data_nef_c17706_2leb save_entry_information _nef_nmr_meta_data.sf_category nef_nmr_meta_data _nef_nmr_meta_data.sf_framecode entry_information _nef_nmr_meta_data.format_name nmr_exchange_format _nef_nmr_meta_data.format_version 1.1 loop_ _nef_related_entries.database_name _nef_related_entries.database_accession_code BMRB 17705 PDB 21ea 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 -33 MET start . . 2 A -32 GLY middle . false 3 A -31 SER middle . . 4 A -30 SER middle . . 5 A -29 HIS middle . . 6 A -28 HIS middle . . 7 A -27 HIS middle . . 8 A -26 HIS middle . . 9 A -25 HIS middle . . 10 A -24 HIS middle . . 11 A -23 SER middle . . 12 A -22 SER middle . . 13 A -21 GLY middle . false 14 A -20 LEU middle . . 15 A -19 VAL middle . . 16 A -18 PRO middle . false 17 A -17 ARG middle . . 18 A -16 GLY middle . false 19 A -15 SER middle . . 20 A -14 HIS middle . . 21 A -13 MET middle . . 22 A -12 ALA middle . . 23 A -11 SER middle . . 24 A -10 MET middle . . 25 A -9 THR middle . . 26 A -8 GLY middle . false 27 A -7 GLY middle . false 28 A -6 GLN middle . . 29 A -5 GLN middle . . 30 A -4 MET middle . . 31 A -3 GLY middle . false 32 A -2 ARG middle . . 33 A -1 GLY middle . false 34 A 0 SER middle . . 35 A 1 MET middle . . 36 A 2 SER middle . . 37 A 3 TYR middle . . 38 A 4 GLY middle . false 39 A 5 ARG middle . . 40 A 6 PRO middle . false 41 A 7 PRO middle . false 42 A 8 PRO middle . false 43 A 9 ASP middle . . 44 A 10 VAL middle . . 45 A 11 GLU middle . . 46 A 12 GLY middle . false 47 A 13 MET middle . . 48 A 14 THR middle . . 49 A 15 SER middle . . 50 A 16 LEU middle . . 51 A 17 LYS middle . . 52 A 18 VAL middle . . 53 A 19 ASP middle . . 54 A 20 ASN middle . . 55 A 21 LEU middle . . 56 A 22 THR middle . . 57 A 23 TYR middle . . 58 A 24 ARG middle . . 59 A 25 THR middle . . 60 A 26 SER middle . . 61 A 27 PRO middle . false 62 A 28 ASP middle . . 63 A 29 THR middle . . 64 A 30 LEU middle . . 65 A 31 ARG middle . . 66 A 32 ARG middle . . 67 A 33 VAL middle . . 68 A 34 PHE middle . . 69 A 35 GLU middle . . 70 A 36 LYS middle . . 71 A 37 TYR middle . . 72 A 38 GLY middle . false 73 A 39 ARG middle . . 74 A 40 VAL middle . . 75 A 41 GLY middle . false 76 A 42 ASP middle . . 77 A 43 VAL middle . . 78 A 44 TYR middle . . 79 A 45 ILE middle . . 80 A 46 PRO middle . false 81 A 47 ARG middle . . 82 A 48 ASP middle . . 83 A 49 ARG middle . . 84 A 50 TYR middle . . 85 A 51 THR middle . . 86 A 52 LYS middle . . 87 A 53 GLU middle . . 88 A 54 SER middle . . 89 A 55 ARG middle . . 90 A 56 GLY middle . false 91 A 57 PHE middle . . 92 A 58 ALA middle . . 93 A 59 PHE middle . . 94 A 60 VAL middle . . 95 A 61 ARG middle . . 96 A 62 PHE middle . . 97 A 63 HIS middle . . 98 A 64 ASP middle . . 99 A 65 LYS middle . . 100 A 66 ARG middle . . 101 A 67 ASP middle . . 102 A 68 ALA middle . . 103 A 69 GLU middle . . 104 A 70 ASP middle . . 105 A 71 ALA middle . . 106 A 72 MET middle . . 107 A 73 ASP middle . . 108 A 74 ALA middle . . 109 A 75 MET middle . . 110 A 76 ASP middle . . 111 A 77 GLY middle . false 112 A 78 ALA middle . . 113 A 79 VAL middle . . 114 A 80 LEU middle . . 115 A 81 ASP middle . . 116 A 82 GLY middle . false 117 A 83 ARG middle . . 118 A 84 GLU middle . . 119 A 85 LEU middle . . 120 A 86 ARG middle . . 121 A 87 VAL middle . . 122 A 88 GLN middle . . 123 A 89 MET middle . . 124 A 90 ALA middle . . 125 A 91 ARG middle . . 126 A 92 TYR middle . . 127 A 93 GLY middle . false 128 A 94 ARG middle . . 129 A 95 PRO middle . false 130 A 96 PRO middle . false 131 A 97 ASP middle . . 132 A 98 SER middle . . 133 A 99 HIS middle . . 134 A 100 HIS middle . . 135 A 101 SER end . . 136 B 102 U start . . 137 B 103 C middle . . 138 B 104 C middle . . 139 B 105 A middle . . 140 B 106 G middle . . 141 B 107 U 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 2 SER H H 1 8.112 0.010 A 2 SER HA H 1 4.388 0.002 A 2 SER HBx H 1 3.742 0.002 A 2 SER HBy H 1 3.742 0.002 A 2 SER CA C 13 55.432 0.000 A 2 SER CB C 13 60.935 0.000 A 2 SER N N 15 116.424 0.000 A 3 TYR H H 1 8.182 0.004 A 3 TYR HA H 1 4.637 0.003 A 3 TYR HBx H 1 2.929 0.001 A 3 TYR HBy H 1 3.178 0.006 A 3 TYR HDx H 1 7.109 0.004 A 3 TYR HDy H 1 7.109 0.004 A 3 TYR HEx H 1 6.747 0.003 A 3 TYR HEy H 1 6.747 0.003 A 3 TYR CB C 13 35.822 0.034 A 3 TYR CDy C 13 133.131 0.004 A 3 TYR N N 15 121.580 0.005 A 4 GLY H H 1 8.361 0.002 A 4 GLY HAx H 1 3.948 0.000 A 4 GLY HAy H 1 3.948 0.000 A 4 GLY CA C 13 42.434 0.000 A 4 GLY N N 15 109.681 0.018 A 5 ARG H H 1 7.950 0.015 A 5 ARG HA H 1 4.579 0.000 A 5 ARG HBx H 1 1.563 0.000 A 5 ARG HBy H 1 1.563 0.000 A 5 ARG HDx H 1 3.122 0.008 A 5 ARG HDy H 1 3.122 0.008 A 5 ARG HGx H 1 1.729 0.000 A 5 ARG HGy H 1 1.729 0.000 A 5 ARG CD C 13 40.498 0.000 A 5 ARG N N 15 120.061 0.013 A 6 PRO HDx H 1 3.376 0.006 A 6 PRO HDy H 1 3.376 0.006 A 6 PRO CD C 13 47.233 0.025 A 8 PRO HA H 1 4.276 0.002 A 8 PRO HBx H 1 1.756 0.000 A 8 PRO HBy H 1 2.198 0.001 A 8 PRO CA C 13 60.335 0.000 A 8 PRO CB C 13 28.836 0.000 A 9 ASP H H 1 8.479 0.009 A 9 ASP HA H 1 4.547 0.002 A 9 ASP HBx H 1 2.685 0.002 A 9 ASP HBy H 1 2.685 0.002 A 9 ASP CB C 13 36.986 0.030 A 9 ASP N N 15 117.712 0.007 A 10 VAL H H 1 7.627 0.019 A 10 VAL HA H 1 4.024 0.002 A 10 VAL HB H 1 2.130 0.005 A 10 VAL HGx% H 1 0.769 0.006 A 10 VAL CA C 13 60.015 0.000 A 10 VAL CB C 13 28.938 0.000 A 10 VAL CGx C 13 17.413 0.000 A 10 VAL N N 15 118.590 0.008 A 11 GLU H H 1 8.507 0.017 A 11 GLU HA H 1 4.043 0.008 A 11 GLU HBx H 1 1.980 0.000 A 11 GLU HBy H 1 1.980 0.000 A 11 GLU HGx H 1 2.250 0.000 A 11 GLU HGy H 1 2.250 0.000 A 11 GLU CA C 13 55.341 0.000 A 11 GLU CB C 13 26.350 0.000 A 11 GLU CG C 13 33.296 0.000 A 11 GLU N N 15 122.294 0.017 A 12 GLY H H 1 8.063 0.000 A 12 GLY HAx H 1 3.878 0.001 A 12 GLY HAy H 1 4.101 0.004 A 12 GLY CA C 13 42.239 0.000 A 12 GLY N N 15 107.496 0.001 A 13 MET H H 1 7.462 0.000 A 13 MET HBx H 1 2.110 0.001 A 13 MET HBy H 1 2.510 0.002 A 13 MET HE% H 1 1.762 0.000 A 13 MET CB C 13 30.961 0.000 A 13 MET CE C 13 15.527 0.034 A 13 MET N N 15 118.513 0.018 A 14 THR H H 1 9.031 0.011 A 14 THR HA H 1 4.524 0.001 A 14 THR HB H 1 3.780 0.004 A 14 THR HG2% H 1 1.186 0.008 A 14 THR CB C 13 67.348 0.000 A 14 THR CG2 C 13 19.127 0.000 A 14 THR N N 15 119.367 0.020 A 15 SER H H 1 9.223 0.013 A 15 SER HA H 1 5.230 0.010 A 15 SER HBx H 1 3.599 0.000 A 15 SER HBy H 1 3.998 0.007 A 15 SER CA C 13 56.244 0.000 A 15 SER CB C 13 61.823 0.018 A 15 SER N N 15 123.278 0.000 A 16 LEU H H 1 9.396 0.013 A 16 LEU HA H 1 5.027 0.002 A 16 LEU HBx H 1 1.175 0.008 A 16 LEU HBy H 1 1.710 0.004 A 16 LEU HDx% H 1 0.871 0.001 A 16 LEU HDy% H 1 0.942 0.002 A 16 LEU CB C 13 40.969 0.026 A 16 LEU CDx C 13 20.677 0.000 A 16 LEU CDy C 13 23.902 0.000 A 16 LEU N N 15 123.351 0.012 A 17 LYS H H 1 9.263 0.006 A 17 LYS HA H 1 4.610 0.010 A 17 LYS HBx H 1 1.163 0.002 A 17 LYS HBy H 1 1.504 0.014 A 17 LYS HDx H 1 1.017 0.000 A 17 LYS HDy H 1 1.017 0.000 A 17 LYS HEx H 1 1.845 0.000 A 17 LYS HEy H 1 2.399 0.000 A 17 LYS HGx H 1 0.871 0.000 A 17 LYS HGy H 1 0.963 0.000 A 17 LYS CB C 13 32.081 0.025 A 17 LYS CE C 13 38.175 0.002 A 17 LYS N N 15 124.202 0.007 A 18 VAL H H 1 9.247 0.013 A 18 VAL HA H 1 4.755 0.002 A 18 VAL HB H 1 1.794 0.002 A 18 VAL HGx% H 1 0.691 0.002 A 18 VAL HGy% H 1 0.960 0.002 A 18 VAL CB C 13 30.590 0.000 A 18 VAL CGx C 13 18.458 0.000 A 18 VAL CGy C 13 19.982 0.002 A 18 VAL N N 15 130.111 0.009 A 19 ASP H H 1 9.269 0.008 A 19 ASP HA H 1 5.220 0.004 A 19 ASP HBx H 1 2.487 0.000 A 19 ASP HBy H 1 2.752 0.003 A 19 ASP CA C 13 50.511 0.000 A 19 ASP CB C 13 42.315 0.000 A 19 ASP N N 15 125.168 0.016 A 20 ASN H H 1 8.434 0.004 A 20 ASN HA H 1 4.533 0.005 A 20 ASN HBx H 1 2.787 0.001 A 20 ASN HBy H 1 3.548 0.006 A 20 ASN HD2y H 1 8.113 0.000 A 20 ASN HD2x H 1 6.749 0.001 A 20 ASN CB C 13 34.471 0.001 A 20 ASN N N 15 112.069 0.033 A 20 ASN ND2 N 15 111.705 0.009 A 21 LEU H H 1 7.446 0.007 A 21 LEU HA H 1 4.361 0.002 A 21 LEU HBx H 1 1.187 0.000 A 21 LEU HBy H 1 1.331 0.001 A 21 LEU HDx% H 1 0.549 0.002 A 21 LEU HDy% H 1 0.732 0.001 A 21 LEU HG H 1 1.431 0.005 A 21 LEU CB C 13 40.669 0.020 A 21 LEU CDy C 13 24.250 0.001 A 21 LEU CDx C 13 21.739 0.000 A 21 LEU N N 15 115.213 0.007 A 22 THR H H 1 8.341 0.004 A 22 THR HA H 1 4.358 0.023 A 22 THR HB H 1 4.407 0.008 A 22 THR HG2% H 1 1.361 0.008 A 22 THR CA C 13 57.847 0.000 A 22 THR CB C 13 67.874 0.000 A 22 THR CG2 C 13 19.870 0.000 A 22 THR N N 15 111.646 0.028 A 23 TYR H H 1 8.574 0.013 A 23 TYR HA H 1 4.332 0.036 A 23 TYR HBx H 1 3.058 0.002 A 23 TYR HBy H 1 3.177 0.000 A 23 TYR HDx H 1 7.070 0.004 A 23 TYR HDy H 1 7.070 0.004 A 23 TYR HEx H 1 6.761 0.007 A 23 TYR HEy H 1 6.761 0.007 A 23 TYR CA C 13 56.013 0.000 A 23 TYR CB C 13 34.030 0.007 A 23 TYR CDx C 13 132.716 0.000 A 23 TYR CEx C 13 118.348 0.000 A 23 TYR N N 15 121.961 0.010 A 24 ARG H H 1 7.306 0.011 A 24 ARG HA H 1 4.243 0.000 A 24 ARG HBx H 1 1.635 0.002 A 24 ARG HBy H 1 1.750 0.003 A 24 ARG HDx H 1 3.056 0.002 A 24 ARG HDy H 1 3.056 0.002 A 24 ARG HE H 1 7.939 0.001 A 24 ARG HGx H 1 1.199 0.002 A 24 ARG HGy H 1 1.385 0.008 A 24 ARG CA C 13 52.918 0.000 A 24 ARG CB C 13 27.167 0.004 A 24 ARG CD C 13 40.935 0.000 A 24 ARG CG C 13 23.066 0.032 A 24 ARG N N 15 115.017 0.007 A 24 ARG NE N 15 85.273 0.000 A 25 THR H H 1 7.336 0.003 A 25 THR HA H 1 4.028 0.014 A 25 THR HB H 1 3.995 0.011 A 25 THR HG2% H 1 1.103 0.006 A 25 THR CA C 13 62.017 0.034 A 25 THR CB C 13 65.531 0.000 A 25 THR N N 15 119.202 0.020 A 26 SER H H 1 8.341 0.000 A 26 SER HA H 1 4.844 0.004 A 26 SER HBx H 1 3.983 0.000 A 26 SER HBy H 1 4.359 0.012 A 26 SER CA C 13 52.638 0.034 A 26 SER CB C 13 61.560 0.000 A 26 SER N N 15 124.278 0.002 A 27 PRO HA H 1 4.013 0.021 A 27 PRO HDx H 1 3.765 0.000 A 27 PRO HDy H 1 3.993 0.002 A 27 PRO HGx H 1 1.926 0.008 A 27 PRO HGy H 1 2.244 0.006 A 27 PRO CA C 13 62.775 0.000 A 27 PRO CD C 13 47.752 0.031 A 27 PRO CG C 13 25.208 0.017 A 28 ASP H H 1 8.012 0.005 A 28 ASP HA H 1 4.374 0.016 A 28 ASP HBx H 1 2.618 0.003 A 28 ASP HBy H 1 2.618 0.003 A 28 ASP CA C 13 54.447 0.000 A 28 ASP CB C 13 38.036 0.018 A 28 ASP N N 15 115.653 0.008 A 29 THR H H 1 7.772 0.008 A 29 THR HA H 1 3.902 0.003 A 29 THR HB H 1 4.327 0.002 A 29 THR HG2% H 1 1.254 0.000 A 29 THR CA C 13 62.742 0.000 A 29 THR CB C 13 65.388 0.000 A 29 THR CG2 C 13 19.323 0.000 A 29 THR N N 15 118.138 0.003 A 30 LEU H H 1 7.434 0.013 A 30 LEU HA H 1 4.048 0.002 A 30 LEU HBx H 1 1.292 0.020 A 30 LEU HBy H 1 1.812 0.003 A 30 LEU HDx% H 1 0.609 0.001 A 30 LEU HDy% H 1 0.675 0.002 A 30 LEU HG H 1 1.563 0.005 A 30 LEU CA C 13 54.961 0.000 A 30 LEU CB C 13 39.534 0.028 A 30 LEU CDy C 13 22.925 0.029 A 30 LEU CDx C 13 21.038 0.044 A 30 LEU CG C 13 23.867 0.000 A 30 LEU N N 15 118.852 0.022 A 31 ARG H H 1 8.563 0.006 A 31 ARG HA H 1 3.628 0.001 A 31 ARG HBx H 1 1.956 0.010 A 31 ARG HBy H 1 1.956 0.010 A 31 ARG HDx H 1 3.152 0.001 A 31 ARG HDy H 1 3.284 0.002 A 31 ARG HE H 1 7.518 0.000 A 31 ARG HGx H 1 1.404 0.014 A 31 ARG HGy H 1 1.500 0.004 A 31 ARG CA C 13 57.985 0.000 A 31 ARG CD C 13 40.328 0.014 A 31 ARG N N 15 119.106 0.004 A 31 ARG NE N 15 84.274 0.001 A 32 ARG H H 1 7.780 0.002 A 32 ARG HA H 1 4.056 0.002 A 32 ARG HBx H 1 1.955 0.011 A 32 ARG HBy H 1 1.955 0.011 A 32 ARG HDx H 1 3.194 0.005 A 32 ARG HDy H 1 3.194 0.005 A 32 ARG HGx H 1 1.679 0.001 A 32 ARG HGy H 1 1.796 0.002 A 32 ARG CA C 13 56.295 0.025 A 32 ARG CB C 13 27.358 0.000 A 32 ARG CD C 13 40.533 0.000 A 32 ARG CG C 13 24.947 0.001 A 32 ARG N N 15 115.807 0.004 A 33 VAL H H 1 7.778 0.004 A 33 VAL HA H 1 3.909 0.003 A 33 VAL HB H 1 2.180 0.001 A 33 VAL HGx% H 1 0.809 0.002 A 33 VAL HGy% H 1 1.084 0.001 A 33 VAL CA C 13 62.241 0.000 A 33 VAL CB C 13 29.263 0.029 A 33 VAL CGx C 13 18.659 0.000 A 33 VAL CGy C 13 19.112 0.000 A 33 VAL N N 15 115.238 0.002 A 34 PHE H H 1 8.256 0.001 A 34 PHE HA H 1 4.502 0.007 A 34 PHE HBx H 1 3.042 0.005 A 34 PHE HBy H 1 3.160 0.006 A 34 PHE HDx H 1 7.729 0.009 A 34 PHE HDy H 1 7.729 0.009 A 34 PHE HEx H 1 6.971 0.001 A 34 PHE HEy H 1 6.971 0.001 A 34 PHE HZ H 1 6.953 0.009 A 34 PHE CB C 13 36.139 0.033 A 34 PHE CDy C 13 132.036 0.014 A 34 PHE CEy C 13 130.433 0.000 A 34 PHE CZ C 13 128.664 0.000 A 34 PHE N N 15 116.326 0.010 A 35 GLU H H 1 8.619 0.005 A 35 GLU HA H 1 5.062 0.003 A 35 GLU HBx H 1 2.093 0.000 A 35 GLU HBy H 1 2.276 0.001 A 35 GLU HGx H 1 2.418 0.002 A 35 GLU HGy H 1 2.553 0.002 A 35 GLU CA C 13 54.671 0.000 A 35 GLU CB C 13 25.902 0.021 A 35 GLU CG C 13 34.009 0.001 A 35 GLU N N 15 119.225 0.003 A 36 LYS H H 1 6.870 0.003 A 36 LYS HA H 1 3.886 0.001 A 36 LYS HBx H 1 1.120 0.000 A 36 LYS HBy H 1 1.409 0.000 A 36 LYS HDy H 1 1.519 0.001 A 36 LYS HEx H 1 2.861 0.001 A 36 LYS HEy H 1 2.861 0.001 A 36 LYS HGx H 1 0.927 0.002 A 36 LYS HGy H 1 1.071 0.000 A 36 LYS CA C 13 55.130 0.033 A 36 LYS CB C 13 28.962 0.005 A 36 LYS CD C 13 25.741 0.023 A 36 LYS CE C 13 39.065 0.000 A 36 LYS CG C 13 21.350 0.044 A 36 LYS N N 15 118.414 0.004 A 37 TYR H H 1 7.619 0.009 A 37 TYR HA H 1 4.310 0.002 A 37 TYR HBx H 1 2.795 0.020 A 37 TYR HBy H 1 3.338 0.005 A 37 TYR HDx H 1 7.211 0.002 A 37 TYR HDy H 1 7.211 0.002 A 37 TYR HEx H 1 6.613 0.006 A 37 TYR HEy H 1 6.613 0.006 A 37 TYR CA C 13 55.763 0.000 A 37 TYR CB C 13 36.453 0.005 A 37 TYR CDx C 13 132.589 0.000 A 37 TYR CEx C 13 118.339 0.000 A 37 TYR N N 15 115.035 0.005 A 38 GLY H H 1 7.363 0.003 A 38 GLY HAx H 1 3.835 0.002 A 38 GLY HAy H 1 4.624 0.000 A 38 GLY CA C 13 41.382 0.000 A 38 GLY N N 15 104.721 0.003 A 39 ARG H H 1 7.996 0.008 A 39 ARG HA H 1 4.378 0.005 A 39 ARG HBx H 1 1.920 0.005 A 39 ARG HBy H 1 1.920 0.005 A 39 ARG HDx H 1 3.161 0.001 A 39 ARG HDy H 1 3.161 0.001 A 39 ARG HGx H 1 1.635 0.002 A 39 ARG HGy H 1 1.766 0.002 A 39 ARG CA C 13 54.444 0.020 A 39 ARG CD C 13 40.552 0.000 A 39 ARG CG C 13 24.131 0.062 A 39 ARG N N 15 115.782 0.004 A 40 VAL H H 1 8.862 0.005 A 40 VAL HA H 1 3.646 0.004 A 40 VAL HB H 1 1.878 0.001 A 40 VAL HGx% H 1 0.468 0.003 A 40 VAL HGy% H 1 0.543 0.004 A 40 VAL CA C 13 59.296 0.039 A 40 VAL CB C 13 30.160 0.000 A 40 VAL CGx C 13 19.159 0.000 A 40 VAL CGy C 13 19.533 0.000 A 40 VAL N N 15 130.211 0.045 A 41 GLY H H 1 9.073 0.001 A 41 GLY HAx H 1 3.339 0.002 A 41 GLY HAy H 1 4.329 0.004 A 41 GLY CA C 13 42.700 0.011 A 41 GLY N N 15 115.326 0.005 A 42 ASP H H 1 7.353 0.002 A 42 ASP HA H 1 4.693 0.000 A 42 ASP HBx H 1 2.848 0.006 A 42 ASP HBy H 1 2.848 