B 45 GLN HBx 1.0 1.712 3.250 1837 1271 A 14 LYS HGx A 14 LYS HDx 1.0 1.758 3.462 1838 1272 B 14 LYS HGx B 14 LYS HDx 1.0 1.758 3.462 1839 1273 A 16 ALA HB% A 17 LEU HA 1.0 1.843 3.915 1840 1274 B 16 ALA HB1 B 17 LEU HA 1.0 1.843 3.915 1841 1275 A 16 ALA HB% A 14 LYS HA 1.0 1.914 4.422 1842 1276 B 16 ALA HB1 B 14 LYS HA 1.0 1.914 4.422 1843 1277 A 16 ALA HB% A 13 GLN HBx 1.0 1.891 4.239 1844 1278 B 16 ALA HB1 B 13 GLN HBx 1.0 1.891 4.239 1845 1279 A 16 ALA HB% A 13 GLN HGy 1.0 0.000 6.000 1846 1280 B 16 ALA HB1 B 13 GLN HGy 1.0 0.000 6.000 1847 1281 A 16 ALA HB% A 17 LEU HDx% 1.0 1.844 3.924 1848 1282 B 16 ALA HB1 B 17 LEU HD11 1.0 1.844 3.924 1849 1283 A 18 ASP H A 17 LEU HA 1.0 1.926 4.536 1850 1284 B 18 ASP H B 17 LEU HA 1.0 1.926 4.536 1851 1285 A 17 LEU HDy% A 46 ILE HG1x 1.0 1.879 4.151 1852 1286 B 17 LEU HD21 B 46 ILE HG1y 1.0 1.879 4.151 1853 1287 A 17 LEU HDy% A 17 LEU HA 1.0 1.828 3.826 1854 1288 B 17 LEU HD21 B 17 LEU HA 1.0 1.828 3.826 1855 1289 A 17 LEU HDy% A 17 LEU H 1.0 1.872 4.104 1856 1290 B 17 LEU HD21 B 17 LEU H 1.0 1.872 4.104 1857 1291 A 17 LEU HDy% A 18 ASP H 1.0 0.000 6.000 1858 1292 B 17 LEU HD21 B 18 ASP H 1.0 0.000 6.000 1859 1293 A 49 TRP HBy A 17 LEU HDx% 1.0 1.969 5.025 1860 1294 B 49 TRP HBx B 17 LEU HD11 1.0 1.969 5.025 1861 1295 A 17 LEU HDy% A 49 TRP HBx 1.0 1.978 5.182 1862 1296 B 17 LEU HD21 B 49 TRP HBy 1.0 1.978 5.182 1863 1297 A 50 PHE HBy A 27 LEU HDx% 1.0 1.915 4.437 1864 1298 B 50 PHE HBx B 27 LEU HD11 1.0 1.915 4.437 1865 1299 A 27 LEU HDx% A 50 PHE HBx 1.0 1.929 4.561 1866 1300 B 27 LEU HD11 B 50 PHE HBy 1.0 1.929 4.561 1867 1301 A 17 LEU HDy% A 9 PHE HBx 1.0 1.969 5.037 1868 1302 B 17 LEU HD21 B 9 PHE HBy 1.0 1.969 5.037 1869 1303 A 17 LEU HDy% A 9 PHE HBy 1.0 1.991 5.457 1870 1304 B 17 LEU HD21 B 9 PHE HBx 1.0 1.991 5.457 1871 1305 A 49 TRP HD1 A 17 LEU HDy% 1.0 1.960 4.912 1872 1306 B 49 TRP HD1 B 17 LEU HD21 1.0 1.960 4.912 1873 1307 A 17 LEU HDy% A 45 GLN HE2x 1.0 1.999 5.761 1874 1308 B 17 LEU HD21 B 45 GLN HE2y 1.0 1.999 5.761 1875 1309 A 17 LEU HDy% A 49 TRP HBy 1.0 1.816 3.758 1876 1310 B 17 LEU HD21 B 49 TRP HBx 1.0 1.816 3.758 1877 1311 A 17 LEU HDy% A 49 TRP HE1 1.0 1.990 5.448 1878 1312 B 17 LEU HD21 B 49 TRP HE1 1.0 1.990 5.448 1879 1313 A 18 ASP HA A 21 PHE H 1.0 1.930 4.578 1880 1314 B 18 ASP HA B 21 PHE H 1.0 1.930 4.578 1881 1315 A 18 ASP HA A 49 TRP HE1 1.0 1.957 4.861 1882 1316 B 18 ASP HA B 49 TRP HE1 1.0 1.957 4.861 1883 1317 A 20 ALA HA A 21 PHE H 1.0 1.921 4.491 1884 1318 B 20 ALA HA B 21 PHE H 1.0 1.921 4.491 1885 1319 A 20 ALA HB% A 26 ARG HDx 1.0 1.894 4.260 1886 1320 B 20 ALA HB1 B 26 ARG HDx 1.0 1.894 4.260 1887 1321 A 20 ALA HB% B 19 LEU HD21 1.0 1.807 3.709 1888 1322 B 20 ALA HB1 A 19 LEU HDy% 1.0 1.807 3.709 1889 1323 A 20 ALA HB% A 39 LEU HDy% 1.0 0.000 6.000 1890 1324 B 20 ALA HB1 B 39 LEU HD21 1.0 0.000 6.000 1891 1325 A 20 ALA HB% A 17 LEU HDx% 1.0 0.000 6.000 1892 1326 B 20 ALA HB1 B 17 LEU HD11 1.0 0.000 6.000 1893 1327 A 20 ALA HB% A 35 LEU HDx% 1.0 1.843 3.917 1894 1328 B 20 ALA HB1 B 35 LEU HD11 1.0 1.843 3.917 1895 1329 A 20 ALA HB% A 50 PHE HEy 1.0 1.868 4.080 1896 1329 A 20 ALA HB% A 50 PHE HEx 1.0 1.868 4.080 1897 1330 B 20 ALA HB1 B 50 PHE HEy 1.0 1.868 4.080 1898 1330 B 20 ALA HB1 B 50 PHE HEx 1.0 1.868 4.080 1899 1331 A 59 TRP HA A 58 GLY HAy 1.0 0.000 6.000 1900 1332 B 59 TRP HA B 58 GLY HAy 1.0 0.000 6.000 1901 1333 A 59 TRP HA A 60 SER HA 1.0 0.000 6.000 1902 1334 B 59 TRP HA B 60 SER HA 1.0 0.000 6.000 1903 1335 A 31 TRP HA A 26 ARG HA 1.0 0.000 6.000 1904 1336 B 31 TRP HA B 26 ARG HA 1.0 0.000 6.000 1905 1337 A 26 ARG HBy A 26 ARG HA 1.0 1.921 4.485 1906 1338 B 26 ARG HBx B 26 ARG HA 1.0 1.921 4.485 1907 1339 A 27 LEU HA A 32 ARG H 1.0 1.909 4.387 1908 1340 B 27 LEU HA B 32 ARG H 1.0 1.909 4.387 1909 1341 A 50 PHE HBy A 27 LEU HA 1.0 0.000 6.000 1910 1342 B 50 PHE HBx B 27 LEU HA 1.0 0.000 6.000 1911 1343 A 28 THR HA A 28 THR HB 1.0 1.704 3.220 1912 1344 B 28 THR HA B 28 THR HB 1.0 1.704 3.220 1913 1345 A 28 THR HB A 30 GLU HBx 1.0 1.912 4.410 1914 1346 B 28 THR HB B 30 GLU HBy 1.0 1.912 4.410 1915 1347 A 28 THR HB A 30 GLU H 1.0 1.941 4.677 1916 1348 B 28 THR HB B 30 GLU H 1.0 1.941 4.677 1917 1349 A 28 THR HB A 28 THR H 1.0 1.970 5.046 1918 1350 B 28 THR HB B 28 THR H 1.0 1.970 5.046 1919 1351 A 28 THR HA A 29 PRO HA 1.0 1.960 4.912 1920 1352 B 28 THR HA B 29 PRO HA 1.0 1.960 4.912 1921 1353 A 33 ARG H A 29 PRO HA 1.0 1.965 4.975 1922 1354 B 33 ARG H B 29 PRO HA 1.0 1.965 4.975 1923 1355 A 29 PRO HA A 32 ARG H 1.0 1.912 4.412 1924 1356 B 29 PRO HA B 32 ARG H 1.0 1.912 4.412 1925 1357 A 12 GLU H A 10 SER HBy 1.0 1.926 4.528 1926 1358 B 12 GLU H B 10 SER HBx 1.0 1.926 4.528 1927 1359 A 12 GLU H A 10 SER HBx 1.0 1.910 4.392 1928 1360 B 12 GLU H B 10 SER HBy 1.0 1.910 4.392 1929 1361 A 13 GLN H A 10 SER HBx 1.0 1.972 5.088 1930 1362 B 13 GLN H B 10 SER HBy 1.0 1.972 5.088 1931 1363 A 64 PHE HA A 49 TRP HE1 1.0 0.000 6.000 1932 1364 B 64 PHE HA B 49 TRP HE1 1.0 0.000 6.000 1933 1365 A 59 TRP HBx A 55 GLN H 1.0 0.000 6.000 1934 1366 B 59 TRP HBy B 55 GLN H 1.0 0.000 6.000 1935 1367 A 55 GLN H A 59 TRP HBy 1.0 0.000 6.000 1936 1368 B 55 GLN H B 59 TRP HBx 1.0 0.000 6.000 1937 1369 A 59 TRP HD1 A 59 TRP HBy 1.0 1.876 4.132 1938 1370 B 59 TRP HD1 B 59 TRP HBx 1.0 1.876 4.132 1939 1371 A 49 TRP HBx A 50 PHE H 1.0 1.966 5.004 1940 1372 B 49 TRP HBy B 50 PHE H 1.0 1.966 5.004 1941 1373 A 54 GLU HA A 59 TRP HBy 1.0 0.000 6.000 1942 1374 B 54 GLU HA B 59 TRP HBx 1.0 0.000 6.000 1943 1375 A 36 SER HBy A 32 ARG HA 1.0 1.957 4.869 1944 1376 B 36 SER HBy B 32 ARG HA 1.0 1.957 4.869 1945 1377 A 32 ARG HA A 35 LEU HDx% 1.0 1.977 5.165 1946 1378 B 32 ARG HA B 35 LEU HD11 1.0 1.977 5.165 1947 1379 A 33 ARG H A 32 ARG HA 1.0 1.960 4.898 1948 1380 B 33 ARG H B 32 ARG HA 1.0 1.960 4.898 1949 1381 A 35 LEU H A 32 ARG HA 1.0 1.973 5.113 1950 1382 B 35 LEU H B 32 ARG HA 1.0 1.973 5.113 1951 1383 A 32 ARG HBy A 32 ARG HDx 1.0 1.973 5.113 1952 1384 B 32 ARG HBx B 32 ARG HDx 1.0 1.973 5.113 1953 1385 A 32 ARG HBy A 32 ARG HBx 1.0 1.822 3.788 1954 1386 B 32 ARG HBx B 32 ARG HBy 1.0 1.822 3.788 1955 1387 A 32 ARG HBy A 27 LEU HDx% 1.0 1.961 4.927 1956 1388 B 32 ARG HBx B 27 LEU HD11 1.0 1.961 4.927 1957 1389 A 52 ARG HA A 55 GLN H 1.0 1.847 3.935 1958 1390 B 52 ARG HA B 55 GLN H 1.0 1.847 3.935 1959 1391 A 61 HIS HD1 A 61 HIS HBy 1.0 1.878 4.144 1960 1392 B 61 HIS HD1 B 61 HIS HBx 1.0 1.878 4.144 1961 1393 A 61 HIS HD1 A 61 HIS HBx 1.0 1.907 4.371 1962 1394 B 61 HIS HD1 B 61 HIS HBy 1.0 1.907 4.371 1963 1395 A 53 LYS HA A 53 LYS HGx 1.0 1.906 4.362 1964 1396 B 53 LYS HA B 53 LYS HGx 1.0 1.906 4.362 1965 1397 A 53 LYS HA A 53 LYS HGy 1.0 1.918 4.468 1966 1398 B 53 LYS HA B 53 LYS HGy 1.0 1.918 4.468 1967 1399 A 35 LEU HBx A 35 LEU HDy% 1.0 1.983 5.285 1968 1400 B 35 LEU HBx B 35 LEU HD21 1.0 1.983 5.285 1969 1401 A 35 LEU HBx A 35 LEU HDx% 1.0 1.991 5.491 1970 1402 B 35 LEU HBx B 35 LEU HD11 1.0 1.991 5.491 1971 1403 A 35 LEU HA A 35 LEU H 1.0 1.950 4.788 1972 1404 B 35 LEU HA B 35 LEU H 1.0 1.950 4.788 1973 1405 A 39 LEU HA A 39 LEU H 1.0 1.904 4.344 1974 1406 B 39 LEU HA B 39 LEU H 1.0 1.904 4.344 1975 1407 A 39 LEU HBy A 39 LEU H 1.0 1.956 4.860 1976 1408 B 39 LEU HBx B 39 LEU H 1.0 1.956 4.860 1977 1409 A 39 LEU HDy% A 13 GLN HBx 1.0 1.915 4.441 1978 1410 B 39 LEU HD21 B 13 GLN HBx 1.0 1.915 4.441 1979 1411 A 39 LEU HDy% A 17 LEU HA 1.0 1.841 3.905 1980 1412 B 39 LEU HD21 B 17 LEU HA 1.0 1.841 3.905 1981 1413 A 39 LEU HDy% A 40 GLY HAx 1.0 0.000 6.000 1982 1414 B 39 LEU HD21 B 40 GLY HAx 1.0 0.000 6.000 1983 1415 A 39 LEU HDy% A 36 SER HA 1.0 1.892 4.246 1984 1416 B 39 LEU HD21 B 36 SER HA 1.0 1.892 4.246 1985 1417 A 41 LEU HA A 41 LEU HDy% 1.0 1.823 3.795 1986 1418 B 41 LEU HA B 41 LEU HD21 1.0 1.823 3.795 1987 1419 A 9 PHE HDx A 39 LEU HDy% 1.0 1.870 4.084 1988 1419 A 9 PHE HDy A 39 LEU HDy% 1.0 1.870 4.084 1989 1420 B 9 PHE HDy B 39 LEU HD21 1.0 1.870 4.084 1990 1420 B 9 PHE HDx B 39 LEU HD21 1.0 1.870 4.084 1991 1421 A 39 LEU HDy% A 39 LEU H 1.0 1.992 6.506 1992 1422 B 39 LEU HD21 B 39 LEU H 1.0 1.992 6.506 1993 1423 A 39 LEU HDy% A 46 ILE H 1.0 1.947 4.755 1994 1424 B 39 LEU HD21 B 46 ILE H 1.0 1.947 4.755 1995 1425 A 40 GLY HAx A 4 ARG HDx 1.0 1.985 5.321 1996 1426 B 40 GLY HAx B 4 ARG HDx 1.0 1.985 5.321 1997 1427 A 45 GLN HBy A 41 LEU HBx 1.0 1.986 5.344 1998 1428 B 45 GLN HBy B 41 LEU HBy 1.0 1.986 5.344 1999 1429 A 41 LEU HBx A 42 ASN H 1.0 1.950 4.786 2000 1430 B 41 LEU HBy B 42 ASN H 1.0 1.950 4.786 2001 1431 A 27 LEU HDy% A 50 PHE H 1.0 1.934 4.618 2002 1432 B 27 LEU HD21 B 50 PHE H 1.0 1.934 4.618 2003 1433 A 27 LEU HDy% A 32 ARG H 1.0 0.000 6.000 2004 1434 B 27 LEU HD21 B 32 ARG H 1.0 0.000 6.000 2005 1435 A 27 LEU HDy% A 47 GLU H 1.0 1.873 4.109 2006 1436 B 27 LEU HD21 B 47 GLU H 1.0 1.873 4.109 2007 1437 A 50 PHE HDy A 27 LEU HDy% 1.0 1.832 3.850 2008 1437 A 50 PHE HDx A 27 LEU HDy% 1.0 1.832 3.850 2009 1438 B 50 PHE HDy B 27 LEU HD21 1.0 1.832 3.850 2010 1438 B 50 PHE HDx B 27 LEU HD21 1.0 1.832 3.850 2011 1439 A 27 LEU HDy% A 46 ILE H 1.0 0.000 6.000 2012 1440 B 27 LEU HD21 B 46 ILE H 1.0 0.000 6.000 2013 1441 A 27 LEU HDy% A 32 ARG HE 1.0 1.885 4.199 2014 1442 B 27 LEU HD21 B 32 ARG HE 1.0 1.885 4.199 2015 1443 A 17 LEU HDy% A 41 LEU HDx% 1.0 1.881 4.165 2016 1444 B 17 LEU HD21 B 41 LEU HD11 1.0 1.881 4.165 2017 1445 A 36 SER HBy A 42 ASN HA 1.0 1.913 4.419 2018 1446 B 36 SER HBy B 42 ASN HA 1.0 1.913 4.419 2019 1447 A 42 ASN HA A 43 GLU HA 1.0 1.920 4.474 2020 1448 B 42 ASN HA B 43 GLU HA 1.0 1.920 4.474 2021 1449 A 42 ASN HA A 42 ASN HD2y 1.0 1.906 4.358 2022 1450 B 42 ASN HA B 42 ASN HD2x 1.0 1.906 4.358 2023 1451 A 42 ASN HA A 44 GLU H 1.0 1.925 4.521 2024 1452 B 42 ASN HA B 44 GLU H 1.0 1.925 4.521 2025 1453 A 36 SER HBy A 42 ASN HBy 1.0 0.000 6.000 2026 1454 B 36 SER HBy B 42 ASN HBx 1.0 0.000 6.000 2027 1455 A 42 ASN HBy A 43 GLU HA 1.0 1.954 4.826 2028 1456 B 42 ASN HBx B 43 GLU HA 1.0 1.954 4.826 2029 1457 A 43 GLU HA A 46 ILE H 1.0 1.948 4.764 2030 1458 B 43 GLU HA B 46 ILE H 1.0 1.948 4.764 2031 1459 A 44 GLU H A 43 GLU HA 1.0 1.918 4.464 2032 1460 B 44 GLU H B 43 GLU HA 1.0 1.918 4.464 2033 1461 A 53 LYS HEx A 53 LYS HGy 1.0 1.984 5.300 2034 1462 B 53 LYS HEx B 53 LYS HGy 1.0 1.984 5.300 2035 1463 A 44 GLU H A 45 GLN HBx 1.0 0.000 6.000 2036 1464 B 44 GLU H B 45 GLN HBx 1.0 0.000 6.000 2037 1465 A 12 GLU H A 13 GLN HBx 1.0 1.993 6.465 2038 1466 B 12 GLU H B 13 GLN HBx 1.0 1.993 6.465 2039 1467 A 45 GLN HBx A 46 ILE H 1.0 1.934 4.604 2040 1468 B 45 GLN HBx B 46 ILE H 1.0 1.934 4.604 2041 1469 A 45 GLN HE2y A 45 GLN HBx 1.0 1.955 4.851 2042 1470 B 45 GLN HE2x B 45 GLN HBx 1.0 1.955 4.851 2043 1471 A 9 PHE HDy A 13 GLN HBx 1.0 1.997 6.345 2044 1471 A 9 PHE HDx A 13 GLN HBx 1.0 1.997 6.345 2045 1472 B 9 PHE HDy B 13 GLN HBx 1.0 1.997 6.345 2046 1472 B 9 PHE HDx B 13 GLN HBx 1.0 1.997 6.345 2047 1473 A 4 ARG HA A 13 GLN HBx 1.0 1.999 6.119 2048 1474 B 4 ARG HA B 13 GLN HBx 1.0 1.999 6.119 2049 1475 A 45 GLN HA A 45 GLN HBx 1.0 1.858 4.008 2050 1476 B 45 GLN HA B 45 GLN HBx 1.0 1.858 4.008 2051 1477 A 45 GLN HBx A 41 LEU HBx 1.0 1.932 4.592 2052 1478 B 45 GLN HBx B 41 LEU HBy 1.0 1.932 4.592 2053 1479 A 45 GLN HBx A 41 LEU HDy% 1.0 1.950 4.782 2054 1480 B 45 GLN HBx B 41 LEU HD21 1.0 1.950 4.782 2055 1481 A 45 GLN HGx A 42 ASN H 1.0 1.956 4.854 2056 1482 B 45 GLN HGx B 42 ASN H 1.0 1.956 4.854 2057 1483 A 17 LEU HDy% A 46 ILE HA 