0.006 A 42 ASP CB C 13 41.207 0.000 A 42 ASP N N 15 115.706 0.017 A 43 VAL H H 1 7.451 0.009 A 43 VAL HA H 1 4.691 0.002 A 43 VAL HB H 1 1.841 0.003 A 43 VAL HGx% H 1 0.787 0.005 A 43 VAL HGy% H 1 0.837 0.004 A 43 VAL CB C 13 31.847 0.022 A 43 VAL CGx C 13 18.874 0.000 A 43 VAL CGy C 13 19.269 0.000 A 43 VAL N N 15 122.699 0.013 A 44 TYR H H 1 9.156 0.003 A 44 TYR HA H 1 5.095 0.010 A 44 TYR HBx H 1 2.729 0.003 A 44 TYR HBy H 1 2.922 0.014 A 44 TYR HDx H 1 6.835 0.007 A 44 TYR HDy H 1 6.835 0.007 A 44 TYR HEx H 1 6.553 0.007 A 44 TYR HEy H 1 6.553 0.007 A 44 TYR CA C 13 52.512 0.029 A 44 TYR CDy C 13 131.399 0.000 A 44 TYR CEy C 13 117.931 0.000 A 44 TYR N N 15 126.254 0.029 A 45 ILE H H 1 8.201 0.012 A 45 ILE HA H 1 4.280 0.001 A 45 ILE HB H 1 1.602 0.000 A 45 ILE HD1% H 1 0.521 0.007 A 45 ILE HG1x H 1 1.212 0.001 A 45 ILE HG1y H 1 1.212 0.001 A 45 ILE HG2% H 1 0.625 0.001 A 45 ILE CB C 13 35.778 0.043 A 45 ILE CD1 C 13 10.519 0.000 A 45 ILE CG2 C 13 13.796 0.020 A 45 ILE N N 15 129.723 0.044 A 46 PRO HA H 1 3.705 0.007 A 46 PRO HBx H 1 2.264 0.005 A 46 PRO HBy H 1 2.264 0.005 A 46 PRO HDx H 1 3.094 0.000 A 46 PRO HDy H 1 3.094 0.000 A 46 PRO HGx H 1 1.542 0.000 A 46 PRO HGy H 1 1.542 0.000 A 46 PRO CA C 13 59.668 0.000 A 46 PRO CD C 13 47.216 0.028 A 47 ARG H H 1 8.340 0.013 A 47 ARG HA H 1 4.642 0.000 A 47 ARG HBx H 1 1.376 0.006 A 47 ARG HBy H 1 1.376 0.006 A 47 ARG HDx H 1 3.037 0.020 A 47 ARG HDy H 1 3.037 0.020 A 47 ARG HE H 1 7.120 0.002 A 47 ARG HGx H 1 1.212 0.014 A 47 ARG HGy H 1 1.560 0.009 A 47 ARG CB C 13 29.579 0.000 A 47 ARG CD C 13 40.098 0.000 A 47 ARG CG C 13 24.331 0.007 A 47 ARG N N 15 119.862 0.007 A 47 ARG NE N 15 85.713 0.000 A 48 ASP H H 1 8.681 0.021 A 48 ASP HA H 1 4.380 0.005 A 48 ASP HBx H 1 2.476 0.005 A 48 ASP HBy H 1 2.998 0.003 A 48 ASP CA C 13 52.101 0.000 A 48 ASP CB C 13 40.610 0.000 A 48 ASP N N 15 123.986 0.010 A 49 ARG H H 1 8.738 0.005 A 49 ARG HA H 1 3.812 0.006 A 49 ARG HBx H 1 1.252 0.004 A 49 ARG HBy H 1 1.382 0.007 A 49 ARG HDx H 1 2.598 0.012 A 49 ARG HDy H 1 2.598 0.012 A 49 ARG HGx H 1 1.075 0.007 A 49 ARG HGy H 1 1.075 0.007 A 49 ARG CA C 13 55.307 0.000 A 49 ARG CB C 13 27.169 0.000 A 49 ARG CG C 13 23.491 0.007 A 49 ARG N N 15 126.275 0.033 A 50 TYR H H 1 8.523 0.002 A 50 TYR HA H 1 4.596 0.000 A 50 TYR HBx H 1 3.049 0.005 A 50 TYR HBy H 1 3.113 0.004 A 50 TYR HDx H 1 7.185 0.004 A 50 TYR HDy H 1 7.185 0.004 A 50 TYR HEx H 1 6.784 0.006 A 50 TYR HEy H 1 6.784 0.006 A 50 TYR CB C 13 35.574 0.018 A 50 TYR CDy C 13 133.094 0.000 A 50 TYR CEy C 13 118.113 0.000 A 50 TYR N N 15 117.791 0.013 A 51 THR H H 1 9.066 0.005 A 51 THR HA H 1 4.235 0.007 A 51 THR HB H 1 4.369 0.003 A 51 THR HG2% H 1 1.238 0.002 A 51 THR CA C 13 59.228 0.000 A 51 THR CB C 13 67.318 0.000 A 51 THR CG2 C 13 18.540 0.000 A 51 THR N N 15 110.505 0.005 A 52 LYS H H 1 7.860 0.006 A 52 LYS HA H 1 3.931 0.002 A 52 LYS HBx H 1 1.984 0.000 A 52 LYS HBy H 1 2.167 0.003 A 52 LYS HDx H 1 1.566 0.016 A 52 LYS HDy H 1 1.566 0.016 A 52 LYS HEx H 1 2.979 0.035 A 52 LYS HEy H 1 2.979 0.035 A 52 LYS HGx H 1 1.216 0.001 A 52 LYS HGy H 1 1.324 0.001 A 52 LYS CA C 13 54.646 0.034 A 52 LYS CD C 13 25.836 0.000 A 52 LYS CE C 13 39.642 0.000 A 52 LYS CG C 13 22.243 0.044 A 52 LYS N N 15 113.729 0.007 A 53 GLU H H 1 7.721 0.005 A 53 GLU HA H 1 4.340 0.010 A 53 GLU HBx H 1 1.740 0.003 A 53 GLU HBy H 1 1.991 0.001 A 53 GLU HGx H 1 2.184 0.003 A 53 GLU HGy H 1 2.250 0.000 A 53 GLU CA C 13 53.567 0.000 A 53 GLU CG C 13 33.253 0.033 A 53 GLU N N 15 119.127 0.004 A 54 SER H H 1 8.654 0.004 A 54 SER HA H 1 4.333 0.000 A 54 SER HBx H 1 3.705 0.004 A 54 SER HBy H 1 3.950 0.003 A 54 SER CB C 13 61.019 0.022 A 54 SER N N 15 116.299 0.002 A 55 ARG H H 1 8.012 0.005 A 55 ARG HA H 1 4.133 0.006 A 55 ARG HBx H 1 1.264 0.011 A 55 ARG HBy H 1 1.264 0.011 A 55 ARG HDx H 1 3.051 0.001 A 55 ARG HDy H 1 3.051 0.001 A 55 ARG HE H 1 7.429 0.002 A 55 ARG HGx H 1 2.167 0.004 A 55 ARG HGy H 1 2.167 0.004 A 55 ARG CA C 13 55.375 0.000 A 55 ARG CB C 13 28.161 0.000 A 55 ARG CD C 13 40.518 0.000 A 55 ARG N N 15 121.221 0.014 A 55 ARG NE N 15 84.584 0.000 A 56 GLY H H 1 8.405 0.008 A 56 GLY HAx H 1 3.492 0.005 A 56 GLY HAy H 1 4.310 0.012 A 56 GLY CA C 13 42.905 0.008 A 56 GLY N N 15 106.752 0.001 A 57 PHE H H 1 6.914 0.003 A 57 PHE HA H 1 5.596 0.006 A 57 PHE HBx H 1 2.819 0.009 A 57 PHE HBy H 1 3.057 0.006 A 57 PHE HDx H 1 6.550 0.005 A 57 PHE HDy H 1 6.550 0.005 A 57 PHE HEx H 1 7.126 0.004 A 57 PHE HEy H 1 7.126 0.004 A 57 PHE HZ H 1 7.076 0.022 A 57 PHE CA C 13 51.481 0.000 A 57 PHE CB C 13 39.229 0.000 A 57 PHE CDy C 13 132.374 0.011 A 57 PHE CEy C 13 130.838 0.000 A 57 PHE CZ C 13 128.251 0.000 A 57 PHE N N 15 112.983 0.013 A 58 ALA H H 1 8.821 0.002 A 58 ALA HA H 1 4.767 0.007 A 58 ALA HB% H 1 0.888 0.001 A 58 ALA CA C 13 46.720 0.000 A 58 ALA CB C 13 23.251 0.000 A 58 ALA N N 15 118.236 0.012 A 59 PHE H H 1 8.991 0.001 A 59 PHE HA H 1 5.701 0.005 A 59 PHE HBx H 1 2.749 0.003 A 59 PHE HBy H 1 2.749 0.003 A 59 PHE HDx H 1 6.914 0.007 A 59 PHE HDy H 1 6.914 0.007 A 59 PHE HEx H 1 7.106 0.000 A 59 PHE HEy H 1 7.106 0.000 A 59 PHE CA C 13 53.534 0.000 A 59 PHE CDx C 13 131.020 0.039 A 59 PHE N N 15 115.842 0.012 A 60 VAL H H 1 8.625 0.011 A 60 VAL HA H 1 4.254 0.008 A 60 VAL HB H 1 1.282 0.006 A 60 VAL HGx% H 1 0.213 0.003 A 60 VAL HGy% H 1 0.279 0.007 A 60 VAL CA C 13 58.598 0.000 A 60 VAL CB C 13 30.714 0.002 A 60 VAL CGx C 13 17.804 0.000 A 60 VAL CGy C 13 18.711 0.000 A 60 VAL N N 15 122.916 0.018 A 61 ARG H H 1 8.780 0.002 A 61 ARG HA H 1 5.411 0.013 A 61 ARG HBx H 1 1.652 0.011 A 61 ARG HBy H 1 1.652 0.011 A 61 ARG HDx H 1 2.782 0.000 A 61 ARG HDy H 1 2.782 0.000 A 61 ARG HGx H 1 1.252 0.009 A 61 ARG HGy H 1 1.252 0.009 A 61 ARG CA C 13 50.673 0.034 A 61 ARG CB C 13 29.124 0.000 A 61 ARG N N 15 124.385 0.016 A 62 PHE H H 1 9.251 0.007 A 62 PHE HA H 1 4.851 0.003 A 62 PHE HBx H 1 2.674 0.007 A 62 PHE HBy H 1 3.660 0.005 A 62 PHE HDx H 1 7.195 0.003 A 62 PHE HDy H 1 7.195 0.003 A 62 PHE HEx H 1 7.046 0.004 A 62 PHE HEy H 1 7.046 0.004 A 62 PHE HZ H 1 7.407 0.003 A 62 PHE CA C 13 54.520 0.000 A 62 PHE CB C 13 39.441 0.000 A 62 PHE CDx C 13 131.742 0.036 A 62 PHE CEx C 13 131.013 0.000 A 62 PHE CZ C 13 129.563 0.000 A 62 PHE N N 15 122.679 0.023 A 63 HIS H H 1 8.022 0.012 A 63 HIS HA H 1 4.359 0.011 A 63 HIS HBx H 1 3.151 0.002 A 63 HIS HBy H 1 3.303 0.004 A 63 HIS HD2 H 1 6.824 0.009 A 63 HIS HE1 H 1 8.087 0.000 A 63 HIS CA C 13 56.936 0.000 A 63 HIS CB C 13 27.011 0.012 A 63 HIS CD2 C 13 120.221 0.007 A 63 HIS CE1 C 13 138.448 0.000 A 63 HIS N N 15 119.799 0.011 A 64 ASP H H 1 9.140 0.005 A 64 ASP HA H 1 5.055 0.001 A 64 ASP HBx H 1 2.586 0.000 A 64 ASP HBy H 1 2.879 0.001 A 64 ASP CA C 13 50.044 0.000 A 64 ASP CB C 13 40.993 0.002 A 64 ASP N N 15 119.751 0.004 A 65 LYS H H 1 8.779 0.002 A 65 LYS HA H 1 3.840 0.003 A 65 LYS HBx H 1 1.788 0.002 A 65 LYS HBy H 1 1.942 0.005 A 65 LYS HDx H 1 1.681 0.003 A 65 LYS HDy H 1 1.681 0.003 A 65 LYS HEx H 1 2.954 0.010 A 65 LYS HEy H 1 2.954 0.010 A 65 LYS HGx H 1 1.354 0.000 A 65 LYS HGy H 1 1.418 0.004 A 65 LYS CA C 13 56.957 0.010 A 65 LYS CB C 13 30.072 0.020 A 65 LYS CE C 13 39.139 0.000 A 65 LYS CG C 13 21.721 0.029 A 65 LYS N N 15 127.656 0.012 A 66 ARG H H 1 8.598 0.003 A 66 ARG HA H 1 4.068 0.002 A 66 ARG HBx H 1 1.825 0.005 A 66 ARG HBy H 1 1.825 0.005 A 66 ARG HDx H 1 3.206 0.001 A 66 ARG HDy H 1 3.206 0.001 A 66 ARG HE H 1 7.476 0.000 A 66 ARG HGx H 1 1.704 0.001 A 66 ARG HGy H 1 1.704 0.001 A 66 ARG CB C 13 26.514 0.023 A 66 ARG CG C 13 24.010 0.000 A 66 ARG N N 15 118.552 0.002 A 66 ARG NE N 15 85.583 0.000 A 67 ASP H H 1 7.079 0.001 A 67 ASP HA H 1 4.203 0.001 A 67 ASP HBx H 1 2.642 0.026 A 67 ASP HBy H 1 2.942 0.025 A 67 ASP CA C 13 53.955 0.007 A 67 ASP N N 15 119.596 0.004 A 68 ALA H H 1 6.810 0.004 A 68 ALA HA H 1 2.896 0.003 A 68 ALA HB% H 1 1.268 0.001 A 68 ALA CA C 13 51.522 0.000 A 68 ALA CB C 13 15.355 0.000 A 68 ALA N N 15 119.561 0.003 A 69 GLU H H 1 8.008 0.004 A 69 GLU HA H 1 3.648 0.002 A 69 GLU HBx H 1 1.927 0.003 A 69 GLU HBy H 1 1.927 0.003 A 69 GLU HGx H 1 2.106 0.008 A 69 GLU HGy H 1 2.425 0.000 A 69 GLU CA C 13 56.927 0.000 A 69 GLU CB C 13 26.724 0.000 A 69 GLU CG C 13 33.879 0.000 A 69 GLU N N 15 117.453 0.003 A 70 ASP H H 1 8.008 0.010 A 70 ASP HA H 1 4.268 0.001 A 70 ASP HBx H 1 2.712 0.000 A 70 ASP HBy H 1 2.975 0.001 A 70 ASP CA C 13 54.239 0.000 A 70 ASP CB C 13 37.290 0.019 A 70 ASP N N 15 120.370 0.002 A 71 ALA H H 1 8.123 0.006 A 71 ALA HA H 1 2.827 0.004 A 71 ALA HB% H 1 1.284 0.001 A 71 ALA CA C 13 51.472 0.000 A 71 ALA CB C 13 16.928 0.000 A 71 ALA N N 15 122.195 0.003 A 72 MET H H 1 8.303 0.003 A 72 MET HA H 1 3.644 0.001 A 72 MET HBx H 1 1.917 0.007 A 72 MET HBy H 1 1.917 0.007 A 72 MET HE% H 1 2.117 0.002 A 72 MET HGx H 1 2.240 0.000 A 72 MET HGy H 1 2.365 0.003 A 72 MET CA C 13 57.019 0.000 A 72 MET CB C 13 30.002 0.000 A 72 MET CE C 13 14.449 0.000 A 72 MET CG C 13 28.190 0.000 A 72 MET N N 15 118.587 0.005 A 73 ASP H H 1 7.696 0.013 A 73 ASP HA H 1 4.319 0.002 A 73 ASP HBx H 1 2.630 0.002 A 73 ASP HBy H 1 2.724 0.004 A 73 ASP CB C 13 37.919 0.000 A 73 ASP N N 15 116.865 0.002 A 74 ALA H H 1 7.298 0.003 A 74 ALA HA H 1 4.112 0.002 A 74 ALA HB% H 1 1.044 0.004 A 74 ALA CA C 13 51.058 0.000 A 74 ALA CB C 13 17.366 0.000 A 74 ALA N N 15 118.013 0.000 A 75 MET H H 1 8.041 0.006 A 75 MET HA H 1 4.729 0.001 A 75 MET HBx H 1 1.916 0.010 A 75 MET HBy H 1 1.916 0.010 A 75 MET HE% H 1 1.484 0.006 A 75 MET HGx H 1 1.632 0.000 A 75 MET HGy H 1 1.751 0.000 A 75 MET CA C 13 50.438 0.000 A 75 MET CE C 13 12.316 0.000 A 75 MET N N 15 112.292 0.003 A 76 ASP H H 1 7.800 0.008 A 76 ASP HA H 1 4.390 0.005 A 76 ASP HBx H 1 2.758 0.000 A 76 ASP HBy H 1 2.989 0.000 A 76 ASP CA C 13 54.835 0.000 A 76 ASP CB C 13 38.427 0.000 A 76 ASP N N 15 119.960 0.001 A 77 GLY H H 1 8.604 0.008 A 77 GLY HAx H 1 3.678 0.001 A 77 GLY HAy H 1 4.233 0.001 A 77 GLY CA C 13 42.772 0.005 A 77 GLY N N 15 117.720 0.002 A 78 ALA H H 1 7.912 0.003 A 78 ALA HA H 1 4.303 0.004 A 78 ALA HB% H 1 1.434 0.010 A 78 ALA CA C 13 49.091 0.000 A 78 ALA CB C 13 17.192 0.004 A 78 ALA N N 15 123.735 0.000 A 79 VAL H H 1 8.068 0.014 A 79 VAL HA H 1 4.627 0.005 A 79 VAL HB H 1 1.786 0.004 A 79 VAL HGx% H 1 0.657 0.001 A 79 VAL HGy% H 1 0.831 0.002 A 79 VAL CB C 13 29.698 0.000 A 79 VAL CGx C 13 18.170 0.000 A 79 VAL CGy C 13 18.916 0.000 A 79 VAL N N 15 118.725 0.007 A 80 LEU H H 1 8.889 0.005 A 80 LEU HA H 1 4.550 0.013 A 80 LEU HBx H 1 1.188 0.005 A 80 LEU HBy H 1 1.791 0.002 A 80 LEU HDx% H 1 0.824 0.003 A 80 LEU HDy% H 1 0.901 0.000 A 80 LEU HG H 1 1.434 0.003 A 80 LEU CB C 13 42.418 0.033 A 80 LEU CDy C 13 23.521 0.000 A 80 LEU CDx C 13 21.293 0.000 A 80 LEU N N 15 129.443 0.003 A 81 ASP H H 1 9.425 0.007 A 81 ASP HA H 1 4.227 0.001 A 81 ASP HBx H 1 2.234 0.003 A 81 ASP HBy H 1 3.071 0.003 A 81 ASP CA C 13 52.030 0.000 A 81 ASP CB C 13 37.032 0.011 A 81 ASP N N 15 129.558 0.004 A 82 GLY H H 1 8.005 0.006 A 82 GLY HAx H 1 3.465 0.001 A 82 GLY HAy H 1 4.016 0.001 A 82 GLY CA C 13 42.597 0.026 A 82 GLY N N 15 100.653 0.000 A 83 ARG H H 1 7.494 0.006 A 83 ARG HA H 1 4.543 0.003 A 83 ARG HBx H 1 1.801 0.004 A 83 ARG HBy H 1 1.801 0.004 A 83 ARG HDx H 1 3.014 0.003 A 83 ARG HDy H 1 3.014 0.003 A 83 ARG HE H 1 6.909 0.004 A 83 ARG HGx H 1 1.434 0.004 A 83 ARG HGy H 1 1.671 0.001 A 83 ARG CA C 13 51.375 0.000 A 83 ARG CB C 13 30.333 0.000 A 83 ARG CD C 13 40.084 0.000 A 83 ARG CG C 13 24.127 0.003 A 83 ARG N N 15 120.115 0.005 A 83 ARG NE N 15 84.634 0.000 A 84 GLU H H 1 8.349 0.009 A 84 GLU HA H 1 4.301 0.003 A 84 GLU HBx H 1 1.782 0.005 A 84 GLU HBy H 1 1.858 0.004 A 84 GLU HGx H 1 2.051 0.002 A 84 GLU HGy H 1 2.134 0.003 A 84 GLU CA C 13 53.137 0.000 A 84 GLU CB C 13 26.935 0.036 A 84 GLU CG C 13 33.365 0.017 A 84 GLU N N 15 121.248 0.001 A 85 LEU H H 1 9.361 0.002 A 85 LEU HA H 1 4.557 0.013 A 85 LEU HBx H 1 1.238 0.002 A 85 LEU HBy H 1 2.114 0.004 A 85 LEU HDx% H 1 0.745 0.001 A 85 LEU HDy% H 1 0.760 0.000 A 85 LEU HG H 1 1.894 0.006 A 85 LEU CB C 13 40.575 0.036 A 85 LEU CDx C 13 19.627 0.037 A 85 LEU CDy C 13 22.448 0.000 A 85 LEU N N 15 128.085 0.003 A 86 ARG H H 1 7.484 0.012 A 86 ARG HA H 1 5.165 0.002 A 86 ARG HBx H 1 1.706 0.002 A 86 ARG HBy H 1 1.878 0.000 A 86 ARG HDx H 1 3.245 0.000 A 86 ARG HDy H 1 3.245 0.000 A 86 ARG HE H 1 7.635 0.000 A 86 ARG HGx H 1 1.583 0.001 A 86 ARG HGy H 1 1.653 0.000 A 86 ARG CA C 13 51.312 0.000 A 86 ARG CB C 13 29.376 0.000 A 86 ARG CD C 13 40.221 0.000 A 86 ARG CG C 13 24.010 0.035 A 86 ARG N N 15 121.116 0.012 A 86 ARG NE N 15 85.175 0.003 A 87 VAL H H 1 9.376 0.008 A 87 VAL HA H 1 5.013 0.005 A 87 VAL HB H 1 1.911 0.010 A 87 VAL HGx% H 1 0.978 0.000 A 87 VAL HGy% H 1 1.018 0.000 A 87 VAL CA C 13 58.310 0.000 A 87 VAL CB C 13 31.333 0.000 A 87 VAL CGy C 13 21.988 0.000 A 87 VAL CGx C 13 19.429 0.000 A 87 VAL N N 15 126.175 0.006 A 88 GLN H H 1 8.496 0.007 A 88 GLN HA H 1 4.979 0.028 A 88 GLN HBx H 1 2.006 0.000 A 88 GLN HBy H 1 2.101 0.001 A 88 GLN HE2y H 1 7.531 0.010 A 88 GLN HE2x H 1 6.830 0.009 A 88 GLN HGx H 1 2.327 0.002 A 88 GLN HGy H 1 2.327 0.002 A 88 GLN CA C 13 50.631 0.000 A 88 GLN CB C 13 30.515 0.000 A 88 GLN CG C 13 30.652 0.005 A 88 GLN N N 15 122.141 0.006 A 88 GLN NE2 N 15 112.378 0.003 A 89 MET H H 1 8.738 0.009 A 89 MET HA H 1 4.597 0.000 A 89 MET HBx H 1 2.005 0.000 A 89 MET HBy H 1 2.005 0.000 A 89 MET HE% H 1 1.929 0.000 A 89 MET HGx H 1 2.599 0.003 A 89 MET HGy H 1 2.750 0.001 A 89 MET CB C 13 28.654 0.000 A 89 MET CE C 13 14.020 0.000 A 89 MET CG C 13 29.340 0.016 A 89 MET N N 15 121.805 0.014 A 90 ALA H H 1 8.643 0.001 A 90 ALA HA H 1 4.595 0.000 A 90 ALA HB% H 1 1.472 0.006 A 90 ALA CB C 13 16.432 0.000 A 90 ALA N N 15 127.625 0.003 A 91 ARG H H 1 10.211 0.040 A 91 ARG HA H 1 4.200 0.004 A 91 ARG HBx H 1 1.474 0.007 A 91 ARG HBy H 1 1.474 0.007 A 91 ARG HGx H 1 1.366 0.000 A 91 ARG HGy H 1 1.366 0.000 A 91 ARG CA C 13 54.040 0.000 A 91 ARG CB C 13 28.411 0.000 A 91 ARG CG C 13 23.415 0.000 A 92 TYR H H 1 8.170 0.004 A 92 TYR HBx H 1 2.887 0.005 A 92 TYR HBy H 1 3.102 0.006 A 92 TYR HDx H 1 7.036 0.003 A 92 TYR HDy H 1 7.036 0.003 A 92 TYR HEx H 1 6.708 0.003 A 92 TYR HEy H 1 6.708 0.003 A 92 TYR CB C 13 36.766 0.023 A 92 TYR CDx C 13 133.329 0.032 A 92 TYR CEx C 13 117.899 0.000 A 92 TYR N N 15 120.061 0.026 A 93 GLY H H 1 8.318 0.012 A 93 GLY HAx H 1 3.703 0.001 A 93 GLY HAy H 1 3.703 0.001 A 93 GLY CA C 13 41.898 0.000 A 93 GLY N N 15 109.723 0.016 A 94 ARG H H 1 8.049 0.013 A 94 ARG HA H 1 4.207 0.012 A 94 ARG HBx H 1 1.481 0.008 A 94 ARG HBy H 1 1.481 0.008 A 94 ARG HDx H 1 3.012 0.011 A 94 ARG HDy H 1 3.012 0.011 A 94 ARG HE H 1 7.124 0.002 A 94 ARG HGx H 1 1.613 0.000 A 94 ARG HGy H 1 1.613 0.000 A 94 ARG CB C 13 28.149 0.018 A 94 ARG N N 15 120.983 0.017 A 94 ARG NE N 15 84.981 0.000 A 95 PRO HDx H 1 3.472 0.000 A 95 PRO HDy H 1 3.724 0.001 A 95 PRO HGx H 1 1.957 0.000 A 95 PRO HGy H 1 1.957 0.000 A 95 PRO CD C 13 47.533 0.002 A 96 PRO HBx H 1 2.176 0.000 A 96 PRO HBy H 1 2.176 0.000 A 97 ASP H H 1 8.189 0.006 A 97 ASP HA H 1 4.504 0.002 A 97 ASP HBx H 1 2.573 0.000 A 97 ASP HBy H 1 2.573 0.000 A 97 ASP CB C 13 38.288 0.024 A 97 ASP N N 15 119.731 0.004 A 98 SER H H 1 8.071 0.000 A 98 SER HA H 1 4.292 0.002 A 98 SER HBx H 1 3.734 0.015 A 98 SER HBy H 1 3.734 0.015 A 98 SER CA C 13 55.578 0.000 A 98 SER N N 15 115.957 0.005 A 99 HIS HBx H 1 3.011 0.000 A 99 HIS HBy H 1 3.100 0.000 A 99 HIS HD2 H 1 7.071 0.003 A 99 HIS HE1 H 1 8.253 0.002 A 99 HIS CB C 13 26.829 0.001 A 99 HIS CD2 C 13 119.755 0.000 A 99 HIS CE1 C 13 137.118 0.000 A 100 HIS H H 1 8.293 0.005 A 100 HIS HBx H 1 3.135 0.000 A 100 HIS HBy H 1 3.222 0.000 A 100 HIS HD2 H 1 7.152 0.001 A 100 HIS HE1 H 1 8.283 0.002 A 100 HIS CB C 13 26.620 0.000 A 100 HIS CD2 C 13 119.968 0.000 A 100 HIS CE1 C 13 136.948 0.000 A 101 SER H H 1 8.163 0.010 A 101 SER HA H 1 4.256 0.002 A 101 SER HBx H 1 3.847 0.001 A 101 SER HBy H 1 3.847 0.001 A 101 SER CA C 13 57.127 0.000 A 101 SER CB C 13 61.230 0.000 A 101 SER N N 15 123.224 0.002 B 102 U H1' H 1 5.667 0.002 B 102 U H2' H 1 4.253 0.009 B 102 U H3' H 1 4.579 0.008 B 102 U H4' H 1 4.117 0.003 B 102 U H5 H 1 5.923 0.009 B 102 U H6 H 1 7.801 0.002 B 103 C H1' H 1 6.424 0.002 B 103 C H2' H 1 4.356 0.003 B 103 C H3' H 1 5.007 0.002 B 103 C H4' H 1 4.243 0.006 B 103 C H5 H 1 6.117 0.003 B 103 C H6 H 1 7.850 0.003 B 104 C H1' H 1 6.364 0.005 B 104 C H2' H 1 4.200 0.010 B 104 C H3' H 1 4.745 0.002 B 104 C H4' H 1 4.480 0.009 B 104 C H5 H 1 6.037 0.004 B 104 C H6 H 1 7.751 0.003 B 105 A H1' H 1 6.154 0.001 B 105 A H2 H 1 8.192 0.003 B 105 A H2' H 1 4.930 0.003 B 105 A H3' H 1 4.792 0.007 B 105 A H4' H 1 4.361 0.004 B 105 A H8 H 1 8.590 0.002 B 106 G H1' H 1 5.912 0.006 B 106 G H2' H 1 4.671 0.003 B 106 G H3' H 1 4.811 0.004 B 106 G H4' H 1 4.239 0.003 B 106 G H8 H 1 7.973 0.002 B 107 U H1' H 1 5.934 0.004 B 107 U H2' H 1 4.330 0.002 B 107 U H3' H 1 4.233 0.002 B 107 U H5 H 1 5.934 0.000 B 107 U H6 H 1 7.887 0.002 stop_ save_ save_AMBER_distance_constraints_2 _nef_distance_restraint_list.sf_category nef_distance_restraint_list _nef_distance_restraint_list.sf_framecode AMBER_distance_constraints_2 _nef_distance_restraint_list.restraint_origin noe _nef_distance_restraint_list.potential_type square-well-parabolic loop_ _nef_distance_restraint.index _nef_distance_restraint.restraint_id _nef_distance_restraint.chain_code_1 _nef_distance_restraint.sequence_code_1 _nef_distance_restraint.residue_name_1 _nef_distance_restraint.atom_name_1 _nef_distance_restraint.chain_code_2 _nef_distance_restraint.sequence_code_2 _nef_distance_restraint.residue_name_2 _nef_distance_restraint.atom_name_2 _nef_distance_restraint.weight _nef_distance_restraint.lower_limit _nef_distance_restraint.upper_limit 1 1 A 63 HIS HE1 A 13 MET HBy 1.0 1.8 6.67 2 1 A 13 MET HBx A 63 HIS HE1 1.0 1.8 6.67 3 2 A 84 GLU HGy A 20 ASN HD2x 1.0 1.8 6.67 4 2 A 20 ASN HD2y A 84 GLU HGy 1.0 1.8 6.67 5 3 A 20 ASN HD2x A 84 GLU HA 1.0 1.8 6.67 6 3 A 20 ASN HD2y A 84 GLU HA 1.0 1.8 6.67 7 4 A 75 MET HBx A 34 PHE HDy 1.0 1.8 7.11 8 4 A 75 MET HBy A 34 PHE HDy 1.0 1.8 7.11 9 4 A 34 PHE HDx A 75 MET HBy 1.0 1.8 7.11 10 4 A 34 PHE HDx A 75 MET HBx 1.0 1.8 7.11 11 5 A 34 PHE HDy A 40 VAL HB 1.0 1.8 6.61 12 5 A 34 PHE HDx A 40 VAL HB 1.0 1.8 6.61 13 6 A 34 PHE HDx A 33 VAL HGx% 1.0 1.8 7.87 14 6 A 34 PHE HDy A 33 VAL HGy% 1.0 1.8 7.87 15 6 A 34 PHE HDx A 33 VAL HGy% 1.0 1.8 7.87 16 6 A 34 PHE HDy A 33 VAL HGx% 1.0 1.8 7.87 17 7 A 34 PHE HDx A 40 VAL HGx% 1.0 1.8 7.13 18 7 A 34 PHE HDy A 40 VAL HGy% 1.0 1.8 7.13 19 7 A 34 PHE HDx A 40 VAL HGy% 1.0 1.8 7.13 20 7 A 34 PHE HDy A 40 VAL HGx% 1.0 1.8 7.13 21 8 A 34 PHE HDy A 30 LEU HA 1.0 1.8 5.23 22 8 A 34 PHE HDx A 30 LEU HA 1.0 1.8 5.23 23 9 A 34 PHE HDy A 31 ARG HA 1.0 1.8 6.31 24 9 A 34 PHE HDx A 31 ARG HA 1.0 1.8 6.31 25 10 A 34 PHE HDy A 40 VAL HA 1.0 1.8 6.67 26 10 A 34 PHE HDx A 40 VAL HA 1.0 1.8 6.67 27 11 A 34 PHE HDy A 37 TYR HBx 1.0 1.8 6.35 28 11 A 34 PHE HDx A 37 TYR HBx 1.0 1.8 6.35 29 12 A 34 PHE HDy A 37 TYR HBy 1.0 1.8 6.26 30 12 A 34 PHE HDx A 37 TYR HBy 1.0 1.8 6.26 31 13 A 34 PHE HDy A 71 ALA HA 1.0 1.8 6.54 32 13 A 34 PHE HDx A 71 ALA HA 1.0 1.8 6.54 33 14 A 34 PHE HDy A 33 VAL HB 1.0 1.8 5.83 34 14 A 34 PHE HDx A 33 VAL HB 1.0 1.8 5.83 35 15 A 34 PHE HDy A 30 LEU HBx 1.0 1.8 5.38 36 15 A 34 PHE HDx A 30 LEU HBx 1.0 1.8 5.38 37 16 A 34 PHE HDy A 60 VAL HGx% 1.0 1.8 6.20 38 16 A 34 PHE HDy A 60 VAL HGy% 1.0 1.8 6.20 39 16 A 34 PHE HDx A 60 VAL HGy% 1.0 1.8 6.20 40 16 A 34 PHE HDx A 60 VAL HGx% 1.0 1.8 6.20 41 17 A 40 VAL HA A 62 PHE HZ 1.0 1.8 5.87 42 18 A 37 TYR HBx A 62 PHE HZ 1.0 1.8 5.70 43 19 A 62 PHE HZ A 34 PHE HBy 1.0 1.8 5.20 44 20 A 62 PHE HZ A 34 PHE HBx 1.0 1.8 5.26 45 21 A 37 TYR HBy A 62 PHE HZ 1.0 1.8 6.00 46 22 A 71 ALA HA A 62 PHE HZ 1.0 1.8 6.00 47 23 A 40 VAL HB A 62 PHE HZ 1.0 1.8 6.00 48 24 A 40 VAL HGx% A 62 PHE HZ 1.0 1.8 6.39 49 24 A 40 VAL HGy% A 62 PHE HZ 1.0 1.8 6.39 50 25 A 34 PHE HDy A 37 TYR HDx 1.0 1.8 5.56 51 25 A 34 PHE HDy A 37 TYR HDy 1.0 1.8 5.56 52 25 A 34 PHE HDx A 37 TYR HDy 1.0 1.8 5.56 53 25 A 34 PHE HDx A 37 TYR HDx 1.0 1.8 5.56 54 26 A 62 PHE HZ A 37 TYR HDy 1.0 1.8 5.52 55 26 A 62 PHE HZ A 37 TYR HDx 1.0 1.8 5.52 56 27 A 71 ALA HA A 37 TYR HDy 1.0 1.8 4.91 57 27 A 71 ALA HA A 37 TYR HDx 1.0 1.8 4.91 58 28 A 37 TYR HDy A 36 LYS HGy 1.0 1.8 5.43 59 28 A 37 TYR HDx A 36 LYS HGy 1.0 1.8 5.43 60 28 A 37 TYR HDy A 36 LYS HGx 1.0 1.8 5.43 61 28 A 37 TYR HDx A 36 LYS HGx 1.0 1.8 5.43 62 29 A 62 PHE HDx A 39 ARG HBy 1.0 1.8 7.10 63 29 A 62 PHE HDy A 39 ARG HBy 1.0 1.8 7.10 64 29 A 39 ARG HBx A 62 PHE HDy 1.0 1.8 7.10 65 29 A 39 ARG HBx A 62 PHE HDx 1.0 1.8 7.10 66 30 A 62 PHE HDy A 61 ARG HBy 1.0 1.8 7.20 67 30 A 62 PHE HDx A 61 ARG HBy 1.0 1.8 7.20 68 30 A 62 PHE HDy A 61 ARG HBx 1.0 1.8 7.20 69 30 A 62 PHE HDx A 61 ARG HBx 1.0 1.8 7.20 70 31 A 37 TYR HDx A 36 LYS HDy 1.0 1.8 6.59 71 31 A 37 TYR HDy A 36 LYS HDy 1.0 1.8 6.59 72 31 A 37 TYR HDy A 36 LYS HDx 1.0 1.8 6.59 73 31 A 37 TYR HDx A 36 LYS HDx 1.0 1.8 6.59 74 32 A 37 TYR HDy A 36 LYS HBy 1.0 1.8 6.35 75 32 A 37 TYR HDx A 36 LYS HBy 1.0 1.8 6.35 76 33 A 50 TYR HDx A 49 ARG HBy 1.0 1.8 7.38 77 33 A 50 TYR HDy A 49 ARG HBy 1.0 1.8 7.38 78 33 A 49 ARG HBx A 50 TYR HDy 1.0 1.8 7.38 79 33 A 49 ARG HBx A 50 TYR HDx 1.0 1.8 7.38 80 34 A 62 PHE HDy A 16 LEU HA 1.0 1.8 6.48 81 34 A 62 PHE HDx A 16 LEU HA 1.0 1.8 6.48 82 35 A 37 TYR HDy A 35 GLU HA 1.0 1.8 6.67 83 35 A 37 TYR HDx A 35 GLU HA 1.0 1.8 6.67 84 36 A 62 PHE HDy A 62 PHE HA 1.0 1.8 4.80 85 36 A 62 PHE HDx A 62 PHE HA 1.0 1.8 4.80 86 37 A 50 TYR HDy A 48 ASP HA 1.0 1.8 6.67 87 37 A 50 TYR HDx A 48 ASP HA 1.0 1.8 6.67 88 38 A 62 PHE HDy A 39 ARG HGy 1.0 1.8 6.71 89 38 A 62 PHE HDx A 39 ARG HGy 1.0 1.8 6.71 90 38 A 62 PHE HDy A 39 ARG HGx 1.0 1.8 6.71 91 38 A 62 PHE HDx A 39 ARG HGx 1.0 1.8 6.71 92 39 A 37 TYR HDy A 75 MET HGx 1.0 1.8 7.25 93 39 A 37 TYR HDx A 75 MET HGy 1.0 1.8 7.25 94 39 A 37 TYR HDx A 75 MET HGx 1.0 1.8 7.25 95 39 A 37 TYR HDy A 75 MET HGy 1.0 1.8 7.25 96 40 A 62 PHE HDy A 16 LEU HBy 1.0 1.8 6.59 97 40 A 62 PHE HDx A 16 LEU HBy 1.0 1.8 6.59 98 40 A 62 PHE HDy A 16 LEU HBx 1.0 1.8 6.59 99 40 A 62 PHE HDx A 16 LEU HBx 1.0 1.8 6.59 100 41 A 37 TYR HDx A 71 ALA HB% 1.0 1.8 5.24 101 41 A 37 TYR HDy A 71 ALA HB% 1.0 1.8 5.24 102 42 A 37 TYR HDy A 36 LYS HGy 1.0 1.8 5.89 103 42 A 37 TYR HDx A 36 LYS HGy 1.0 1.8 5.89 104 42 A 37 TYR HDy A 36 LYS HGx 1.0 1.8 5.89 105 42 A 37 TYR HDx A 36 LYS HGx 1.0 1.8 5.89 106 43 A 40 VAL HGx% A 37 TYR HDy 1.0 1.8 8.82 107 43 A 40 VAL HGy% A 37 TYR HDy 1.0 1.8 8.82 108 43 A 40 VAL HGx% A 37 TYR HDx 1.0 1.8 8.82 109 43 A 40 VAL HGy% A 37 TYR HDx 1.0 1.8 8.82 110 44 A 60 VAL HGx% A 62 PHE HDx 1.0 1.8 6.64 111 44 A 60 VAL HGy% A 62 PHE HDx 1.0 1.8 6.64 112 44 A 60 VAL HGx% A 62 PHE HDy 1.0 1.8 6.64 113 44 A 60 VAL HGy% A 62 PHE HDy 1.0 1.8 6.64 114 45 A 57 PHE HA A 57 PHE HEy 1.0 1.8 6.67 115 45 A 57 PHE HA A 57 PHE HEx 1.0 1.8 6.67 116 46 A 57 PHE HEy A 45 ILE HA 1.0 1.8 6.43 117 46 A 57 PHE HEx A 45 ILE HA 1.0 1.8 6.43 118 47 A 61 ARG HDx A 59 PHE HEy 1.0 1.8 7.43 119 47 A 61 ARG HDy A 59 PHE HEy 1.0 1.8 7.43 120 47 A 59 PHE HEx A 61 ARG HDy 1.0 1.8 7.43 121 47 A 59 PHE HEx A 61 ARG HDx 1.0 1.8 7.43 122 48 A 57 PHE HEy A 46 PRO HBy 1.0 1.8 7.43 123 48 A 57 PHE HEx A 46 PRO HBy 1.0 1.8 7.43 124 48 A 57 PHE HEy A 46 PRO HBx 1.0 1.8 7.43 125 48 A 57 PHE HEx A 46 PRO HBx 1.0 1.8 7.43 126 49 A 59 PHE HEy A 17 LYS HBx 1.0 1.8 4.78 127 49 A 59 PHE HEx A 17 LYS HBx 1.0 1.8 4.78 128 50 A 59 PHE HEy A 17 LYS HDy 1.0 1.8 6.82 129 50 A 59 PHE HEx A 17 LYS HDy 1.0 1.8 6.82 130 50 A 59 PHE HEy A 17 LYS HDx 1.0 1.8 6.82 131 50 A 59 PHE HEx A 17 LYS HDx 1.0 1.8 6.82 132 51 A 57 PHE HEy A 46 PRO HDy 1.0 1.8 5.17 133 51 A 57 PHE HEx A 46 PRO HDy 1.0 1.8 5.17 134 51 A 57 PHE HEy A 46 PRO HDx 1.0 1.8 5.17 135 51 A 57 PHE HEx A 46 PRO HDx 1.0 1.8 5.17 136 52 A 57 PHE HEx A 46 PRO HGy 1.0 1.8 6.33 137 52 A 57 PHE HEy A 46 PRO HGy 1.0 1.8 6.33 138 52 A 57 PHE HEy A 46 PRO HGx 1.0 1.8 6.33 139 52 A 57 PHE HEx A 46 PRO HGx 1.0 1.8 6.33 140 53 A 59 PHE HEx A 17 LYS HEy 1.0 1.8 7.01 141 53 A 59 PHE HEy A 17 LYS HEx 1.0 1.8 7.01 142 53 A 59 PHE HEx A 17 LYS HEx 1.0 1.8 7.01 143 53 A 59 PHE HEy A 17 LYS HEy 1.0 1.8 7.01 144 54 A 43 VAL HB A 3 TYR HDy 1.0 1.8 6.67 145 54 A 3 TYR HDx A 43 VAL HB 1.0 1.8 6.67 146 55 A 62 PHE HEx A 75 MET HE% 1.0 1.8 7.78 147 55 A 75 MET HE% A 62 PHE HEy 1.0 1.8 7.78 148 56 A 46 PRO HBy A 57 PHE HZ 1.0 1.8 6.47 149 56 A 46 PRO HBx A 57 PHE HZ 1.0 1.8 6.47 150 57 A 34 PHE HDy A 62 PHE HEy 1.0 1.8 5.45 151 57 A 34 PHE HDy A 62 PHE HEx 1.0 1.8 5.45 152 57 A 34 PHE HDx A 62 PHE HEy 1.0 1.8 5.45 153 57 A 34 PHE HDx A 62 PHE HEx 1.0 1.8 5.45 154 58 A 35 GLU HA A 62 PHE HEy 1.0 1.8 5.61 155 58 A 35 GLU HA A 62 PHE HEx 1.0 1.8 5.61 156 59 A 62 PHE HA A 62 PHE HEy 1.0 1.8 6.07 157 59 A 62 PHE HA A 62 PHE HEx 1.0 1.8 6.07 158 60 A 40 VAL HA A 62 PHE HEy 1.0 1.8 5.11 159 60 A 40 VAL HA A 62 PHE HEx 1.0 1.8 5.11 160 61 A 37 TYR HBx A 62 PHE HEy 1.0 1.8 6.24 161 61 A 37 TYR HBx A 62 PHE HEx 1.0 1.8 6.24 162 62 A 62 PHE HEy A 60 VAL HB 1.0 1.8 4.89 163 62 A 62 PHE HEx A 60 VAL HB 1.0 1.8 4.89 164 63 A 71 ALA HB% A 62 PHE HEx 1.0 1.8 5.92 165 63 A 71 ALA HB% A 62 PHE HEy 1.0 1.8 5.92 166 64 A 62 PHE HEx A 16 LEU HDx% 1.0 1.8 5.86 167 64 A 62 PHE HEy A 16 LEU HDx% 1.0 1.8 5.86 168 64 A 62 PHE HEx A 16 LEU HDy% 1.0 1.8 5.86 169 64 A 62 PHE HEy A 16 LEU HDy% 1.0 1.8 5.86 170 65 A 92 TYR HDx A 91 ARG HBy 1.0 1.8 6.03 171 65 A 92 TYR HDy A 91 ARG HBy 1.0 1.8 6.03 172 65 A 91 ARG HBx A 92 TYR HDy 1.0 1.8 6.03 173 65 A 91 ARG HBx A 92 TYR HDx 1.0 1.8 6.03 174 66 A 62 PHE HZ A 34 PHE HEy 1.0 1.8 5.70 175 66 A 62 PHE HZ A 34 PHE HEx 1.0 1.8 5.70 176 67 A 30 LEU HA A 34 PHE HEy 1.0 1.8 5.73 177 67 A 30 LEU HA A 34 PHE HEx 1.0 1.8 5.73 178 68 A 34 PHE HZ A 75 MET HA 1.0 1.8 6.00 179 69 A 34 PHE HZ A 18 VAL HB 1.0 1.8 5.82 180 70 A 34 PHE HEy A 18 VAL HB 1.0 1.8 6.00 181 70 A 34 PHE HEx A 18 VAL HB 1.0 1.8 6.00 182 71 A 75 MET HGx A 34 PHE HEy 1.0 1.8 7.28 183 71 A 75 MET HGy A 34 PHE HEx 1.0 1.8 7.28 184 71 A 75 MET HGx A 34 PHE HEx 1.0 1.8 7.28 185 71 A 75 MET HGy A 34 PHE HEy 1.0 1.8 7.28 186 72 A 34 PHE HEy A 30 LEU HBy 1.0 1.8 4.99 187 72 A 34 PHE HEx A 30 LEU HBy 1.0 1.8 4.99 188 73 A 60 VAL HGy% A 34 PHE HEy 1.0 1.8 7.88 189 73 A 60 VAL HGx% A 34 PHE HEx 1.0 1.8 7.88 190 73 A 60 VAL HGy% A 34 PHE HEx 1.0 1.8 7.88 191 73 A 60 VAL HGx% A 34 PHE HEy 1.0 1.8 7.88 192 74 A 46 PRO HDy A 44 TYR HDy 1.0 1.8 5.43 193 74 A 46 PRO HDx A 44 TYR HDy 1.0 1.8 5.43 194 74 A 46 PRO HDy A 44 TYR HDx 1.0 1.8 5.43 195 74 A 46 PRO HDx A 44 TYR HDx 1.0 1.8 5.43 196 75 A 88 GLN HE2y A 88 GLN HBy 1.0 1.8 7.43 197 75 A 88 GLN HBx A 88 GLN HE2x 1.0 1.8 7.43 198 75 A 88 GLN HBx A 88 GLN HE2y 1.0 1.8 7.43 199 75 A 88 GLN HE2x A 88 GLN HBy 1.0 1.8 7.43 200 76 A 24 ARG HGx A 23 TYR HEy 1.0 1.8 6.86 201 76 A 24 ARG HGy A 23 TYR HEy 1.0 1.8 6.86 202 76 A 23 TYR HEx A 24 ARG HGy 1.0 1.8 6.86 203 76 A 23 TYR HEx A 24 ARG HGx 1.0 1.8 6.86 204 77 A 23 TYR HEy A 22 THR HB 1.0 1.8 6.06 205 77 A 23 TYR HEx A 22 THR HB 1.0 1.8 6.06 206 78 A 20 ASN HD2x A 84 GLU HA 1.0 1.8 6.03 207 78 A 20 ASN HD2y A 84 GLU HA 1.0 1.8 6.03 208 79 A 23 TYR HEy A 24 ARG HDy 1.0 1.8 5.98 209 79 A 23 TYR HEy A 24 ARG HDx 1.0 1.8 5.98 210 79 A 23 TYR HEx A 24 ARG HDy 1.0 1.8 5.98 211 79 A 23 TYR HEx A 24 ARG HDx 1.0 1.8 5.98 212 80 A 23 TYR HEy A 24 ARG HBy 1.0 1.8 6.56 213 80 A 23 TYR HEx A 24 ARG HBy 1.0 1.8 6.56 214 81 A 24 ARG HGx A 23 TYR HEy 1.0 1.8 7.43 215 81 A 24 ARG HGy A 23 TYR HEy 1.0 1.8 7.43 216 81 A 23 TYR HEx A 24 ARG HGy 1.0 1.8 7.43 217 81 A 23 TYR HEx A 24 ARG HGx 1.0 1.8 7.43 218 82 A 49 ARG HBy A 50 TYR HEy 1.0 1.8 7.32 219 82 A 49 ARG HBy A 50 TYR HEx 1.0 1.8 7.32 220 82 A 49 ARG HBx A 50 TYR HEy 1.0 1.8 7.32 221 82 A 49 ARG HBx A 50 TYR HEx 1.0 1.8 7.32 222 83 A 43 VAL HA A 3 TYR HEy 1.0 1.8 6.67 223 83 A 3 TYR HEx A 43 VAL HA 1.0 1.8 6.67 224 84 A 3 TYR HEy A 31 ARG HDy 1.0 1.8 7.43 225 84 A 3 TYR HEy A 31 ARG HDx 1.0 1.8 7.43 226 84 A 3 TYR HEx A 31 ARG HDy 1.0 1.8 7.43 227 84 A 3 TYR HEx A 31 ARG HDx 1.0 1.8 7.43 228 85 A 50 TYR HEx A 49 ARG HDy 1.0 1.8 7.43 229 85 A 50 TYR HEy A 49 ARG HDx 1.0 1.8 7.43 230 85 A 50 TYR HEx A 49 ARG HDx 1.0 1.8 7.43 231 85 A 50 TYR HEy A 49 ARG HDy 1.0 1.8 7.43 232 86 A 84 GLU HGy A 20 ASN HD2x 1.0 1.8 6.67 233 86 A 20 ASN HD2y A 84 GLU HGy 1.0 1.8 6.67 234 87 A 3 TYR HEy A 31 ARG HBx 1.0 1.8 6.31 235 87 A 3 TYR HEy A 31 ARG HBy 1.0 1.8 6.31 236 87 A 3 TYR HEx A 31 ARG HBy 1.0 1.8 6.31 237 87 A 3 TYR HEx A 31 ARG HBx 1.0 1.8 6.31 238 88 A 3 TYR HEx A 43 VAL HGx% 1.0 1.8 7.78 239 88 A 3 TYR HEy A 43 VAL HGy% 1.0 1.8 7.78 240 88 A 