1.0 1.930 4.578 2058 1484 B 17 LEU HD21 B 46 ILE HA 1.0 1.930 4.578 2059 1485 A 46 ILE HB A 46 ILE H 1.0 1.853 3.979 2060 1486 B 46 ILE HB B 46 ILE H 1.0 1.853 3.979 2061 1487 A 17 LEU HDy% A 46 ILE HD1% 1.0 1.858 4.008 2062 1488 B 17 LEU HD21 B 46 ILE HD11 1.0 1.858 4.008 2063 1489 A 46 ILE HD1% A 35 LEU HDx% 1.0 1.875 4.125 2064 1490 B 46 ILE HD11 B 35 LEU HD11 1.0 1.875 4.125 2065 1491 A 46 ILE HD1% A 45 GLN HGx 1.0 0.000 6.000 2066 1492 B 46 ILE HD11 B 45 GLN HGx 1.0 0.000 6.000 2067 1493 A 46 ILE HD1% A 35 LEU HA 1.0 0.000 6.000 2068 1494 B 46 ILE HD11 B 35 LEU HA 1.0 0.000 6.000 2069 1495 A 46 ILE HD1% A 9 PHE HBy 1.0 1.980 5.210 2070 1496 B 46 ILE HD11 B 9 PHE HBx 1.0 1.980 5.210 2071 1497 A 46 ILE HD1% A 36 SER HG 1.0 1.853 3.977 2072 1498 B 46 ILE HD11 B 36 SER HG 1.0 1.853 3.977 2073 1499 A 46 ILE HD1% A 46 ILE H 1.0 1.778 3.556 2074 1500 B 46 ILE HD11 B 46 ILE H 1.0 1.778 3.556 2075 1501 A 46 ILE HD1% A 35 LEU H 1.0 1.886 4.202 2076 1502 B 46 ILE HD11 B 35 LEU H 1.0 1.886 4.202 2077 1503 A 46 ILE HD1% A 44 GLU H 1.0 1.983 5.285 2078 1504 B 46 ILE HD11 B 44 GLU H 1.0 1.983 5.285 2079 1505 A 46 ILE HD1% A 43 GLU H 1.0 1.906 4.366 2080 1506 B 46 ILE HD11 B 43 GLU H 1.0 1.906 4.366 2081 1507 A 46 ILE HG2% A 35 LEU HDx% 1.0 1.839 3.893 2082 1508 B 46 ILE HG21 B 35 LEU HD11 1.0 1.839 3.893 2083 1509 A 17 LEU HDy% A 46 ILE HG2% 1.0 1.921 4.483 2084 1510 B 17 LEU HD21 B 46 ILE HG21 1.0 1.921 4.483 2085 1511 A 46 ILE HD1% A 46 ILE HG2% 1.0 1.511 2.533 2086 1512 B 46 ILE HD11 B 46 ILE HG21 1.0 1.511 2.533 2087 1513 A 46 ILE HG2% A 46 ILE HG1y 1.0 1.785 3.591 2088 1514 B 46 ILE HG21 B 46 ILE HG1x 1.0 1.785 3.591 2089 1515 A 50 PHE HDx A 46 ILE HG2% 1.0 1.823 3.797 2090 1515 A 50 PHE HDy A 46 ILE HG2% 1.0 1.823 3.797 2091 1516 B 50 PHE HDx B 46 ILE HG21 1.0 1.823 3.797 2092 1516 B 50 PHE HDy B 46 ILE HG21 1.0 1.823 3.797 2093 1517 A 46 ILE HG2% A 47 GLU H 1.0 1.824 3.802 2094 1518 B 46 ILE HG21 B 47 GLU H 1.0 1.824 3.802 2095 1519 A 46 ILE HG2% A 32 ARG H 1.0 1.971 5.077 2096 1520 B 46 ILE HG21 B 32 ARG H 1.0 1.971 5.077 2097 1521 A 46 ILE HG2% A 50 PHE H 1.0 1.943 4.703 2098 1522 B 46 ILE HG21 B 50 PHE H 1.0 1.943 4.703 2099 1523 A 47 GLU HA A 50 PHE H 1.0 1.956 4.860 2100 1524 B 47 GLU HA B 50 PHE H 1.0 1.956 4.860 2101 1525 A 47 GLU HBx A 47 GLU HA 1.0 1.708 3.236 2102 1526 B 47 GLU HBx B 47 GLU HA 1.0 1.708 3.236 2103 1527 A 47 GLU HGx A 47 GLU H 1.0 1.694 3.174 2104 1528 B 47 GLU HGx B 47 GLU H 1.0 1.694 3.174 2105 1529 A 47 GLU HGx A 47 GLU HA 1.0 1.649 3.001 2106 1530 B 47 GLU HGx B 47 GLU HA 1.0 1.649 3.001 2107 1531 A 48 ARG HA A 48 ARG H 1.0 1.658 3.034 2108 1532 B 48 ARG HA B 48 ARG H 1.0 1.658 3.034 2109 1533 A 48 ARG HDx A 48 ARG HA 1.0 1.747 3.409 2110 1534 B 48 ARG HDy B 48 ARG HA 1.0 1.747 3.409 2111 1535 A 48 ARG HDy A 48 ARG HBy 1.0 0.000 6.000 2112 1536 B 48 ARG HDx B 48 ARG HBx 1.0 0.000 6.000 2113 1537 A 52 ARG H A 52 ARG HGy 1.0 1.834 3.862 2114 1538 B 52 ARG H B 52 ARG HGx 1.0 1.834 3.862 2115 1539 A 53 LYS HBy A 53 LYS HGx 1.0 1.977 5.167 2116 1540 B 53 LYS HBx B 53 LYS HGx 1.0 1.977 5.167 2117 1541 A 53 LYS HEy A 53 LYS HBx 1.0 1.959 4.895 2118 1542 B 53 LYS HEy B 53 LYS HBy 1.0 1.959 4.895 2119 1543 A 54 GLU HGx A 53 LYS HBx 1.0 2.000 6.106 2120 1544 B 54 GLU HGy B 53 LYS HBy 1.0 2.000 6.106 2121 1545 A 53 LYS HBy A 53 LYS HBx 1.0 1.829 3.831 2122 1546 B 53 LYS HBx B 53 LYS HBy 1.0 1.829 3.831 2123 1547 A 53 LYS HGy A 53 LYS HBx 1.0 1.946 4.740 2124 1548 B 53 LYS HGy B 53 LYS HBy 1.0 1.946 4.740 2125 1549 A 53 LYS HBx A 21 PHE HZ 1.0 1.956 4.850 2126 1550 B 53 LYS HBy B 21 PHE HZ 1.0 1.956 4.850 2127 1551 A 21 PHE HEy A 53 LYS HBx 1.0 1.996 5.636 2128 1551 A 21 PHE HEx A 53 LYS HBx 1.0 1.996 5.636 2129 1552 B 21 PHE HEy B 53 LYS HBy 1.0 1.996 5.636 2130 1552 B 21 PHE HEx B 53 LYS HBy 1.0 1.996 5.636 2131 1553 A 53 LYS HEy A 53 LYS HGx 1.0 1.940 4.672 2132 1554 B 53 LYS HEy B 53 LYS HGx 1.0 1.940 4.672 2133 1555 A 53 LYS HDx A 53 LYS HGx 1.0 1.961 4.919 2134 1556 B 53 LYS HDy B 53 LYS HGx 1.0 1.961 4.919 2135 1557 A 53 LYS HBx A 53 LYS HGx 1.0 1.922 4.502 2136 1558 B 53 LYS HBy B 53 LYS HGx 1.0 1.922 4.502 2137 1559 A 53 LYS HDy A 53 LYS HGx 1.0 1.956 4.858 2138 1560 B 53 LYS HDx B 53 LYS HGx 1.0 1.956 4.858 2139 1561 A 53 LYS HDy A 53 LYS HGy 1.0 1.989 5.415 2140 1562 B 53 LYS HDx B 53 LYS HGy 1.0 1.989 5.415 2141 1563 A 53 LYS HDx A 53 LYS HGy 1.0 2.000 5.866 2142 1564 B 53 LYS HDy B 53 LYS HGy 1.0 2.000 5.866 2143 1565 A 54 GLU HA A 54 GLU HBx 1.0 1.699 3.195 2144 1566 B 54 GLU HA B 54 GLU HBx 1.0 1.699 3.195 2145 1567 A 54 GLU HA A 54 GLU HBy 1.0 1.675 3.097 2146 1568 B 54 GLU HA B 54 GLU HBy 1.0 1.675 3.097 2147 1569 A 54 GLU H A 54 GLU HBy 1.0 1.750 3.422 2148 1570 B 54 GLU H B 54 GLU HBy 1.0 1.750 3.422 2149 1571 A 54 GLU HBx A 54 GLU HBy 1.0 1.534 2.606 2150 1572 B 54 GLU HBx B 54 GLU HBy 1.0 1.534 2.606 2151 1573 A 54 GLU HA A 58 GLY H 1.0 0.000 6.000 2152 1574 B 54 GLU HA B 58 GLY H 1.0 0.000 6.000 2153 1575 A 56 GLN HBx A 56 GLN HA 1.0 1.577 2.745 2154 1576 B 56 GLN HBy B 56 GLN HA 1.0 1.577 2.745 2155 1577 A 56 GLN HA A 56 GLN HGx 1.0 1.814 3.746 2156 1578 B 56 GLN HA B 56 GLN HGy 1.0 1.814 3.746 2157 1579 A 57 ILE HB A 58 GLY HAx 1.0 1.954 4.838 2158 1580 B 57 ILE HB B 58 GLY HAx 1.0 1.954 4.838 2159 1581 A 58 GLY HAy A 59 TRP HBy 1.0 1.938 4.652 2160 1582 B 58 GLY HAy B 59 TRP HBx 1.0 1.938 4.652 2161 1583 A 59 TRP HA A 59 TRP HBx 1.0 0.000 6.000 2162 1584 B 59 TRP HA B 59 TRP HBy 1.0 0.000 6.000 2163 1585 A 59 TRP HA A 59 TRP HBy 1.0 1.591 2.791 2164 1586 B 59 TRP HA B 59 TRP HBx 1.0 1.591 2.791 2165 1587 A 59 TRP HBx A 59 TRP HBy 1.0 1.382 2.170 2166 1588 B 59 TRP HBy B 59 TRP HBx 1.0 1.382 2.170 2167 1589 A 57 ILE HG2% A 59 TRP HBy 1.0 0.000 6.000 2168 1590 B 57 ILE HG21 B 59 TRP HBx 1.0 0.000 6.000 2169 1591 A 62 PRO HDy A 61 HIS HBy 1.0 0.000 6.000 2170 1592 B 62 PRO HDy B 61 HIS HBx 1.0 0.000 6.000 2171 1593 A 62 PRO HDx A 61 HIS HBy 1.0 0.000 6.000 2172 1594 B 62 PRO HDx B 61 HIS HBx 1.0 0.000 6.000 2173 1595 A 62 PRO HDx A 61 HIS HBx 1.0 0.000 6.000 2174 1596 B 62 PRO HDx B 61 HIS HBy 1.0 0.000 6.000 2175 1597 A 60 SER HBx A 60 SER HA 1.0 1.483 2.451 2176 1598 B 60 SER HBy B 60 SER HA 1.0 1.483 2.451 2177 1599 A 60 SER HBy A 60 SER HA 1.0 1.522 2.566 2178 1600 B 60 SER HBx B 60 SER HA 1.0 1.522 2.566 2179 1601 A 60 SER HG A 60 SER HA 1.0 1.975 5.117 2180 1602 B 60 SER HG B 60 SER HA 1.0 1.975 5.117 2181 1603 A 61 HIS HA A 61 HIS HBy 1.0 1.652 3.012 2182 1604 B 61 HIS HA B 61 HIS HBx 1.0 1.652 3.012 2183 1605 A 61 HIS HA A 61 HIS HBx 1.0 1.636 2.954 2184 1606 B 61 HIS HA B 61 HIS HBy 1.0 1.636 2.954 2185 1607 A 61 HIS HA A 54 GLU HBy 1.0 1.960 4.902 2186 1608 B 61 HIS HA B 54 GLU HBy 1.0 1.960 4.902 2187 1609 A 64 PHE HDy A 63 GLN HGy 1.0 0.000 6.000 2188 1609 A 64 PHE HDx A 63 GLN HGy 1.0 0.000 6.000 2189 1610 B 64 PHE HDy B 63 GLN HGy 1.0 0.000 6.000 2190 1610 B 64 PHE HDx B 63 GLN HGy 1.0 0.000 6.000 2191 1611 A 64 PHE HBx A 64 PHE HBy 1.0 1.354 2.100 2192 1612 B 64 PHE HBx B 64 PHE HBy 1.0 1.354 2.100 2193 1613 A 66 LYS HA A 66 LYS HEy 1.0 1.767 8.969 2194 1614 B 66 LYS HA B 66 LYS HEx 1.0 1.767 8.969 2195 1615 A 66 LYS HA A 66 LYS HBy 1.0 1.798 3.656 2196 1616 B 66 LYS HA B 66 LYS HBx 1.0 1.798 3.656 2197 1617 A 66 LYS HGx A 66 LYS HA 1.0 1.859 4.013 2198 1618 B 66 LYS HGy B 66 LYS HA 1.0 1.859 4.013 2199 1619 A 66 LYS HBy A 66 LYS HDy 1.0 1.809 3.719 2200 1620 B 66 LYS HBx B 66 LYS HDy 1.0 1.809 3.719 2201 1621 A 65 GLU HA A 65 GLU HGy 1.0 1.786 3.596 2202 1622 B 65 GLU HA B 65 GLU HGy 1.0 1.786 3.596 2203 1623 A 39 LEU HDy% A 39 LEU HA 1.0 1.877 4.141 2204 1624 B 39 LEU HD21 B 39 LEU HA 1.0 1.877 4.141 2205 1625 A 17 LEU HDy% A 9 PHE HA 1.0 2.000 5.986 2206 1626 B 17 LEU HD21 B 9 PHE HA 1.0 2.000 5.986 2207 1627 A 9 PHE HA A 41 LEU HDy% 1.0 1.973 5.105 2208 1628 B 9 PHE HA B 41 LEU HD21 1.0 1.973 5.105 2209 1629 A 9 PHE HA A 13 GLN HGy 1.0 1.976 5.152 2210 1630 B 9 PHE HA B 13 GLN HGy 1.0 1.976 5.152 2211 1631 A 17 LEU HDy% A 18 ASP HA 1.0 1.998 5.750 2212 1632 B 17 LEU HD21 B 18 ASP HA 1.0 1.998 5.750 2213 1633 A 17 LEU HDy% A 13 GLN HA 1.0 0.000 6.000 2214 1634 B 17 LEU HD21 B 13 GLN HA 1.0 0.000 6.000 2215 1635 A 53 LYS HGy A 53 LYS HGx 1.0 1.854 3.984 2216 1636 B 53 LYS HGy B 53 LYS HGx 1.0 1.854 3.984 2217 1637 A 17 LEU HBy A 17 LEU HBx 1.0 0.000 6.000 2218 1638 B 17 LEU HBx B 17 LEU HBy 1.0 0.000 6.000 2219 1639 A 35 LEU HDy% A 35 LEU HBy 1.0 1.975 5.125 2220 1640 B 35 LEU HD21 B 35 LEU HBy 1.0 1.975 5.125 2221 1641 A 35 LEU HA A 35 LEU HBy 1.0 1.999 5.795 2222 1642 B 35 LEU HA B 35 LEU HBy 1.0 1.999 5.795 2223 1643 A 36 SER H A 35 LEU HBy 1.0 2.000 6.118 2224 1644 B 36 SER H B 35 LEU HBy 1.0 2.000 6.118 2225 1645 A 35 LEU HBy A 35 LEU HDx% 1.0 2.000 6.046 2226 1646 B 35 LEU HBy B 35 LEU HD11 1.0 2.000 6.046 2227 1647 A 9 PHE HBx A 13 GLN HBx 1.0 1.964 4.956 2228 1648 B 9 PHE HBy B 13 GLN HBx 1.0 1.964 4.956 2229 1649 A 9 PHE HBy A 13 GLN HBx 1.0 1.976 5.148 2230 1650 B 9 PHE HBx B 13 GLN HBx 1.0 1.976 5.148 2231 1651 A 13 GLN HBx A 41 LEU HDy% 1.0 1.990 5.456 2232 1652 B 13 GLN HBx B 41 LEU HD21 1.0 1.990 5.456 2233 1653 A 17 LEU HDy% A 13 GLN HBx 1.0 1.999 5.827 2234 1654 B 17 LEU HD21 B 13 GLN HBx 1.0 1.999 5.827 2235 1655 A 9 PHE HA A 13 GLN HBx 1.0 1.980 5.228 2236 1656 B 9 PHE HA B 13 GLN HBx 1.0 1.980 5.228 2237 1657 A 28 THR H A 27 LEU HBy 1.0 1.991 5.463 2238 1658 B 28 THR H B 27 LEU HBx 1.0 1.991 5.463 2239 1659 A 50 PHE HDy A 27 LEU HBy 1.0 1.980 5.232 2240 1659 A 50 PHE HDx A 27 LEU HBy 1.0 1.980 5.232 2241 1660 B 50 PHE HDy B 27 LEU HBx 1.0 1.980 5.232 2242 1660 B 50 PHE HDx B 27 LEU HBx 1.0 1.980 5.232 2243 1661 A 32 ARG HE A 27 LEU HBy 1.0 2.000 5.918 2244 1662 B 32 ARG HE B 27 LEU HBx 1.0 2.000 5.918 2245 1663 A 50 PHE HBy A 27 LEU HBy 1.0 1.994 5.560 2246 1664 B 50 PHE HBx B 27 LEU HBx 1.0 1.994 5.560 2247 1665 A 50 PHE HBx A 27 LEU HBy 1.0 1.998 5.802 2248 1666 B 50 PHE HBy B 27 LEU HBx 1.0 1.998 5.802 2249 1667 A 17 LEU HBx A 17 LEU HG 1.0 1.982 5.270 2250 1668 B 17 LEU HBy B 17 LEU HG 1.0 1.982 5.270 2251 1669 A 17 LEU HBx A 17 LEU HDx% 1.0 1.960 4.912 2252 1670 B 17 LEU HBy B 17 LEU HD11 1.0 1.960 4.912 2253 1671 A 49 TRP HBy A 17 LEU HBx 1.0 1.995 5.587 2254 1672 B 49 TRP HBx B 17 LEU HBy 1.0 1.995 5.587 2255 1673 A 17 LEU HBx A 49 TRP HBx 1.0 1.987 5.369 2256 1674 B 17 LEU HBy B 49 TRP HBy 1.0 1.987 5.369 2257 1675 A 50 PHE HBy A 27 LEU HBx 1.0 2.000 6.054 2258 1676 B 50 PHE HBx B 27 LEU HBy 1.0 2.000 6.054 2259 1677 A 27 LEU HBx A 50 PHE HBx 1.0 1.990 6.578 2260 1678 B 27 LEU HBy B 50 PHE HBy 1.0 1.990 6.578 2261 1679 A 27 LEU HBx A 32 ARG HE 1.0 1.999 6.199 2262 1680 B 27 LEU HBy B 32 ARG HE 1.0 1.999 6.199 2263 1681 A 27 LEU HBx A 28 THR H 1.0 1.983 5.265 2264 1682 B 27 LEU HBy B 28 THR H 1.0 1.983 5.265 2265 1683 A 50 PHE HDy A 27 LEU HBx 1.0 2.000 5.990 2266 1683 A 50 PHE HDx A 27 LEU HBx 1.0 2.000 5.990 2267 1684 B 50 PHE HDy B 27 LEU HBy 1.0 2.000 5.990 2268 1684 B 50 PHE HDx B 27 LEU HBy 1.0 2.000 5.990 2269 1685 A 27 LEU HDx% A 46 ILE H 1.0 0.000 6.000 2270 1686 B 27 LEU HD11 B 46 ILE H 1.0 0.000 6.000 2271 1687 A 51 ARG H A 27 LEU HDx% 1.0 1.979 5.199 2272 1688 B 51 ARG H B 27 LEU HD11 1.0 1.979 5.199 2273 1689 A 32 ARG HDy A 27 LEU HDy% 1.0 1.983 5.265 2274 1690 B 32 ARG HDy B 27 LEU HD21 1.0 1.983 5.265 2275 1691 A 47 GLU HGx A 27 LEU HDx% 1.0 1.949 4.775 2276 1692 B 47 GLU HGx B 27 LEU HD11 1.0 1.949 4.775 2277 1693 A 46 ILE HG2% A 