3 TYR HEy A 43 VAL HGx% 1.0 1.8 7.78 241 88 A 3 TYR HEx A 43 VAL HGy% 1.0 1.8 7.78 242 89 A 34 PHE HDy A 37 TYR HEx 1.0 1.8 6.22 243 89 A 34 PHE HDy A 37 TYR HEy 1.0 1.8 6.22 244 89 A 34 PHE HDx A 37 TYR HEy 1.0 1.8 6.22 245 89 A 34 PHE HDx A 37 TYR HEx 1.0 1.8 6.22 246 90 A 62 PHE HZ A 37 TYR HEy 1.0 1.8 6.67 247 90 A 62 PHE HZ A 37 TYR HEx 1.0 1.8 6.67 248 91 A 75 MET HA A 37 TYR HEy 1.0 1.8 6.58 249 91 A 75 MET HA A 37 TYR HEx 1.0 1.8 6.58 250 92 A 37 TYR HEy A 34 PHE HA 1.0 1.8 4.77 251 92 A 37 TYR HEx A 34 PHE HA 1.0 1.8 4.77 252 93 A 37 TYR HEy A 37 TYR HA 1.0 1.8 5.88 253 93 A 37 TYR HEx A 37 TYR HA 1.0 1.8 5.88 254 94 A 37 TYR HEy A 70 ASP HBy 1.0 1.8 6.46 255 94 A 37 TYR HEx A 70 ASP HBy 1.0 1.8 6.46 256 95 A 71 ALA HA A 37 TYR HEy 1.0 1.8 4.65 257 95 A 71 ALA HA A 37 TYR HEx 1.0 1.8 4.65 258 96 A 33 VAL HB A 37 TYR HEy 1.0 1.8 6.67 259 96 A 33 VAL HB A 37 TYR HEx 1.0 1.8 6.67 260 97 A 75 MET HGy A 37 TYR HEy 1.0 1.8 6.59 261 97 A 75 MET HGx A 37 TYR HEy 1.0 1.8 6.59 262 97 A 75 MET HGy A 37 TYR HEx 1.0 1.8 6.59 263 97 A 75 MET HGx A 37 TYR HEx 1.0 1.8 6.59 264 98 A 75 MET HGy A 37 TYR HEy 1.0 1.8 5.98 265 98 A 75 MET HGx A 37 TYR HEy 1.0 1.8 5.98 266 98 A 75 MET HGy A 37 TYR HEx 1.0 1.8 5.98 267 98 A 75 MET HGx A 37 TYR HEx 1.0 1.8 5.98 268 99 A 75 MET HE% A 37 TYR HEx 1.0 1.8 5.58 269 99 A 75 MET HE% A 37 TYR HEy 1.0 1.8 5.58 270 100 A 37 TYR HEx A 74 ALA HB% 1.0 1.8 4.77 271 100 A 37 TYR HEy A 74 ALA HB% 1.0 1.8 4.77 272 101 A 44 TYR HA A 44 TYR HEy 1.0 1.8 5.90 273 101 A 44 TYR HA A 44 TYR HEx 1.0 1.8 5.90 274 102 A 58 ALA HA A 57 PHE HDy 1.0 1.8 6.27 275 102 A 57 PHE HDx A 58 ALA HA 1.0 1.8 6.27 276 103 A 57 PHE HDy A 19 ASP HA 1.0 1.8 5.93 277 103 A 57 PHE HDx A 19 ASP HA 1.0 1.8 5.93 278 104 A 45 ILE HA A 57 PHE HDy 1.0 1.8 6.59 279 104 A 45 ILE HA A 57 PHE HDx 1.0 1.8 6.59 280 105 A 57 PHE HDy A 56 GLY HAy 1.0 1.8 7.43 281 105 A 57 PHE HDx A 56 GLY HAy 1.0 1.8 7.43 282 105 A 57 PHE HDy A 56 GLY HAx 1.0 1.8 7.43 283 105 A 57 PHE HDx A 56 GLY HAx 1.0 1.8 7.43 284 106 A 57 PHE HDx A 58 ALA HB% 1.0 1.8 7.91 285 106 A 57 PHE HDy A 58 ALA HB% 1.0 1.8 7.91 286 107 A 57 PHE HA A 19 ASP HA 1.0 1.8 4.89 287 108 A 57 PHE HA A 21 LEU HG 1.0 1.8 4.95 288 109 A 57 PHE HA A 21 LEU HDy% 1.0 1.8 6.86 289 109 A 57 PHE HA A 21 LEU HDx% 1.0 1.8 6.86 290 110 A 57 PHE HA A 21 LEU HDy% 1.0 1.8 5.76 291 110 A 57 PHE HA A 21 LEU HDx% 1.0 1.8 5.76 292 111 A 16 LEU HBy A 61 ARG HA 1.0 1.8 6.40 293 111 A 16 LEU HBx A 61 ARG HA 1.0 1.8 6.40 294 112 A 19 ASP HA A 57 PHE HBy 1.0 1.8 5.66 295 112 A 19 ASP HA A 57 PHE HBx 1.0 1.8 5.66 296 113 A 18 VAL HB A 19 ASP HA 1.0 1.8 5.40 297 114 A 16 LEU HBy A 15 SER HA 1.0 1.8 6.22 298 114 A 16 LEU HBx A 15 SER HA 1.0 1.8 6.22 299 115 A 61 ARG HBy A 15 SER HA 1.0 1.8 5.55 300 115 A 61 ARG HBx A 15 SER HA 1.0 1.8 5.55 301 116 A 19 ASP HA A 21 LEU HG 1.0 1.8 5.93 302 117 A 19 ASP HA A 58 ALA HB% 1.0 1.8 7.11 303 118 A 19 ASP HA A 21 LEU HDx% 1.0 1.8 7.91 304 118 A 19 ASP HA A 21 LEU HDy% 1.0 1.8 7.91 305 119 A 86 ARG HA A 76 ASP HBy 1.0 1.8 6.59 306 119 A 76 ASP HBx A 86 ARG HA 1.0 1.8 6.59 307 120 A 86 ARG HA A 76 ASP HBy 1.0 1.8 5.52 308 120 A 76 ASP HBx A 86 ARG HA 1.0 1.8 5.52 309 121 A 86 ARG HA A 85 LEU HBx 1.0 1.8 5.68 310 122 A 86 ARG HA A 85 LEU HDx% 1.0 1.8 7.83 311 122 A 86 ARG HA A 85 LEU HDy% 1.0 1.8 7.83 312 123 A 44 TYR HDy A 44 TYR HA 1.0 1.8 4.78 313 123 A 44 TYR HDx A 44 TYR HA 1.0 1.8 4.78 314 124 A 62 PHE HZ A 35 GLU HA 1.0 1.8 6.00 315 125 A 35 GLU HA A 38 GLY HAy 1.0 1.8 6.67 316 125 A 35 GLU HA A 38 GLY HAx 1.0 1.8 6.67 317 126 A 35 GLU HA A 35 GLU HGy 1.0 1.8 4.42 318 126 A 35 GLU HA A 35 GLU HGx 1.0 1.8 4.42 319 127 A 18 VAL HB A 87 VAL HA 1.0 1.8 5.48 320 128 A 34 PHE HEy A 87 VAL HA 1.0 1.8 6.67 321 128 A 34 PHE HEx A 87 VAL HA 1.0 1.8 6.67 322 129 A 60 VAL HGy% A 62 PHE HA 1.0 1.8 7.81 323 129 A 60 VAL HGx% A 62 PHE HA 1.0 1.8 7.81 324 130 A 62 PHE HA A 39 ARG HGy 1.0 1.8 6.38 325 130 A 62 PHE HA A 39 ARG HGx 1.0 1.8 6.38 326 131 A 62 PHE HA A 41 GLY HAy 1.0 1.8 5.34 327 131 A 62 PHE HA A 41 GLY HAx 1.0 1.8 5.34 328 132 A 25 THR HG2% A 26 SER HA 1.0 1.8 6.53 329 133 A 21 LEU HDx% A 26 SER HA 1.0 1.8 7.91 330 133 A 21 LEU HDy% A 26 SER HA 1.0 1.8 7.91 331 134 A 26 SER HA A 30 LEU HDx% 1.0 1.8 6.62 332 134 A 26 SER HA A 30 LEU HDy% 1.0 1.8 6.62 333 135 A 45 ILE HA A 58 ALA HA 1.0 1.8 4.51 334 136 A 46 PRO HDy A 58 ALA HA 1.0 1.8 5.62 335 136 A 46 PRO HDx A 58 ALA HA 1.0 1.8 5.62 336 137 A 57 PHE HEy A 58 ALA HA 1.0 1.8 6.67 337 137 A 57 PHE HEx A 58 ALA HA 1.0 1.8 6.67 338 138 A 75 MET HGy A 75 MET HA 1.0 1.8 4.75 339 138 A 75 MET HGx A 75 MET HA 1.0 1.8 4.75 340 139 A 3 TYR HEy A 3 TYR HA 1.0 1.8 6.49 341 139 A 3 TYR HEx A 3 TYR HA 1.0 1.8 6.49 342 140 A 43 VAL HA A 43 VAL HGx% 1.0 1.8 5.19 343 140 A 43 VAL HA A 43 VAL HGy% 1.0 1.8 5.19 344 141 A 40 VAL HGx% A 42 ASP HA 1.0 1.8 6.84 345 141 A 40 VAL HGy% A 42 ASP HA 1.0 1.8 6.84 346 142 A 40 VAL HGy% A 43 VAL HA 1.0 1.8 7.47 347 142 A 40 VAL HGx% A 43 VAL HA 1.0 1.8 7.47 348 143 A 43 VAL HA A 60 VAL HA 1.0 1.8 4.06 349 144 A 41 GLY HAy A 42 ASP HA 1.0 1.8 6.67 350 144 A 41 GLY HAx A 42 ASP HA 1.0 1.8 6.67 351 145 A 57 PHE HZ A 47 ARG HA 1.0 1.8 6.00 352 146 A 78 ALA HB% A 79 VAL HA 1.0 1.8 7.11 353 147 A 85 LEU HDx% A 85 LEU HA 1.0 1.8 4.88 354 147 A 85 LEU HDy% A 85 LEU HA 1.0 1.8 4.88 355 148 A 85 LEU HA A 84 GLU HBy 1.0 1.8 5.04 356 149 A 80 LEU HA A 80 LEU HG 1.0 1.8 4.59 357 150 A 37 TYR HBx A 34 PHE HA 1.0 1.8 4.60 358 151 A 62 PHE HZ A 34 PHE HA 1.0 1.8 5.10 359 152 A 62 PHE HEy A 34 PHE HA 1.0 1.8 6.04 360 152 A 62 PHE HEx A 34 PHE HA 1.0 1.8 6.04 361 153 A 34 PHE HEy A 34 PHE HA 1.0 1.8 5.82 362 153 A 34 PHE HEx A 34 PHE HA 1.0 1.8 5.82 363 154 A 86 ARG HA A 76 ASP HA 1.0 1.8 5.05 364 155 A 76 ASP HA A 87 VAL HGx% 1.0 1.8 5.12 365 155 A 76 ASP HA A 87 VAL HGy% 1.0 1.8 5.12 366 156 A 51 THR HB A 53 GLU HGy 1.0 1.8 5.20 367 156 A 51 THR HB A 53 GLU HGx 1.0 1.8 5.20 368 157 A 75 MET HBy A 76 ASP HA 1.0 1.8 4.81 369 157 A 75 MET HBx A 76 ASP HA 1.0 1.8 4.81 370 158 A 39 ARG HGy A 39 ARG HA 1.0 1.8 4.66 371 158 A 39 ARG HGx A 39 ARG HA 1.0 1.8 4.66 372 159 A 21 LEU HDx% A 21 LEU HA 1.0 1.8 5.72 373 159 A 21 LEU HDy% A 21 LEU HA 1.0 1.8 5.72 374 160 A 21 LEU HDy% A 22 THR HA 1.0 1.8 6.26 375 160 A 21 LEU HDx% A 22 THR HA 1.0 1.8 6.26 376 161 A 63 HIS HA A 64 ASP HA 1.0 1.8 5.39 377 162 A 39 ARG HGy A 39 ARG HA 1.0 1.8 4.93 378 162 A 39 ARG HGx A 39 ARG HA 1.0 1.8 4.93 379 163 A 98 SER HA A 100 HIS HE1 1.0 1.8 6.00 380 164 A 33 VAL HB A 29 THR HB 1.0 1.8 5.03 381 165 A 25 THR HG2% A 29 THR HB 1.0 1.8 5.34 382 166 A 36 LYS HGy A 37 TYR HA 1.0 1.8 5.58 383 166 A 36 LYS HGx A 37 TYR HA 1.0 1.8 5.58 384 167 A 37 TYR HDy A 37 TYR HA 1.0 1.8 4.33 385 167 A 37 TYR HDx A 37 TYR HA 1.0 1.8 4.33 386 168 A 45 ILE HA A 44 TYR HEy 1.0 1.8 6.67 387 168 A 45 ILE HA A 44 TYR HEx 1.0 1.8 6.67 388 169 A 43 VAL HGx% A 60 VAL HA 1.0 1.8 5.81 389 169 A 43 VAL HGy% A 60 VAL HA 1.0 1.8 5.81 390 170 A 94 ARG HA A 94 ARG HGy 1.0 1.8 4.83 391 170 A 94 ARG HA A 94 ARG HGx 1.0 1.8 4.83 392 171 A 24 ARG HGy A 24 ARG HA 1.0 1.8 4.77 393 171 A 24 ARG HGx A 24 ARG HA 1.0 1.8 4.77 394 172 A 91 ARG HA A 91 ARG HGy 1.0 1.8 5.03 395 172 A 91 ARG HA A 91 ARG HGx 1.0 1.8 5.03 396 173 A 37 TYR HDy A 67 ASP HA 1.0 1.8 6.67 397 173 A 37 TYR HDx A 67 ASP HA 1.0 1.8 6.67 398 174 A 62 PHE HDy A 67 ASP HA 1.0 1.8 6.67 399 174 A 62 PHE HDx A 67 ASP HA 1.0 1.8 6.67 400 175 A 37 TYR HEy A 74 ALA HA 1.0 1.8 6.00 401 175 A 37 TYR HEx A 74 ALA HA 1.0 1.8 6.00 402 176 A 66 ARG HA A 69 GLU HGy 1.0 1.8 6.67 403 176 A 66 ARG HA A 69 GLU HGx 1.0 1.8 6.67 404 177 A 32 ARG HA A 35 GLU HBy 1.0 1.8 4.53 405 177 A 32 ARG HA A 35 GLU HBx 1.0 1.8 4.53 406 178 A 66 ARG HA A 69 GLU HGy 1.0 1.8 5.07 407 178 A 66 ARG HA A 69 GLU HGx 1.0 1.8 5.07 408 179 A 32 ARG HA A 32 ARG HBy 1.0 1.8 3.76 409 179 A 32 ARG HA A 32 ARG HBx 1.0 1.8 3.76 410 180 A 66 ARG HA A 66 ARG HBy 1.0 1.8 3.82 411 180 A 66 ARG HA A 66 ARG HBx 1.0 1.8 3.82 412 181 A 32 ARG HA A 31 ARG HGy 1.0 1.8 4.79 413 181 A 32 ARG HA A 31 ARG HGx 1.0 1.8 4.79 414 182 A 25 THR HA A 29 THR HG2% 1.0 1.8 5.54 415 183 A 30 LEU HA A 60 VAL HGx% 1.0 1.8 7.06 416 183 A 30 LEU HA A 60 VAL HGy% 1.0 1.8 7.06 417 184 A 25 THR HA A 24 ARG HBx 1.0 1.8 5.26 418 185 A 30 LEU HA A 30 LEU HG 1.0 1.8 4.23 419 186 A 33 VAL HGx% A 30 LEU HA 1.0 1.8 4.76 420 186 A 33 VAL HGy% A 30 LEU HA 1.0 1.8 4.76 421 187 A 25 THR HB A 21 LEU HBy 1.0 1.8 5.36 422 187 A 21 LEU HBx A 25 THR HB 1.0 1.8 5.36 423 188 A 25 THR HB A 22 THR HG2% 1.0 1.8 6.28 424 189 A 25 THR HB A 21 LEU HBy 1.0 1.8 4.31 425 189 A 21 LEU HBx A 25 THR HB 1.0 1.8 4.31 426 190 A 21 LEU HDx% A 25 THR HB 1.0 1.8 4.58 427 190 A 21 LEU HDy% A 25 THR HB 1.0 1.8 4.58 428 191 A 27 PRO HA A 45 ILE HD1% 1.0 1.8 5.17 429 192 A 3 TYR HDy A 4 GLY HAy 1.0 1.8 7.43 430 192 A 3 TYR HDy A 4 GLY HAx 1.0 1.8 7.43 431 192 A 3 TYR HDx A 4 GLY HAy 1.0 1.8 7.43 432 192 A 3 TYR HDx A 4 GLY HAx 1.0 1.8 7.43 433 193 A 59 PHE HEx A 15 SER HBy 1.0 1.8 7.43 434 193 A 59 PHE HEy A 15 SER HBy 1.0 1.8 7.43 435 193 A 59 PHE HEy A 15 SER HBx 1.0 1.8 7.43 436 193 A 59 PHE HEx A 15 SER HBx 1.0 1.8 7.43 437 194 A 16 LEU HA A 15 SER HBy 1.0 1.8 5.94 438 194 A 16 LEU HA A 15 SER HBx 1.0 1.8 5.94 439 195 A 45 ILE HG2% A 54 SER HBx 1.0 1.8 7.47 440 195 A 45 ILE HG2% A 54 SER HBy 1.0 1.8 7.47 441 196 A 57 PHE HZ A 54 SER HBy 1.0 1.8 6.67 442 196 A 57 PHE HZ A 54 SER HBx 1.0 1.8 6.67 443 197 A 34 PHE HDy A 33 VAL HA 1.0 1.8 6.67 444 197 A 34 PHE HDx A 33 VAL HA 1.0 1.8 6.67 445 198 A 29 THR HA A 28 ASP HBy 1.0 1.8 5.57 446 198 A 28 ASP HBx A 29 THR HA 1.0 1.8 5.57 447 199 A 33 VAL HA A 32 ARG HGy 1.0 1.8 5.32 448 199 A 33 VAL HA A 32 ARG HGx 1.0 1.8 5.32 449 200 A 37 TYR HDy A 33 VAL HA 1.0 1.8 6.67 450 200 A 37 TYR HDx A 33 VAL HA 1.0 1.8 6.67 451 201 A 37 TYR HDy A 36 LYS HA 1.0 1.8 6.67 452 201 A 37 TYR HDx A 36 LYS HA 1.0 1.8 6.67 453 202 A 37 TYR HEy A 33 VAL HA 1.0 1.8 6.09 454 202 A 37 TYR HEx A 33 VAL HA 1.0 1.8 6.09 455 203 A 69 GLU HGy A 65 LYS HA 1.0 1.8 5.07 456 203 A 69 GLU HGx A 65 LYS HA 1.0 1.8 5.07 457 204 A 50 TYR HDy A 49 ARG HA 1.0 1.8 6.28 458 204 A 50 TYR HDx A 49 ARG HA 1.0 1.8 6.28 459 205 A 65 LYS HA A 65 LYS HGy 1.0 1.8 5.02 460 205 A 65 LYS HA A 65 LYS HGx 1.0 1.8 5.02 461 206 A 49 ARG HDy A 49 ARG HA 1.0 1.8 6.07 462 206 A 49 ARG HDx A 49 ARG HA 1.0 1.8 6.07 463 207 A 57 PHE HEy A 54 SER HBy 1.0 1.8 7.42 464 207 A 57 PHE HEx A 54 SER HBy 1.0 1.8 7.42 465 207 A 57 PHE HEy A 54 SER HBx 1.0 1.8 7.42 466 207 A 57 PHE HEx A 54 SER HBx 1.0 1.8 7.42 467 208 A 78 ALA HB% A 77 GLY HAx 1.0 1.8 6.34 468 209 A 64 ASP HA A 62 PHE HBy 1.0 1.8 6.00 469 210 A 87 VAL HA A 72 MET HA 1.0 1.8 6.00 470 211 A 15 SER HBy A 14 THR HG2% 1.0 1.8 7.91 471 211 A 15 SER HBx A 14 THR HG2% 1.0 1.8 7.91 472 212 A 39 ARG HGy A 41 GLY HAy 1.0 1.8 5.25 473 212 A 39 ARG HGy A 41 GLY HAx 1.0 1.8 5.25 474 212 A 39 ARG HGx A 41 GLY HAy 1.0 1.8 5.25 475 212 A 39 ARG HGx A 41 GLY HAx 1.0 1.8 5.25 476 213 A 64 ASP HA A 63 HIS HBy 1.0 1.8 6.67 477 213 A 64 ASP HA A 63 HIS HBx 1.0 1.8 6.67 478 214 A 87 VAL HA A 86 ARG HDy 1.0 1.8 6.67 479 214 A 87 VAL HA A 86 ARG HDx 1.0 1.8 6.67 480 215 A 46 PRO HDy A 59 PHE HDx 1.0 1.8 6.09 481 215 A 46 PRO HDy A 59 PHE HDy 1.0 1.8 6.09 482 215 A 46 PRO HDx A 59 PHE HDy 1.0 1.8 6.09 483 215 A 46 PRO HDx A 59 PHE HDx 1.0 1.8 6.09 484 216 A 24 ARG HDy A 24 ARG HA 1.0 1.8 4.46 485 216 A 24 ARG HDx A 24 ARG HA 1.0 1.8 4.46 486 217 A 33 VAL HGx% A 34 PHE HBx 1.0 1.8 6.34 487 217 A 33 VAL HGy% A 34 PHE HBx 1.0 1.8 6.34 488 218 A 85 LEU HDx% A 83 ARG HDy 1.0 1.8 7.75 489 218 A 85 LEU HDx% A 83 ARG HDx 1.0 1.8 7.75 490 218 A 85 LEU HDy% A 83 ARG HDx 1.0 1.8 7.75 491 218 A 85 LEU HDy% A 83 ARG HDy 1.0 1.8 7.75 492 219 A 55 ARG HDx A 55 ARG HBy 1.0 1.8 5.62 493 219 A 55 ARG HDy A 55 ARG HBy 1.0 1.8 5.62 494 219 A 55 ARG HBx A 55 ARG HDy 1.0 1.8 5.62 495 219 A 55 ARG HBx A 55 ARG HDx 1.0 1.8 5.62 496 220 A 52 LYS HEx A 52 LYS HGy 1.0 1.8 5.39 497 220 A 52 LYS HEy A 52 LYS HGy 1.0 1.8 5.39 498 220 A 52 LYS HGx A 52 LYS HEy 1.0 1.8 5.39 499 220 A 52 LYS HGx A 52 LYS HEx 1.0 1.8 5.39 500 221 A 37 TYR HDy A 70 ASP HBy 1.0 1.8 5.08 501 221 A 37 TYR HDx A 70 ASP HBy 1.0 1.8 5.08 502 222 A 37 TYR HDx A 36 LYS HEy 1.0 1.8 6.09 503 222 A 37 TYR HDy A 36 LYS HEy 1.0 1.8 6.09 504 222 A 37 TYR HDy A 36 LYS HEx 1.0 1.8 6.09 505 222 A 37 TYR HDx A 36 LYS HEx 1.0 1.8 6.09 506 223 A 60 VAL HGx% A 42 ASP HBy 1.0 1.8 8.82 507 223 A 60 VAL HGy% A 42 ASP HBy 1.0 1.8 8.82 508 223 A 60 VAL HGx% A 42 ASP HBx 1.0 1.8 8.82 509 223 A 60 VAL HGy% A 42 ASP HBx 1.0 1.8 8.82 510 224 A 61 ARG HDy A 15 SER HA 1.0 1.8 6.48 511 224 A 61 ARG HDx A 15 SER HA 1.0 1.8 6.48 512 225 A 21 LEU HDx% A 57 PHE HBx 1.0 1.8 8.69 513 225 A 21 LEU HDy% A 57 PHE HBx 1.0 1.8 8.69 514 225 A 21 LEU HDy% A 57 PHE HBy 1.0 1.8 8.69 515 225 A 21 LEU HDx% A 57 PHE HBy 1.0 1.8 8.69 516 226 A 57 PHE HDx A 19 ASP HBy 1.0 1.8 6.88 517 226 A 57 PHE HDy A 19 ASP HBy 1.0 1.8 6.88 518 226 A 57 PHE HDy A 19 ASP HBx 1.0 1.8 6.88 519 226 A 57 PHE HDx A 19 ASP HBx 1.0 1.8 6.88 520 227 A 57 PHE HDy A 59 PHE HBx 1.0 1.8 7.28 521 227 A 57 PHE HDy A 59 PHE HBy 1.0 1.8 7.28 522 227 A 57 PHE HDx A 59 PHE HBy 1.0 1.8 7.28 523 227 A 57 PHE HDx A 59 PHE HBx 1.0 1.8 7.28 524 228 A 74 ALA HB% A 73 ASP HBx 1.0 1.8 7.05 525 229 A 16 LEU HDy% A 89 MET HGy 1.0 1.8 7.93 526 229 A 16 LEU HDy% A 89 MET HGx 1.0 1.8 7.93 527 229 A 16 LEU HDx% A 89 MET HGx 1.0 1.8 7.93 528 229 A 16 LEU HDx% A 89 MET HGy 1.0 1.8 7.93 529 230 A 35 GLU HGy A 32 ARG HA 1.0 1.8 5.26 530 230 A 35 GLU HGx A 32 ARG HA 1.0 1.8 5.26 531 231 A 57 PHE HA A 19 ASP HBy 1.0 1.8 6.67 532 231 A 57 PHE HA A 19 ASP HBx 1.0 1.8 6.67 533 232 A 48 ASP HBx A 51 THR HG2% 1.0 1.8 6.22 534 232 A 51 THR HG2% A 48 ASP HBy 1.0 1.8 6.22 535 233 A 69 GLU HGy A 69 GLU HA 1.0 1.8 4.92 536 233 A 69 GLU HGx A 69 GLU HA 1.0 1.8 4.92 537 234 A 88 GLN HBy A 88 GLN HGy 1.0 1.8 3.71 538 234 A 88 GLN HBy A 88 GLN HGx 1.0 1.8 3.71 539 234 A 88 GLN HBx A 88 GLN HGy 1.0 1.8 3.71 540 234 A 88 GLN HBx A 88 GLN HGx 1.0 1.8 3.71 541 235 A 46 PRO HBy A 47 ARG HBx 1.0 1.8 7.43 542 235 A 46 PRO HBy A 47 ARG HBy 1.0 1.8 7.43 543 235 A 46 PRO HBx A 47 ARG HBy 1.0 1.8 7.43 544 235 A 46 PRO HBx A 47 ARG HBx 1.0 1.8 7.43 545 236 A 46 PRO HBy A 44 TYR HEy 1.0 1.8 7.19 546 236 A 46 PRO HBx A 44 TYR HEy 1.0 1.8 7.19 547 236 A 46 PRO HBy A 44 TYR HEx 