27 LEU HDx% 1.0 0.000 6.000 2278 1694 B 46 ILE HG21 B 27 LEU HD11 1.0 0.000 6.000 2279 1695 A 27 LEU HDy% A 27 LEU HDx% 1.0 1.648 2.998 2280 1696 B 27 LEU HD21 B 27 LEU HD11 1.0 1.648 2.998 2281 1697 A 35 LEU HA A 35 LEU HDy% 1.0 1.848 3.946 2282 1698 B 35 LEU HA B 35 LEU HD21 1.0 1.848 3.946 2283 1699 A 54 GLU HBx A 59 TRP HBx 1.0 1.950 4.794 2284 1700 B 54 GLU HBx B 59 TRP HBy 1.0 1.950 4.794 2285 1701 A 31 TRP HA A 30 GLU HBx 1.0 0.000 6.000 2286 1702 B 31 TRP HA B 30 GLU HBy 1.0 0.000 6.000 2287 1703 A 21 PHE HEy A 54 GLU HBx 1.0 0.000 6.000 2288 1703 A 21 PHE HEx A 54 GLU HBx 1.0 0.000 6.000 2289 1704 B 21 PHE HEy B 54 GLU HBx 1.0 0.000 6.000 2290 1704 B 21 PHE HEx B 54 GLU HBx 1.0 0.000 6.000 2291 1705 A 54 GLU HBx A 54 GLU HGx 1.0 1.733 3.343 2292 1706 B 54 GLU HBx B 54 GLU HGy 1.0 1.733 3.343 2293 1707 A 54 GLU HGx A 54 GLU HBy 1.0 1.720 3.288 2294 1708 B 54 GLU HGy B 54 GLU HBy 1.0 1.720 3.288 2295 1709 A 54 GLU HGy A 54 GLU HBy 1.0 1.692 3.170 2296 1710 B 54 GLU HGx B 54 GLU HBy 1.0 1.692 3.170 2297 1711 A 21 PHE HEy A 54 GLU HBy 1.0 1.902 4.324 2298 1711 A 21 PHE HEx A 54 GLU HBy 1.0 1.902 4.324 2299 1712 B 21 PHE HEy B 54 GLU HBy 1.0 1.902 4.324 2300 1712 B 21 PHE HEx B 54 GLU HBy 1.0 1.902 4.324 2301 1713 A 53 LYS HGy A 21 PHE HZ 1.0 1.996 6.384 2302 1714 B 53 LYS HGy B 21 PHE HZ 1.0 1.996 6.384 2303 1715 A 21 PHE HZ A 53 LYS HGx 1.0 1.992 5.516 2304 1716 B 21 PHE HZ B 53 LYS HGx 1.0 1.992 5.516 2305 1717 A 53 LYS HBy A 21 PHE HZ 1.0 1.999 5.803 2306 1718 B 53 LYS HBx B 21 PHE HZ 1.0 1.999 5.803 2307 1719 A 54 GLU HBx A 21 PHE HZ 1.0 1.973 5.099 2308 1720 B 54 GLU HBx B 21 PHE HZ 1.0 1.973 5.099 2309 1721 A 16 ALA HB% A 35 LEU HDy% 1.0 1.951 4.797 2310 1722 B 16 ALA HB1 B 35 LEU HD21 1.0 1.951 4.797 2311 1723 A 39 LEU HDy% A 35 LEU HBy 1.0 1.953 4.819 2312 1724 B 39 LEU HD21 B 35 LEU HBy 1.0 1.953 4.819 2313 1725 A 35 LEU HDy% A 35 LEU HDx% 1.0 1.915 4.431 2314 1726 B 35 LEU HD21 B 35 LEU HD11 1.0 1.915 4.431 2315 1727 A 16 ALA HB% A 35 LEU HDx% 1.0 1.985 5.319 2316 1728 B 16 ALA HB1 B 35 LEU HD11 1.0 1.985 5.319 2317 1729 A 27 LEU HDx% A 35 LEU HDx% 1.0 0.000 6.000 2318 1730 B 27 LEU HD11 B 35 LEU HD11 1.0 0.000 6.000 2319 1731 A 39 LEU HDx% A 39 LEU HA 1.0 1.517 2.551 2320 1732 B 39 LEU HD11 B 39 LEU HA 1.0 1.517 2.551 2321 1733 A 39 LEU HDx% A 13 GLN HA 1.0 1.762 3.476 2322 1734 B 39 LEU HD11 B 13 GLN HA 1.0 1.762 3.476 2323 1735 A 18 ASP H A 39 LEU HDx% 1.0 0.000 6.000 2324 1736 B 18 ASP H B 39 LEU HD11 1.0 0.000 6.000 2325 1737 A 39 LEU HDx% A 17 LEU HA 1.0 1.898 4.292 2326 1738 B 39 LEU HD11 B 17 LEU HA 1.0 1.898 4.292 2327 1739 A 36 SER HA A 41 LEU HDx% 1.0 1.842 3.912 2328 1740 B 36 SER HA B 41 LEU HD11 1.0 1.842 3.912 2329 1741 A 40 GLY HAx A 41 LEU HDx% 1.0 1.845 3.927 2330 1742 B 40 GLY HAx B 41 LEU HD11 1.0 1.845 3.927 2331 1743 A 9 PHE HBx A 41 LEU HDx% 1.0 1.878 4.144 2332 1744 B 9 PHE HBy B 41 LEU HD11 1.0 1.878 4.144 2333 1745 A 9 PHE HBx A 39 LEU HDx% 1.0 1.882 4.178 2334 1746 B 9 PHE HBy B 39 LEU HD11 1.0 1.882 4.178 2335 1747 A 39 LEU HDx% A 13 GLN HBx 1.0 1.815 3.755 2336 1748 B 39 LEU HD11 B 13 GLN HBx 1.0 1.815 3.755 2337 1749 A 13 GLN HGy A 41 LEU HDx% 1.0 1.822 3.788 2338 1750 B 13 GLN HGy B 41 LEU HD11 1.0 1.822 3.788 2339 1751 A 39 LEU HDy% A 39 LEU HG 1.0 1.953 4.823 2340 1752 B 39 LEU HD21 B 39 LEU HG 1.0 1.953 4.823 2341 1753 A 39 LEU HDy% A 39 LEU HBy 1.0 1.798 3.656 2342 1754 B 39 LEU HD21 B 39 LEU HBx 1.0 1.798 3.656 2343 1755 A 39 LEU HDx% A 39 LEU HBy 1.0 1.773 3.531 2344 1756 B 39 LEU HD11 B 39 LEU HBx 1.0 1.773 3.531 2345 1757 A 39 LEU HBx A 39 LEU HDy% 1.0 1.807 3.709 2346 1758 B 39 LEU HBy B 39 LEU HD21 1.0 1.807 3.709 2347 1759 A 39 LEU HBx A 39 LEU HDx% 1.0 1.792 3.632 2348 1760 B 39 LEU HBy B 39 LEU HD11 1.0 1.792 3.632 2349 1761 A 39 LEU HDx% A 13 GLN HGy 1.0 1.806 3.700 2350 1762 B 39 LEU HD11 B 13 GLN HGy 1.0 1.806 3.700 2351 1763 A 43 GLU HBx A 43 GLU HGx 1.0 1.721 3.291 2352 1764 B 43 GLU HBx B 43 GLU HGx 1.0 1.721 3.291 2353 1765 A 28 THR HB A 31 TRP HBx 1.0 2.000 6.054 2354 1766 B 28 THR HB B 31 TRP HBx 1.0 2.000 6.054 2355 1767 A 28 THR HB A 31 TRP H 1.0 2.000 5.990 2356 1768 B 28 THR HB B 31 TRP H 1.0 2.000 5.990 2357 1769 A 28 THR HB A 31 TRP HBy 1.0 1.631 9.805 2358 1770 B 28 THR HB B 31 TRP HBy 1.0 1.631 9.805 2359 1771 A 28 THR HA A 31 TRP HBy 1.0 1.995 5.607 2360 1772 B 28 THR HA B 31 TRP HBy 1.0 1.995 5.607 2361 1773 A 57 ILE HG1x A 60 SER HG 1.0 1.958 4.878 2362 1774 B 57 ILE HG1y B 60 SER HG 1.0 1.958 4.878 2363 1775 A 43 GLU HA A 46 ILE HG1y 1.0 1.882 4.170 2364 1776 B 43 GLU HA B 46 ILE HG1x 1.0 1.882 4.170 2365 1777 A 15 LYS HA A 15 LYS HGx 1.0 1.716 3.266 2366 1778 B 15 LYS HA B 15 LYS HGx 1.0 1.716 3.266 2367 1779 A 3 LYS HGy A 1 MET HA 1.0 0.000 6.000 2368 1780 B 3 LYS HGx B 1 MET HA 1.0 0.000 6.000 2369 1781 A 57 ILE HG1x A 60 SER H 1.0 1.810 3.722 2370 1782 B 57 ILE HG1y B 60 SER H 1.0 1.810 3.722 2371 1783 A 9 PHE H A 39 LEU HG 1.0 0.000 6.000 2372 1784 B 9 PHE H B 39 LEU HG 1.0 0.000 6.000 2373 1785 A 42 ASN HBy A 42 ASN HBx 1.0 1.496 2.486 2374 1786 B 42 ASN HBx B 42 ASN HBy 1.0 1.496 2.486 2375 1787 A 34 TYR HBy A 34 TYR HBx 1.0 1.799 3.667 2376 1788 B 34 TYR HBx B 34 TYR HBy 1.0 1.799 3.667 2377 1789 A 57 ILE HA A 56 GLN HGy 1.0 1.896 4.278 2378 1790 B 57 ILE HA B 56 GLN HGx 1.0 1.896 4.278 2379 1791 A 30 GLU HA A 30 GLU HBx 1.0 1.721 3.291 2380 1792 B 30 GLU HA B 30 GLU HBy 1.0 1.721 3.291 2381 1793 A 30 GLU HA A 30 GLU HGx 1.0 1.847 3.941 2382 1794 B 30 GLU HA B 30 GLU HGx 1.0 1.847 3.941 2383 1795 A 33 ARG HDx A 30 GLU HA 1.0 1.884 4.194 2384 1796 B 33 ARG HDx B 30 GLU HA 1.0 1.884 4.194 2385 1797 A 45 GLN H A 42 ASN HBy 1.0 1.926 4.538 2386 1798 B 45 GLN H B 42 ASN HBx 1.0 1.926 4.538 2387 1799 A 50 PHE HBx A 50 PHE HEy 1.0 1.992 5.490 2388 1799 A 50 PHE HEx A 50 PHE HBx 1.0 1.992 5.490 2389 1800 B 50 PHE HBy B 50 PHE HEy 1.0 1.992 5.490 2390 1800 B 50 PHE HEx B 50 PHE HBy 1.0 1.992 5.490 2391 1801 A 34 TYR HDx A 34 TYR HBx 1.0 1.907 4.371 2392 1802 B 34 TYR HDx B 34 TYR HBy 1.0 1.907 4.371 2393 1803 A 45 GLN HA A 9 PHE HBy 1.0 0.000 6.000 2394 1804 B 45 GLN HA B 9 PHE HBx 1.0 0.000 6.000 2395 1805 A 45 GLN HBy A 9 PHE HA 1.0 1.991 5.477 2396 1806 B 45 GLN HBy B 9 PHE HA 1.0 1.991 5.477 2397 1807 A 9 PHE HBy A 45 GLN HBx 1.0 1.913 4.423 2398 1808 B 9 PHE HBx B 45 GLN HBx 1.0 1.913 4.423 2399 1809 A 9 PHE HBy A 14 LYS HGx 1.0 1.933 4.603 2400 1810 B 9 PHE HBx B 14 LYS HGx 1.0 1.933 4.603 2401 1811 A 14 LYS HEx A 49 TRP HBx 1.0 0.000 6.000 2402 1812 B 14 LYS HEx B 49 TRP HBy 1.0 0.000 6.000 2403 1813 A 42 ASN HBx A 7 THR HB 1.0 1.985 5.321 2404 1814 B 42 ASN HBy B 7 THR HB 1.0 1.985 5.321 2405 1815 A 41 LEU HG A 7 THR HB 1.0 1.962 4.940 2406 1816 B 41 LEU HG B 7 THR HB 1.0 1.962 4.940 2407 1817 A 44 GLU HGy A 7 THR HB 1.0 0.000 6.000 2408 1818 B 44 GLU HGy B 7 THR HB 1.0 0.000 6.000 2409 1819 A 45 GLN HBy A 7 THR HB 1.0 1.954 4.826 2410 1820 B 45 GLN HBy B 7 THR HB 1.0 1.954 4.826 2411 1821 A 45 GLN HGx A 7 THR HB 1.0 1.999 5.817 2412 1822 B 45 GLN HGx B 7 THR HB 1.0 1.999 5.817 2413 1823 A 7 THR HB A 8 GLU H 1.0 0.000 6.000 2414 1824 B 7 THR HB B 8 GLU H 1.0 0.000 6.000 2415 1825 A 13 GLN H A 12 GLU HBy 1.0 1.741 3.381 2416 1826 B 13 GLN H B 12 GLU HBx 1.0 1.741 3.381 2417 1827 A 66 LYS H A 66 LYS HEx 1.0 1.995 5.589 2418 1828 B 66 LYS H B 66 LYS HEy 1.0 1.995 5.589 2419 1829 A 18 ASP HBx A 18 ASP H 1.0 1.907 4.371 2420 1830 B 18 ASP HBy B 18 ASP H 1.0 1.907 4.371 2421 1831 A 49 TRP HA A 49 TRP H 1.0 1.787 3.601 2422 1832 B 49 TRP HA B 49 TRP H 1.0 1.787 3.601 2423 1833 A 49 TRP HBx A 49 TRP H 1.0 1.788 3.610 2424 1834 B 49 TRP HBy B 49 TRP H 1.0 1.788 3.610 2425 1835 A 49 TRP HBy A 49 TRP H 1.0 1.766 3.498 2426 1836 B 49 TRP HBx B 49 TRP H 1.0 1.766 3.498 2427 1837 A 41 LEU HBy A 41 LEU H 1.0 1.909 4.387 2428 1838 B 41 LEU HBx B 41 LEU H 1.0 1.909 4.387 2429 1839 A 41 LEU HBx A 41 LEU H 1.0 1.862 4.040 2430 1840 B 41 LEU HBy B 41 LEU H 1.0 1.862 4.040 2431 1841 A 34 TYR H A 34 TYR HBy 1.0 1.843 3.915 2432 1842 B 34 TYR H B 34 TYR HBx 1.0 1.843 3.915 2433 1843 A 34 TYR H A 34 TYR HBx 1.0 1.797 3.659 2434 1844 B 34 TYR H B 34 TYR HBy 1.0 1.797 3.659 2435 1845 A 34 TYR HA A 34 TYR H 1.0 1.852 3.970 2436 1846 B 34 TYR HA B 34 TYR H 1.0 1.852 3.970 2437 1847 A 30 GLU H A 30 GLU HBx 1.0 1.994 5.546 2438 1848 B 30 GLU H B 30 GLU HBy 1.0 1.994 5.546 2439 1849 A 30 GLU H A 30 GLU HBy 1.0 2.000 6.026 2440 1850 B 30 GLU H B 30 GLU HBx 1.0 2.000 6.026 2441 1851 A 31 TRP HA A 32 ARG H 1.0 1.999 5.839 2442 1852 B 31 TRP HA B 32 ARG H 1.0 1.999 5.839 2443 1853 A 31 TRP H A 31 TRP HBx 1.0 1.999 6.199 2444 1854 B 31 TRP H B 31 TRP HBx 1.0 1.999 6.199 2445 1855 A 27 LEU HDx% A 28 THR H 1.0 1.990 5.426 2446 1856 B 27 LEU HD11 B 28 THR H 1.0 1.990 5.426 2447 1857 A 28 THR HG2% A 28 THR H 1.0 1.825 3.807 2448 1858 B 28 THR HG21 B 28 THR H 1.0 1.825 3.807 2449 1859 A 21 PHE H A 21 PHE HA 1.0 1.981 5.239 2450 1860 B 21 PHE H B 21 PHE HA 1.0 1.981 5.239 2451 1861 A 64 PHE HDx A 64 PHE H 1.0 1.882 4.172 2452 1862 B 64 PHE HDx B 64 PHE H 1.0 1.882 4.172 2453 1863 A 52 ARG H A 50 PHE H 1.0 1.929 4.559 2454 1864 B 52 ARG H B 50 PHE H 1.0 1.929 4.559 2455 1865 A 9 PHE HEy A 49 TRP H 1.0 1.964 4.962 2456 1865 A 9 PHE HEx A 49 TRP H 1.0 1.964 4.962 2457 1866 B 9 PHE HEy B 49 TRP H 1.0 1.964 4.962 2458 1866 B 9 PHE HEx B 49 TRP H 1.0 1.964 4.962 2459 1867 A 49 TRP HD1 A 49 TRP H 1.0 1.974 5.120 2460 1868 B 49 TRP HD1 B 49 TRP H 1.0 1.974 5.120 2461 1869 A 44 GLU H A 46 ILE H 1.0 1.974 5.126 2462 1870 B 44 GLU H B 46 ILE H 1.0 1.974 5.126 2463 1871 A 9 PHE HDx A 9 PHE H 1.0 1.847 3.939 2464 1872 B 9 PHE HDx B 9 PHE H 1.0 1.847 3.939 2465 1873 A 66 LYS H A 66 LYS HZ% 1.0 1.766 8.968 2466 1874 B 66 LYS H B 66 LYS HZ% 1.0 1.766 8.968 2467 1875 A 52 ARG H A 52 ARG HE 1.0 1.987 6.671 2468 1876 B 52 ARG H B 52 ARG HE 1.0 1.987 6.671 2469 1877 A 51 ARG H A 51 ARG HE 1.0 1.664 9.616 2470 1878 B 51 ARG H B 51 ARG HE 1.0 1.664 9.616 2471 1879 A 48 ARG H A 48 ARG HE 1.0 1.992 5.498 2472 1880 B 48 ARG H B 48 ARG HE 1.0 1.992 5.498 2473 1881 A 45 GLN H A 46 ILE H 1.0 1.830 3.840 2474 1882 B 45 GLN H B 46 ILE H 1.0 1.830 3.840 2475 1883 A 45 GLN H A 45 GLN HE2x 1.0 2.000 6.000 2476 1884 B 45 GLN H B 45 GLN HE2y 1.0 2.000 6.000 2477 1885 A 42 ASN H A 42 ASN HD2y 1.0 1.976 5.144 2478 1886 B 42 ASN H B 42 ASN HD2x 1.0 1.976 5.144 2479 1887 A 36 SER HG A 36 SER H 1.0 1.987 5.367 2480 1888 B 36 SER HG B 36 SER H 1.0 1.987 5.367 2481 1889 A 33 ARG H A 33 ARG HE 1.0 1.968 7.050 2482 1890 B 33 ARG H B 33 ARG HE 1.0 1.968 7.050 2483 1891 A 32 ARG H A 32 ARG HE 1.0 1.999 6.157 2484 1892 B 32 ARG H B 32 ARG HE 1.0 1.999 6.157 2485 1893 A 41 LEU H A 40 GLY H 1.0 1.792 3.626 2486 1894 B 41 LEU H B 40 GLY H 1.0 1.792 3.626 2487 1895 A 40 GLY H A 39 LEU H 1.0 1.844 3.924 2488 1896 B 40 GLY H B 39 LEU H 1.0 1.844 3.924 2489 1897 A 41 LEU H A 8 GLU H 1.0 0.000 6.000 2490 1898 B 41 LEU H B 8 GLU H 1.0 0.000 6.000 2491 1899 A 23 PHE HA A 24 ASP H 1.0 1.989 5.417 2492 1900 B 23 PHE HA B 24 ASP H 1.0 1.989 5.417 2493 1901 A 39 LEU HDx% A 38 ARG H 1.0 1.993 5.537 2494 1902 B 39 LEU HD11 B 38 ARG H 1.0 1.993 5.537 2495 1903 A 37 GLN HA A 38 ARG H 1.0 1.980 5.216 2496 1904 B 37 GLN HA B 38 ARG H 1.0 1.980 5.216 2497 1905 A 66 LYS H A 66 LYS HA 1.0 1.752 3.430 2498 1906 B 66 LYS H B 66 LYS HA 1.0 1.752 3.430 2499 1907 A 65 GLU HBy A 66 LYS H 1.0 0.000 6.000 2500 1908 B 65 GLU HBy B 66 LYS H 1.0 0.000 6.000 2501 1909 A 66 LYS H A 66 LYS HBy 1.0 1.736 3.360 2502 1910 B 66 LYS H B 66 LYS HBx 1.0 1.736 3.360 2503 1911 A 66 LYS H A 65 GLU HGy 1.0 1.936 4.630 2504 1912 B 66 LYS H B 65 GLU HGy 1.0 1.936 4.630 2505 1913 A 66 LYS H A 65 GLU HBx 1.0 0.000 6.000 2506 1914 B 66 LYS H B 65 GLU HBx 1.0 0.000 6.000 2507 1915 A 64 PHE HA A 66 LYS H 1.0 1.992 5.490 2508 1916 B 64 PHE HA B 66 LYS H 1.0 1.992 5.490 2509 1917 A 64 PHE HBx A 66 LYS H 1.0 1.986 5.366 2510 1918 B 64 PHE HBx B 66 LYS H 1.0 1.986 5.366 2511 1919 A 66 LYS HGx A 66 LYS H 1.0 1.861 4.031 2512 1920 B 66 LYS HGy B 66 LYS H 1.0 1.861 4.031 2513 1921 A 4 ARG HGx A 8 GLU H 1.0 1.953 4.819 2514 1922 B 4 ARG HGx B 8 GLU H 1.0 1.953 4.819 2515 1923 A 9 PHE H A 8 GLU H 1.0 1.694 3.176 2516 1924 B 9 PHE H B 8 GLU H 1.0 1.694 3.176 2517 1925 A 4 ARG HA A 8 GLU H 1.0 0.000 6.000 2518 1926 B 4 ARG HA B 8 GLU H 1.0 0.000 6.000 2519 1927 A 27 LEU H A 31 TRP HA 1.0 0.000 6.000 2520 1928 B 27 LEU H B 31 TRP HA 1.0 0.000 6.000 2521 1929 A 4 ARG HA A 3 LYS H 1.0 0.000 6.000 2522 1930 B 4 ARG HA B 3 LYS H 1.0 0.000 6.000 2523 1931 A 3 LYS HGx A 3 LYS H 1.0 1.968 5.016 2524 1932 B 3 LYS HGy B 3 LYS H 1.0 1.968 5.016 2525 1933 A 3 LYS H A 3 LYS HBy 1.0 1.834 3.858 2526 1934 B 3 LYS H B 3 LYS HBy 1.0 1.834 3.858 2527 1935 A 27 LEU H A 24 ASP H 1.0 0.000 6.000 2528 1936 B 27 LEU H B 24 ASP H 1.0 0.000 6.000 2529 1937 A 65 GLU H A 66 LYS HBy 1.0 1.976 5.144 2530 1938 B 65 GLU H B 66 LYS HBx 1.0 1.976 5.144 2531 1939 A 26 ARG HBy A 26 ARG H 1.0 1.978 5.182 2532 1940 B 26 ARG HBx B 26 ARG H 1.0 1.978 5.182 2533 1941 A 64 PHE HDx A 65 GLU H 1.0 1.968 5.018 2534 1942 B 64 PHE HDx B 65 GLU H 1.0 1.968 5.018 2535 1943 A 65 GLU H A 64 PHE HBx 1.0 1.782 3.578 2536 1944 B 65 GLU H B 64 PHE HBx 1.0 1.782 3.578 2537 1945 A 65 GLU H A 64 PHE HBy 1.0 1.821 3.783 2538 1946 B 65 GLU H B 64 PHE HBy 1.0 1.821 3.783 2539 1947 A 64 PHE HA A 65 GLU H 1.0 0.000 6.000 2540 1948 B 64 PHE HA B 65 GLU H 1.0 0.000 6.000 2541 1949 B 19 LEU HA A 26 ARG H 1.0 0.000 6.000 2542 1950 A 19 LEU HA B 26 ARG H 1.0 0.000 6.000 2543 1951 A 65 GLU HA A 65 GLU H 1.0 1.682 3.130 2544 1952 B 65 GLU HA B 65 GLU H 1.0 1.682 3.130 2545 1953 A 4 ARG HA A 4 ARG H 1.0 1.702 3.210 2546 1954 B 4 ARG HA B 4 ARG H 1.0 1.702 3.210 2547 1955 A 4 ARG H A 10 SER HBx 1.0 1.936 4.632 2548 1956 B 4 ARG H B 10 SER HBy 1.0 1.936 4.632 2549 1957 A 8 GLU H A 8 GLU HA 1.0 1.655 3.021 2550 1958 B 8 GLU H B 8 GLU HA 1.0 1.655 3.021 2551 1959 A 10 SER HBy A 4 ARG H 1.0 1.989 5.409 2552 1960 B 10 SER HBx B 4 ARG H 1.0 1.989 5.409 2553 1961 A 8 GLU HBx A 8 GLU H 1.0 0.000 6.000 2554 1962 B 8 GLU HBx B 8 GLU H 1.0 0.000 6.000 2555 1963 A 4 ARG H A 4 ARG HBy 1.0 1.645 2.985 2556 1964 B 4 ARG H B 4 ARG HBx 1.0 1.645 2.985 2557 1965 A 12 GLU H A 4 ARG H 1.0 0.000 6.000 2558 1966 B 12 GLU H B 4 ARG H 1.0 0.000 6.000 2559 1967 A 42 ASN H A 8 GLU H 1.0 0.000 6.000 2560 1968 B 42 ASN H B 8 GLU H 1.0 0.000 6.000 2561 1969 A 4 ARG HA A 2 GLU H 1.0 0.000 6.000 2562 1970 B 4 ARG HA B 2 GLU H 1.0 0.000 6.000 2563 1971 A 2 GLU HBx A 3 LYS H 1.0 1.991 5.487 2564 1972 B 2 GLU HBy B 3 LYS H 1.0 1.991 5.487 2565 1973 A 2 GLU HA A 3 LYS H 1.0 0.000 6.000 2566 1974 B 2 GLU HA B 3 LYS H 1.0 0.000 6.000 2567 1975 A 9 PHE HBy A 8 GLU H 1.0 1.978 5.182 2568 1976 B 9 PHE HBx B 8 GLU H 1.0 1.978 5.182 2569 1977 A 11 GLU H A 13 GLN HGx 1.0 0.000 6.000 2570 1978 B 11 GLU H B 13 GLN HGx 1.0 0.000 6.000 2571 1979 A 12 GLU HBy A 11 GLU H 1.0 1.937 4.641 2572 1980 B 12 GLU HBx B 11 GLU H 1.0 1.937 4.641 2573 1981 A 14 LYS H A 11 GLU H 1.0 1.995 5.631 2574 1982 B 14 LYS H B 11 GLU H 1.0 1.995 5.631 2575 1983 A 13 GLN H A 11 GLU H 1.0 1.989 5.413 2576 1984 B 13 GLN H B 11 GLU H 1.0 1.989 5.413 2577 1985 A 53 LYS H A 52 ARG HE 1.0 1.983 5.279 2578 1986 B 53 LYS H B 52 ARG HE 1.0 1.983 5.279 2579 1987 A 53 LYS H A 54 GLU HA 1.0 0.000 6.000 2580 1988 B 53 LYS H B 54 GLU HA 1.0 0.000 6.000 2581 1989 A 16 ALA H A 13 GLN HA 1.0 1.978 5.184 2582 1990 B 16 ALA H B 13 GLN HA 1.0 1.978 5.184 2583 1991 A 53 LYS H A 53 LYS HDx 1.0 1.978 5.190 2584 1992 B 53 LYS H B 53 LYS HDy 1.0 1.978 5.190 2585 1993 A 53 LYS H A 53 LYS HBx 1.0 1.818 3.770 2586 1994 B 53 LYS H B 53 LYS HBy 1.0 1.818 3.770 2587 1995 A 53 LYS H A 53 LYS HBy 1.0 1.840 3.900 2588 1996 B 53 LYS H B 53 LYS HBx 1.0 1.840 3.900 2589 1997 A 53 LYS H A 53 LYS HGx 1.0 1.939 4.663 2590 1998 B 53 LYS H B 53 LYS HGx 1.0 1.939 4.663 2591 1999 A 53 LYS H A 53 LYS HGy 1.0 1.959 4.891 2592 2000 B 53 LYS H B 53 LYS HGy 1.0 1.959 4.891 2593 2001 A 53 LYS H A 54 GLU HGx 1.0 1.989 5.433 2594 2002 B 53 LYS H B 54 GLU HGy 1.0 1.989 5.433 2595 2003 A 53 LYS H A 55 GLN HBy 1.0 1.973 5.105 2596 2004 B 53 LYS H B 55 GLN HBx 1.0 1.973 5.105 2597 2005 A 53 LYS H A 52 ARG HBy 1.0 1.771 3.523 2598 2006 B 53 LYS H B 52 ARG HBx 1.0 1.771 3.523 2599 2007 A 53 LYS H A 52 ARG HGy 1.0 1.969 5.033 2600 2008 B 53 LYS H B 52 ARG HGx 1.0 1.969 5.033 2601 2009 A 15 LYS HBx A 16 ALA H 1.0 1.800 3.674 2602 2010 B 15 LYS HBx B 16 ALA H 1.0 1.800 3.674 2603 2011 A 16 ALA H A 17 LEU HG 1.0 0.000 6.000 2604 2012 B 16 ALA H B 17 LEU HG 1.0 0.000 6.000 2605 2013 A 17 LEU HBx A 16 ALA H 1.0 1.963 4.953 2606 2014 B 17 LEU HBy B 16 ALA H 1.0 1.963 4.953 2607 2015 A 15 LYS H A 16 ALA H 1.0 1.808 3.714 2608 2016 B 15 LYS H B 16 ALA H 1.0 1.808 3.714 2609 2017 A 53 LYS H A 51 ARG H 1.0 1.965 4.975 2610 2018 B 53 LYS H B 51 ARG H 1.0 1.965 4.975 2611 2019 A 53 LYS H A 55 GLN H 1.0 1.906 4.364 2612 2020 B 53 LYS H B 55 GLN H 1.0 1.906 4.364 2613 2021 A 44 GLU HA A 43 GLU H 1.0 1.997 5.683 2614 2022 B 44 GLU HA B 43 GLU H 1.0 1.997 5.683 2615 2023 A 36 SER HBy A 43 GLU H 1.0 1.967 4.999 2616 2024 B 36 SER HBy B 43 GLU H 1.0 1.967 4.999 2617 2025 A 42 ASN HBx A 43 GLU H 1.0 1.840 3.894 2618 2026 B 42 ASN HBy B 43 GLU H 1.0 1.840 3.894 2619 2027 A 42 ASN HBy A 43 GLU H 1.0 1.882 4.174 2620 2028 B 42 ASN HBx B 43 GLU H 1.0 1.882 4.174 2621 2029 A 44 GLU HGy A 43 GLU H 1.0 0.000 6.000 2622 2030 B 44 GLU HGy B 43 GLU H 1.0 0.000 6.000 2623 2031 A 43 GLU HBx A 43 GLU H 1.0 1.806 3.704 2624 2032 B 43 GLU HBx B 43 GLU H 1.0 1.806 3.704 2625 2033 A 46 ILE HG1x A 43 GLU H 1.0 1.997 5.699 2626 2034 B 46 ILE HG1y B 43 GLU H 1.0 1.997 5.699 2627 2035 A 63 GLN H A 63 GLN HBy 1.0 1.605 2.843 2628 2036 B 63 GLN H B 63 GLN HBy 1.0 1.605 2.843 2629 2037 A 25 ARG H A 25 ARG HBx 1.0 1.998 5.728 2630 2038 B 25 ARG H B 25 ARG HBx 1.0 1.998 5.728 2631 2039 A 62 PRO HDx A 63 GLN H 1.0 1.974 5.116 2632 2040 B 62 PRO HDx B 63 GLN H 1.0 1.974 5.116 2633 2041 A 62 PRO HDy A 63 GLN H 1.0 1.939 4.669 2634 2042 B 62 PRO HDy B 63 GLN H 1.0 1.939 4.669 2635 2043 A 63 GLN H A 61 HIS HBy 1.0 1.998 5.738 2636 2044 B 63 GLN H B 61 HIS HBx 1.0 1.998 5.738 2637 2045 A 5 PRO HA A 6 ARG H 1.0 0.000 6.000 2638 2046 B 5 PRO HA B 6 ARG H 1.0 0.000 6.000 2639 2047 A 4 ARG HA A 6 ARG H 1.0 0.000 6.000 2640 2048 B 4 ARG HA B 6 ARG H 1.0 0.000 6.000 2641 2049 A 39 LEU HDy% A 49 TRP H 1.0 0.000 6.000 2642 2050 B 39 LEU HD21 B 49 TRP H 1.0 0.000 6.000 2643 2051 A 48 ARG HBy A 49 TRP H 1.0 1.783 3.581 2644 2052 B 48 ARG HBx B 49 TRP H 1.0 1.783 3.581 2645 2053 A 48 ARG HGy A 49 TRP H 1.0 1.953 4.829 2646 2054 B 48 ARG HGx B 49 TRP H 1.0 1.953 4.829 2647 2055 A 65 GLU H A 65 GLU HGy 1.0 1.760 3.466 2648 2056 B 65 GLU H B 65 GLU HGy 1.0 1.760 3.466 2649 2057 A 65 GLU H A 65 GLU HBx 1.0 0.000 6.000 2650 2058 B 65 GLU H B 65 GLU HBx 1.0 0.000 6.000 2651 2059 A 65 GLU HBy A 65 GLU H 1.0 1.637 2.953 2652 2060 B 65 GLU HBy B 65 GLU H 1.0 1.637 2.953 2653 2061 A 59 TRP H A 55 GLN H 1.0 1.960 4.906 2654 2062 B 59 TRP H B 55 GLN H 1.0 1.960 4.906 2655 2063 A 58 GLY HAy A 59 TRP H 1.0 0.000 6.000 2656 2064 B 58 GLY HAy B 59 TRP H 1.0 0.000 6.000 2657 2065 A 59 TRP H A 60 SER HA 1.0 1.992 5.508 2658 2066 B 59 TRP H B 60 SER HA 1.0 1.992 5.508 2659 2067 A 62 PRO HDy A 59 TRP H 1.0 1.991 5.465 2660 2068 B 62 PRO HDy B 59 TRP H 1.0 1.991 5.465 2661 2069 A 59 TRP H A 59 TRP HBy 1.0 0.000 6.000 2662 2070 B 59 TRP H B 59 TRP HBx 1.0 0.000 6.000 2663 2071 A 59 TRP H A 61 HIS HBy 1.0 0.000 6.000 2664 2072 B 59 TRP H B 61 HIS HBx 1.0 0.000 6.000 2665 2073 A 54 GLU HBx A 59 TRP H 1.0 1.998 5.744 2666 2074 B 54 GLU HBx B 59 TRP H 1.0 1.998 5.744 2667 2075 A 59 TRP H A 54 GLU HBy 1.0 1.991 5.459 2668 2076 B 59 TRP H B 54 GLU HBy 1.0 1.991 5.459 2669 2077 A 57 ILE HG1x A 59 TRP H 1.0 1.899 4.305 2670 2078 B 57 ILE HG1y B 59 TRP H 1.0 1.899 4.305 2671 2079 A 59 TRP H A 57 ILE HG1y 1.0 1.959 4.903 2672 2080 B 59 TRP H B 57 ILE HG1x 1.0 1.959 4.903 2673 2081 A 57 ILE HG2% A 59 TRP H 1.0 1.891 4.243 2674 2082 B 57 ILE HG21 B 59 TRP H 1.0 1.891 4.243 2675 2083 A 49 TRP HBy A 50 PHE H 1.0 1.917 4.455 2676 2084 B 49 TRP HBx B 50 PHE H 1.0 1.917 4.455 2677 2085 A 9 PHE HBx A 10 SER H 1.0 1.950 4.784 2678 2086 B 9 PHE HBy B 10 SER H 1.0 1.950 4.784 2679 2087 A 9 PHE HBy A 10 SER H 1.0 1.980 5.222 2680 2088 B 9 PHE HBx B 10 SER H 1.0 1.980 5.222 2681 2089 A 13 GLN HBx A 10 SER H 1.0 1.923 4.511 2682 2090 B 13 GLN HBx B 10 SER H 1.0 1.923 4.511 2683 2091 A 63 GLN HGy A 63 GLN H 1.0 1.729 3.325 2684 2092 B 63 GLN HGy B 63 GLN H 1.0 1.729 3.325 2685 2093 A 5 PRO HBx A 6 ARG H 1.0 1.816 3.758 2686 2094 B 5 PRO HBy B 6 ARG H 1.0 1.816 3.758 2687 2095 A 63 GLN H A 62 PRO HBy 1.0 0.000 6.000 2688 2096 B 63 GLN H B 62 PRO HBx 1.0 0.000 6.000 2689 2097 A 6 ARG HGx A 6 ARG H 1.0 1.741 3.377 2690 2098 B 6 ARG HGx B 6 ARG H 1.0 1.741 3.377 2691 2099 A 6 ARG HBy A 6 ARG H 1.0 1.548 2.650 2692 2100 B 6 ARG HBy B 6 ARG H 1.0 1.548 2.650 2693 2101 A 52 ARG HBx A 49 TRP H 1.0 1.966 4.998 2694 2102 B 52 ARG HBy B 49 TRP H 1.0 1.966 4.998 2695 2103 A 57 ILE HG1x A 61 HIS H 1.0 1.998 5.760 2696 2104 B 57 ILE HG1y B 61 HIS H 1.0 1.998 5.760 2697 2105 A 14 LYS HGx A 17 LEU H 1.0 0.000 6.000 2698 2106 B 14 LYS HGx B 17 LEU H 1.0 0.000 6.000 2699 2107 A 61 HIS H A 57 ILE HG2% 1.0 1.982 5.248 2700 2108 B 61 HIS H B 57 ILE HG21 1.0 1.982 5.248 2701 2109 A 17 LEU HDx% A 17 LEU H 1.0 1.927 4.545 2702 2110 B 17 LEU HD11 B 17 LEU H 1.0 1.927 4.545 2703 2111 A 61 HIS H A 54 GLU HBy 1.0 1.984 5.300 2704 2112 B 61 HIS H B 54 GLU HBy 1.0 1.984 5.300 2705 2113 A 14 LYS HA A 17 LEU H 1.0 1.932 4.596 2706 2114 B 14 LYS HA B 17 LEU H 1.0 1.932 4.596 2707 2115 A 61 HIS H A 61 HIS HBy 1.0 1.716 3.268 2708 2116 B 61 HIS H B 61 HIS HBx 1.0 1.716 3.268 2709 2117 A 60 SER HBy A 61 HIS H 1.0 0.000 6.000 2710 2118 B 60 SER HBx B 61 HIS H 1.0 0.000 6.000 2711 2119 A 61 HIS H A 61 HIS HA 1.0 1.684 3.134 2712 2120 B 61 HIS H B 61 HIS HA 1.0 1.684 3.134 2713 2121 A 61 HIS H A 60 SER HG 1.0 1.710 3.244 2714 2122 B 61 HIS H B 60 SER HG 1.0 1.710 3.244 2715 2123 A 61 HIS H A 60 SER HA 1.0 0.000 6.000 2716 2124 B 61 HIS H B 60 SER HA 1.0 0.000 6.000 2717 2125 A 61 HIS H A 60 SER H 1.0 1.775 3.539 2718 2126 B 61 HIS H B 60 SER H 1.0 1.775 3.539 2719 2127 A 45 GLN H A 49 TRP H 1.0 0.000 6.000 2720 2128 B 45 GLN H B 49 TRP H 1.0 0.000 6.000 2721 2129 A 52 ARG H A 49 TRP H 1.0 1.945 4.737 2722 2130 B 52 ARG H B 49 TRP H 1.0 1.945 4.737 2723 2131 A 64 PHE H A 64 PHE HBx 1.0 0.000 6.000 2724 2132 B 64 PHE H B 64 PHE HBx 1.0 0.000 6.000 2725 2133 A 64 PHE H A 64 PHE HBy 1.0 1.613 2.869 2726 2134 B 64 PHE H B 64 PHE HBy 1.0 1.613 2.869 2727 2135 A 64 PHE H A 63 GLN HBy 1.0 0.000 6.000 2728 2136 B 64 PHE H B 63 GLN HBy 1.0 0.000 6.000 2729 2137 A 64 PHE H A 62 PRO HBy 1.0 0.000 6.000 2730 2138 B 64 PHE H B 62 PRO HBx 1.0 0.000 6.000 2731 2139 