1.0 1.8 7.19 548 236 A 46 PRO HBx A 44 TYR HEx 1.0 1.8 7.19 549 237 A 32 ARG HA A 35 GLU HBy 1.0 1.8 4.29 550 237 A 32 ARG HA A 35 GLU HBx 1.0 1.8 4.29 551 238 A 16 LEU HDy% A 72 MET HGx 1.0 1.8 5.33 552 238 A 16 LEU HDx% A 72 MET HGx 1.0 1.8 5.33 553 239 A 69 GLU HGx A 69 GLU HBy 1.0 1.8 3.94 554 239 A 69 GLU HGy A 69 GLU HBy 1.0 1.8 3.94 555 239 A 69 GLU HGy A 69 GLU HBx 1.0 1.8 3.94 556 239 A 69 GLU HGx A 69 GLU HBx 1.0 1.8 3.94 557 240 A 69 GLU HA A 72 MET HE% 1.0 1.8 3.66 558 241 A 75 MET HBy A 34 PHE HEy 1.0 1.8 4.91 559 241 A 75 MET HBx A 34 PHE HEy 1.0 1.8 4.91 560 241 A 75 MET HBy A 34 PHE HEx 1.0 1.8 4.91 561 241 A 75 MET HBx A 34 PHE HEx 1.0 1.8 4.91 562 242 A 75 MET HBy A 34 PHE HZ 1.0 1.8 4.87 563 242 A 75 MET HBx A 34 PHE HZ 1.0 1.8 4.87 564 243 A 84 GLU HGy A 84 GLU HBx 1.0 1.8 2.90 565 244 A 60 VAL HGy% A 43 VAL HB 1.0 1.8 7.43 566 244 A 60 VAL HGx% A 43 VAL HB 1.0 1.8 7.43 567 245 A 60 VAL HGy% A 43 VAL HB 1.0 1.8 7.85 568 245 A 60 VAL HGx% A 43 VAL HB 1.0 1.8 7.85 569 246 A 75 MET HGy A 72 MET HA 1.0 1.8 6.16 570 246 A 75 MET HGx A 72 MET HA 1.0 1.8 6.16 571 247 A 32 ARG HA A 32 ARG HGy 1.0 1.8 4.65 572 247 A 32 ARG HA A 32 ARG HGx 1.0 1.8 4.65 573 248 A 86 ARG HDy A 86 ARG HBy 1.0 1.8 4.24 574 248 A 86 ARG HDx A 86 ARG HBy 1.0 1.8 4.24 575 249 A 88 GLN HE2x A 86 ARG HBy 1.0 1.8 3.96 576 249 A 88 GLN HE2y A 86 ARG HBy 1.0 1.8 3.96 577 250 A 75 MET HGx A 34 PHE HEy 1.0 1.8 4.72 578 250 A 75 MET HGy A 34 PHE HEx 1.0 1.8 4.72 579 250 A 75 MET HGx A 34 PHE HEx 1.0 1.8 4.72 580 250 A 75 MET HGy A 34 PHE HEy 1.0 1.8 4.72 581 251 A 37 TYR HDy A 75 MET HGx 1.0 1.8 6.46 582 251 A 37 TYR HDx A 75 MET HGy 1.0 1.8 6.46 583 251 A 37 TYR HDx A 75 MET HGx 1.0 1.8 6.46 584 251 A 37 TYR HDy A 75 MET HGy 1.0 1.8 6.46 585 252 A 86 ARG HDx A 86 ARG HGy 1.0 1.8 4.17 586 252 A 86 ARG HDy A 86 ARG HGy 1.0 1.8 4.17 587 252 A 86 ARG HDy A 86 ARG HGx 1.0 1.8 4.17 588 252 A 86 ARG HDx A 86 ARG HGx 1.0 1.8 4.17 589 253 A 24 ARG HDy A 24 ARG HBx 1.0 1.8 4.34 590 253 A 24 ARG HDx A 24 ARG HBx 1.0 1.8 4.34 591 254 A 39 ARG HBy A 39 ARG HGy 1.0 1.8 3.84 592 254 A 39 ARG HBy A 39 ARG HGx 1.0 1.8 3.84 593 254 A 39 ARG HBx A 39 ARG HGy 1.0 1.8 3.84 594 254 A 39 ARG HBx A 39 ARG HGx 1.0 1.8 3.84 595 255 A 75 MET HBy A 75 MET HGy 1.0 1.8 4.02 596 255 A 75 MET HBy A 75 MET HGx 1.0 1.8 4.02 597 255 A 75 MET HBx A 75 MET HGy 1.0 1.8 4.02 598 255 A 75 MET HBx A 75 MET HGx 1.0 1.8 4.02 599 256 A 45 ILE HD1% A 45 ILE HB 1.0 1.8 4.27 600 257 A 88 GLN HE2y A 86 ARG HGy 1.0 1.8 6.74 601 257 A 88 GLN HE2x A 86 ARG HGx 1.0 1.8 6.74 602 257 A 88 GLN HE2y A 86 ARG HGx 1.0 1.8 6.74 603 257 A 88 GLN HE2x A 86 ARG HGy 1.0 1.8 6.74 604 258 A 60 VAL HGx% A 30 LEU HG 1.0 1.8 6.97 605 258 A 60 VAL HGy% A 30 LEU HG 1.0 1.8 6.97 606 259 A 52 LYS HGy A 52 LYS HDx 1.0 1.8 3.81 607 259 A 52 LYS HGy A 52 LYS HDy 1.0 1.8 3.81 608 259 A 52 LYS HGx A 52 LYS HDy 1.0 1.8 3.81 609 259 A 52 LYS HGx A 52 LYS HDx 1.0 1.8 3.81 610 260 A 52 LYS HA A 47 ARG HGy 1.0 1.8 5.47 611 260 A 47 ARG HGx A 52 LYS HA 1.0 1.8 5.47 612 261 A 75 MET HE% A 75 MET HA 1.0 1.8 5.86 613 262 A 36 LYS HGy A 36 LYS HDy 1.0 1.8 3.83 614 262 A 36 LYS HGx A 36 LYS HDy 1.0 1.8 3.83 615 262 A 36 LYS HGx A 36 LYS HDx 1.0 1.8 3.83 616 262 A 36 LYS HGy A 36 LYS HDx 1.0 1.8 3.83 617 263 A 36 LYS HGy A 36 LYS HDy 1.0 1.8 3.76 618 263 A 36 LYS HGx A 36 LYS HDy 1.0 1.8 3.76 619 263 A 36 LYS HGx A 36 LYS HDx 1.0 1.8 3.76 620 263 A 36 LYS HGy A 36 LYS HDx 1.0 1.8 3.76 621 264 A 21 LEU HG A 25 THR HB 1.0 1.8 4.73 622 265 A 85 LEU HDx% A 78 ALA HB% 1.0 1.8 5.97 623 265 A 85 LEU HDy% A 78 ALA HB% 1.0 1.8 5.97 624 266 A 31 ARG HA A 31 ARG HGy 1.0 1.8 5.06 625 266 A 31 ARG HA A 31 ARG HGx 1.0 1.8 5.06 626 267 A 80 LEU HG A 81 ASP HBy 1.0 1.8 5.82 627 267 A 80 LEU HG A 81 ASP HBx 1.0 1.8 5.82 628 268 A 81 ASP HBy A 83 ARG HGx 1.0 1.8 6.04 629 268 A 81 ASP HBx A 83 ARG HGx 1.0 1.8 6.04 630 269 A 65 LYS HA A 65 LYS HGy 1.0 1.8 4.98 631 269 A 65 LYS HA A 65 LYS HGx 1.0 1.8 4.98 632 270 A 22 THR HG2% A 81 ASP HBy 1.0 1.8 5.26 633 270 A 22 THR HG2% A 81 ASP HBx 1.0 1.8 5.26 634 271 A 57 PHE HA A 21 LEU HBy 1.0 1.8 6.67 635 271 A 57 PHE HA A 21 LEU HBx 1.0 1.8 6.67 636 272 A 21 LEU HDx% A 21 LEU HBy 1.0 1.8 5.89 637 272 A 21 LEU HDy% A 21 LEU HBy 1.0 1.8 5.89 638 272 A 21 LEU HDx% A 21 LEU HBx 1.0 1.8 5.89 639 272 A 21 LEU HDy% A 21 LEU HBx 1.0 1.8 5.89 640 273 A 71 ALA HB% A 37 TYR HEx 1.0 1.8 6.81 641 273 A 71 ALA HB% A 37 TYR HEy 1.0 1.8 6.81 642 274 A 16 LEU HA A 68 ALA HB% 1.0 1.8 6.49 643 275 A 62 PHE HA A 61 ARG HGy 1.0 1.8 6.67 644 275 A 62 PHE HA A 61 ARG HGx 1.0 1.8 6.67 645 276 A 62 PHE HA A 68 ALA HB% 1.0 1.8 7.11 646 277 A 62 PHE HBy A 68 ALA HB% 1.0 1.8 5.32 647 278 A 29 THR HG2% A 26 SER HBx 1.0 1.8 6.93 648 278 A 29 THR HG2% A 26 SER HBy 1.0 1.8 6.93 649 279 A 24 ARG HGy A 24 ARG HA 1.0 1.8 4.38 650 279 A 24 ARG HGx A 24 ARG HA 1.0 1.8 4.38 651 280 A 44 TYR HA A 45 ILE HG1y 1.0 1.8 5.74 652 280 A 44 TYR HA A 45 ILE HG1x 1.0 1.8 5.74 653 281 A 57 PHE HA A 21 LEU HBy 1.0 1.8 6.67 654 281 A 57 PHE HA A 21 LEU HBx 1.0 1.8 6.67 655 282 A 57 PHE HA A 45 ILE HG1y 1.0 1.8 6.67 656 282 A 57 PHE HA A 45 ILE HG1x 1.0 1.8 6.67 657 283 A 58 ALA HB% A 45 ILE HG1x 1.0 1.8 5.04 658 283 A 58 ALA HB% A 45 ILE HG1y 1.0 1.8 5.04 659 284 A 14 THR HG2% A 14 THR HA 1.0 1.8 4.69 660 285 A 65 LYS HA A 14 THR HG2% 1.0 1.8 4.37 661 286 A 62 PHE HBy A 14 THR HG2% 1.0 1.8 7.00 662 287 A 16 LEU HBy A 62 PHE HBy 1.0 1.8 6.67 663 287 A 16 LEU HBx A 62 PHE HBy 1.0 1.8 6.67 664 288 A 14 THR HG2% A 65 LYS HBy 1.0 1.8 5.99 665 288 A 14 THR HG2% A 65 LYS HBx 1.0 1.8 5.99 666 289 A 62 PHE HDy A 16 LEU HBy 1.0 1.8 6.23 667 289 A 62 PHE HDx A 16 LEU HBy 1.0 1.8 6.23 668 289 A 62 PHE HDy A 16 LEU HBx 1.0 1.8 6.23 669 289 A 62 PHE HDx A 16 LEU HBx 1.0 1.8 6.23 670 290 A 21 LEU HDx% A 25 THR HG2% 1.0 1.8 6.43 671 290 A 21 LEU HDy% A 25 THR HG2% 1.0 1.8 6.43 672 291 A 36 LYS HGy A 34 PHE HA 1.0 1.8 6.01 673 291 A 36 LYS HGx A 34 PHE HA 1.0 1.8 6.01 674 292 A 34 PHE HEy A 25 THR HG2% 1.0 1.8 7.67 675 292 A 34 PHE HEx A 25 THR HG2% 1.0 1.8 7.67 676 293 A 33 VAL HGy% A 34 PHE HEx 1.0 1.8 8.82 677 293 A 33 VAL HGx% A 34 PHE HEx 1.0 1.8 8.82 678 293 A 33 VAL HGx% A 34 PHE HEy 1.0 1.8 8.82 679 293 A 33 VAL HGy% A 34 PHE HEy 1.0 1.8 8.82 680 294 A 37 TYR HDx A 74 ALA HB% 1.0 1.8 6.05 681 294 A 37 TYR HDy A 74 ALA HB% 1.0 1.8 6.05 682 295 A 34 PHE HEx A 87 VAL HGy% 1.0 1.8 6.39 683 295 A 34 PHE HEx A 87 VAL HGx% 1.0 1.8 6.39 684 295 A 34 PHE HEy A 87 VAL HGy% 1.0 1.8 6.39 685 295 A 34 PHE HEy A 87 VAL HGx% 1.0 1.8 6.39 686 296 A 34 PHE HZ A 87 VAL HGx% 1.0 1.8 6.46 687 296 A 34 PHE HZ A 87 VAL HGy% 1.0 1.8 6.46 688 297 A 87 VAL HA A 87 VAL HGx% 1.0 1.8 5.51 689 297 A 87 VAL HA A 87 VAL HGy% 1.0 1.8 5.51 690 298 A 75 MET HA A 74 ALA HB% 1.0 1.8 5.77 691 299 A 76 ASP HBy A 87 VAL HGx% 1.0 1.8 8.82 692 299 A 76 ASP HBx A 87 VAL HGy% 1.0 1.8 8.82 693 299 A 76 ASP HBx A 87 VAL HGx% 1.0 1.8 8.82 694 299 A 76 ASP HBy A 87 VAL HGy% 1.0 1.8 8.82 695 300 A 36 LYS HGy A 37 TYR HEx 1.0 1.8 6.84 696 300 A 36 LYS HGx A 37 TYR HEy 1.0 1.8 6.84 697 300 A 36 LYS HGx A 37 TYR HEx 1.0 1.8 6.84 698 300 A 36 LYS HGy A 37 TYR HEy 1.0 1.8 6.84 699 301 A 36 LYS HGy A 36 LYS HA 1.0 1.8 4.88 700 301 A 36 LYS HGx A 36 LYS HA 1.0 1.8 4.88 701 302 A 36 LYS HGy A 34 PHE HA 1.0 1.8 4.81 702 302 A 36 LYS HGx A 34 PHE HA 1.0 1.8 4.81 703 303 A 62 PHE HDy A 16 LEU HDy% 1.0 1.8 7.69 704 303 A 62 PHE HDy A 16 LEU HDx% 1.0 1.8 7.69 705 303 A 62 PHE HDx A 16 LEU HDx% 1.0 1.8 7.69 706 303 A 62 PHE HDx A 16 LEU HDy% 1.0 1.8 7.69 707 304 A 16 LEU HA A 16 LEU HDy% 1.0 1.8 5.88 708 304 A 16 LEU HA A 16 LEU HDx% 1.0 1.8 5.88 709 305 A 16 LEU HDx% A 88 GLN HA 1.0 1.8 6.38 710 305 A 16 LEU HDy% A 88 GLN HA 1.0 1.8 6.38 711 306 A 16 LEU HDx% A 69 GLU HA 1.0 1.8 7.70 712 306 A 16 LEU HDy% A 69 GLU HA 1.0 1.8 7.70 713 307 A 16 LEU HDy% A 72 MET HBy 1.0 1.8 6.28 714 307 A 16 LEU HDx% A 72 MET HBy 1.0 1.8 6.28 715 307 A 16 LEU HDy% A 72 MET HBx 1.0 1.8 6.28 716 307 A 16 LEU HDx% A 72 MET HBx 1.0 1.8 6.28 717 308 A 43 VAL HGy% A 27 PRO HA 1.0 1.8 5.38 718 308 A 43 VAL HGx% A 27 PRO HA 1.0 1.8 5.38 719 309 A 82 GLY HAx A 79 VAL HGy% 1.0 1.8 6.82 720 309 A 82 GLY HAy A 79 VAL HGy% 1.0 1.8 6.82 721 309 A 79 VAL HGx% A 82 GLY HAy 1.0 1.8 6.82 722 309 A 79 VAL HGx% A 82 GLY HAx 1.0 1.8 6.82 723 310 A 33 VAL HGx% A 30 LEU HDy% 1.0 1.8 5.50 724 310 A 33 VAL HGy% A 30 LEU HDx% 1.0 1.8 5.50 725 310 A 33 VAL HGy% A 30 LEU HDy% 1.0 1.8 5.50 726 310 A 33 VAL HGx% A 30 LEU HDx% 1.0 1.8 5.50 727 311 A 33 VAL HGx% A 34 PHE HA 1.0 1.8 6.27 728 311 A 33 VAL HGy% A 34 PHE HA 1.0 1.8 6.27 729 312 A 80 LEU HDx% A 80 LEU HBy 1.0 1.8 5.36 730 312 A 80 LEU HBx A 80 LEU HDy% 1.0 1.8 5.36 731 312 A 80 LEU HDy% A 80 LEU HBy 1.0 1.8 5.36 732 312 A 80 LEU HBx A 80 LEU HDx% 1.0 1.8 5.36 733 313 A 33 VAL HGx% A 37 TYR HDx 1.0 1.8 8.52 734 313 A 33 VAL HGy% A 37 TYR HDy 1.0 1.8 8.52 735 313 A 33 VAL HGy% A 37 TYR HDx 1.0 1.8 8.52 736 313 A 33 VAL HGx% A 37 TYR HDy 1.0 1.8 8.52 737 314 A 43 VAL HGx% A 44 TYR HA 1.0 1.8 7.91 738 314 A 43 VAL HGy% A 44 TYR HA 1.0 1.8 7.91 739 315 A 34 PHE HZ A 85 LEU HDx% 1.0 1.8 6.09 740 315 A 34 PHE HZ A 85 LEU HDy% 1.0 1.8 6.09 741 316 A 85 LEU HBx A 85 LEU HDx% 1.0 1.8 5.20 742 316 A 85 LEU HBx A 85 LEU HDy% 1.0 1.8 5.20 743 317 A 75 MET HA A 85 LEU HDx% 1.0 1.8 5.97 744 317 A 75 MET HA A 85 LEU HDy% 1.0 1.8 5.97 745 318 A 85 LEU HDx% A 20 ASN HBx 1.0 1.8 7.36 746 318 A 85 LEU HDy% A 20 ASN HBx 1.0 1.8 7.36 747 319 A 85 LEU HDx% A 80 LEU HBx 1.0 1.8 5.39 748 319 A 85 LEU HDx% A 80 LEU HBy 1.0 1.8 5.39 749 319 A 85 LEU HDy% A 80 LEU HBy 1.0 1.8 5.39 750 319 A 85 LEU HDy% A 80 LEU HBx 1.0 1.8 5.39 751 320 A 85 LEU HDx% A 20 ASN HBy 1.0 1.8 6.55 752 320 A 85 LEU HDy% A 20 ASN HBy 1.0 1.8 6.55 753 321 A 85 LEU HDx% A 80 LEU HBx 1.0 1.8 6.07 754 321 A 85 LEU HDx% A 80 LEU HBy 1.0 1.8 6.07 755 321 A 85 LEU HDy% A 80 LEU HBy 1.0 1.8 6.07 756 321 A 85 LEU HDy% A 80 LEU HBx 1.0 1.8 6.07 757 322 A 21 LEU HDx% A 25 THR HG2% 1.0 1.8 5.84 758 322 A 21 LEU HDy% A 25 THR HG2% 1.0 1.8 5.84 759 323 A 21 LEU HDx% A 21 LEU HBy 1.0 1.8 5.86 760 323 A 21 LEU HDy% A 21 LEU HBy 1.0 1.8 5.86 761 323 A 21 LEU HDx% A 21 LEU HBx 1.0 1.8 5.86 762 323 A 21 LEU HDy% A 21 LEU HBx 1.0 1.8 5.86 763 324 A 80 LEU HA A 79 VAL HGx% 1.0 1.8 6.98 764 324 A 80 LEU HA A 79 VAL HGy% 1.0 1.8 6.98 765 325 A 79 VAL HGx% A 83 ARG HA 1.0 1.8 7.81 766 325 A 79 VAL HGy% A 83 ARG HA 1.0 1.8 7.81 767 326 A 58 ALA HA A 45 ILE HG2% 1.0 1.8 5.54 768 327 A 34 PHE HDy A 30 LEU HDx% 1.0 1.8 7.97 769 327 A 34 PHE HDx A 30 LEU HDx% 1.0 1.8 7.97 770 327 A 34 PHE HDy A 30 LEU HDy% 1.0 1.8 7.97 771 327 A 34 PHE HDx A 30 LEU HDy% 1.0 1.8 7.97 772 328 A 34 PHE HEx A 30 LEU HDy% 1.0 1.8 7.08 773 328 A 34 PHE HEy A 30 LEU HDy% 1.0 1.8 7.08 774 328 A 34 PHE HEx A 30 LEU HDx% 1.0 1.8 7.08 775 328 A 34 PHE HEy A 30 LEU HDx% 1.0 1.8 7.08 776 329 A 30 LEU HDx% A 27 PRO HDx 1.0 1.8 8.82 777 329 A 30 LEU HDx% A 27 PRO HDy 1.0 1.8 8.82 778 329 A 30 LEU HDy% A 27 PRO HDy 1.0 1.8 8.82 779 329 A 30 LEU HDy% A 27 PRO HDx 1.0 1.8 8.82 780 330 A 45 ILE HG2% A 27 PRO HDx 1.0 1.8 7.91 781 330 A 45 ILE HG2% A 27 PRO HDy 1.0 1.8 7.91 782 331 A 45 ILE HG2% A 45 ILE HG1y 1.0 1.8 5.61 783 331 A 45 ILE HG2% A 45 ILE HG1x 1.0 1.8 5.61 784 332 A 25 THR HG2% A 30 LEU HDx% 1.0 1.8 6.68 785 332 A 25 THR HG2% A 30 LEU HDy% 1.0 1.8 6.68 786 333 A 46 PRO HDx A 45 ILE HD1% 1.0 1.8 7.37 787 333 A 46 PRO HDy A 45 ILE HD1% 1.0 1.8 7.37 788 334 A 34 PHE HDx A 40 VAL HGx% 1.0 1.8 8.82 789 334 A 34 PHE HDy A 40 VAL HGy% 1.0 1.8 8.82 790 334 A 34 PHE HDx A 40 VAL HGy% 1.0 1.8 8.82 791 334 A 34 PHE HDy A 40 VAL HGx% 1.0 1.8 8.82 792 335 A 40 VAL HGx% A 62 PHE HZ 1.0 1.8 7.91 793 335 A 40 VAL HGy% A 62 PHE HZ 1.0 1.8 7.91 794 336 A 40 VAL HGx% A 62 PHE HDx 1.0 1.8 8.61 795 336 A 40 VAL HGx% A 62 PHE HDy 1.0 1.8 8.61 796 336 A 40 VAL HGy% A 62 PHE HDx 1.0 1.8 8.61 797 336 A 40 VAL HGy% A 62 PHE HDy 1.0 1.8 8.61 798 337 A 40 VAL HGy% A 62 PHE HEx 1.0 1.8 8.49 799 337 A 40 VAL HGx% A 62 PHE HEx 1.0 1.8 8.49 800 337 A 40 VAL HGx% A 62 PHE HEy 1.0 1.8 8.49 801 337 A 40 VAL HGy% A 62 PHE HEy 1.0 1.8 8.49 802 338 A 40 VAL HGy% A 35 GLU HBy 1.0 1.8 7.67 803 338 A 40 VAL HGx% A 35 GLU HBy 1.0 1.8 7.67 804 338 A 40 VAL HGx% A 35 GLU HBx 1.0 1.8 7.67 805 338 A 40 VAL HGy% A 35 GLU HBx 1.0 1.8 7.67 806 339 A 60 VAL HGx% A 34 PHE HA 1.0 1.8 7.91 807 339 A 60 VAL HGy% A 34 PHE HA 1.0 1.8 7.91 808 340 A 30 LEU HA A 60 VAL HGx% 1.0 1.8 7.91 809 340 A 30 LEU HA A 60 VAL HGy% 1.0 1.8 7.91 810 341 A 60 VAL HGx% A 34 PHE HBx 1.0 1.8 6.36 811 341 A 60 VAL HGy% A 34 PHE HBx 1.0 1.8 6.36 812 342 A 60 VAL HGy% A 18 VAL HB 1.0 1.8 5.38 813 342 A 60 VAL HGx% A 18 VAL HB 1.0 1.8 5.38 814 343 A 60 VAL HGy% A 18 VAL HGx% 1.0 1.8 5.66 815 343 A 60 VAL HGx% A 18 VAL HGx% 1.0 1.8 5.66 816 344 A 60 VAL HGx% A 18 VAL HGy% 1.0 1.8 5.50 817 344 A 60 VAL HGy% A 18 VAL HGy% 1.0 1.8 5.50 818 345 A 40 VAL HGx% A 60 VAL HGy% 1.0 1.8 5.79 819 345 A 40 VAL HGx% A 60 VAL HGx% 1.0 1.8 5.79 820 345 A 40 VAL HGy% A 60 VAL HGy% 1.0 1.8 5.79 821 345 A 40 VAL HGy% A 60 VAL HGx% 1.0 1.8 5.79 822 346 A 60 VAL HGy% A 18 VAL HB 1.0 1.8 5.57 823 346 A 60 VAL HGx% A 18 VAL HB 1.0 1.8 5.57 824 347 A 30 LEU HBx A 60 VAL HGx% 1.0 1.8 6.07 825 347 A 30 LEU HBx A 60 VAL HGy% 1.0 1.8 6.07 826 348 A 22 THR HB A 23 TYR HDy 1.0 1.8 6.01 827 348 A 22 THR HB A 23 TYR HDx 1.0 1.8 6.01 828 349 A 22 THR HB A 83 ARG HBy 1.0 1.8 6.67 829 349 A 22 THR HB A 83 ARG HBx 1.0 1.8 6.67 830 350 A 51 THR HB A 52 LYS H 1.0 1.8 4.94 831 351 A 51 THR HB A 53 GLU H 1.0 1.8 6.00 832 352 A 51 THR HB A 53 GLU HGy 1.0 1.8 4.89 833 352 A 51 THR HB A 53 GLU HGx 1.0 1.8 4.89 834 353 A 51 THR HB A 53 GLU HBy 1.0 1.8 6.67 835 353 A 51 THR HB A 53 GLU HBx 1.0 1.8 6.67 836 354 A 29 THR HB A 29 THR H 1.0 1.8 4.27 837 355 A 25 THR HB A 26 SER H 1.0 1.8 5.19 838 356 A 32 ARG HBy A 29 THR HA 1.0 1.8 4.98 839 356 A 32 ARG HBx A 29 THR HA 1.0 1.8 4.98 840 357 A 29 THR HA A 32 ARG HDy 1.0 1.8 5.53 841 357 A 29 THR HA A 32 ARG HDx 1.0 1.8 5.53 842 358 A 33 VAL HA A 36 LYS H 1.0 1.8 5.59 843 359 A 26 SER HBy A 27 PRO HGx 1.0 1.8 6.43 844 359 A 26 SER HBy A 27 PRO HGy 1.0 1.8 6.43 845 359 A 26 SER HBx A 27 PRO HGy 1.0 1.8 6.43 846 359 A 26 SER HBx A 27 PRO HGx 1.0 1.8 6.43 847 360 A 25 THR HA A 26 SER H 1.0 1.8 4.04 848 361 A 25 THR HG2% A 25 THR HA 1.0 1.8 4.55 849 362 A 15 