A 64 PHE HA A 64 PHE H 1.0 1.613 2.867 2732 2140 B 64 PHE HA B 64 PHE H 1.0 1.613 2.867 2733 2141 A 34 TYR H A 33 ARG HGx 1.0 1.932 4.596 2734 2142 B 34 TYR H B 33 ARG HGx 1.0 1.932 4.596 2735 2143 A 18 ASP H A 17 LEU HBx 1.0 1.977 5.175 2736 2144 B 18 ASP H B 17 LEU HBy 1.0 1.977 5.175 2737 2145 A 13 GLN H A 13 GLN HGy 1.0 1.880 4.160 2738 2146 B 13 GLN H B 13 GLN HGy 1.0 1.880 4.160 2739 2147 A 13 GLN H A 13 GLN HBx 1.0 1.762 3.482 2740 2148 B 13 GLN H B 13 GLN HBx 1.0 1.762 3.482 2741 2149 A 9 PHE HA A 13 GLN H 1.0 1.963 4.957 2742 2150 B 9 PHE HA B 13 GLN H 1.0 1.963 4.957 2743 2151 A 4 ARG HA A 13 GLN H 1.0 0.000 6.000 2744 2152 B 4 ARG HA B 13 GLN H 1.0 0.000 6.000 2745 2153 A 13 GLN H A 10 SER H 1.0 1.944 4.714 2746 2154 B 13 GLN H B 10 SER H 1.0 1.944 4.714 2747 2155 A 13 GLN H A 14 LYS H 1.0 1.837 3.875 2748 2156 B 13 GLN H B 14 LYS H 1.0 1.837 3.875 2749 2157 A 13 GLN H A 17 LEU H 1.0 0.000 6.000 2750 2158 B 13 GLN H B 17 LEU H 1.0 0.000 6.000 2751 2159 A 50 PHE H A 49 TRP H 1.0 1.862 4.034 2752 2160 B 50 PHE H B 49 TRP H 1.0 1.862 4.034 2753 2161 A 10 SER H A 10 SER HA 1.0 1.950 4.780 2754 2162 B 10 SER H B 10 SER HA 1.0 1.950 4.780 2755 2163 A 10 SER H A 10 SER HBx 1.0 1.985 5.333 2756 2164 B 10 SER H B 10 SER HBy 1.0 1.985 5.333 2757 2165 A 41 LEU HG A 42 ASN H 1.0 0.000 6.000 2758 2166 B 41 LEU HG B 42 ASN H 1.0 0.000 6.000 2759 2167 A 41 LEU HBy A 42 ASN H 1.0 1.924 4.516 2760 2168 B 41 LEU HBx B 42 ASN H 1.0 1.924 4.516 2761 2169 A 42 ASN H A 41 LEU HDy% 1.0 1.931 4.579 2762 2170 B 42 ASN H B 41 LEU HD21 1.0 1.931 4.579 2763 2171 A 42 ASN HBx A 42 ASN H 1.0 1.842 3.906 2764 2172 B 42 ASN HBy B 42 ASN H 1.0 1.842 3.906 2765 2173 A 42 ASN HBy A 42 ASN H 1.0 1.870 4.096 2766 2174 B 42 ASN HBx B 42 ASN H 1.0 1.870 4.096 2767 2175 A 45 GLN HBx A 42 ASN H 1.0 0.000 6.000 2768 2176 B 45 GLN HBx B 42 ASN H 1.0 0.000 6.000 2769 2177 A 45 GLN HBy A 42 ASN H 1.0 1.938 4.646 2770 2178 B 45 GLN HBy B 42 ASN H 1.0 1.938 4.646 2771 2179 A 41 LEU HA A 42 ASN H 1.0 1.672 3.088 2772 2180 B 41 LEU HA B 42 ASN H 1.0 1.672 3.088 2773 2181 A 45 GLN H A 44 GLU H 1.0 1.797 3.655 2774 2182 B 45 GLN H B 44 GLU H 1.0 1.797 3.655 2775 2183 A 21 PHE HBx A 21 PHE H 1.0 1.998 5.748 2776 2184 B 21 PHE HBx B 21 PHE H 1.0 1.998 5.748 2777 2185 A 44 GLU HGy A 44 GLU H 1.0 1.828 3.828 2778 2186 B 44 GLU HGy B 44 GLU H 1.0 1.828 3.828 2779 2187 A 36 SER HBy A 44 GLU H 1.0 0.000 6.000 2780 2188 B 36 SER HBy B 44 GLU H 1.0 0.000 6.000 2781 2189 A 44 GLU H A 44 GLU HBx 1.0 1.613 2.869 2782 2190 B 44 GLU H B 44 GLU HBx 1.0 1.613 2.869 2783 2191 A 43 GLU HBx A 44 GLU H 1.0 0.000 6.000 2784 2192 B 43 GLU HBx B 44 GLU H 1.0 0.000 6.000 2785 2193 A 46 ILE HA A 47 GLU H 1.0 1.887 4.209 2786 2194 B 46 ILE HA B 47 GLU H 1.0 1.887 4.209 2787 2195 A 47 GLU H A 32 ARG HA 1.0 0.000 6.000 2788 2196 B 47 GLU H B 32 ARG HA 1.0 0.000 6.000 2789 2197 A 48 ARG HDx A 47 GLU H 1.0 1.958 4.882 2790 2198 B 48 ARG HDy B 47 GLU H 1.0 1.958 4.882 2791 2199 A 47 GLU H A 46 ILE HG1y 1.0 1.966 4.986 2792 2200 B 47 GLU H B 46 ILE HG1x 1.0 1.966 4.986 2793 2201 A 63 GLN H A 64 PHE H 1.0 1.704 3.220 2794 2202 B 63 GLN H B 64 PHE H 1.0 1.704 3.220 2795 2203 A 10 SER HBy A 10 SER H 1.0 1.959 4.897 2796 2204 B 10 SER HBx B 10 SER H 1.0 1.959 4.897 2797 2205 A 46 ILE HG1x A 46 ILE H 1.0 0.000 6.000 2798 2206 B 46 ILE HG1y B 46 ILE H 1.0 0.000 6.000 2799 2207 A 46 ILE HG1y A 46 ILE H 1.0 1.959 4.897 2800 2208 B 46 ILE HG1x B 46 ILE H 1.0 1.959 4.897 2801 2209 A 45 GLN HA A 46 ILE H 1.0 1.988 5.404 2802 2210 B 45 GLN HA B 46 ILE H 1.0 1.988 5.404 2803 2211 A 47 GLU H A 46 ILE H 1.0 1.937 4.643 2804 2212 B 47 GLU H B 46 ILE H 1.0 1.937 4.643 2805 2213 A 41 LEU HA A 41 LEU H 1.0 1.884 4.188 2806 2214 B 41 LEU HA B 41 LEU H 1.0 1.884 4.188 2807 2215 A 41 LEU H A 42 ASN H 1.0 1.988 5.384 2808 2216 B 41 LEU H B 42 ASN H 1.0 1.988 5.384 2809 2217 A 41 LEU H A 39 LEU H 1.0 1.989 5.427 2810 2218 B 41 LEU H B 39 LEU H 1.0 1.989 5.427 2811 2219 A 32 ARG HBx A 32 ARG H 1.0 1.849 3.955 2812 2220 B 32 ARG HBy B 32 ARG H 1.0 1.849 3.955 2813 2221 A 32 ARG HBy A 32 ARG H 1.0 1.853 3.977 2814 2222 B 32 ARG HBx B 32 ARG H 1.0 1.853 3.977 2815 2223 A 27 LEU HDx% A 32 ARG H 1.0 1.988 5.396 2816 2224 B 27 LEU HD11 B 32 ARG H 1.0 1.988 5.396 2817 2225 A 32 ARG HDx A 32 ARG H 1.0 1.987 5.379 2818 2226 B 32 ARG HDx B 32 ARG H 1.0 1.987 5.379 2819 2227 A 32 ARG H A 30 GLU HBx 1.0 1.997 5.677 2820 2228 B 32 ARG H B 30 GLU HBy 1.0 1.997 5.677 2821 2229 A 35 LEU H A 35 LEU HBy 1.0 1.946 4.734 2822 2230 B 35 LEU H B 35 LEU HBy 1.0 1.946 4.734 2823 2231 A 39 LEU HDy% A 35 LEU H 1.0 1.977 5.163 2824 2232 B 39 LEU HD21 B 35 LEU H 1.0 1.977 5.163 2825 2233 A 35 LEU HDy% A 35 LEU H 1.0 1.959 4.891 2826 2234 B 35 LEU HD21 B 35 LEU H 1.0 1.959 4.891 2827 2235 A 35 LEU HBx A 35 LEU H 1.0 1.904 4.342 2828 2236 B 35 LEU HBx B 35 LEU H 1.0 1.904 4.342 2829 2237 A 35 LEU H A 34 TYR HBx 1.0 1.894 4.260 2830 2238 B 35 LEU H B 34 TYR HBy 1.0 1.894 4.260 2831 2239 A 34 TYR HBy A 35 LEU H 1.0 1.947 4.745 2832 2240 B 34 TYR HBx B 35 LEU H 1.0 1.947 4.745 2833 2241 A 34 TYR HDx A 35 LEU H 1.0 1.947 4.753 2834 2242 B 34 TYR HDx B 35 LEU H 1.0 1.947 4.753 2835 2243 A 34 TYR H A 35 LEU H 1.0 1.957 4.861 2836 2244 B 34 TYR H B 35 LEU H 1.0 1.957 4.861 2837 2245 A 32 ARG H A 31 TRP H 1.0 1.909 4.383 2838 2246 B 32 ARG H B 31 TRP H 1.0 1.909 4.383 2839 2247 A 33 ARG H A 32 ARG H 1.0 1.919 4.469 2840 2248 B 33 ARG H B 32 ARG H 1.0 1.919 4.469 2841 2249 A 44 GLU H A 47 GLU H 1.0 1.969 5.035 2842 2250 B 44 GLU H B 47 GLU H 1.0 1.969 5.035 2843 2251 A 61 HIS H A 63 GLN H 1.0 0.000 6.000 2844 2252 B 61 HIS H B 63 GLN H 1.0 0.000 6.000 2845 2253 A 45 GLN H A 42 ASN H 1.0 1.969 5.027 2846 2254 B 45 GLN H B 42 ASN H 1.0 1.969 5.027 2847 2255 A 9 PHE H A 10 SER H 1.0 1.931 4.589 2848 2256 B 9 PHE H B 10 SER H 1.0 1.931 4.589 2849 2257 A 18 ASP H A 17 LEU H 1.0 1.815 3.749 2850 2258 B 18 ASP H B 17 LEU H 1.0 1.815 3.749 2851 2259 A 16 ALA H A 17 LEU H 1.0 1.832 3.850 2852 2260 B 16 ALA H B 17 LEU H 1.0 1.832 3.850 2853 2261 A 45 GLN H A 46 ILE HG2% 1.0 0.000 6.000 2854 2262 B 45 GLN H B 46 ILE HG21 1.0 0.000 6.000 2855 2263 A 46 ILE HD1% A 45 GLN H 1.0 1.987 5.355 2856 2264 B 46 ILE HD11 B 45 GLN H 1.0 1.987 5.355 2857 2265 A 46 ILE HA A 45 GLN H 1.0 0.000 6.000 2858 2266 B 46 ILE HA B 45 GLN H 1.0 0.000 6.000 2859 2267 A 45 GLN HA A 45 GLN H 1.0 1.772 3.526 2860 2268 B 45 GLN HA B 45 GLN H 1.0 1.772 3.526 2861 2269 A 54 GLU HBx A 55 GLN H 1.0 1.753 3.437 2862 2270 B 54 GLU HBx B 55 GLN H 1.0 1.753 3.437 2863 2271 A 55 GLN HBy A 55 GLN H 1.0 1.608 2.850 2864 2272 B 55 GLN HBx B 55 GLN H 1.0 1.608 2.850 2865 2273 A 53 LYS HA A 55 GLN H 1.0 1.982 5.264 2866 2274 B 53 LYS HA B 55 GLN H 1.0 1.982 5.264 2867 2275 A 47 GLU HGy A 48 ARG H 1.0 1.870 4.092 2868 2276 B 47 GLU HGy B 48 ARG H 1.0 1.870 4.092 2869 2277 A 51 ARG HGx A 48 ARG H 1.0 0.000 6.000 2870 2277 A 51 ARG HGy A 48 ARG H 1.0 0.000 6.000 2871 2278 B 51 ARG HGx B 48 ARG H 1.0 0.000 6.000 2872 2278 B 51 ARG HGy B 48 ARG H 1.0 0.000 6.000 2873 2279 A 49 TRP HBx A 48 ARG H 1.0 1.996 5.652 2874 2280 B 49 TRP HBy B 48 ARG H 1.0 1.996 5.652 2875 2281 A 9 PHE HBx A 14 LYS H 1.0 1.962 4.940 2876 2282 B 9 PHE HBy B 14 LYS H 1.0 1.962 4.940 2877 2283 A 9 PHE HBy A 14 LYS H 1.0 1.989 5.409 2878 2284 B 9 PHE HBx B 14 LYS H 1.0 1.989 5.409 2879 2285 A 13 GLN HBx A 14 LYS H 1.0 1.916 4.446 2880 2286 B 13 GLN HBx B 14 LYS H 1.0 1.916 4.446 2881 2287 A 45 GLN H A 46 ILE HG1x 1.0 1.972 5.078 2882 2288 B 45 GLN H B 46 ILE HG1y 1.0 1.972 5.078 2883 2289 A 27 LEU HDy% A 28 THR H 1.0 1.956 4.862 2884 2290 B 27 LEU HD21 B 28 THR H 1.0 1.956 4.862 2885 2291 A 53 LYS HBy A 54 GLU H 1.0 1.926 4.536 2886 2292 B 53 LYS HBx B 54 GLU H 1.0 1.926 4.536 2887 2293 A 54 GLU H A 53 LYS HGx 1.0 1.992 5.494 2888 2294 B 54 GLU H B 53 LYS HGx 1.0 1.992 5.494 2889 2295 A 7 THR HG2% A 9 PHE H 1.0 0.000 6.000 2890 2296 B 7 THR HG21 B 9 PHE H 1.0 0.000 6.000 2891 2297 A 54 GLU H A 53 LYS HBx 1.0 1.857 4.009 2892 2298 B 54 GLU H B 53 LYS HBy 1.0 1.857 4.009 2893 2299 A 9 PHE H A 41 LEU HDx% 1.0 1.994 5.562 2894 2300 B 9 PHE H B 41 LEU HD11 1.0 1.994 5.562 2895 2301 A 9 PHE H A 45 GLN HBx 1.0 1.954 4.834 2896 2302 B 9 PHE H B 45 GLN HBx 1.0 1.954 4.834 2897 2303 A 9 PHE H A 13 GLN HGy 1.0 1.987 5.351 2898 2304 B 9 PHE H B 13 GLN HGy 1.0 1.987 5.351 2899 2305 A 54 GLU HBx A 54 GLU H 1.0 1.748 3.412 2900 2306 B 54 GLU HBx B 54 GLU H 1.0 1.748 3.412 2901 2307 A 54 GLU H A 63 GLN HBy 1.0 0.000 6.000 2902 2308 B 54 GLU H B 63 GLN HBy 1.0 0.000 6.000 2903 2309 A 8 GLU HBx A 9 PHE H 1.0 0.000 6.000 2904 2310 B 8 GLU HBx B 9 PHE H 1.0 0.000 6.000 2905 2311 A 9 PHE HBx A 9 PHE H 1.0 0.000 6.000 2906 2312 B 9 PHE HBy B 9 PHE H 1.0 0.000 6.000 2907 2313 A 9 PHE HBy A 9 PHE H 1.0 1.735 3.353 2908 2314 B 9 PHE HBx B 9 PHE H 1.0 1.735 3.353 2909 2315 A 45 GLN H A 42 ASN HBx 1.0 1.960 4.902 2910 2316 B 45 GLN H B 42 ASN HBy 1.0 1.960 4.902 2911 2317 A 45 GLN H A 42 ASN HA 1.0 1.982 5.270 2912 2318 B 45 GLN H B 42 ASN HA 1.0 1.982 5.270 2913 2319 A 56 GLN H A 55 GLN H 1.0 1.716 3.272 2914 2320 B 56 GLN H B 55 GLN H 1.0 1.716 3.272 2915 2321 A 32 ARG H A 28 THR H 1.0 1.978 5.180 2916 2322 B 32 ARG H B 28 THR H 1.0 1.978 5.180 2917 2323 A 28 THR H A 32 ARG HE 1.0 1.943 4.707 2918 2324 B 28 THR H B 32 ARG HE 1.0 1.943 4.707 2919 2325 A 51 ARG H A 50 PHE H 1.0 1.890 4.232 2920 2326 B 51 ARG H B 50 PHE H 1.0 1.890 4.232 2921 2327 A 12 GLU H A 11 GLU H 1.0 1.804 3.694 2922 2328 B 12 GLU H B 11 GLU H 1.0 1.804 3.694 2923 2329 A 44 GLU H A 43 GLU H 1.0 1.851 3.965 2924 2330 B 44 GLU H B 43 GLU H 1.0 1.851 3.965 2925 2331 A 55 GLN H A 53 LYS HBx 1.0 1.996 5.672 2926 2332 B 55 GLN H B 53 LYS HBy 1.0 1.996 5.672 2927 2333 A 33 ARG H A 30 GLU HA 1.0 1.941 4.687 2928 2334 B 33 ARG H B 30 GLU HA 1.0 1.941 4.687 2929 2335 A 44 GLU HA A 47 GLU H 1.0 1.834 3.862 2930 2336 B 44 GLU HA B 47 GLU H 1.0 1.834 3.862 2931 2337 A 47 GLU H A 47 GLU HA 1.0 1.814 3.746 2932 2338 B 47 GLU H B 47 GLU HA 1.0 1.814 3.746 2933 2339 A 14 LYS H A 13 GLN HA 1.0 1.972 5.090 2934 2340 B 14 LYS H B 13 GLN HA 1.0 1.972 5.090 2935 2341 A 47 GLU HA A 48 ARG H 1.0 1.952 4.814 2936 2342 B 47 GLU HA B 48 ARG H 1.0 1.952 4.814 2937 2343 A 50 PHE HA A 51 ARG H 1.0 1.855 3.993 2938 2344 B 50 PHE HA B 51 ARG H 1.0 1.855 3.993 2939 2345 A 51 ARG H A 50 PHE HBx 1.0 1.914 4.422 2940 2346 B 51 ARG H B 50 PHE HBy 1.0 1.914 4.422 2941 2347 A 57 ILE H A 54 GLU HBy 1.0 0.000 6.000 2942 2348 B 57 ILE H B 54 GLU HBy 1.0 0.000 6.000 2943 2349 A 56 GLN HBx A 56 GLN H 1.0 1.595 2.805 2944 2350 B 56 GLN HBy B 56 GLN H 1.0 1.595 2.805 2945 2351 A 57 ILE H A 57 ILE HB 1.0 0.000 6.000 2946 2352 B 57 ILE H B 57 ILE HB 1.0 0.000 6.000 2947 2353 A 14 LYS HBy A 15 LYS H 1.0 1.668 3.076 2948 2354 B 14 LYS HBx B 15 LYS H 1.0 1.668 3.076 2949 2355 A 52 ARG HBy A 56 GLN H 1.0 1.989 5.423 2950 2356 B 52 ARG HBx B 56 GLN H 1.0 1.989 5.423 2951 2357 A 15 LYS HGx A 15 LYS H 1.0 1.761 3.475 2952 2358 B 15 LYS HGx B 15 LYS H 1.0 1.761 3.475 2953 2359 A 53 LYS HA A 56 GLN H 1.0 1.932 4.596 2954 2360 B 53 LYS HA B 56 GLN H 1.0 1.932 4.596 2955 2361 A 52 ARG H A 52 ARG HA 1.0 1.734 3.348 2956 2362 B 52 ARG H B 52 ARG HA 1.0 1.734 3.348 2957 2363 A 60 SER H A 59 TRP HBx 1.0 0.000 6.000 2958 2364 B 60 SER H B 59 TRP HBy 1.0 0.000 6.000 2959 2365 A 47 GLU HGy A 47 GLU H 1.0 1.746 3.402 2960 2366 B 47 GLU HGy B 47 GLU H 1.0 1.746 