SER HBy A 90 ALA H 1.0 1.8 6.43 850 362 A 15 SER HBx A 90 ALA H 1.0 1.8 6.43 851 363 A 15 SER HBx A 90 ALA HB% 1.0 1.8 6.27 852 363 A 15 SER HBy A 90 ALA HB% 1.0 1.8 6.27 853 364 A 54 SER HBy A 48 ASP H 1.0 1.8 5.14 854 364 A 54 SER HBx A 48 ASP H 1.0 1.8 5.14 855 365 A 54 SER HBy A 55 ARG H 1.0 1.8 5.27 856 365 A 54 SER HBx A 55 ARG H 1.0 1.8 5.27 857 366 A 47 ARG HA A 54 SER HBy 1.0 1.8 3.87 858 366 A 47 ARG HA A 54 SER HBx 1.0 1.8 3.87 859 367 A 47 ARG HA A 54 SER HBy 1.0 1.8 4.61 860 367 A 47 ARG HA A 54 SER HBx 1.0 1.8 4.61 861 368 A 54 SER HBy A 53 GLU HBy 1.0 1.8 7.43 862 368 A 54 SER HBx A 53 GLU HBy 1.0 1.8 7.43 863 368 A 54 SER HBy A 53 GLU HBx 1.0 1.8 7.43 864 368 A 54 SER HBx A 53 GLU HBx 1.0 1.8 7.43 865 369 A 54 SER HBy A 47 ARG HDy 1.0 1.8 7.43 866 369 A 54 SER HBx A 47 ARG HDy 1.0 1.8 7.43 867 369 A 54 SER HBy A 47 ARG HDx 1.0 1.8 7.43 868 369 A 54 SER HBx A 47 ARG HDx 1.0 1.8 7.43 869 370 A 8 PRO HA A 9 ASP HBy 1.0 1.8 5.88 870 370 A 8 PRO HA A 9 ASP HBx 1.0 1.8 5.88 871 371 A 8 PRO HA A 10 VAL H 1.0 1.8 5.14 872 372 A 10 VAL HA A 13 MET HE% 1.0 1.8 4.64 873 373 A 10 VAL HA A 10 VAL HGx% 1.0 1.8 4.92 874 373 A 10 VAL HA A 10 VAL HG21 1.0 1.8 4.92 875 374 A 13 MET HBy A 10 VAL HA 1.0 1.8 5.55 876 374 A 13 MET HBx A 10 VAL HA 1.0 1.8 5.55 877 375 A 51 THR HB A 51 THR HA 1.0 1.8 3.47 878 376 A 48 ASP HBy A 51 THR HA 1.0 1.8 6.66 879 376 A 48 ASP HBx A 51 THR HA 1.0 1.8 6.66 880 377 A 51 THR HA A 50 TYR HBy 1.0 1.8 6.67 881 377 A 51 THR HA A 50 TYR HBx 1.0 1.8 6.67 882 378 A 51 THR HG2% A 51 THR HA 1.0 1.8 4.37 883 379 A 51 THR HA A 50 TYR HA 1.0 1.8 5.13 884 380 A 40 VAL HA A 62 PHE HDy 1.0 1.8 6.34 885 380 A 40 VAL HA A 62 PHE HDx 1.0 1.8 6.34 886 381 A 40 VAL HA A 62 PHE HA 1.0 1.8 4.68 887 382 A 40 VAL HA A 41 GLY HAy 1.0 1.8 6.53 888 382 A 40 VAL HA A 41 GLY HAx 1.0 1.8 6.53 889 383 A 40 VAL HGy% A 40 VAL HA 1.0 1.8 5.06 890 383 A 40 VAL HGx% A 40 VAL HA 1.0 1.8 5.06 891 384 A 40 VAL HA A 39 ARG HA 1.0 1.8 5.21 892 385 A 87 VAL HA A 87 VAL HGx% 1.0 1.8 5.08 893 385 A 87 VAL HA A 87 VAL HGy% 1.0 1.8 5.08 894 386 A 60 VAL HGx% A 60 VAL HA 1.0 1.8 5.31 895 386 A 60 VAL HGy% A 60 VAL HA 1.0 1.8 5.31 896 387 A 43 VAL HGx% A 60 VAL HA 1.0 1.8 6.86 897 387 A 43 VAL HGy% A 60 VAL HA 1.0 1.8 6.86 898 388 A 22 THR HA A 23 TYR HDy 1.0 1.8 5.57 899 388 A 22 THR HA A 23 TYR HDx 1.0 1.8 5.57 900 389 A 22 THR HA A 22 THR HG2% 1.0 1.8 4.61 901 390 A 22 THR HA A 24 ARG H 1.0 1.8 4.89 902 391 A 69 GLU HA A 73 ASP H 1.0 1.8 5.01 903 392 A 65 LYS HA A 65 LYS HEy 1.0 1.8 5.58 904 392 A 65 LYS HA A 65 LYS HEx 1.0 1.8 5.58 905 393 A 72 MET HA A 73 ASP HA 1.0 1.8 5.30 906 394 A 69 GLU HA A 68 ALA HB% 1.0 1.8 5.69 907 395 A 71 ALA HB% A 72 MET HA 1.0 1.8 6.08 908 396 A 87 VAL HGx% A 72 MET HA 1.0 1.8 4.80 909 396 A 87 VAL HGy% A 72 MET HA 1.0 1.8 4.80 910 397 A 15 SER HA A 14 THR HG2% 1.0 1.8 6.55 911 398 A 15 SER HA A 61 ARG HGy 1.0 1.8 6.67 912 398 A 15 SER HA A 61 ARG HGx 1.0 1.8 6.67 913 399 A 23 TYR HDy A 23 TYR HA 1.0 1.8 4.84 914 399 A 23 TYR HDx A 23 TYR HA 1.0 1.8 4.84 915 400 A 35 GLU HA A 32 ARG HA 1.0 1.8 5.48 916 401 A 32 ARG HA A 32 ARG HDy 1.0 1.8 5.60 917 401 A 32 ARG HA A 32 ARG HDx 1.0 1.8 5.60 918 402 A 35 GLU HGy A 32 ARG HA 1.0 1.8 6.15 919 402 A 35 GLU HGx A 32 ARG HA 1.0 1.8 6.15 920 403 A 11 GLU HA A 11 GLU HBy 1.0 1.8 3.59 921 403 A 11 GLU HA A 11 GLU HBx 1.0 1.8 3.59 922 404 A 2 SER HA A 2 SER HBy 1.0 1.8 3.26 923 404 A 2 SER HA A 2 SER HBx 1.0 1.8 3.26 924 405 A 98 SER HA A 98 SER HBy 1.0 1.8 3.71 925 405 A 98 SER HA A 98 SER HBx 1.0 1.8 3.71 926 406 A 54 SER H A 55 ARG HA 1.0 1.8 5.67 927 407 A 55 ARG HA A 47 ARG H 1.0 1.8 6.00 928 408 A 47 ARG HGy A 55 ARG HA 1.0 1.8 5.66 929 408 A 47 ARG HGx A 55 ARG HA 1.0 1.8 5.66 930 409 A 45 ILE HG2% A 55 ARG HA 1.0 1.8 5.69 931 410 A 40 VAL HB A 35 GLU HA 1.0 1.8 5.75 932 411 A 31 ARG HA A 35 GLU HA 1.0 1.8 6.00 933 412 A 40 VAL HA A 35 GLU HA 1.0 1.8 6.00 934 413 A 36 LYS HA A 35 GLU H 1.0 1.8 6.00 935 414 A 36 LYS HA A 36 LYS HEy 1.0 1.8 6.19 936 414 A 36 LYS HA A 36 LYS HEx 1.0 1.8 6.19 937 415 A 36 LYS HA A 36 LYS HBx 1.0 1.8 3.49 938 416 A 35 GLU HA A 36 LYS HA 1.0 1.8 5.35 939 417 A 34 PHE HBy A 35 GLU HA 1.0 1.8 5.58 940 418 A 40 VAL HGy% A 35 GLU HA 1.0 1.8 5.04 941 418 A 40 VAL HGx% A 35 GLU HA 1.0 1.8 5.04 942 419 A 73 ASP H A 70 ASP HA 1.0 1.8 5.26 943 420 A 71 ALA HB% A 70 ASP HA 1.0 1.8 6.70 944 421 A 48 ASP HBy A 52 LYS HA 1.0 1.8 5.39 945 421 A 48 ASP HBx A 52 LYS HA 1.0 1.8 5.39 946 422 A 67 ASP HA A 66 ARG H 1.0 1.8 6.00 947 423 A 67 ASP HA A 70 ASP H 1.0 1.8 4.52 948 424 A 59 PHE HDy A 59 PHE HA 1.0 1.8 5.29 949 424 A 59 PHE HDx A 59 PHE HA 1.0 1.8 5.29 950 425 A 59 PHE HA A 17 LYS HA 1.0 1.8 5.47 951 426 A 58 ALA HB% A 59 PHE HA 1.0 1.8 6.30 952 427 A 84 GLU HA A 79 VAL HA 1.0 1.8 3.78 953 428 A 84 GLU HA A 84 GLU HGx 1.0 1.8 3.30 954 429 A 43 VAL HGx% A 44 TYR HA 1.0 1.8 7.54 955 429 A 43 VAL HGy% A 44 TYR HA 1.0 1.8 7.54 956 430 A 44 TYR HA A 45 ILE HG2% 1.0 1.8 7.11 957 431 A 26 SER HA A 27 PRO HDy 1.0 1.8 4.34 958 431 A 26 SER HA A 27 PRO HDx 1.0 1.8 4.34 959 432 A 26 SER HA A 27 PRO HDy 1.0 1.8 4.64 960 432 A 26 SER HA A 27 PRO HDx 1.0 1.8 4.64 961 433 A 26 SER HA A 27 PRO HGy 1.0 1.8 5.94 962 433 A 26 SER HA A 27 PRO HGx 1.0 1.8 5.94 963 434 A 84 GLU HA A 83 ARG HA 1.0 1.8 5.48 964 435 A 83 ARG HGx A 83 ARG HA 1.0 1.8 4.53 965 436 A 62 PHE HDy A 68 ALA HA 1.0 1.8 5.35 966 436 A 62 PHE HDx A 68 ALA HA 1.0 1.8 5.35 967 437 A 62 PHE HEy A 68 ALA HA 1.0 1.8 6.17 968 437 A 62 PHE HEx A 68 ALA HA 1.0 1.8 6.17 969 438 A 72 MET HBy A 68 ALA HA 1.0 1.8 6.53 970 438 A 72 MET HBx A 68 ALA HA 1.0 1.8 6.53 971 439 A 62 PHE HBy A 68 ALA HA 1.0 1.8 5.94 972 440 A 69 GLU HA A 68 ALA HA 1.0 1.8 6.00 973 441 A 71 ALA HA A 73 ASP H 1.0 1.8 6.00 974 442 A 75 MET HBy A 71 ALA HA 1.0 1.8 5.64 975 442 A 75 MET HBx A 71 ALA HA 1.0 1.8 5.64 976 443 A 71 ALA HA A 74 ALA HB% 1.0 1.8 5.14 977 444 A 57 PHE HA A 58 ALA HB% 1.0 1.8 5.92 978 445 A 86 ARG HA A 20 ASN HBx 1.0 1.8 5.69 979 446 A 86 ARG HA A 86 ARG HGy 1.0 1.8 4.77 980 446 A 86 ARG HA A 86 ARG HGx 1.0 1.8 4.77 981 447 A 86 ARG HA A 87 VAL HGy% 1.0 1.8 5.93 982 447 A 86 ARG HA A 87 VAL HGx% 1.0 1.8 5.93 983 448 A 82 GLY HAy A 83 ARG HA 1.0 1.8 5.71 984 448 A 82 GLY HAx A 83 ARG HA 1.0 1.8 5.71 985 449 A 74 ALA HA A 73 ASP HBy 1.0 1.8 5.49 986 450 A 75 MET HBy A 74 ALA HA 1.0 1.8 6.67 987 450 A 75 MET HBx A 74 ALA HA 1.0 1.8 6.67 988 451 A 71 ALA HB% A 68 ALA HA 1.0 1.8 4.97 989 452 A 16 LEU HDy% A 68 ALA HA 1.0 1.8 5.61 990 452 A 16 LEU HDx% A 68 ALA HA 1.0 1.8 5.61 991 453 A 71 ALA HA A 37 TYR HA 1.0 1.8 5.82 992 454 A 71 ALA HA A 70 ASP HA 1.0 1.8 6.00 993 455 A 19 ASP HA A 18 VAL HA 1.0 1.8 5.25 994 456 A 19 ASP HA A 86 ARG HBx 1.0 1.8 5.47 995 457 A 88 GLN HA A 89 MET H 1.0 1.8 3.77 996 458 A 88 GLN HA A 89 MET HA 1.0 1.8 5.08 997 459 A 88 GLN HBy A 88 GLN HA 1.0 1.8 3.86 998 459 A 88 GLN HBx A 88 GLN HA 1.0 1.8 3.86 999 460 A 19 ASP HA A 21 LEU HDx% 1.0 1.8 7.29 1000 460 A 19 ASP HA A 21 LEU HDy% 1.0 1.8 7.29 1001 461 A 19 ASP HA A 20 ASN HA 1.0 1.8 5.54 1002 462 A 64 ASP HA A 68 ALA H 1.0 1.8 6.00 1003 463 A 64 ASP HA A 65 LYS HA 1.0 1.8 5.10 1004 464 A 64 ASP HA A 65 LYS HBy 1.0 1.8 5.79 1005 464 A 64 ASP HA A 65 LYS HBx 1.0 1.8 5.79 1006 465 A 64 ASP HA A 14 THR HG2% 1.0 1.8 5.88 1007 466 A 87 VAL HGx% A 88 GLN HA 1.0 1.8 6.43 1008 466 A 87 VAL HGy% A 88 GLN HA 1.0 1.8 6.43 1009 467 A 75 MET HA A 78 ALA HB% 1.0 1.8 4.15 1010 468 A 64 ASP HA A 66 ARG H 1.0 1.8 4.91 1011 469 A 79 VAL HA A 78 ALA HA 1.0 1.8 5.07 1012 470 A 45 ILE HD1% A 27 PRO HDx 1.0 1.8 5.89 1013 470 A 45 ILE HD1% A 27 PRO HDy 1.0 1.8 5.89 1014 471 A 26 SER HBy A 27 PRO HDy 1.0 1.8 5.62 1015 471 A 26 SER HBy A 27 PRO HDx 1.0 1.8 5.62 1016 471 A 26 SER HBx A 27 PRO HDy 1.0 1.8 5.62 1017 471 A 26 SER HBx A 27 PRO HDx 1.0 1.8 5.62 1018 472 A 27 PRO HDy A 28 ASP H 1.0 1.8 6.03 1019 472 A 27 PRO HDx A 28 ASP H 1.0 1.8 6.03 1020 473 A 94 ARG HA A 95 PRO HDy 1.0 1.8 4.61 1021 473 A 94 ARG HA A 95 PRO HDx 1.0 1.8 4.61 1022 474 A 94 ARG HA A 95 PRO HDy 1.0 1.8 5.09 1023 474 A 94 ARG HA A 95 PRO HDx 1.0 1.8 5.09 1024 475 A 95 PRO HDy A 94 ARG HBy 1.0 1.8 5.74 1025 475 A 95 PRO HDy A 94 ARG HBx 1.0 1.8 5.74 1026 475 A 95 PRO HDx A 94 ARG HBx 1.0 1.8 5.74 1027 475 A 95 PRO HDx A 94 ARG HBy 1.0 1.8 5.74 1028 476 A 6 PRO HDx A 5 ARG HBy 1.0 1.8 5.45 1029 476 A 6 PRO HDy A 5 ARG HBy 1.0 1.8 5.45 1030 476 A 5 ARG HBx A 6 PRO HDy 1.0 1.8 5.45 1031 476 A 5 ARG HBx A 6 PRO HDx 1.0 1.8 5.45 1032 477 A 6 PRO HDy A 5 ARG HA 1.0 1.8 4.50 1033 477 A 6 PRO HDx A 5 ARG HA 1.0 1.8 4.50 1034 478 A 58 ALA HA A 21 LEU HDx% 1.0 1.8 5.76 1035 478 A 58 ALA HA A 21 LEU HDy% 1.0 1.8 5.76 1036 479 A 58 ALA HA A 59 PHE HBy 1.0 1.8 6.38 1037 479 A 58 ALA HA A 59 PHE HBx 1.0 1.8 6.38 1038 480 A 84 GLU HBy A 77 GLY HAx 1.0 1.8 6.00 1039 481 A 63 HIS HE1 A 41 GLY HAy 1.0 1.8 6.67 1040 481 A 63 HIS HE1 A 41 GLY HAx 1.0 1.8 6.67 1041 482 A 78 ALA HB% A 77 GLY HAy 1.0 1.8 6.60 1042 483 A 82 GLY HAy A 79 VAL HB 1.0 1.8 6.16 1043 483 A 82 GLY HAx A 79 VAL HB 1.0 1.8 6.16 1044 484 A 4 GLY HAy A 5 ARG HBy 1.0 1.8 6.02 1045 484 A 4 GLY HAy A 5 ARG HBx 1.0 1.8 6.02 1046 484 A 4 GLY HAx A 5 ARG HBy 1.0 1.8 6.02 1047 484 A 4 GLY HAx A 5 ARG HBx 1.0 1.8 6.02 1048 485 A 4 GLY HAy A 5 ARG H 1.0 1.8 4.13 1049 485 A 4 GLY HAx A 5 ARG H 1.0 1.8 4.13 1050 486 A 82 GLY HAx A 79 VAL HGy% 1.0 1.8 8.47 1051 486 A 82 GLY HAy A 79 VAL HGy% 1.0 1.8 8.47 1052 486 A 79 VAL HGx% A 82 GLY HAy 1.0 1.8 8.47 1053 486 A 79 VAL HGx% A 82 GLY HAx 1.0 1.8 8.47 1054 487 A 82 GLY HAx A 79 VAL HGy% 1.0 1.8 6.16 1055 487 A 82 GLY HAy A 79 VAL HGy% 1.0 1.8 6.16 1056 487 A 79 VAL HGx% A 82 GLY HAy 1.0 1.8 6.16 1057 487 A 79 VAL HGx% A 82 GLY HAx 1.0 1.8 6.16 1058 488 A 40 VAL HGx% A 41 GLY HAx 1.0 1.8 7.58 1059 488 A 40 VAL HGy% A 41 GLY HAx 1.0 1.8 7.58 1060 488 A 40 VAL HGy% A 41 GLY HAy 1.0 1.8 7.58 1061 488 A 40 VAL HGx% A 41 GLY HAy 1.0 1.8 7.58 1062 489 A 19 ASP HBy A 20 ASN HA 1.0 1.8 6.13 1063 489 A 19 ASP HBx A 20 ASN HA 1.0 1.8 6.13 1064 490 A 19 ASP HBy A 86 ARG HBx 1.0 1.8 5.89 1065 490 A 19 ASP HBx A 86 ARG HBx 1.0 1.8 5.89 1066 491 A 19 ASP HBy A 18 VAL HGx% 1.0 1.8 7.78 1067 491 A 19 ASP HBx A 18 VAL HGx% 1.0 1.8 7.78 1068 492 A 19 ASP HBy A 86 ARG HBy 1.0 1.8 5.66 1069 492 A 19 ASP HBx A 86 ARG HBy 1.0 1.8 5.66 1070 493 A 19 ASP HBy A 18 VAL HGx% 1.0 1.8 6.85 1071 493 A 19 ASP HBx A 18 VAL HGx% 1.0 1.8 6.85 1072 494 A 85 LEU HDx% A 80 LEU HBx 1.0 1.8 6.14 1073 494 A 85 LEU HDx% A 80 LEU HBy 1.0 1.8 6.14 1074 494 A 85 LEU HDy% A 80 LEU HBy 1.0 1.8 6.14 1075 494 A 85 LEU HDy% A 80 LEU HBx 1.0 1.8 6.14 1076 495 A 94 ARG HBx A 93 GLY HAy 1.0 1.8 5.97 1077 495 A 94 ARG HBy A 93 GLY HAy 1.0 1.8 5.97 1078 495 A 94 ARG HBy A 93 GLY HAx 1.0 1.8 5.97 1079 495 A 94 ARG HBx A 93 GLY HAx 1.0 1.8 5.97 1080 496 A 19 ASP HBy A 86 ARG H 1.0 1.8 6.67 1081 496 A 19 ASP HBx A 86 ARG H 1.0 1.8 6.67 1082 497 A 19 ASP HBy A 86 ARG HBx 1.0 1.8 5.63 1083 497 A 19 ASP HBx A 86 ARG HBx 1.0 1.8 5.63 1084 498 A 19 ASP HBy A 20 ASN H 1.0 1.8 5.62 1085 498 A 19 ASP HBx A 20 ASN H 1.0 1.8 5.62 1086 499 A 93 GLY HAy A 92 TYR HA 1.0 1.8 5.27 1087 499 A 93 GLY HAx A 92 TYR HA 1.0 1.8 5.27 1088 500 A 43 VAL HGx% A 42 ASP HBy 1.0 1.8 8.02 1089 500 A 43 VAL HGx% A 42 ASP HBx 1.0 1.8 8.02 1090 500 A 43 VAL HGy% A 42 ASP HBy 1.0 1.8 8.02 1091 500 A 43 VAL HGy% A 42 ASP HBx 1.0 1.8 8.02 1092 501 A 64 ASP H A 64 ASP HBy 1.0 1.8 4.74 1093 501 A 64 ASP H A 64 ASP HBx 1.0 1.8 4.74 1094 502 A 16 LEU HBy A 16 LEU HDy% 1.0 1.8 6.19 1095 502 A 16 LEU HBx A 16 LEU HDx% 1.0 1.8 6.19 1096 502 A 16 LEU HBy A 16 LEU HDx% 1.0 1.8 6.19 1097 502 A 16 LEU HBx A 16 LEU HDy% 1.0 1.8 6.19 1098 503 A 60 VAL HGx% A 16 LEU HBx 1.0 1.8 8.63 1099 503 A 60 VAL HGx% A 16 LEU HBy 1.0 1.8 8.63 1100 503 A 60 VAL HGy% A 16 LEU HBy 1.0 1.8 8.63 1101 503 A 60 VAL HGy% A 16 LEU HBx 1.0 1.8 8.63 1102 504 A 31 ARG HA A 31 ARG HDy 1.0 1.8 4.68 1103 504 A 31 ARG HA A 31 ARG HDx 1.0 1.8 4.68 1104 505 A 31 ARG HDy A 40 VAL H 1.0 1.8 6.08 1105 505 A 31 ARG HDx A 40 VAL H 1.0 1.8 6.08 1106 506 A 3 TYR HDy A 31 ARG HDy 1.0 1.8 7.43 1107 506 A 3 TYR HDy A 31 ARG HDx 1.0 1.8 7.43 1108 506 A 3 TYR HDx A 31 ARG HDy 1.0 1.8 7.43 1109 506 A 3 TYR HDx A 31 ARG HDx 1.0 1.8 7.43 1110 507 A 5 ARG HBy A 5 ARG HDx 1.0 1.8 3.79 1111 507 A 5 ARG HBy A 5 ARG HDy 1.0 1.8 3.79 1112 507 A 5 ARG HBx A 5 ARG HDy 1.0 1.8 3.79 1113 507 A 5 ARG HBx A 5 ARG HDx 1.0 1.8 3.79 1114 508 A 48 ASP H A 47 ARG HDy 1.0 1.8 6.43 1115 508 A 48 ASP H A 47 ARG HDx 1.0 1.8 6.43 1116 509 A 47 ARG HDy A 52 LYS HBx 1.0 1.8 7.43 1117 509 A 47 ARG HDx A 52 LYS HBy 1.0 1.8 7.43 1118 509 A 47 ARG HDx A 52 LYS HBx 1.0 1.8 7.43 1119 509 A 47 ARG HDy A 52 LYS HBy 1.0 1.8 7.43 1120 510 A 47 ARG HDy A 55 ARG HGx 1.0 1.8 7.43 1121 510 A 47 ARG HDy A 55 ARG HGy 1.0 1.8 7.43 1122 510 A 47 ARG HDx A 55 ARG HGy 1.0 1.8 7.43 1123 510 A 47 ARG HDx A 55 ARG HGx 1.0 1.8 7.43 1124 511 A 47 ARG HGy A 47 ARG HDx 1.0 1.8 4.20 1125 511 A 47 ARG HGy A 47 ARG HDy 1.0 1.8 4.20 1126 511 A 47 ARG HGx A 47 ARG HDy 1.0 1.8 4.20 1127 511 A 47 ARG HGx A 47 ARG HDx 1.0 1.8 4.20 1128 512 A 47 ARG HBy A 47 ARG HDx 1.0 1.8 4.37 1129 512 A 47 ARG HBy A 47 ARG HDy 1.0 1.8 4.37 1130 512 A 47 ARG HBx A 47 ARG HDy 1.0 1.8 4.37 1131 512 A 47 ARG HBx A 47 ARG HDx 1.0 1.8 4.37 1132 513 A 65 LYS HA A 64 ASP HBy 1.0 1.8 6.67 1133 513 A 65 LYS HA A 64 ASP HBx 1.0 1.8 6.67 1134 514 A 68 ALA H A 64 ASP HBy 1.0 1.8 6.15 1135 514 A 68 ALA H A 64 ASP HBx 1.0 1.8 6.15 1136 515 A 85 LEU HBx A 78 ALA HB% 1.0 1.8 6.54 1137 516 A 85 LEU HBx A 85 LEU HDx% 1.0 1.8 5.30 1138 516 A 85 LEU HBx A 85 LEU HDy% 1.0 1.8 5.30 1139 517 A 85 LEU HBx A 78 ALA HA 1.0 1.8 5.93 1140 518 A 84 GLU HA A 85 LEU HBx 1.0 1.8 6.00 1141 519 A 16 LEU HBy A 62 PHE H 1.0 1.8 5.93 1142 519 A 16 LEU HBx A 62 PHE H 1.0 1.8 5.93 1143 520 A 21 LEU HBy A 22 THR H 1.0 1.8 5.42 1144 520 A 21 LEU HBx A 22 THR H 1.0 1.8 5.42 1145 521 A 21 LEU HBy A 83 ARG HDx 1.0 1.8 6.67 1146 521 A 21 LEU HBy A 83 ARG HDy 1.0 1.8 6.67 1147 521 A 21 LEU HBx A 83 ARG HDy 1.0 1.8 6.67 1148 521 A 21 LEU HBx A 83 ARG HDx 1.0 1.8 6.67 1149 522 A 21 LEU HDx% A 21 LEU HBy 1.0 1.8 6.19 1150 522 A 21 LEU HDy% A 21 LEU HBy 1.0 1.8 6.19 1151 522 A 21 LEU HDx% A 21 LEU HBx 1.0 1.8 6.19 1152 522 A 21 LEU HDy% A 21 LEU HBx 1.0 1.8 6.19 1153 523 A 21 LEU HBy A 26 SER H 1.0 1.8 6.67 1154 523 A 21 LEU HBx A 