3.402 2961 2367 A 14 LYS H A 11 GLU HBx 1.0 0.000 6.000 2962 2368 B 14 LYS H B 11 GLU HBx 1.0 0.000 6.000 2963 2369 A 13 GLN HBy A 14 LYS H 1.0 1.918 4.464 2964 2370 B 13 GLN HBy B 14 LYS H 1.0 1.918 4.464 2965 2371 A 46 ILE HB A 47 GLU H 1.0 1.763 3.479 2966 2372 B 46 ILE HB B 47 GLU H 1.0 1.763 3.479 2967 2373 A 14 LYS HBy A 14 LYS H 1.0 1.760 3.468 2968 2374 B 14 LYS HBx B 14 LYS H 1.0 1.760 3.468 2969 2375 A 33 ARG H A 33 ARG HGx 1.0 1.903 4.337 2970 2376 B 33 ARG H B 33 ARG HGx 1.0 1.903 4.337 2971 2377 A 14 LYS H A 14 LYS HDx 1.0 1.825 3.813 2972 2378 B 14 LYS H B 14 LYS HDx 1.0 1.825 3.813 2973 2379 A 47 GLU H A 46 ILE HG1x 1.0 1.922 4.502 2974 2380 B 47 GLU H B 46 ILE HG1y 1.0 1.922 4.502 2975 2381 A 14 LYS HGx A 14 LYS H 1.0 1.878 4.144 2976 2382 B 14 LYS HGx B 14 LYS H 1.0 1.878 4.144 2977 2383 A 17 LEU H A 17 LEU HG 1.0 1.835 3.871 2978 2384 B 17 LEU H B 17 LEU HG 1.0 1.835 3.871 2979 2385 A 17 LEU HBx A 17 LEU H 1.0 1.809 3.719 2980 2386 B 17 LEU HBy B 17 LEU H 1.0 1.809 3.719 2981 2387 A 51 ARG HBx A 51 ARG H 1.0 1.766 3.498 2982 2388 B 51 ARG HBx B 51 ARG H 1.0 1.766 3.498 2983 2389 A 51 ARG H A 51 ARG HGy 1.0 1.862 4.034 2984 2390 B 51 ARG H B 51 ARG HGy 1.0 1.862 4.034 2985 2391 A 53 LYS H A 54 GLU H 1.0 1.750 3.422 2986 2392 B 53 LYS H B 54 GLU H 1.0 1.750 3.422 2987 2393 A 55 GLN H A 54 GLU H 1.0 1.775 3.543 2988 2394 B 55 GLN H B 54 GLU H 1.0 1.775 3.543 2989 2395 A 12 GLU H A 12 GLU HA 1.0 1.692 3.168 2990 2396 B 12 GLU H B 12 GLU HA 1.0 1.692 3.168 2991 2397 A 12 GLU H A 10 SER HA 1.0 0.000 6.000 2992 2398 B 12 GLU H B 10 SER HA 1.0 0.000 6.000 2993 2399 A 21 PHE HEy A 54 GLU H 1.0 1.973 5.095 2994 2399 A 21 PHE HEx A 54 GLU H 1.0 1.973 5.095 2995 2400 B 21 PHE HEy B 54 GLU H 1.0 1.973 5.095 2996 2400 B 21 PHE HEx B 54 GLU H 1.0 1.973 5.095 2997 2401 A 59 TRP HD1 A 60 SER H 1.0 0.000 6.000 2998 2402 B 59 TRP HD1 B 60 SER H 1.0 0.000 6.000 2999 2403 A 52 ARG H A 51 ARG H 1.0 1.772 3.526 3000 2404 B 52 ARG H B 51 ARG H 1.0 1.772 3.526 3001 2405 A 12 GLU H A 13 GLN H 1.0 1.806 3.700 3002 2406 B 12 GLU H B 13 GLN H 1.0 1.806 3.700 3003 2407 A 7 THR H A 7 THR HG1 1.0 0.000 6.000 3004 2408 B 7 THR H B 7 THR HG1 1.0 0.000 6.000 3005 2409 A 7 THR HB A 7 THR H 1.0 0.000 6.000 3006 2410 B 7 THR HB B 7 THR H 1.0 0.000 6.000 3007 2411 A 4 ARG HA A 7 THR H 1.0 0.000 6.000 3008 2412 B 4 ARG HA B 7 THR H 1.0 0.000 6.000 3009 2413 A 5 PRO HBx A 7 THR H 1.0 0.000 6.000 3010 2414 B 5 PRO HBy B 7 THR H 1.0 0.000 6.000 3011 2415 A 6 ARG HBx A 7 THR H 1.0 0.000 6.000 3012 2416 B 6 ARG HBx B 7 THR H 1.0 0.000 6.000 3013 2417 A 60 SER H A 58 GLY HAy 1.0 1.937 4.651 3014 2418 B 60 SER H B 58 GLY HAy 1.0 1.937 4.651 3015 2419 A 33 ARG H A 33 ARG HDx 1.0 1.960 4.908 3016 2420 B 33 ARG H B 33 ARG HDx 1.0 1.960 4.908 3017 2421 A 15 LYS H A 14 LYS H 1.0 1.890 4.234 3018 2422 B 15 LYS H B 14 LYS H 1.0 1.890 4.234 3019 2423 A 34 TYR H A 33 ARG H 1.0 1.891 4.239 3020 2424 B 34 TYR H B 33 ARG H 1.0 1.891 4.239 3021 2425 A 52 ARG HE A 54 GLU H 1.0 0.000 6.000 3022 2426 B 52 ARG HE B 54 GLU H 1.0 0.000 6.000 3023 2427 A 12 GLU HA A 14 LYS H 1.0 0.000 6.000 3024 2428 B 12 GLU HA B 14 LYS H 1.0 0.000 6.000 3025 2429 A 35 LEU H A 36 SER H 1.0 1.848 3.942 3026 2430 B 35 LEU H B 36 SER H 1.0 1.848 3.942 3027 2431 A 33 ARG H A 36 SER H 1.0 1.964 4.962 3028 2432 B 33 ARG H B 36 SER H 1.0 1.964 4.962 3029 2433 A 35 LEU HBx A 36 SER H 1.0 1.878 4.146 3030 2434 B 35 LEU HBx B 36 SER H 1.0 1.878 4.146 3031 2435 A 35 LEU HDy% A 36 SER H 1.0 1.981 5.241 3032 2436 B 35 LEU HD21 B 36 SER H 1.0 1.981 5.241 3033 2437 A 36 SER HA A 36 SER H 1.0 1.811 3.727 3034 2438 B 36 SER HA B 36 SER H 1.0 1.811 3.727 3035 2439 A 36 SER HBy A 36 SER H 1.0 1.682 3.130 3036 2440 B 36 SER HBy B 36 SER H 1.0 1.682 3.130 3037 2441 A 35 LEU HA A 36 SER H 1.0 1.948 4.762 3038 2442 B 35 LEU HA B 36 SER H 1.0 1.948 4.762 3039 2443 A 57 ILE HA A 58 GLY H 1.0 1.736 3.358 3040 2444 B 57 ILE HA B 58 GLY H 1.0 1.736 3.358 3041 2445 A 58 GLY H A 58 GLY HAx 1.0 1.612 2.864 3042 2446 B 58 GLY H B 58 GLY HAx 1.0 1.612 2.864 3043 2447 A 58 GLY H A 57 ILE HB 1.0 0.000 6.000 3044 2448 B 58 GLY H B 57 ILE HB 1.0 0.000 6.000 3045 2449 A 57 ILE HG1x A 58 GLY H 1.0 1.940 4.676 3046 2450 B 57 ILE HG1y B 58 GLY H 1.0 1.940 4.676 3047 2451 A 58 GLY H A 57 ILE HG1y 1.0 1.951 4.789 3048 2452 B 58 GLY H B 57 ILE HG1x 1.0 1.951 4.789 3049 2453 A 57 ILE H A 58 GLY H 1.0 1.731 3.335 3050 2454 B 57 ILE H B 58 GLY H 1.0 1.731 3.335 3051 2455 A 39 LEU HG A 40 GLY H 1.0 1.924 4.520 3052 2456 B 39 LEU HG B 40 GLY H 1.0 1.924 4.520 3053 2457 A 40 GLY H A 39 LEU HBy 1.0 1.898 4.292 3054 2458 B 40 GLY H B 39 LEU HBx 1.0 1.898 4.292 3055 2459 A 39 LEU HDx% A 40 GLY H 1.0 1.940 4.680 3056 2460 B 39 LEU HD11 B 40 GLY H 1.0 1.940 4.680 3057 2461 A 40 GLY H A 41 LEU HDy% 1.0 1.980 5.216 3058 2462 B 40 GLY H B 41 LEU HD21 1.0 1.980 5.216 3059 2463 A 41 LEU HA A 40 GLY H 1.0 1.976 5.154 3060 2464 B 41 LEU HA B 40 GLY H 1.0 1.976 5.154 3061 2465 A 39 LEU HA A 40 GLY H 1.0 1.947 4.751 3062 2466 B 39 LEU HA B 40 GLY H 1.0 1.947 4.751 3063 2467 A 8 GLU HGx A 8 GLU H 1.0 1.833 3.855 3064 2468 B 8 GLU HGx B 8 GLU H 1.0 1.833 3.855 3065 2469 A 65 GLU H A 66 LYS H 1.0 1.785 3.591 3066 2470 B 65 GLU H B 66 LYS H 1.0 1.785 3.591 3067 2471 A 64 PHE H A 66 LYS H 1.0 1.799 3.665 3068 2472 B 64 PHE H B 66 LYS H 1.0 1.799 3.665 3069 2473 A 63 GLN H A 66 LYS H 1.0 0.000 6.000 3070 2474 B 63 GLN H B 66 LYS H 1.0 0.000 6.000 3071 2475 A 43 GLU H A 42 ASN HD2y 1.0 1.997 5.681 3072 2476 B 43 GLU H B 42 ASN HD2x 1.0 1.997 5.681 3073 2477 A 63 GLN H A 61 HIS HBx 1.0 1.986 5.350 3074 2478 B 63 GLN H B 61 HIS HBy 1.0 1.986 5.350 3075 2479 A 34 TYR H A 33 ARG HA 1.0 1.924 4.514 3076 2480 B 34 TYR H B 33 ARG HA 1.0 1.924 4.514 3077 2481 A 16 ALA HA A 17 LEU H 1.0 1.939 4.663 3078 2482 B 16 ALA HA B 17 LEU H 1.0 1.939 4.663 3079 2483 A 61 HIS HA A 64 PHE H 1.0 1.990 5.442 3080 2484 B 61 HIS HA B 64 PHE H 1.0 1.990 5.442 3081 2485 A 52 ARG H A 52 ARG HBy 1.0 0.000 6.000 3082 2486 B 52 ARG H B 52 ARG HBx 1.0 0.000 6.000 3083 2487 A 6 ARG HDx A 6 ARG H 1.0 1.946 4.738 3084 2488 B 6 ARG HDx B 6 ARG H 1.0 1.946 4.738 3085 2489 A 45 GLN HGx A 44 GLU H 1.0 1.931 4.587 3086 2490 B 45 GLN HGx B 44 GLU H 1.0 1.931 4.587 3087 2491 A 20 ALA H A 21 PHE H 1.0 1.999 5.871 3088 2492 B 20 ALA H B 21 PHE H 1.0 1.999 5.871 3089 2493 A 14 LYS H A 10 SER H 1.0 2.000 6.006 3090 2494 B 14 LYS H B 10 SER H 1.0 2.000 6.006 3091 2495 A 13 GLN HGy A 10 SER H 1.0 2.000 5.896 3092 2496 B 13 GLN HGy B 10 SER H 1.0 2.000 5.896 3093 2497 A 4 ARG HBx A 10 SER H 1.0 1.997 6.313 3094 2498 B 4 ARG HBy B 10 SER H 1.0 1.997 6.313 3095 2499 A 56 GLN HA A 56 GLN H 1.0 1.686 3.144 3096 2500 B 56 GLN HA B 56 GLN H 1.0 1.686 3.144 3097 2501 A 27 LEU HDy% A 48 ARG H 1.0 1.999 5.813 3098 2502 B 27 LEU HD21 B 48 ARG H 1.0 1.999 5.813 3099 2503 A 14 LYS HA A 16 ALA H 1.0 2.000 6.066 3100 2504 B 14 LYS HA B 16 ALA H 1.0 2.000 6.066 3101 2505 A 41 LEU HA A 9 PHE H 1.0 1.971 5.057 3102 2506 B 41 LEU HA B 9 PHE H 1.0 1.971 5.057 3103 2507 A 33 ARG H A 31 TRP HA 1.0 1.994 5.576 3104 2508 B 33 ARG H B 31 TRP HA 1.0 1.994 5.576 3105 2509 A 52 ARG H A 48 ARG H 1.0 0.000 6.000 3106 2510 B 52 ARG H B 48 ARG H 1.0 0.000 6.000 3107 2511 A 9 PHE HDx A 10 SER H 1.0 2.000 5.988 3108 2512 B 9 PHE HDx B 10 SER H 1.0 2.000 5.988 3109 2513 A 33 ARG HA A 32 ARG H 1.0 1.994 5.536 3110 2514 B 33 ARG HA B 32 ARG H 1.0 1.994 5.536 3111 2515 A 35 LEU H A 35 LEU HDx% 1.0 1.999 5.903 3112 2516 B 35 LEU H B 35 LEU HD11 1.0 1.999 5.903 3113 2517 A 45 GLN H A 46 ILE HG1y 1.0 1.997 5.691 3114 2518 B 45 GLN H B 46 ILE HG1x 1.0 1.997 5.691 3115 2519 A 15 LYS H A 14 LYS HA 1.0 1.976 5.148 3116 2520 B 15 LYS H B 14 LYS HA 1.0 1.976 5.148 3117 2521 A 60 SER HBx A 60 SER H 1.0 0.000 6.000 3118 2522 B 60 SER HBy B 60 SER H 1.0 0.000 6.000 3119 2523 A 57 ILE HA A 60 SER H 1.0 0.000 6.000 3120 2524 B 57 ILE HA B 60 SER H 1.0 0.000 6.000 3121 2525 A 60 SER H A 57 ILE HG2% 1.0 1.978 5.182 3122 2526 B 60 SER H B 57 ILE HG21 1.0 1.978 5.182 3123 2527 A 57 ILE HB A 60 SER H 1.0 1.995 5.631 3124 2528 B 57 ILE HB B 60 SER H 1.0 1.995 5.631 3125 2529 A 36 SER H A 46 ILE HG1y 1.0 1.986 5.352 3126 2530 B 36 SER H B 46 ILE HG1x 1.0 1.986 5.352 3127 2531 A 43 GLU HA A 36 SER H 1.0 1.986 5.350 3128 2532 B 43 GLU HA B 36 SER H 1.0 1.986 5.350 3129 2533 A 36 SER H A 34 TYR HBx 1.0 1.997 5.707 3130 2534 B 36 SER H B 34 TYR HBy 1.0 1.997 5.707 3131 2535 A 34 TYR HBy A 36 SER H 1.0 1.999 5.851 3132 2536 B 34 TYR HBx B 36 SER H 1.0 1.999 5.851 3133 2537 A 58 GLY H A 60 SER HG 1.0 1.986 5.354 3134 2538 B 58 GLY H B 60 SER HG 1.0 1.986 5.354 3135 2539 A 1 MET HA A 2 GLU H 1.0 2.000 5.884 3136 2540 B 1 MET HA B 2 GLU H 1.0 2.000 5.884 3137 2541 A 2 GLU HA A 2 GLU H 1.0 1.998 6.232 3138 2542 B 2 GLU HA B 2 GLU H 1.0 1.998 6.232 3139 2543 A 3 LYS HA A 3 LYS H 1.0 1.934 4.618 3140 2544 B 3 LYS HA B 3 LYS H 1.0 1.934 4.618 3141 2545 A 3 LYS H A 2 GLU HBy 1.0 1.997 6.323 3142 2546 B 3 LYS H B 2 GLU HBx 1.0 1.997 6.323 3143 2547 A 3 LYS HBx A 3 LYS H 1.0 1.981 5.229 3144 2548 B 3 LYS HBx B 3 LYS H 1.0 1.981 5.229 3145 2549 A 4 ARG H A 4 ARG HDx 1.0 1.997 5.691 3146 2550 B 4 ARG H B 4 ARG HDx 1.0 1.997 5.691 3147 2551 A 6 ARG HA A 6 ARG H 1.0 0.000 6.000 3148 2552 B 6 ARG HA B 6 ARG H 1.0 0.000 6.000 3149 2553 A 5 PRO HBy A 6 ARG H 1.0 1.748 3.416 3150 2554 B 5 PRO HBx B 6 ARG H 1.0 1.748 3.416 3151 2555 A 8 GLU H A 7 THR H 1.0 1.727 3.321 3152 2556 B 8 GLU H B 7 THR H 1.0 1.727 3.321 3153 2557 A 6 ARG HA A 7 THR H 1.0 0.000 6.000 3154 2558 B 6 ARG HA B 7 THR H 1.0 0.000 6.000 3155 2559 A 7 THR H A 4 ARG HDx 1.0 1.995 5.581 3156 2560 B 7 THR H B 4 ARG HDx 1.0 1.995 5.581 3157 2561 A 39 LEU H A 38 ARG HGx 1.0 1.978 5.174 3158 2562 B 39 LEU H B 38 ARG HGx 1.0 1.978 5.174 3159 2563 A 39 LEU HG A 39 LEU H 1.0 1.973 5.099 3160 2564 B 39 LEU HG B 39 LEU H 1.0 1.973 5.099 3161 2565 A 7 THR HA A 7 THR H 1.0 1.470 2.410 3162 2566 B 7 THR HA B 7 THR H 1.0 1.470 2.410 3163 2567 A 10 SER HBy A 11 GLU H 1.0 1.767 3.501 3164 2568 B 10 SER HBx B 11 GLU H 1.0 1.767 3.501 3165 2569 A 12 GLU HBx A 12 GLU H 1.0 1.672 3.088 3166 2570 B 12 GLU HBy B 12 GLU H 1.0 1.672 3.088 3167 2571 A 13 GLN H A 12 GLU HA 1.0 1.821 3.787 3168 2572 B 13 GLN H B 12 GLU HA 1.0 1.821 3.787 3169 2573 A 13 GLN H A 13 GLN HBy 1.0 1.839 3.887 3170 2574 B 13 GLN H B 13 GLN HBy 1.0 1.839 3.887 3171 2575 A 15 LYS HA A 15 LYS H 1.0 1.749 3.415 3172 2576 B 15 LYS HA B 15 LYS H 1.0 1.749 3.415 3173 2577 A 15 LYS HA A 16 ALA H 1.0 1.876 4.134 3174 2578 B 15 LYS HA B 16 ALA H 1.0 1.876 4.134 3175 2579 A 16 ALA H A 17 LEU HDx% 1.0 1.997 6.309 3176 2580 B 16 ALA H B 17 LEU HD11 1.0 1.997 6.309 3177 2581 A 17 LEU HDy% A 16 ALA H 1.0 1.999 6.171 3178 2582 B 17 LEU HD21 B 16 ALA H 1.0 1.999 6.171 3179 2583 A 16 ALA H A 17 LEU HA 1.0 1.992 6.494 3180 2584 B 16 ALA H B 17 LEU HA 1.0 1.992 6.494 3181 2585 A 19 LEU H A 18 ASP HA 1.0 2.000 5.974 3182 2586 B 19 LEU H B 18 ASP HA 1.0 2.000 5.974 3183 2587 A 24 ASP HA A 24 ASP H 1.0 2.000 5.864 3184 2588 B 24 ASP HA B 24 ASP H 1.0 2.000 5.864 3185 2589 A 23 PHE HA A 25 ARG H 1.0 1.975 5.139 3186 2590 B 23 PHE HA B 25 ARG H 1.0 1.975 5.139 3187 2591 A 25 ARG HA A 25 ARG H 1.0 1.997 6.291 3188 2592 B 25 ARG HA B 25 ARG H 1.0 1.997 6.291 3189 2593 A 25 ARG HA A 26 ARG H 1.0 1.843 3.911 3190 2594 B 25 ARG HA B 26 ARG H 1.0 1.843 3.911 3191 2595 A 26 ARG HA A 26 ARG H 1.0 1.984 5.318 3192 2596 B 26 ARG HA B 26 ARG H 1.0 1.984 5.318 3193 2597 A 30 GLU H A 31 TRP H 1.0 1.998 6.284 3194 2598 B 30 GLU H B 31 TRP H 1.0 1.998 6.284 3195 2599 A 32 ARG HE A 31 TRP H 1.0 1.977 6.883 3196 2600 B 32 ARG HE B 31 TRP H 1.0 1.977 6.883 3197 2601 A 28 THR H A 31 TRP H 1.0 1.967 7.057 3198 2602 B 28 THR H B 31 TRP H 1.0 1.967 7.057 3199 2603 A 34 TYR HDx A 31 TRP H 1.0 1.956 7.220 3200 2604 B 34 TYR HDx B 31 TRP H 1.0 1.956 7.220 3201 2605 A 31 TRP HA A 31 TRP H 1.0 1.993 6.467 3202 2606 B 31 TRP HA B 31 TRP H 1.0 1.993 6.467 3203 2607 A 30 GLU HA A 31 TRP H 1.0 1.991 6.565 3204 2608 B 30 GLU HA B 31 TRP H 1.0 1.991 6.565 3205 2609 A 31 TRP H A 30 GLU HBy 1.0 1.991 6.519 3206 2610 B 31 TRP H B 30 GLU HBx 1.0 1.991 6.519 3207 2611 A 31 TRP H A 30 GLU HBx 1.0 1.998 6.258 3208 2612 B 31 TRP H B 30 GLU HBy 1.0 1.998 6.258 3209 2613 A 29 PRO HA A 30 GLU H 1.0 1.995 5.637 3210 2614 B 29 PRO HA B 30 GLU H 1.0 1.995 5.637 3211 2615 A 34 TYR HDx A 32 ARG H 1.0 1.983 6.753 3212 2616 B 34 TYR HDx B 32 ARG H 1.0 1.983 6.753 3213 2617 A 33 ARG H A 33 ARG HBx 1.0 1.796 3.648 3214 2618 B 33 ARG H B 33 ARG HBx 1.0 1.796 3.648 3215 2619 A 38 ARG HBy A 38 ARG H 1.0 1.977 6.881 3216 2620 B 38 ARG HBx B 38 ARG H 1.0 1.977 6.881 3217 2621 A 38 ARG HBx A 38 ARG H 1.0 1.363 11.151 3218 2622 B 38 ARG HBy B 38 ARG H 1.0 1.363 11.151 3219 2623 A 38 ARG H A 37 GLN HBy 1.0 1.810 8.654 3220 2624 B 38 ARG H B 37 GLN HBx 1.0 1.810 8.654 3221 2625 A 37 GLN HBx A 38 ARG H 1.0 1.948 7.344 3222 2626 B 37 GLN HBy B 38 ARG H 1.0 1.948 7.344 3223 2627 A 38 ARG H A 38 ARG HGx 1.0 0.000 24.090 3224 2628 B 38 ARG H B 38 ARG HGx 1.0 0.000 24.090 3225 2629 A 4 ARG HGx A 7 THR H 1.0 1.873 4.111 3226 2630 B 4 ARG HGx B 7 THR H 1.0 1.873 4.111 3227 2631 A 45 GLN HE2x A 42 ASN H 1.0 1.999 6.181 3228 2632 B 45 GLN HE2y B 42 ASN H 1.0 1.999 6.181 3229 2633 A 36 SER HBy A 42 ASN H 1.0 2.000 6.002 3230 2634 B 36 SER HBy B 42 ASN H 1.0 2.000 6.002 3231 2635 A 42 ASN HA A 42 ASN H 1.0 1.729 3.329 3232 2636 B 42 ASN HA B 42 ASN H 1.0 1.729 3.329 3233 2637 A 45 GLN H A 43 GLU H 1.0 1.999 5.869 3234 2638 B 45 GLN H B 43 GLU H 1.0 1.999 5.869 3235 2639 A 45 GLN H A 45 GLN HE2y 1.0 1.999 5.845 3236 2640 B 45 GLN H B 45 GLN HE2x 1.0 1.999 5.845 3237 2641 A 45 GLN H A 45 GLN HGy 1.0 1.792 3.626 3238 2642 B 45 GLN H B 45 GLN HGy 1.0 1.792 3.626 3239 2643 A 45 GLN H A 45 GLN HBx 1.0 1.790 3.618 3240 2644 B 45 GLN H B 45 GLN HBx 1.0 1.790 3.618 3241 2645 A 45 GLN HBy A 46 ILE H 1.0 1.972 5.084 3242 2646 B 45 GLN HBy B 46 ILE H 1.0 1.972 5.084 3243 2647 A 50 PHE H A 48 ARG H 1.0 1.999 6.139 3244 2648 B 50 PHE H B 48 ARG H 1.0 1.999 6.139 3245 2649 A 45 GLN H A 48 ARG H 1.0 1.992 5.488 3246 2650 B 45 GLN H B 48 ARG H 1.0 1.992 5.488 3247 2651 A 47 GLU HBy A 48 ARG H 1.0 1.722 3.298 3248 2652 B 47 GLU HBy B 48 ARG H 1.0 1.722 3.298 3249 2653 A 49 TRP H A 46 ILE H 1.0 2.000 6.092 3250 2654 B 49 TRP H B 46 ILE H 1.0 2.000 6.092 3251 2655 A 54 GLU HGy A 51 ARG H 1.0 1.999 6.167 3252 2656 B 54 GLU HGx B 51 ARG H 1.0 1.999 6.167 3253 2657 A 52 ARG H A 51 ARG HBy 1.0 1.813 3.743 3254 2658 B 52 ARG H B 51 ARG HBy 1.0 1.813 3.743 3255 2659 A 53 LYS HGy A 54 GLU H 1.0 1.996 5.630 3256 2660 B 53 LYS HGy B 54 GLU H 1.0 1.996 5.630 3257 2661 A 56 GLN H A 55 GLN HBy 1.0 1.692 3.168 3258 2662 B 56 GLN H B 55 GLN HBx 1.0 1.692 3.168 3259 2663 A 57 ILE H A 56 GLN HGy 1.0 1.961 4.929 3260 2664 B 57 ILE H B 56 GLN HGx 1.0 1.961 4.929 3261 2665 A 56 GLN HBy A 57 ILE H 1.0 1.675 3.101 3262 2666 B 56 GLN HBx B 57 ILE H 1.0 1.675 3.101 3263 2667 A 61 HIS H A 61 HIS HBx 1.0 0.000 6.000 3264 2668 B 61 HIS H B 61 HIS HBy 1.0 0.000 6.000 3265 2669 A 63 GLN H A 63 GLN HA 1.0 1.693 3.175 3266 2670 B 63 GLN H B 63 GLN HA 1.0 1.693 3.175 3267 2671 A 27 LEU HDx% A 47 GLU H 1.0 1.987 5.347 3268 2672 B 27 LEU HD11 B 47 GLU H 1.0 1.987 5.347 3269 2673 A 53 LYS H A 21 PHE HEy 1.0 1.994 6.422 3270 2673 A 53 LYS H A 21 PHE HEx 1.0 1.994 6.422 3271 2674 B 53 LYS H B 21 PHE HEy 1.0 1.994 6.422 3272 2674 B 53 LYS H B 21 PHE HEx 1.0 1.994 6.422 3273 2675 A 21 PHE HDy A 21 PHE H 1.0 1.992 6.514 3274 2675 A 21 PHE HDx A 21 PHE H 1.0 1.992 6.514 3275 2676 B 21 PHE HDy B 21 PHE H 1.0 1.992 6.514 3276 2676 B 21 PHE HDx B 21 PHE H 1.0 1.992 6.514 3277 2677 A 17 LEU HDy% A 14 LYS H 1.0 2.000 6.096 3278 2678 B 17 LEU HD21 B 14 LYS H 1.0 2.000 6.096 3279 2679 A 50 PHE H A 50 PHE HEy 1.0 1.998 6.284 3280 2679 A 50 PHE H A 50 PHE HEx 1.0 1.998 6.284 3281 2680 B 50 PHE H B 50 PHE HEy 1.0 1.998 6.284 3282 2680 B 50 PHE H B 50 PHE HEx 1.0 1.998 6.284 3283 2681 A 28 THR H A 31 TRP HBx 1.0 1.988 5.390 3284 2682 B 28 THR H B 31 TRP HBx 1.0 1.988 5.390 3285 2683 A 29 PRO HDx A 30 GLU H 1.0 1.998 6.226 3286 2684 B 29 PRO HDx B 30 GLU H 1.0 1.998 6.226 3287 2685 A 30 GLU H A 30 GLU HGx 1.0 1.995 6.411 3288 2686 B 30 GLU H B 30 GLU HGx 1.0 1.995 6.411 3289 2687 A 28 THR HG2% A 30 GLU H 1.0 1.984 6.728 3290 2688 B 28 THR HG21 B 30 GLU H 1.0 1.984 6.728 3291 2689 A 29 PRO HBy A 30 GLU H 1.0 2.000 6.044 3292 2690 B 29 PRO HBx B 30 GLU H 1.0 2.000 6.044 3293 2691 A 7 THR H A 6 ARG H 1.0 1.801 3.677 3294 2692 B 7 THR H B 6 ARG H 1.0 1.801 3.677 3295 2693 A 8 GLU H A 6 ARG H 1.0 0.000 6.000 3296 2694 B 8 GLU H B 6 ARG H 1.0 0.000 6.000 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 hbond _nef_distance_restraint_list.potential_type square-well-parabolic loop_ _nef_distance_restraint.index _nef_distance_restraint.restraint_id _nef_distance_restraint.chain_code_1 _nef_distance_restraint.sequence_code_1 _nef_distance_restraint.residue_name_1 _nef_distance_restraint.atom_name_1 _nef_distance_restraint.chain_code_2 _nef_distance_restraint.sequence_code_2 _nef_distance_restraint.residue_name_2 _nef_distance_restraint.atom_name_2 _nef_distance_restraint.weight _nef_distance_restraint.lower_limit _nef_distance_restraint.upper_limit 1 1 A 15 LYS H A 11 GLU O 1.0 1.730 2.700 2 2 A 16 ALA H A 12 GLU O 1.0 1.730 2.700 3 3 A 17 LEU H A 13 GLN O 1.0 1.730 2.700 4 4 A 18 ASP H A 14 LYS O 1.0 1.730 2.700 5 5 A 19 LEU H A 15 LYS O 1.0 1.730 2.700 6 6 A 20 ALA H A 16 ALA O 1.0 1.730 2.700 7 7 A 33 ARG H A 29 PRO O 1.0 1.730 2.700 8 8 A 34 TYR H A 30 GLU O 1.0 1.730 2.700 9 9 A 35 LEU H A 31 TRP O 1.0 1.730 2.700 10 10 A 36 SER H A 32 ARG O 1.0 1.730 2.700 11 11 A 37 GLN H A 33 ARG O 1.0 1.730 2.700 12 12 A 47 GLU H A 43 GLU O 1.0 1.730 2.700 13 13 A 48 ARG H A 44 GLU O 1.0 1.730 2.700 14 14 A 49 TRP H A 45 GLN O 1.0 1.730 2.700 15 15 A 50 PHE H A 46 ILE O 1.0 1.730 2.700 16 16 A 51 ARG H A 47 GLU O 1.0 1.730 2.700 17 17 A 52 ARG H A 48 ARG O 1.0 1.730 2.700 18 18 A 53 LYS H A 49 TRP O 1.0 1.730 2.700 19 19 A 55 GLN H A 51 ARG O 1.0 1.730 2.700 20 20 A 56 GLN H A 52 ARG O 1.0 1.730 2.700 21 21 A 43 GLU O A 47 GLU N 1.0 2.516 3.927 22 22 A 14 LYS O A 18 ASP N 1.0 2.516 3.927 23 23 A 11 GLU O A 15 LYS N 1.0 2.516 3.927 24 24 A 47 GLU O A 51 ARG N 1.0 2.516 3.927 25 25 A 30 GLU O A 34 TYR N 1.0 2.516 3.927 26 26 A 44 GLU O A 48 ARG N 1.0 2.516 3.927 27 27 A 32 ARG O A 36 SER N 1.0 2.516 3.927 28 28 A 48 ARG O A 52 ARG N 1.0 2.516 3.927 29 29 A 46 ILE O A 50 PHE N 1.0 2.516 3.927 30 30 A 31 TRP O A 35 LEU N 1.0 2.516 3.927 31 31 A 33 ARG O A 37 GLN N 1.0 2.516 3.927 32 32 A 29 PRO O A 33 ARG N 1.0 2.516 3.927 33 33 A 52 ARG O A 56 GLN N 1.0 2.516 3.927 34 34 A 49 TRP O A 53 LYS N 1.0 2.516 3.927 35 35 A 45 GLN O A 49 TRP N 1.0 2.516 3.927 36 36 A 13 GLN O A 17 LEU N 1.0 2.516 3.927 37 37 A 15 LYS O A 19 LEU N 1.0 2.516 3.927 38 38 A 12 GLU O A 16 ALA N 1.0 2.516 3.927 39 39 A 16 ALA O A 20 ALA N 1.0 2.516 3.927 40 40 A 51 ARG O A 55 GLN N 1.0 2.516 3.927 41 41 A 54 GLU H A 50 PHE O 1.0 1.730 2.700 42 42 A 50 PHE O A 54 GLU N 1.0 2.516 3.927 43 43 B 15 LYS H B 11 GLU O 1.0 1.730 2.700 44 44 B 16 ALA H B 12 GLU O 1.0 1.730 2.700 45 45 B 17 LEU H B 13 GLN O 1.0 1.730 2.700 46 46 B 18 ASP H B 14 LYS O 1.0 1.730 2.700 47 47 B 19 LEU H B 15 LYS O 1.0 1.730 2.700 48 48 B 20 ALA H B 16 ALA O 1.0 1.730 2.700 49 49 B 33 ARG H B 29 PRO O 1.0 1.730 2.700 50 50 B 34 TYR H B 30 GLU O 1.0 1.730 2.700 51 51 B 35 LEU H B 31 TRP O 1.0 1.730 2.700 52 52 B 36 SER H B 32 ARG O 1.0 1.730 2.700 53 53 B 37 GLN H B 33 ARG O 1.0 1.730 2.700 54 54 B 47 GLU H B 43 GLU O 1.0 1.730 2.700 55 55 B 48 ARG H B 44 GLU O 1.0 1.730 2.700 56 56 B 49 TRP H B 45 GLN O 1.0 1.730 2.700 57 57 B 50 PHE H B 46 ILE O 1.0 1.730 2.700 58 58 B 51 ARG H B 47 GLU O 1.0 1.730 2.700 59 59 B 52 ARG H B 48 ARG O 1.0 1.730 2.700 60 60 B 53 LYS H B 49 TRP O 1.0 1.730 2.700 61 61 B 55 GLN H B 51 ARG O 1.0 1.730 2.700 62 62 B 56 GLN H B 52 ARG O 1.0 1.730 2.700 63 63 B 43 GLU O B 47 GLU N 1.0 2.516 3.927 64 64 B 14 LYS O B 18 ASP N 1.0 2.516 3.927 65 65 B 11 GLU O B 15 LYS N 1.0 2.516 3.927 66 66 B 47 GLU O B 51 ARG N 1.0 2.516 3.927 67 67 B 30 GLU O B 34 TYR N 1.0 2.516 3.927 68 68 B 44 GLU O B 48 ARG N 1.0 2.516 3.927 69 69 B 32 ARG O B 36 SER N 1.0 2.516 3.927 70 70 B 48 ARG O B 52 ARG N 1.0 2.516 3.927 71 71 B 46 ILE O B 50 PHE N 1.0 2.516 3.927 72 72 B 31 TRP O B 35 LEU N 1.0 2.516 3.927 73 73 B 33 ARG O B 37 GLN N 1.0 2.516 3.927 74 74 B 29 PRO O B 33 ARG N 1.0 2.516 3.927 75 75 B 52 ARG O B 56 GLN N 1.0 2.516 3.927 76 76 B 49 TRP O B 53 LYS N 1.0 2.516 3.927 77 77 B 45 GLN O B 49 TRP N 1.0 2.516 3.927 78 78 B 13 GLN O B 17 LEU N 1.0 2.516 3.927 79 79 B 15 LYS O B 19 LEU N 1.0 2.516 3.927 80 80 B 12 GLU O B 16 ALA N 1.0 2.516 3.927 81 81 B 16 ALA O B 20 ALA N 1.0 2.516 3.927 82 82 B 51 ARG O B 55 GLN N 1.0 2.516 3.927 83 83 B 54 GLU H B 50 PHE O 1.0 1.730 2.700 84 84 B 50 PHE O B 54 GLU N 1.0 2.516 3.927 stop_ save_ save_CNS/XPLOR_dihedral_3 _nef_dihedral_restraint_list.sf_category nef_dihedral_restraint_list _nef_dihedral_restraint_list.sf_framecode CNS/XPLOR_dihedral_3 _nef_dihedral_restraint_list.potential_type square-well-parabolic _nef_dihedral_restraint_list.restraint_origin . loop_ _nef_dihedral_restraint.index _nef_dihedral_restraint.restraint_id _nef_dihedral_restraint.chain_code_1 _nef_dihedral_restraint.sequence_code_1 _nef_dihedral_restraint.residue_name_1 _nef_dihedral_restraint.atom_name_1 _nef_dihedral_restraint.chain_code_2 _nef_dihedral_restraint.sequence_code_2 _nef_dihedral_restraint.residue_name_2 _nef_dihedral_restraint.atom_name_2 _nef_dihedral_restraint.chain_code_3 _nef_dihedral_restraint.sequence_code_3 _nef_dihedral_restraint.residue_name_3 _nef_dihedral_restraint.atom_name_3 _nef_dihedral_restraint.chain_code_4 _nef_dihedral_restraint.sequence_code_4 _nef_dihedral_restraint.residue_name_4 _nef_dihedral_restraint.atom_name_4 _nef_dihedral_restraint.weight _nef_dihedral_restraint.lower_limit _nef_dihedral_restraint.upper_limit _nef_dihedral_restraint.name 1 1 A 9 PHE C A 10 SER N A 10 SER CA A 10 SER C 1.0 -97.71 -67.61 PHI 2 2 A 10 SER C A 11 GLU N A 11 GLU CA A 11 GLU C 1.0 -67.62 -50.42 PHI 3 3 A 11 GLU C A 12 GLU N A 12 GLU CA A 12 GLU C 1.0 -76.09 -51.11 PHI 4 4 A 12 GLU C A 13 GLN N A 13 GLN CA A 13 GLN C 1.0 -72.41 -57.15 PHI 5 5 A 13 GLN C A 14 LYS N A 14 LYS CA A 14 LYS C 1.0 -73.31 -52.09 PHI 6 6 A 14 LYS C A 15 LYS N A 15 LYS CA A 15 LYS C 1.0 -65.17 -49.35 PHI 7 7 A 15 LYS C A 16 ALA N A 16 ALA CA A 16 ALA C 1.0 -85.82 -49.90 PHI 8 8 A 16 ALA C A 17 LEU N A 17 LEU CA A 17 LEU C 1.0 -76.70 -56.70 PHI 9 9 A 17 LEU C A 18 ASP N A 18 ASP CA A 18 ASP C 1.0 -78.28 -49.50 PHI 10 10 A 18 ASP C A 19 LEU N A 19 LEU CA A 19 LEU C 1.0 -79.04 -54.72 PHI 11 11 A 19 LEU C A 20 ALA N A 20 ALA