26 SER H 1.0 1.8 6.67 1155 524 A 76 ASP HA A 86 ARG HDy 1.0 1.8 6.31 1156 524 A 76 ASP HA A 86 ARG HDx 1.0 1.8 6.31 1157 525 A 31 ARG HA A 31 ARG HDy 1.0 1.8 5.28 1158 525 A 31 ARG HA A 31 ARG HDx 1.0 1.8 5.28 1159 526 A 31 ARG HDy A 31 ARG HBy 1.0 1.8 4.88 1160 526 A 31 ARG HDx A 31 ARG HBy 1.0 1.8 4.88 1161 526 A 31 ARG HDy A 31 ARG HBx 1.0 1.8 4.88 1162 526 A 31 ARG HDx A 31 ARG HBx 1.0 1.8 4.88 1163 527 A 31 ARG HDy A 43 VAL HGy% 1.0 1.8 6.70 1164 527 A 31 ARG HDx A 43 VAL HGx% 1.0 1.8 6.70 1165 527 A 31 ARG HDy A 43 VAL HGx% 1.0 1.8 6.70 1166 527 A 31 ARG HDx A 43 VAL HGy% 1.0 1.8 6.70 1167 528 A 40 VAL HGx% A 31 ARG HDx 1.0 1.8 7.35 1168 528 A 40 VAL HGy% A 31 ARG HDx 1.0 1.8 7.35 1169 528 A 40 VAL HGx% A 31 ARG HDy 1.0 1.8 7.35 1170 528 A 40 VAL HGy% A 31 ARG HDy 1.0 1.8 7.35 1171 529 A 86 ARG HDy A 87 VAL H 1.0 1.8 4.91 1172 529 A 86 ARG HDx A 87 VAL H 1.0 1.8 4.91 1173 530 A 86 ARG HDy A 77 GLY H 1.0 1.8 6.55 1174 530 A 86 ARG HDx A 77 GLY H 1.0 1.8 6.55 1175 531 A 86 ARG HA A 86 ARG HDy 1.0 1.8 4.55 1176 531 A 86 ARG HA A 86 ARG HDx 1.0 1.8 4.55 1177 532 A 86 ARG HDx A 86 ARG HGy 1.0 1.8 4.03 1178 532 A 86 ARG HDy A 86 ARG HGy 1.0 1.8 4.03 1179 532 A 86 ARG HDy A 86 ARG HGx 1.0 1.8 4.03 1180 532 A 86 ARG HDx A 86 ARG HGx 1.0 1.8 4.03 1181 533 A 87 VAL HGx% A 86 ARG HDy 1.0 1.8 8.02 1182 533 A 87 VAL HGy% A 86 ARG HDy 1.0 1.8 8.02 1183 533 A 87 VAL HGx% A 86 ARG HDx 1.0 1.8 8.02 1184 533 A 87 VAL HGy% A 86 ARG HDx 1.0 1.8 8.02 1185 534 A 32 ARG HGy A 32 ARG HDy 1.0 1.8 3.75 1186 534 A 32 ARG HGy A 32 ARG HDx 1.0 1.8 3.75 1187 534 A 32 ARG HGx A 32 ARG HDy 1.0 1.8 3.75 1188 534 A 32 ARG HGx A 32 ARG HDx 1.0 1.8 3.75 1189 535 A 31 ARG HDy A 31 ARG H 1.0 1.8 6.57 1190 535 A 31 ARG HDx A 31 ARG H 1.0 1.8 6.57 1191 536 A 31 ARG HDy A 43 VAL HGy% 1.0 1.8 6.57 1192 536 A 31 ARG HDx A 43 VAL HGx% 1.0 1.8 6.57 1193 536 A 31 ARG HDy A 43 VAL HGx% 1.0 1.8 6.57 1194 536 A 31 ARG HDx A 43 VAL HGy% 1.0 1.8 6.57 1195 537 A 40 VAL HGx% A 31 ARG HDx 1.0 1.8 7.75 1196 537 A 40 VAL HGy% A 31 ARG HDx 1.0 1.8 7.75 1197 537 A 40 VAL HGx% A 31 ARG HDy 1.0 1.8 7.75 1198 537 A 40 VAL HGy% A 31 ARG HDy 1.0 1.8 7.75 1199 538 A 52 LYS HA A 47 ARG HDy 1.0 1.8 5.80 1200 538 A 52 LYS HA A 47 ARG HDx 1.0 1.8 5.80 1201 539 A 54 SER HBy A 47 ARG HDy 1.0 1.8 7.34 1202 539 A 54 SER HBx A 47 ARG HDy 1.0 1.8 7.34 1203 539 A 54 SER HBy A 47 ARG HDx 1.0 1.8 7.34 1204 539 A 54 SER HBx A 47 ARG HDx 1.0 1.8 7.34 1205 540 A 83 ARG HDy A 22 THR H 1.0 1.8 4.92 1206 540 A 83 ARG HDx A 22 THR H 1.0 1.8 4.92 1207 541 A 83 ARG HDy A 83 ARG HBy 1.0 1.8 4.53 1208 541 A 83 ARG HDx A 83 ARG HBy 1.0 1.8 4.53 1209 541 A 83 ARG HDy A 83 ARG HBx 1.0 1.8 4.53 1210 541 A 83 ARG HDx A 83 ARG HBx 1.0 1.8 4.53 1211 542 A 21 LEU HDx% A 83 ARG HDx 1.0 1.8 8.20 1212 542 A 21 LEU HDy% A 83 ARG HDx 1.0 1.8 8.20 1213 542 A 21 LEU HDy% A 83 ARG HDy 1.0 1.8 8.20 1214 542 A 21 LEU HDx% A 83 ARG HDy 1.0 1.8 8.20 1215 543 A 85 LEU HDx% A 83 ARG HDy 1.0 1.8 8.46 1216 543 A 85 LEU HDx% A 83 ARG HDx 1.0 1.8 8.46 1217 543 A 85 LEU HDy% A 83 ARG HDx 1.0 1.8 8.46 1218 543 A 85 LEU HDy% A 83 ARG HDy 1.0 1.8 8.46 1219 544 A 83 ARG HDy A 21 LEU H 1.0 1.8 5.94 1220 544 A 83 ARG HDx A 21 LEU H 1.0 1.8 5.94 1221 545 A 21 LEU HA A 83 ARG HDy 1.0 1.8 5.42 1222 545 A 21 LEU HA A 83 ARG HDx 1.0 1.8 5.42 1223 546 A 22 THR HA A 83 ARG HDy 1.0 1.8 5.99 1224 546 A 22 THR HA A 83 ARG HDx 1.0 1.8 5.99 1225 547 A 52 LYS HEy A 52 LYS HA 1.0 1.8 5.91 1226 547 A 52 LYS HEx A 52 LYS HA 1.0 1.8 5.91 1227 548 A 30 LEU HBx A 27 PRO HA 1.0 1.8 4.61 1228 549 A 30 LEU HBx A 43 VAL HGy% 1.0 1.8 4.88 1229 549 A 30 LEU HBx A 43 VAL HGx% 1.0 1.8 4.88 1230 550 A 30 LEU HBx A 30 LEU HDy% 1.0 1.8 5.08 1231 550 A 30 LEU HBx A 30 LEU HDx% 1.0 1.8 5.08 1232 551 A 33 VAL HGx% A 30 LEU HBy 1.0 1.8 6.23 1233 551 A 33 VAL HGy% A 30 LEU HBy 1.0 1.8 6.23 1234 552 A 30 LEU HBy A 30 LEU HDx% 1.0 1.8 5.65 1235 552 A 30 LEU HBy A 30 LEU HDy% 1.0 1.8 5.65 1236 553 A 60 VAL HGx% A 30 LEU HBy 1.0 1.8 6.42 1237 553 A 60 VAL HGy% A 30 LEU HBy 1.0 1.8 6.42 1238 554 A 65 LYS HEy A 65 LYS H 1.0 1.8 6.25 1239 554 A 65 LYS HEx A 65 LYS H 1.0 1.8 6.25 1240 555 A 65 LYS HBy A 65 LYS HEy 1.0 1.8 4.61 1241 555 A 65 LYS HBy A 65 LYS HEx 1.0 1.8 4.61 1242 555 A 65 LYS HBx A 65 LYS HEy 1.0 1.8 4.61 1243 555 A 65 LYS HBx A 65 LYS HEx 1.0 1.8 4.61 1244 556 A 65 LYS HEx A 65 LYS HDy 1.0 1.8 3.89 1245 556 A 65 LYS HEy A 65 LYS HDy 1.0 1.8 3.89 1246 556 A 65 LYS HEy A 65 LYS HDx 1.0 1.8 3.89 1247 556 A 65 LYS HEx A 65 LYS HDx 1.0 1.8 3.89 1248 557 A 65 LYS HGy A 65 LYS HEx 1.0 1.8 4.95 1249 557 A 65 LYS HGy A 65 LYS HEy 1.0 1.8 4.95 1250 557 A 65 LYS HGx A 65 LYS HEy 1.0 1.8 4.95 1251 557 A 65 LYS HGx A 65 LYS HEx 1.0 1.8 4.95 1252 558 A 36 LYS HEy A 36 LYS H 1.0 1.8 5.20 1253 558 A 36 LYS HEx A 36 LYS H 1.0 1.8 5.20 1254 559 A 37 TYR HEy A 36 LYS HEy 1.0 1.8 5.35 1255 559 A 37 TYR HEx A 36 LYS HEy 1.0 1.8 5.35 1256 559 A 37 TYR HEy A 36 LYS HEx 1.0 1.8 5.35 1257 559 A 37 TYR HEx A 36 LYS HEx 1.0 1.8 5.35 1258 560 A 33 VAL HA A 36 LYS HEy 1.0 1.8 4.88 1259 560 A 33 VAL HA A 36 LYS HEx 1.0 1.8 4.88 1260 561 A 36 LYS HDy A 36 LYS HEx 1.0 1.8 3.69 1261 561 A 36 LYS HDy A 36 LYS HEy 1.0 1.8 3.69 1262 561 A 36 LYS HDx A 36 LYS HEy 1.0 1.8 3.69 1263 561 A 36 LYS HDx A 36 LYS HEx 1.0 1.8 3.69 1264 562 A 36 LYS HEy A 36 LYS HBx 1.0 1.8 4.73 1265 562 A 36 LYS HEx A 36 LYS HBx 1.0 1.8 4.73 1266 563 A 36 LYS HGy A 36 LYS HEx 1.0 1.8 4.44 1267 563 A 36 LYS HGy A 36 LYS HEy 1.0 1.8 4.44 1268 563 A 36 LYS HGx A 36 LYS HEy 1.0 1.8 4.44 1269 563 A 36 LYS HGx A 36 LYS HEx 1.0 1.8 4.44 1270 564 A 59 PHE HBy A 44 TYR HBy 1.0 1.8 5.07 1271 564 A 59 PHE HBx A 44 TYR HBy 1.0 1.8 5.07 1272 564 A 59 PHE HBy A 44 TYR HBx 1.0 1.8 5.07 1273 564 A 59 PHE HBx A 44 TYR HBx 1.0 1.8 5.07 1274 565 A 76 ASP HBy A 87 VAL HGx% 1.0 1.8 6.96 1275 565 A 76 ASP HBx A 87 VAL HGy% 1.0 1.8 6.96 1276 565 A 76 ASP HBx A 87 VAL HGx% 1.0 1.8 6.96 1277 565 A 76 ASP HBy A 87 VAL HGy% 1.0 1.8 6.96 1278 566 A 70 ASP HA A 73 ASP HBy 1.0 1.8 3.62 1279 567 A 69 GLU HA A 73 ASP HBy 1.0 1.8 6.00 1280 568 A 69 GLU HBy A 73 ASP HBy 1.0 1.8 6.29 1281 568 A 69 GLU HBx A 73 ASP HBy 1.0 1.8 6.29 1282 569 A 74 ALA HB% A 73 ASP HBy 1.0 1.8 5.32 1283 570 A 73 ASP HBx A 74 ALA H 1.0 1.8 4.90 1284 571 A 73 ASP HBx A 73 ASP HA 1.0 1.8 3.34 1285 572 A 29 THR HG2% A 28 ASP HBy 1.0 1.8 7.00 1286 572 A 29 THR HG2% A 28 ASP HBx 1.0 1.8 7.00 1287 573 A 73 ASP HBx A 69 GLU HBy 1.0 1.8 5.42 1288 573 A 73 ASP HBx A 69 GLU HBx 1.0 1.8 5.42 1289 574 A 59 PHE HEx A 17 LYS HEy 1.0 1.8 7.30 1290 574 A 59 PHE HEy A 17 LYS HEx 1.0 1.8 7.30 1291 574 A 59 PHE HEx A 17 LYS HEx 1.0 1.8 7.30 1292 574 A 59 PHE HEy A 17 LYS HEy 1.0 1.8 7.30 1293 575 A 69 GLU HBy A 70 ASP HBx 1.0 1.8 5.88 1294 575 A 69 GLU HBx A 70 ASP HBx 1.0 1.8 5.88 1295 576 A 22 THR HG2% A 81 ASP HBy 1.0 1.8 5.31 1296 576 A 22 THR HG2% A 81 ASP HBx 1.0 1.8 5.31 1297 577 A 81 ASP HBy A 80 LEU HDy% 1.0 1.8 7.58 1298 577 A 81 ASP HBy A 80 LEU HDx% 1.0 1.8 7.58 1299 577 A 81 ASP HBx A 80 LEU HDx% 1.0 1.8 7.58 1300 577 A 81 ASP HBx A 80 LEU HDy% 1.0 1.8 7.58 1301 578 A 71 ALA HB% A 70 ASP HBx 1.0 1.8 5.81 1302 579 A 9 ASP HBx A 8 PRO HBy 1.0 1.8 7.43 1303 579 A 9 ASP HBy A 8 PRO HBy 1.0 1.8 7.43 1304 579 A 9 ASP HBy A 8 PRO HBx 1.0 1.8 7.43 1305 579 A 9 ASP HBx A 8 PRO HBx 1.0 1.8 7.43 1306 580 A 9 ASP HBx A 13 MET HE% 1.0 1.8 7.91 1307 580 A 9 ASP HBy A 13 MET HE% 1.0 1.8 7.91 1308 581 A 9 ASP HBy A 10 VAL HG21 1.0 1.8 8.72 1309 581 A 9 ASP HBy A 10 VAL HGx% 1.0 1.8 8.72 1310 581 A 9 ASP HBx A 10 VAL HGx% 1.0 1.8 8.72 1311 581 A 9 ASP HBx A 10 VAL HG21 1.0 1.8 8.72 1312 582 A 37 TYR HBx A 36 LYS HGy 1.0 1.8 6.53 1313 582 A 37 TYR HBx A 36 LYS HGx 1.0 1.8 6.53 1314 583 A 34 PHE HBy A 71 ALA HB% 1.0 1.8 6.96 1315 584 A 60 VAL HGy% A 34 PHE HBy 1.0 1.8 6.42 1316 584 A 60 VAL HGx% A 34 PHE HBy 1.0 1.8 6.42 1317 585 A 40 VAL HGx% A 34 PHE HBy 1.0 1.8 6.58 1318 585 A 40 VAL HGy% A 34 PHE HBy 1.0 1.8 6.58 1319 586 A 37 TYR HBy A 71 ALA HB% 1.0 1.8 5.63 1320 587 A 50 TYR HBy A 51 THR H 1.0 1.8 5.11 1321 587 A 50 TYR HBx A 51 THR H 1.0 1.8 5.11 1322 588 A 50 TYR HBy A 50 TYR H 1.0 1.8 4.96 1323 588 A 50 TYR HBx A 50 TYR H 1.0 1.8 4.96 1324 589 A 51 THR HG2% A 50 TYR HBy 1.0 1.8 6.05 1325 589 A 51 THR HG2% A 50 TYR HBx 1.0 1.8 6.05 1326 590 A 44 TYR HA A 45 ILE HB 1.0 1.8 5.36 1327 591 A 44 TYR HDy A 45 ILE HB 1.0 1.8 6.49 1328 591 A 44 TYR HDx A 45 ILE HB 1.0 1.8 6.49 1329 592 A 46 PRO HDy A 45 ILE HB 1.0 1.8 6.67 1330 592 A 46 PRO HDx A 45 ILE HB 1.0 1.8 6.67 1331 593 A 45 ILE HB A 47 ARG HDy 1.0 1.8 6.67 1332 593 A 45 ILE HB A 47 ARG HDx 1.0 1.8 6.67 1333 594 A 20 ASN HBy A 86 ARG H 1.0 1.8 4.89 1334 595 A 83 ARG HDy A 20 ASN HBy 1.0 1.8 6.16 1335 595 A 83 ARG HDx A 20 ASN HBy 1.0 1.8 6.16 1336 596 A 20 ASN HBx A 86 ARG H 1.0 1.8 4.70 1337 597 A 84 GLU HBy A 20 ASN HBx 1.0 1.8 6.00 1338 598 A 84 GLU HBx A 20 ASN HBx 1.0 1.8 6.00 1339 599 A 86 ARG HGy A 20 ASN HBx 1.0 1.8 5.89 1340 599 A 86 ARG HGx A 20 ASN HBx 1.0 1.8 5.89 1341 600 A 19 ASP HA A 20 ASN HBx 1.0 1.8 5.73 1342 601 A 22 THR HG2% A 23 TYR HBy 1.0 1.8 7.91 1343 601 A 22 THR HG2% A 23 TYR HBx 1.0 1.8 7.91 1344 602 A 24 ARG H A 23 TYR HBy 1.0 1.8 5.78 1345 602 A 24 ARG H A 23 TYR HBx 1.0 1.8 5.78 1346 603 A 35 GLU HGy A 36 LYS H 1.0 1.8 6.52 1347 603 A 35 GLU HGx A 36 LYS H 1.0 1.8 6.52 1348 604 A 40 VAL HGy% A 35 GLU HGy 1.0 1.8 6.43 1349 604 A 40 VAL HGx% A 35 GLU HGx 1.0 1.8 6.43 1350 604 A 40 VAL HGy% A 35 GLU HGx 1.0 1.8 6.43 1351 604 A 40 VAL HGx% A 35 GLU HGy 1.0 1.8 6.43 1352 605 A 35 GLU HA A 35 GLU HGy 1.0 1.8 5.09 1353 605 A 35 GLU HA A 35 GLU HGx 1.0 1.8 5.09 1354 606 A 40 VAL HGy% A 35 GLU HGy 1.0 1.8 6.42 1355 606 A 40 VAL HGx% A 35 GLU HGx 1.0 1.8 6.42 1356 606 A 40 VAL HGy% A 35 GLU HGx 1.0 1.8 6.42 1357 606 A 40 VAL HGx% A 35 GLU HGy 1.0 1.8 6.42 1358 607 A 69 GLU HGy A 69 GLU HA 1.0 1.8 4.72 1359 607 A 69 GLU HGx A 69 GLU HA 1.0 1.8 4.72 1360 608 A 69 GLU HGy A 65 LYS HEy 1.0 1.8 7.43 1361 608 A 69 GLU HGx A 65 LYS HEy 1.0 1.8 7.43 1362 608 A 69 GLU HGy A 65 LYS HEx 1.0 1.8 7.43 1363 608 A 69 GLU HGx A 65 LYS HEx 1.0 1.8 7.43 1364 609 A 11 GLU H A 11 GLU HGy 1.0 1.8 4.31 1365 609 A 11 GLU H A 11 GLU HGx 1.0 1.8 4.31 1366 610 A 11 GLU HA A 11 GLU HGy 1.0 1.8 4.24 1367 610 A 11 GLU HA A 11 GLU HGx 1.0 1.8 4.24 1368 611 A 11 GLU HBy A 11 GLU HGx 1.0 1.8 3.68 1369 611 A 11 GLU HBy A 11 GLU HGy 1.0 1.8 3.68 1370 611 A 11 GLU HBx A 11 GLU HGy 1.0 1.8 3.68 1371 611 A 11 GLU HBx A 11 GLU HGx 1.0 1.8 3.68 1372 612 A 84 GLU HGy A 85 LEU H 1.0 1.8 5.41 1373 613 A 84 GLU HGy A 84 GLU HA 1.0 1.8 4.01 1374 614 A 84 GLU HGy A 79 VAL HGx% 1.0 1.8 6.53 1375 614 A 84 GLU HGy A 79 VAL HGy% 1.0 1.8 6.53 1376 615 A 84 GLU HGy A 84 GLU H 1.0 1.8 4.95 1377 616 A 69 GLU HGy A 66 ARG H 1.0 1.8 6.57 1378 616 A 69 GLU HGx A 66 ARG H 1.0 1.8 6.57 1379 617 A 84 GLU HGx A 84 GLU H 1.0 1.8 4.94 1380 618 A 79 VAL HGy% A 84 GLU HGx 1.0 1.8 5.27 1381 618 A 79 VAL HGx% A 84 GLU HGx 1.0 1.8 5.27 1382 619 A 84 GLU HGx A 85 LEU H 1.0 1.8 4.76 1383 620 A 53 GLU HGy A 53 GLU HA 1.0 1.8 4.93 1384 620 A 53 GLU HGx A 53 GLU HA 1.0 1.8 4.93 1385 621 A 53 GLU HGy A 51 THR HG2% 1.0 1.8 6.32 1386 621 A 53 GLU HGx A 51 THR HG2% 1.0 1.8 6.32 1387 622 A 53 GLU HGy A 53 GLU HBy 1.0 1.8 4.25 1388 622 A 53 GLU HGx A 53 GLU HBy 1.0 1.8 4.25 1389 622 A 53 GLU HGy A 53 GLU HBx 1.0 1.8 4.25 1390 622 A 53 GLU HGx A 53 GLU HBx 1.0 1.8 4.25 1391 623 A 53 GLU HGy A 51 THR HG2% 1.0 1.8 6.67 1392 623 A 53 GLU HGx A 51 THR HG2% 1.0 1.8 6.67 1393 624 A 76 ASP HBy A 87 VAL HB 1.0 1.8 6.08 1394 624 A 76 ASP HBx A 87 VAL HB 1.0 1.8 6.08 1395 625 A 88 GLN HGy A 88 GLN HA 1.0 1.8 4.82 1396 625 A 88 GLN HGx A 88 GLN HA 1.0 1.8 4.82 1397 626 A 88 GLN HBy A 87 VAL HGx% 1.0 1.8 8.82 1398 626 A 88 GLN HBx A 87 VAL HGy% 1.0 1.8 8.82 1399 626 A 88 GLN HBx A 87 VAL HGx% 1.0 1.8 8.82 1400 626 A 88 GLN HBy A 87 VAL HGy% 1.0 1.8 8.82 1401 627 A 18 VAL HB A 18 VAL H 1.0 1.8 4.50 1402 628 A 60 VAL HB A 18 VAL HB 1.0 1.8 5.58 1403 629 A 30 LEU HBx A 60 VAL HB 1.0 1.8 6.00 1404 630 A 34 PHE HDy A 60 VAL HB 1.0 1.8 6.67 1405 630 A 34 PHE HDx A 60 VAL HB 1.0 1.8 6.67 1406 631 A 16 LEU HDy% A 72 MET HBy 1.0 1.8 5.98 1407 631 A 16 LEU HDx% A 72 MET HBy 1.0 1.8 5.98 1408 631 A 16 LEU HDy% A 72 MET HBx 1.0 1.8 5.98 1409 631 A 16 LEU HDx% A 72 MET HBx 1.0 1.8 5.98 1410 632 A 65 LYS HBy A 66 ARG H 1.0 1.8 5.93 1411 632 A 65 LYS HBx A 66 ARG H 1.0 1.8 5.93 1412 633 A 47 ARG HBy A 54 SER H 1.0 1.8 6.44 1413 633 A 47 ARG HBx A 54 SER H 1.0 1.8 6.44 1414 634 A 89 MET HGy A 88 GLN HA 1.0 1.8 6.26 1415 634 A 89 MET HGx A 88 GLN HA 1.0 1.8 6.26 1416 635 A 89 MET HGx A 89 MET HBy 1.0 1.8 4.04 1417 635 A 89 MET HGy A 89 MET HBx 1.0 1.8 4.04 1418 635 A 89 MET HGx A 89 MET HBx 1.0 1.8 4.04 1419 635 A 89 MET HGy A 89 MET HBy 1.0 1.8 4.04 1420 636 A 72 MET HBy A 71 ALA H 1.0 1.8 6.51 1421 636 A 72 MET HBx A 71 ALA H 1.0 1.8 6.51 1422 637 A 86 ARG HBx A 86 ARG H 1.0 1.8 4.42 1423 638 A 89 MET HGx A 89 MET HE% 1.0 1.8 4.81 1424 638 A 89 MET HGy A 89 MET HE% 1.0 1.8 4.81 1425 639 A 16 LEU HBy A 89 MET HGy 1.0 1.8 7.13 1426 639 A 16 LEU HBy A 89 MET HGx 1.0 1.8 7.13 1427 639 A 16 LEU HBx A 89 MET HGy 1.0 1.8 7.13 1428 639 A 16 LEU HBx A 89 MET HGx 1.0 1.8 7.13 1429 640 A 16 LEU HDy% A 89 MET HGy 1.0 1.8 7.10 1430 640 A 16 LEU HDy% A 89 MET HGx 1.0 1.8 7.10 1431 640 A 16 LEU HDx% A 89 MET HGx 1.0 1.8 7.10 1432 640 A 16 LEU HDx% A 89 MET HGy 1.0 1.8 7.10 1433 641 A 89 MET HGy A 89 MET HA 1.0 1.8 5.07 1434 641 A 89 MET HGx A 89 MET HA 1.0 1.8 5.07 1435 642 A 33 VAL HB A 34 PHE HEy 1.0 1.8 6.67 1436 642 A 33 VAL HB A 34 PHE HEx 1.0 1.8 6.67 1437 643 A 33 VAL HB A 34 PHE H 1.0 1.8 4.57 1438 644 A 30 LEU HA A 33 VAL HB 1.0 1.8 4.91 1439 645 A 88 GLN HE2x A 86 ARG HBy 1.0 1.8 5.99 1440 645 A 88 GLN HE2y A 86 ARG HBy 1.0 1.8 5.99 1441 646 A 86 ARG HBy A 20 ASN HBx 1.0 1.8 5.07 1442 647 A 36 LYS HBy A 37 TYR HEy 1.0 1.8 6.09 1443 647 A 36 LYS HBy A 37 TYR HEx 1.0 1.8 6.09 1444 648 A 36 LYS HBy A 36 LYS HEy 1.0 1.8 5.27 1445 648 A 36 LYS HBy A 36 LYS HEx 1.0 1.8 5.27 1446 649 A 8 PRO HBy A 9 ASP H 1.0 1.8 5.55 1447 649 A 8 PRO HBx A 9 ASP H 1.0 1.8 5.55 1448 650 A 9 ASP H A 10 VAL HB 1.0 1.8 5.97 1449 651 A 91 ARG HBy A 92 TYR HA 1.0 1.8 5.71 1450 651 A 91 ARG HBx A 92 TYR HA 1.0 1.8 5.71 1451 652 A 36 LYS HBx A 37 TYR H 1.0 1.8 4.90 1452 653 A 36 LYS H A 36 LYS HBx 1.0 1.8 4.19 1453 654 A 37 