CA A 20 ALA C 1.0 -107.78 -47.54 PHI 12 12 A 25 ARG C A 26 ARG N A 26 ARG CA A 26 ARG C 1.0 -157.86 -63.26 PHI 13 13 A 27 LEU C A 28 THR N A 28 THR CA A 28 THR C 1.0 -165.79 -50.77 PHI 14 14 A 28 THR C A 29 PRO N A 29 PRO CA A 29 PRO C 1.0 -75.12 -33.44 PHI 15 15 A 29 PRO C A 30 GLU N A 30 GLU CA A 30 GLU C 1.0 -99.57 -46.83 PHI 16 16 A 30 GLU C A 31 TRP N A 31 TRP CA A 31 TRP C 1.0 -128.90 -29.14 PHI 17 17 A 31 TRP C A 32 ARG N A 32 ARG CA A 32 ARG C 1.0 -78.77 -44.05 PHI 18 18 A 32 ARG C A 33 ARG N A 33 ARG CA A 33 ARG C 1.0 -70.31 -54.45 PHI 19 19 A 33 ARG C A 34 TYR N A 34 TYR CA A 34 TYR C 1.0 -73.25 -56.77 PHI 20 20 A 34 TYR C A 35 LEU N A 35 LEU CA A 35 LEU C 1.0 -72.77 -51.99 PHI 21 21 A 35 LEU C A 36 SER N A 36 SER CA A 36 SER C 1.0 -86.06 -53.40 PHI 22 22 A 36 SER C A 37 GLN N A 37 GLN CA A 37 GLN C 1.0 -109.86 -53.98 PHI 23 23 A 38 ARG C A 39 LEU N A 39 LEU CA A 39 LEU C 1.0 -119.97 -68.05 PHI 24 24 A 39 LEU C A 40 GLY N A 40 GLY CA A 40 GLY C 1.0 55.04 100.40 PHI 25 25 A 40 GLY C A 41 LEU N A 41 LEU CA A 41 LEU C 1.0 -150.57 -82.23 PHI 26 26 A 41 LEU C A 42 ASN N A 42 ASN CA A 42 ASN C 1.0 -107.78 -45.50 PHI 27 27 A 42 ASN C A 43 GLU N A 43 GLU CA A 43 GLU C 1.0 -67.36 -50.20 PHI 28 28 A 43 GLU C A 44 GLU N A 44 GLU CA A 44 GLU C 1.0 -77.56 -50.26 PHI 29 29 A 44 GLU C A 45 GLN N A 45 GLN CA A 45 GLN C 1.0 -78.39 -53.49 PHI 30 30 A 45 GLN C A 46 ILE N A 46 ILE CA A 46 ILE C 1.0 -76.89 -54.89 PHI 31 31 A 46 ILE C A 47 GLU N A 47 GLU CA A 47 GLU C 1.0 -75.06 -51.48 PHI 32 32 A 47 GLU C A 48 ARG N A 48 ARG CA A 48 ARG C 1.0 -72.96 -54.54 PHI 33 33 A 48 ARG C A 49 TRP N A 49 TRP CA A 49 TRP C 1.0 -84.05 -52.53 PHI 34 34 A 49 TRP C A 50 PHE N A 50 PHE CA A 50 PHE C 1.0 -71.76 -53.36 PHI 35 35 A 50 PHE C A 51 ARG N A 51 ARG CA A 51 ARG C 1.0 -71.84 -52.36 PHI 36 36 A 51 ARG C A 52 ARG N A 52 ARG CA A 52 ARG C 1.0 -81.05 -49.29 PHI 37 37 A 52 ARG C A 53 LYS N A 53 LYS CA A 53 LYS C 1.0 -76.61 -52.55 PHI 38 38 A 53 LYS C A 54 GLU N A 54 GLU CA A 54 GLU C 1.0 -87.85 -44.37 PHI 39 39 A 54 GLU C A 55 GLN N A 55 GLN CA A 55 GLN C 1.0 -74.09 -52.05 PHI 40 40 A 55 GLN C A 56 GLN N A 56 GLN CA A 56 GLN C 1.0 -79.19 -52.27 PHI 41 41 A 56 GLN C A 57 ILE N A 57 ILE CA A 57 ILE C 1.0 -114.36 -68.72 PHI 42 42 A 10 SER N A 10 SER CA A 10 SER C A 11 GLU N 1.0 141.32 192.40 PSI 43 43 A 11 GLU N A 11 GLU CA A 11 GLU C A 12 GLU N 1.0 -53.77 -28.11 PSI 44 44 A 12 GLU N A 12 GLU CA A 12 GLU C A 13 GLN N 1.0 -54.70 -26.60 PSI 45 45 A 13 GLN N A 13 GLN CA A 13 GLN C A 14 LYS N 1.0 -52.19 -34.33 PSI 46 46 A 14 LYS N A 14 LYS CA A 14 LYS C A 15 LYS N 1.0 -54.08 -35.20 PSI 47 47 A 15 LYS N A 15 LYS CA A 15 LYS C A 16 ALA N 1.0 -55.96 -33.70 PSI 48 48 A 16 ALA N A 16 ALA CA A 16 ALA C A 17 LEU N 1.0 -54.24 -34.02 PSI 49 49 A 17 LEU N A 17 LEU CA A 17 LEU C A 18 ASP N 1.0 -53.90 -26.62 PSI 50 50 A 18 ASP N A 18 ASP CA A 18 ASP C A 19 LEU N 1.0 -52.95 -25.23 PSI 51 51 A 19 LEU N A 19 LEU CA A 19 LEU C A 20 ALA N 1.0 -54.30 -17.50 PSI 52 52 A 20 ALA N A 20 ALA CA A 20 ALA C A 21 PHE N 1.0 -55.39 -0.55 PSI 53 53 A 26 ARG N A 26 ARG CA A 26 ARG C A 27 LEU N 1.0 93.54 181.44 PSI 54 54 A 28 THR N A 28 THR CA A 28 THR C A 29 PRO N 1.0 134.34 202.16 PSI 55 55 A 29 PRO N A 29 PRO CA A 29 PRO C A 30 GLU N 1.0 -49.87 -21.37 PSI 56 56 A 30 GLU N A 30 GLU CA A 30 GLU C A 31 TRP N 1.0 -54.33 10.93 PSI 57 57 A 31 TRP N A 31 TRP CA A 31 TRP C A 32 ARG N 1.0 -79.95 35.37 PSI 58 58 A 32 ARG N A 32 ARG CA A 32 ARG C A 33 ARG N 1.0 -59.09 -23.85 PSI 59 59 A 33 ARG N A 33 ARG CA A 33 ARG C A 34 TYR N 1.0 -55.69 -34.23 PSI 60 60 A 34 TYR N A 34 TYR CA A 34 TYR C A 35 LEU N 1.0 -52.32 -34.86 PSI 61 61 A 35 LEU N A 35 LEU CA A 35 LEU C A 36 SER N 1.0 -51.15 -26.67 PSI 62 62 A 36 SER N A 36 SER CA A 36 SER C A 37 GLN N 1.0 -56.55 -3.41 PSI 63 63 A 37 GLN N A 37 GLN CA A 37 GLN C A 38 ARG N 1.0 -63.94 20.34 PSI 64 64 A 39 LEU N A 39 LEU CA A 39 LEU C A 40 GLY N 1.0 -11.87 27.41 PSI 65 65 A 40 GLY N A 40 GLY CA A 40 GLY C A 41 LEU N 1.0 -6.85 55.63 PSI 66 66 A 41 LEU N A 41 LEU CA A 41 LEU C A 42 ASN N 1.0 130.29 168.41 PSI 67 67 A 42 ASN N A 42 ASN CA A 42 ASN C A 43 GLU N 1.0 133.83 182.77 PSI 68 68 A 43 GLU N A 43 GLU CA A 43 GLU C A 44 GLU N 1.0 -49.77 -25.31 PSI 69 69 A 44 GLU N A 44 GLU CA A 44 GLU C A 45 GLN N 1.0 -56.02 -32.46 PSI 70 70 A 45 GLN N A 45 GLN CA A 45 GLN C A 46 ILE N 1.0 -56.61 -22.93 PSI 71 71 A 46 ILE N A 46 ILE CA A 46 ILE C A 47 GLU N 1.0 -53.37 -26.45 PSI 72 72 A 47 GLU N A 47 GLU CA A 47 GLU C A 48 ARG N 1.0 -45.82 -30.96 PSI 73 73 A 48 ARG N A 48 ARG CA A 48 ARG C A 49 TRP N 1.0 -58.01 -25.59 PSI 74 74 A 49 TRP N A 49 TRP CA A 49 TRP C A 50 PHE N 1.0 -53.67 -26.57 PSI 75 75 A 50 PHE N A 50 PHE CA A 50 PHE C A 51 ARG N 1.0 -54.44 -30.44 PSI 76 76 A 51 ARG N A 51 ARG CA A 51 ARG C A 52 ARG N 1.0 -57.50 -31.52 PSI 77 77 A 52 ARG N A 52 ARG CA A 52 ARG C A 53 LYS N 1.0 -62.12 -22.78 PSI 78 78 A 53 LYS N A 53 LYS CA A 53 LYS C A 54 GLU N 1.0 -47.42 -31.12 PSI 79 79 A 54 GLU N A 54 GLU CA A 54 GLU C A 55 GLN N 1.0 -52.31 -15.89 PSI 80 80 A 55 GLN N A 55 GLN CA A 55 GLN C A 56 GLN N 1.0 -52.36 -30.92 PSI 81 81 A 56 GLN N A 56 GLN CA A 56 GLN C A 57 ILE N 1.0 -51.61 -5.97 PSI 82 82 A 57 ILE N A 57 ILE CA A 57 ILE C A 58 GLY N 1.0 -30.10 20.54 PSI 83 83 B 9 PHE C B 10 SER N B 10 SER CA B 10 SER C 1.0 -97.71 -67.61 PHI 84 84 B 10 SER C B 11 GLU N B 11 GLU CA B 11 GLU C 1.0 -67.62 -50.42 PHI 85 85 B 11 GLU C B 12 GLU N B 12 GLU CA B 12 GLU C 1.0 -76.09 -51.11 PHI 86 86 B 12 GLU C B 13 GLN N B 13 GLN CA B 13 GLN C 1.0 -72.41 -57.15 PHI 87 87 B 13 GLN C B 14 LYS N B 14 LYS CA B 14 LYS C 1.0 -73.31 -52.09 PHI 88 88 B 14 LYS C B 15 LYS N B 15 LYS CA B 15 LYS C 1.0 -65.17 -49.35 PHI 89 89 B 15 LYS C B 16 ALA N B 16 ALA CA B 16 ALA C 1.0 -85.82 -49.90 PHI 90 90 B 16 ALA C B 17 LEU N B 17 LEU CA B 17 LEU C 1.0 -76.70 -56.70 PHI 91 91 B 17 LEU C B 18 ASP N B 18 ASP CA B 18 ASP C 1.0 -78.28 -49.50 PHI 92 92 B 18 ASP C B 19 LEU N B 19 LEU CA B 19 LEU C 1.0 -79.04 -54.72 PHI 93 93 B 19 LEU C B 20 ALA N B 20 ALA CA B 20 ALA C 1.0 -107.78 -47.54 PHI 94 94 B 25 ARG C B 26 ARG N B 26 ARG CA B 26 ARG C 1.0 -157.86 -63.26 PHI 95 95 B 27 LEU C B 28 THR N B 28 THR CA B 28 THR C 1.0 -165.79 -50.77 PHI 96 96 B 28 THR C B 29 PRO N B 29 PRO CA B 29 PRO C 1.0 -75.12 -33.44 PHI 97 97 B 29 PRO C B 30 GLU N B 30 GLU CA B 30 GLU C 1.0 -99.57 -46.83 PHI 98 98 B 30 GLU C B 31 TRP N B 31 TRP CA B 31 TRP C 1.0 -128.90 -29.14 PHI 99 99 B 31 TRP C B 32 ARG N B 32 ARG CA B 32 ARG C 1.0 -78.77 -44.05 PHI 100 100 B 32 ARG C B 33 ARG N B 33 ARG CA B 33 ARG C 1.0 -70.31 -54.45 PHI 101 101 B 33 ARG C B 34 TYR N B 34 TYR CA B 34 TYR C 1.0 -73.25 -56.77 PHI 102 102 B 34 TYR C B 35 LEU N B 35 LEU CA B 35 LEU C 1.0 -72.77 -51.99 PHI 103 103 B 35 LEU C B 36 SER N B 36 SER CA B 36 SER C 1.0 -86.06 -53.40 PHI 104 104 B 36 SER C B 37 GLN N B 37 GLN CA B 37 GLN C 1.0 -109.86 -53.98 PHI 105 105 B 38 ARG C B 39 LEU N B 39 LEU CA B 39 LEU C 1.0 -119.97 -68.05 PHI 106 106 B 39 LEU C B 40 GLY N B 40 GLY CA B 40 GLY C 1.0 55.04 100.40 PHI 107 107 B 40 GLY C B 41 LEU N B 41 LEU CA B 41 LEU C 1.0 -150.57 -82.23 PHI 108 108 B 41 LEU C B 42 ASN N B 42 ASN CA B 42 ASN C 1.0 -107.78 -45.50 PHI 109 109 B 42 ASN C B 43 GLU N B 43 GLU CA B 43 GLU C 1.0 -67.36 -50.20 PHI 110 110 B 43 GLU C B 44 GLU N B 44 GLU CA B 44 GLU C 1.0 -77.56 -50.26 PHI 111 111 B 44 GLU C B 45 GLN N B 45 GLN CA B 45 GLN C 1.0 -78.39 -53.49 PHI 112 112 B 45 GLN C B 46 ILE N B 46 ILE CA B 46 ILE C 1.0 -76.89 -54.89 PHI 113 113 B 46 ILE C B 47 GLU N B 47 GLU CA B 47 GLU C 1.0 -75.06 -51.48 PHI 114 114 B 47 GLU C B 48 ARG N B 48 ARG CA B 48 ARG C 1.0 -72.96 -54.54 PHI 115 115 B 48 ARG C B 49 TRP N B 49 TRP CA B 49 TRP C 1.0 -84.05 -52.53 PHI 116 116 B 49 TRP C B 50 PHE N B 50 PHE CA B 50 PHE C 1.0 -71.76 -53.36 PHI 117 117 B 50 PHE C B 51 ARG N B 51 ARG CA B 51 ARG C 1.0 -71.84 -52.36 PHI 118 118 B 51 ARG C B 52 ARG N B 52 ARG CA B 52 ARG C 1.0 -81.05 -49.29 PHI 119 119 B 52 ARG C B 53 LYS N B 53 LYS CA B 53 LYS C 1.0 -76.61 -52.55 PHI 120 120 B 53 LYS C B 54 GLU N B 54 GLU CA B 54 GLU C 1.0 -87.85 -44.37 PHI 121 121 B 54 GLU C B 55 GLN N B 55 GLN CA B 55 GLN C 1.0 -74.09 -52.05 PHI 122 122 B 55 GLN C B 56 GLN N B 56 GLN CA B 56 GLN C 1.0 -79.19 -52.27 PHI 123 123 B 56 GLN C B 57 ILE N B 57 ILE CA B 57 ILE C 1.0 -114.36 -68.72 PHI 124 124 B 10 SER N B 10 SER CA B 10 SER C B 11 GLU N 1.0 141.32 192.40 PSI 125 125 B 11 GLU N B 11 GLU CA B 11 GLU C B 12 GLU N 1.0 -53.77 -28.11 PSI 126 126 B 12 GLU N B 12 GLU CA B 12 GLU C B 13 GLN N 1.0 -54.70 -26.60 PSI 127 127 B 13 GLN N B 13 GLN CA B 13 GLN C B 14 LYS N 1.0 -52.19 -34.33 PSI 128 128 B 14 LYS N B 14 LYS CA B 14 LYS C B 15 LYS N 1.0 -54.08 -35.20 PSI 129 129 B 15 LYS N B 15 LYS CA B 15 LYS C B 16 ALA N 1.0 -55.96 -33.70 PSI 130 130 B 16 ALA N B 16 ALA CA B 16 ALA C B 17 LEU N 1.0 -54.24 -34.02 PSI 131 131 B 17 LEU N B 17 LEU CA B 17 LEU C B 18 ASP N 1.0 -53.90 -26.62 PSI 132 132 B 18 ASP N B 18 ASP CA B 18 ASP C B 19 LEU N 1.0 -52.95 -25.23 PSI 133 133 B 19 LEU N B 19 LEU CA B 19 LEU C B 20 ALA N 1.0 -54.30 -17.50 PSI 134 134 B 20 ALA N B 20 ALA CA B 20 ALA C B 21 PHE N 1.0 -55.39 -0.55 PSI 135 135 B 26 ARG N B 26 ARG CA B 26 ARG C B 27 LEU N 1.0 93.54 181.44 PSI 136 136 B 28 THR N B 28 THR CA B 28 THR C B 29 PRO N 1.0 134.34 202.16 PSI 137 137 B 29 PRO N B 29 PRO CA B 29 PRO C B 30 GLU N 1.0 -49.87 -21.37 PSI 138 138 B 30 GLU N B 30 GLU CA B 30 GLU C B 31 TRP N 1.0 -54.33 10.93 PSI 139 139 B 31 TRP N B 31 TRP CA B 31 TRP C B 32 ARG N 1.0 -79.95 35.37 PSI 140 140 B 32 ARG N B 32 ARG CA B 32 ARG C B 33 ARG N 1.0 -59.09 -23.85 PSI 141 141 B 33 ARG N B 33 ARG CA B 33 ARG C B 34 TYR N 1.0 -55.69 -34.23 PSI 142 142 B 34 TYR N B 34 TYR CA B 34 TYR C B 35 LEU N 1.0 -52.32 -34.86 PSI 143 143 B 35 LEU N B 35 LEU CA B 35 LEU C B 36 SER N 1.0 -51.15 -26.67 PSI 144 144 B 36 SER N B 36 SER CA B 36 SER C B 37 GLN N 1.0 -56.55 -3.41 PSI 145 145 B 37 GLN N B 37 GLN CA B 37 GLN C B 38 ARG N 1.0 -63.94 20.34 PSI 146 146 B 39 LEU N B 39 LEU CA B 39 LEU C B 40 GLY N 1.0 -11.87 27.41 PSI 147 147 B 40 GLY N B 40 GLY CA B 40 GLY C B 41 LEU N 1.0 -6.85 55.63 PSI 148 148 B 41 LEU N B 41 LEU CA B 41 LEU C B 42 ASN N 1.0 130.29 168.41 PSI 149 149 B 42 ASN N B 42 ASN CA B 42 ASN C B 43 GLU N 1.0 133.83 182.77 PSI 150 150 B 43 GLU N B 43 GLU CA B 43 GLU C B 44 GLU N 1.0 -49.77 -25.31 PSI 151 151 B 44 GLU N B 44 GLU CA B 44 GLU C B 45 GLN N 1.0 -56.02 -32.46 PSI 152 152 B 45 GLN N B 45 GLN CA B 45 GLN C B 46 ILE N 1.0 -56.61 -22.93 PSI 153 153 B 46 ILE N B 46 ILE CA B 46 ILE C B 47 GLU N 1.0 -53.37 -26.45 PSI 154 154 B 47 GLU N B 47 GLU CA B 47 GLU C B 48 ARG N 1.0 -45.82 -30.96 PSI 155 155 B 48 ARG N B 48 ARG CA B 48 ARG C B 49 TRP N 1.0 -58.01 -25.59 PSI 156 156 B 49 TRP N B 49 TRP CA B 49 TRP C B 50 PHE N 1.0 -53.67 -26.57 PSI 157 157 B 50 PHE N B 50 PHE CA B 50 PHE C B 51 ARG N 1.0 -54.44 -30.44 PSI 158 158 B 51 ARG N B 51 ARG CA B 51 ARG C B 52 ARG N 1.0 -57.50 -31.52 PSI 159 159 B 52 ARG N B 52 ARG CA B 52 ARG C B 53 LYS N 1.0 -62.12 -22.78 PSI 160 160 B 53 LYS N B 53 LYS CA B 53 LYS C B 54 GLU N 1.0 -47.42 -31.12 PSI 161 161 B 54 GLU N B 54 GLU CA B 54 GLU C B 55 GLN N 1.0 -52.31 -15.89 PSI 162 162 B 55 GLN N B 55 GLN CA B 55 GLN C B 56 GLN N 1.0 -52.36 -30.92 PSI 163 163 B 56 GLN N B 56 GLN CA B 56 GLN C B 57 ILE N 1.0 -51.61 -5.97 PSI 164 164 B 57 ILE N B 57 ILE CA B 57 ILE C B 58 GLY N 1.0 -30.10 20.54 PSI stop_ save_