TYR HEy A 36 LYS HBx 1.0 1.8 6.67 1454 654 A 37 TYR HEx A 36 LYS HBx 1.0 1.8 6.67 1455 655 A 87 VAL HGx% A 72 MET HGy 1.0 1.8 6.74 1456 655 A 87 VAL HGy% A 72 MET HGy 1.0 1.8 6.74 1457 656 A 69 GLU HA A 72 MET HGy 1.0 1.8 4.70 1458 657 A 73 ASP HA A 72 MET HGy 1.0 1.8 5.18 1459 658 A 72 MET HGx A 88 GLN HA 1.0 1.8 6.00 1460 659 A 69 GLU HA A 72 MET HGx 1.0 1.8 3.84 1461 660 A 16 LEU HDy% A 72 MET HGx 1.0 1.8 7.29 1462 660 A 16 LEU HDx% A 72 MET HGx 1.0 1.8 7.29 1463 661 A 87 VAL HGx% A 72 MET HGx 1.0 1.8 7.70 1464 661 A 87 VAL HGy% A 72 MET HGx 1.0 1.8 7.70 1465 662 A 55 ARG HBy A 54 SER HA 1.0 1.8 5.98 1466 662 A 55 ARG HBx A 54 SER HA 1.0 1.8 5.98 1467 663 A 55 ARG HBy A 47 ARG HDy 1.0 1.8 7.37 1468 663 A 55 ARG HBx A 47 ARG HDy 1.0 1.8 7.37 1469 663 A 55 ARG HBy A 47 ARG HDx 1.0 1.8 7.37 1470 663 A 55 ARG HBx A 47 ARG HDx 1.0 1.8 7.37 1471 664 A 55 ARG HBy A 47 ARG HE 1.0 1.8 6.67 1472 664 A 55 ARG HBx A 47 ARG HE 1.0 1.8 6.67 1473 665 A 94 ARG HBy A 94 ARG HDy 1.0 1.8 5.53 1474 665 A 94 ARG HBy A 94 ARG HDx 1.0 1.8 5.53 1475 665 A 94 ARG HBx A 94 ARG HDy 1.0 1.8 5.53 1476 665 A 94 ARG HBx A 94 ARG HDx 1.0 1.8 5.53 1477 666 A 32 ARG HBy A 31 ARG H 1.0 1.8 5.78 1478 666 A 32 ARG HBx A 31 ARG H 1.0 1.8 5.78 1479 667 A 32 ARG HBy A 32 ARG H 1.0 1.8 3.96 1480 667 A 32 ARG HBx A 32 ARG H 1.0 1.8 3.96 1481 668 A 32 ARG HBy A 32 ARG HDy 1.0 1.8 4.46 1482 668 A 32 ARG HBy A 32 ARG HDx 1.0 1.8 4.46 1483 668 A 32 ARG HBx A 32 ARG HDy 1.0 1.8 4.46 1484 668 A 32 ARG HBx A 32 ARG HDx 1.0 1.8 4.46 1485 669 A 62 PHE HA A 63 HIS HBy 1.0 1.8 6.04 1486 669 A 62 PHE HA A 63 HIS HBx 1.0 1.8 6.04 1487 670 A 101 SER H A 100 HIS HBy 1.0 1.8 5.94 1488 670 A 100 HIS HBx A 101 SER H 1.0 1.8 5.94 1489 671 A 100 HIS HBy A 100 HIS HD2 1.0 1.8 4.91 1490 671 A 100 HIS HBx A 100 HIS HD2 1.0 1.8 4.91 1491 672 A 63 HIS HBy A 64 ASP H 1.0 1.8 5.48 1492 672 A 63 HIS HBx A 64 ASP H 1.0 1.8 5.48 1493 673 A 100 HIS H A 99 HIS HBy 1.0 1.8 6.67 1494 673 A 99 HIS HBx A 100 HIS H 1.0 1.8 6.67 1495 674 A 100 HIS H A 99 HIS HBy 1.0 1.8 5.90 1496 674 A 99 HIS HBx A 100 HIS H 1.0 1.8 5.90 1497 675 A 24 ARG HBx A 23 TYR H 1.0 1.8 6.00 1498 676 A 66 ARG HBx A 65 LYS HEy 1.0 1.8 7.43 1499 676 A 66 ARG HBy A 65 LYS HEy 1.0 1.8 7.43 1500 676 A 66 ARG HBy A 65 LYS HEx 1.0 1.8 7.43 1501 676 A 66 ARG HBx A 65 LYS HEx 1.0 1.8 7.43 1502 677 A 36 LYS HBy A 35 GLU HBy 1.0 1.8 6.67 1503 677 A 36 LYS HBy A 35 GLU HBx 1.0 1.8 6.67 1504 678 A 35 GLU HBy A 40 VAL H 1.0 1.8 6.28 1505 678 A 35 GLU HBx A 40 VAL H 1.0 1.8 6.28 1506 679 A 31 ARG HDy A 35 GLU HBx 1.0 1.8 7.43 1507 679 A 31 ARG HDy A 35 GLU HBy 1.0 1.8 7.43 1508 679 A 31 ARG HDx A 35 GLU HBy 1.0 1.8 7.43 1509 679 A 31 ARG HDx A 35 GLU HBx 1.0 1.8 7.43 1510 680 A 52 LYS HDy A 52 LYS H 1.0 1.8 5.84 1511 680 A 52 LYS HDx A 52 LYS H 1.0 1.8 5.84 1512 681 A 36 LYS HDy A 33 VAL HA 1.0 1.8 6.16 1513 681 A 36 LYS HDx A 33 VAL HA 1.0 1.8 6.16 1514 682 A 36 LYS HDy A 36 LYS HA 1.0 1.8 6.45 1515 682 A 36 LYS HDx A 36 LYS HA 1.0 1.8 6.45 1516 683 A 36 LYS HDy A 36 LYS HBx 1.0 1.8 4.32 1517 683 A 36 LYS HDx A 36 LYS HBx 1.0 1.8 4.32 1518 684 A 26 SER HBy A 27 PRO HGx 1.0 1.8 5.74 1519 684 A 26 SER HBy A 27 PRO HGy 1.0 1.8 5.74 1520 684 A 26 SER HBx A 27 PRO HGy 1.0 1.8 5.74 1521 684 A 26 SER HBx A 27 PRO HGx 1.0 1.8 5.74 1522 685 A 45 ILE HD1% A 27 PRO HGy 1.0 1.8 6.09 1523 685 A 45 ILE HD1% A 27 PRO HGx 1.0 1.8 6.09 1524 686 A 26 SER HA A 27 PRO HGy 1.0 1.8 5.92 1525 686 A 26 SER HA A 27 PRO HGx 1.0 1.8 5.92 1526 687 A 45 ILE HD1% A 27 PRO HGy 1.0 1.8 6.19 1527 687 A 45 ILE HD1% A 27 PRO HGx 1.0 1.8 6.19 1528 688 A 36 LYS HDy A 36 LYS H 1.0 1.8 5.63 1529 688 A 36 LYS HDx A 36 LYS H 1.0 1.8 5.63 1530 689 A 36 LYS HDy A 37 TYR HEx 1.0 1.8 6.40 1531 689 A 36 LYS HDy A 37 TYR HEy 1.0 1.8 6.40 1532 689 A 36 LYS HDx A 37 TYR HEy 1.0 1.8 6.40 1533 689 A 36 LYS HDx A 37 TYR HEx 1.0 1.8 6.40 1534 690 A 32 ARG HGy A 33 VAL H 1.0 1.8 4.50 1535 690 A 32 ARG HGx A 33 VAL H 1.0 1.8 4.50 1536 691 A 32 ARG HA A 32 ARG HGy 1.0 1.8 4.57 1537 691 A 32 ARG HA A 32 ARG HGx 1.0 1.8 4.57 1538 692 A 39 ARG HGy A 63 HIS HD2 1.0 1.8 5.96 1539 692 A 39 ARG HGx A 63 HIS HD2 1.0 1.8 5.96 1540 693 A 66 ARG HA A 66 ARG HGy 1.0 1.8 4.27 1541 693 A 66 ARG HA A 66 ARG HGx 1.0 1.8 4.27 1542 694 A 47 ARG HGy A 54 SER H 1.0 1.8 5.29 1543 694 A 47 ARG HGx A 54 SER H 1.0 1.8 5.29 1544 695 A 47 ARG HGy A 54 SER H 1.0 1.8 6.67 1545 695 A 47 ARG HGx A 54 SER H 1.0 1.8 6.67 1546 696 A 45 ILE HG2% A 47 ARG HGy 1.0 1.8 6.53 1547 696 A 45 ILE HG2% A 47 ARG HGx 1.0 1.8 6.53 1548 697 A 21 LEU HDy% A 21 LEU H 1.0 1.8 5.56 1549 697 A 21 LEU HDx% A 21 LEU H 1.0 1.8 5.56 1550 698 A 21 LEU HDx% A 21 LEU HA 1.0 1.8 6.16 1551 698 A 21 LEU HDy% A 21 LEU HA 1.0 1.8 6.16 1552 699 A 56 GLY HAx A 21 LEU HDy% 1.0 1.8 8.61 1553 699 A 56 GLY HAx A 21 LEU HDx% 1.0 1.8 8.61 1554 699 A 56 GLY HAy A 21 LEU HDy% 1.0 1.8 8.61 1555 699 A 56 GLY HAy A 21 LEU HDx% 1.0 1.8 8.61 1556 700 A 21 LEU HDx% A 57 PHE HBx 1.0 1.8 7.97 1557 700 A 21 LEU HDy% A 57 PHE HBx 1.0 1.8 7.97 1558 700 A 21 LEU HDy% A 57 PHE HBy 1.0 1.8 7.97 1559 700 A 21 LEU HDx% A 57 PHE HBy 1.0 1.8 7.97 1560 701 A 21 LEU HDx% A 57 PHE HBx 1.0 1.8 8.43 1561 701 A 21 LEU HDy% A 57 PHE HBx 1.0 1.8 8.43 1562 701 A 21 LEU HDy% A 57 PHE HBy 1.0 1.8 8.43 1563 701 A 21 LEU HDx% A 57 PHE HBy 1.0 1.8 8.43 1564 702 A 58 ALA HB% A 21 LEU HDx% 1.0 1.8 5.45 1565 702 A 58 ALA HB% A 21 LEU HDy% 1.0 1.8 5.45 1566 703 A 39 ARG HGy A 63 HIS H 1.0 1.8 5.69 1567 703 A 39 ARG HGx A 63 HIS H 1.0 1.8 5.69 1568 704 A 39 ARG HGy A 41 GLY HAy 1.0 1.8 6.11 1569 704 A 39 ARG HGy A 41 GLY HAx 1.0 1.8 6.11 1570 704 A 39 ARG HGx A 41 GLY HAy 1.0 1.8 6.11 1571 704 A 39 ARG HGx A 41 GLY HAx 1.0 1.8 6.11 1572 705 A 68 ALA H A 66 ARG HGy 1.0 1.8 6.57 1573 705 A 68 ALA H A 66 ARG HGx 1.0 1.8 6.57 1574 706 A 82 GLY H A 83 ARG HGy 1.0 1.8 5.20 1575 707 A 66 ARG HGy A 66 ARG HDx 1.0 1.8 4.00 1576 707 A 66 ARG HGy A 66 ARG HDy 1.0 1.8 4.00 1577 707 A 66 ARG HGx A 66 ARG HDy 1.0 1.8 4.00 1578 707 A 66 ARG HGx A 66 ARG HDx 1.0 1.8 4.00 1579 708 A 85 LEU H A 83 ARG HGy 1.0 1.8 6.00 1580 709 A 86 ARG HGy A 87 VAL H 1.0 1.8 6.67 1581 709 A 86 ARG HGx A 87 VAL H 1.0 1.8 6.67 1582 710 A 39 ARG HGy A 40 VAL H 1.0 1.8 5.61 1583 710 A 39 ARG HGx A 40 VAL H 1.0 1.8 5.61 1584 711 A 39 ARG HGy A 39 ARG H 1.0 1.8 6.22 1585 711 A 39 ARG HGx A 39 ARG H 1.0 1.8 6.22 1586 712 A 39 ARG HGy A 63 HIS H 1.0 1.8 6.67 1587 712 A 39 ARG HGx A 63 HIS H 1.0 1.8 6.67 1588 713 A 88 GLN HE2y A 86 ARG HGy 1.0 1.8 6.93 1589 713 A 88 GLN HE2x A 86 ARG HGx 1.0 1.8 6.93 1590 713 A 88 GLN HE2y A 86 ARG HGx 1.0 1.8 6.93 1591 713 A 88 GLN HE2x A 86 ARG HGy 1.0 1.8 6.93 1592 714 A 39 ARG HGy A 41 GLY HAy 1.0 1.8 5.53 1593 714 A 39 ARG HGy A 41 GLY HAx 1.0 1.8 5.53 1594 714 A 39 ARG HGx A 41 GLY HAy 1.0 1.8 5.53 1595 714 A 39 ARG HGx A 41 GLY HAx 1.0 1.8 5.53 1596 715 A 39 ARG HGy A 39 ARG HDy 1.0 1.8 4.07 1597 715 A 39 ARG HGy A 39 ARG HDx 1.0 1.8 4.07 1598 715 A 39 ARG HGx A 39 ARG HDy 1.0 1.8 4.07 1599 715 A 39 ARG HGx A 39 ARG HDx 1.0 1.8 4.07 1600 716 A 86 ARG HGy A 85 LEU H 1.0 1.8 6.67 1601 716 A 86 ARG HGx A 85 LEU H 1.0 1.8 6.67 1602 717 A 86 ARG HGy A 87 VAL H 1.0 1.8 6.67 1603 717 A 86 ARG HGx A 87 VAL H 1.0 1.8 6.67 1604 718 A 86 ARG HA A 86 ARG HGy 1.0 1.8 4.84 1605 718 A 86 ARG HA A 86 ARG HGx 1.0 1.8 4.84 1606 719 A 47 ARG HA A 47 ARG HGy 1.0 1.8 4.54 1607 719 A 47 ARG HA A 47 ARG HGx 1.0 1.8 4.54 1608 720 A 29 THR HB A 30 LEU HG 1.0 1.8 4.09 1609 721 A 47 ARG HGy A 53 GLU H 1.0 1.8 6.34 1610 721 A 47 ARG HGx A 53 GLU H 1.0 1.8 6.34 1611 722 A 83 ARG HGx A 82 GLY HAy 1.0 1.8 6.46 1612 722 A 83 ARG HGx A 82 GLY HAx 1.0 1.8 6.46 1613 723 A 83 ARG HGx A 82 GLY H 1.0 1.8 4.68 1614 724 A 16 LEU HDx% A 16 LEU H 1.0 1.8 6.47 1615 724 A 16 LEU HDy% A 16 LEU H 1.0 1.8 6.47 1616 725 A 34 PHE HDx A 16 LEU HDy% 1.0 1.8 7.29 1617 725 A 34 PHE HDy A 16 LEU HDy% 1.0 1.8 7.29 1618 725 A 34 PHE HDy A 16 LEU HDx% 1.0 1.8 7.29 1619 725 A 34 PHE HDx A 16 LEU HDx% 1.0 1.8 7.29 1620 726 A 16 LEU HDy% A 34 PHE HEx 1.0 1.8 7.13 1621 726 A 16 LEU HDy% A 34 PHE HEy 1.0 1.8 7.13 1622 726 A 16 LEU HDx% A 34 PHE HEy 1.0 1.8 7.13 1623 726 A 16 LEU HDx% A 34 PHE HEx 1.0 1.8 7.13 1624 727 A 16 LEU HA A 16 LEU HDy% 1.0 1.8 6.23 1625 727 A 16 LEU HA A 16 LEU HDx% 1.0 1.8 6.23 1626 728 A 16 LEU HDy% A 62 PHE HBy 1.0 1.8 7.44 1627 728 A 16 LEU HDx% A 62 PHE HBy 1.0 1.8 7.44 1628 729 A 16 LEU HDy% A 72 MET HA 1.0 1.8 7.91 1629 729 A 16 LEU HDx% A 72 MET HA 1.0 1.8 7.91 1630 730 A 71 ALA HB% A 16 LEU HDy% 1.0 1.8 4.79 1631 730 A 71 ALA HB% A 16 LEU HDx% 1.0 1.8 4.79 1632 731 A 21 LEU HDx% A 25 THR HB 1.0 1.8 6.34 1633 731 A 21 LEU HDy% A 25 THR HB 1.0 1.8 6.34 1634 732 A 58 ALA HB% A 57 PHE H 1.0 1.8 6.61 1635 733 A 45 ILE HA A 58 ALA HB% 1.0 1.8 5.52 1636 734 A 46 PRO HDx A 58 ALA HB% 1.0 1.8 7.20 1637 734 A 46 PRO HDy A 58 ALA HB% 1.0 1.8 7.20 1638 735 A 58 ALA HB% A 59 PHE HBx 1.0 1.8 6.86 1639 735 A 58 ALA HB% A 59 PHE HBy 1.0 1.8 6.86 1640 736 A 30 LEU HBx A 58 ALA HB% 1.0 1.8 5.76 1641 737 A 58 ALA HB% A 30 LEU HDx% 1.0 1.8 4.90 1642 737 A 58 ALA HB% A 30 LEU HDy% 1.0 1.8 4.90 1643 738 A 60 VAL HGx% A 58 ALA HB% 1.0 1.8 7.02 1644 738 A 60 VAL HGy% A 58 ALA HB% 1.0 1.8 7.02 1645 739 A 80 LEU HDx% A 80 LEU H 1.0 1.8 6.50 1646 739 A 80 LEU HDy% A 80 LEU H 1.0 1.8 6.50 1647 740 A 80 LEU HDy% A 83 ARG H 1.0 1.8 7.91 1648 740 A 80 LEU HDx% A 83 ARG H 1.0 1.8 7.91 1649 741 A 83 ARG HDx A 80 LEU HDy% 1.0 1.8 8.76 1650 741 A 83 ARG HDy A 80 LEU HDy% 1.0 1.8 8.76 1651 741 A 83 ARG HDx A 80 LEU HDx% 1.0 1.8 8.76 1652 741 A 83 ARG HDy A 80 LEU HDx% 1.0 1.8 8.76 1653 742 A 80 LEU HDx% A 80 LEU HBy 1.0 1.8 5.04 1654 742 A 80 LEU HBx A 80 LEU HDy% 1.0 1.8 5.04 1655 742 A 80 LEU HDy% A 80 LEU HBy 1.0 1.8 5.04 1656 742 A 80 LEU HBx A 80 LEU HDx% 1.0 1.8 5.04 1657 743 A 24 ARG HGy A 24 ARG H 1.0 1.8 5.91 1658 743 A 24 ARG HGx A 24 ARG H 1.0 1.8 5.91 1659 744 A 30 LEU HDx% A 31 ARG H 1.0 1.8 7.08 1660 744 A 30 LEU HDy% A 31 ARG H 1.0 1.8 7.08 1661 745 A 30 LEU HDx% A 29 THR H 1.0 1.8 7.51 1662 745 A 30 LEU HDy% A 29 THR H 1.0 1.8 7.51 1663 746 A 30 LEU HDx% A 27 PRO HA 1.0 1.8 5.02 1664 746 A 30 LEU HDy% A 27 PRO HA 1.0 1.8 5.02 1665 747 A 43 VAL HGy% A 30 LEU HDx% 1.0 1.8 6.66 1666 747 A 43 VAL HGx% A 30 LEU HDy% 1.0 1.8 6.66 1667 747 A 43 VAL HGx% A 30 LEU HDx% 1.0 1.8 6.66 1668 747 A 43 VAL HGy% A 30 LEU HDy% 1.0 1.8 6.66 1669 748 A 60 VAL HGy% A 30 LEU HDx% 1.0 1.8 6.99 1670 748 A 60 VAL HGy% A 30 LEU HDy% 1.0 1.8 6.99 1671 748 A 60 VAL HGx% A 30 LEU HDy% 1.0 1.8 6.99 1672 748 A 60 VAL HGx% A 30 LEU HDx% 1.0 1.8 6.99 1673 749 A 85 LEU HDy% A 80 LEU HA 1.0 1.8 5.68 1674 749 A 85 LEU HDx% A 80 LEU HA 1.0 1.8 5.68 1675 750 A 85 LEU HDx% A 85 LEU HA 1.0 1.8 6.31 1676 750 A 85 LEU HDy% A 85 LEU HA 1.0 1.8 6.31 1677 751 A 85 LEU HDx% A 78 ALA HB% 1.0 1.8 5.05 1678 751 A 85 LEU HDy% A 78 ALA HB% 1.0 1.8 5.05 1679 752 A 21 LEU HDx% A 21 LEU HBy 1.0 1.8 4.51 1680 752 A 21 LEU HDy% A 21 LEU HBy 1.0 1.8 4.51 1681 752 A 21 LEU HDx% A 21 LEU HBx 1.0 1.8 4.51 1682 752 A 21 LEU HDy% A 21 LEU HBx 1.0 1.8 4.51 1683 753 A 85 LEU HDy% A 85 LEU HBy 1.0 1.8 4.52 1684 753 A 85 LEU HDx% A 85 LEU HBy 1.0 1.8 4.52 1685 754 A 52 LYS HGy A 52 LYS H 1.0 1.8 5.34 1686 754 A 52 LYS HGx A 52 LYS H 1.0 1.8 5.34 1687 755 A 52 LYS HEx A 52 LYS HGy 1.0 1.8 5.16 1688 755 A 52 LYS HEy A 52 LYS HGy 1.0 1.8 5.16 1689 755 A 52 LYS HGx A 52 LYS HEy 1.0 1.8 5.16 1690 755 A 52 LYS HGx A 52 LYS HEx 1.0 1.8 5.16 1691 756 A 52 LYS HGy A 52 LYS HA 1.0 1.8 4.91 1692 756 A 52 LYS HGx A 52 LYS HA 1.0 1.8 4.91 1693 757 A 52 LYS HGy A 52 LYS H 1.0 1.8 5.41 1694 757 A 52 LYS HGx A 52 LYS H 1.0 1.8 5.41 1695 758 A 52 LYS HGy A 52 LYS HA 1.0 1.8 4.99 1696 758 A 52 LYS HGx A 52 LYS HA 1.0 1.8 4.99 1697 759 A 34 PHE HDx A 87 VAL HGx% 1.0 1.8 7.81 1698 759 A 34 PHE HDy A 87 VAL HGy% 1.0 1.8 7.81 1699 759 A 34 PHE HDy A 87 VAL HGx% 1.0 1.8 7.81 1700 759 A 34 PHE HDx A 87 VAL HGy% 1.0 1.8 7.81 1701 760 A 34 PHE HEx A 87 VAL HGy% 1.0 1.8 5.86 1702 760 A 34 PHE HEx A 87 VAL HGx% 1.0 1.8 5.86 1703 760 A 34 PHE HEy A 87 VAL HGy% 1.0 1.8 5.86 1704 760 A 34 PHE HEy A 87 VAL HGx% 1.0 1.8 5.86 1705 761 A 87 VAL HGy% A 72 MET HBy 1.0 1.8 5.01 1706 761 A 87 VAL HGx% A 72 MET HBy 1.0 1.8 5.01 1707 761 A 87 VAL HGx% A 72 MET HBx 1.0 1.8 5.01 1708 761 A 87 VAL HGy% A 72 MET HBx 1.0 1.8 5.01 1709 762 A 60 VAL HGx% A 87 VAL HGx% 1.0 1.8 10.49 1710 762 A 60 VAL HGx% A 87 VAL HGy% 1.0 1.8 10.49 1711 762 A 60 VAL HGy% A 87 VAL HGx% 1.0 1.8 10.49 1712 762 A 60 VAL HGy% A 87 VAL HGy% 1.0 1.8 10.49 1713 763 A 21 LEU HDx% A 58 ALA H 1.0 1.8 7.52 1714 763 A 21 LEU HDy% A 58 ALA H 1.0 1.8 7.52 1715 764 A 21 LEU HDx% A 23 TYR H 1.0 1.8 7.47 1716 764 A 21 LEU HDy% A 23 TYR H 1.0 1.8 7.47 1717 765 A 56 GLY HAx A 21 LEU HDy% 1.0 1.8 8.35 1718 765 A 56 GLY HAx A 21 LEU HDx% 1.0 1.8 8.35 1719 765 A 56 GLY HAy A 21 LEU HDy% 1.0 1.8 8.35 1720 765 A 56 GLY HAy A 21 LEU HDx% 1.0 1.8 8.35 1721 766 A 21 LEU HDx% A 57 PHE HBx 1.0 1.8 8.13 1722 766 A 21 LEU HDy% A 57 PHE HBx 1.0 1.8 8.13 1723 766 A 21 LEU HDy% A 57 PHE HBy 1.0 1.8 8.13 1724 766 A 21 LEU HDx% A 57 PHE HBy 1.0 1.8 8.13 1725 767 A 64 ASP HA A 65 LYS HGy 1.0 1.8 6.67 1726 767 A 64 ASP HA A 65 LYS HGx 1.0 1.8 6.67 1727 768 A 65 LYS HGy A 66 ARG H 1.0 1.8 6.27 1728 768 A 65 LYS HGx A 66 ARG H 1.0 1.8 6.27 1729 769 A 69 GLU HGy A 65 LYS HGy 1.0 1.8 7.43 1730 769 A 69 GLU HGx A 65 LYS HGy 1.0 1.8 7.43 1731 769 A 69 GLU HGy A 65 LYS HGx 1.0 1.8 7.43 1732 769 A 69 GLU HGx A 65 LYS HGx 1.0 1.8 7.43 1733 770 A 65 LYS HGy A 65 LYS HEx 1.0 1.8 5.16 1734 770 A 65 LYS HGy A 65 LYS HEy 1.0 1.8 5.16 1735 770 A 65 LYS HGx A 65 LYS HEy 1.0 1.8 5.16 1736 770 A 65 LYS HGx A 65 LYS HEx 1.0 1.8 5.16 1737 771 A 64 ASP HA A 65 LYS HGy 1.0 1.8 6.36 1738 771 A 64 ASP HA A 65 LYS HGx 1.0 1.8 6.36 1739 772 A 36 LYS HGy A 36 LYS HEx 1.0 1.8 5.35 1740 772 A 36 LYS HGy A 36 LYS HEy 1.0 1.8 5.35 1741 772 A 36 LYS HGx A 36 LYS HEy 1.0 1.8 5.35 1742 772 A 36 LYS HGx A 36 LYS HEx 1.0 1.8 5.35 1743 773 A 36 LYS HGy A 36 LYS H 1.0 1.8 4.81 1744 773 A 36 LYS HGx A 36 LYS H 1.0 1.8 4.81 1745 774 A 36 LYS HGy A 36 LYS HA 1.0 1.8 4.86 1746 774 A 36 LYS HGx A 36 LYS HA 1.0 1.8 4.86 1747 775 A 36 LYS HGy A 35 GLU H 1.0 1.8 6.55 1748 775 A 36 LYS HGx A 35 GLU H 1.0 1.8 6.55 1749 776 A 81 ASP HBy A 80 LEU HDy% 1.0 1.8 6.85 1750 776 A 81 ASP HBy A 80 LEU HDx% 1.0 1.8 6.85 1751 776 A 81 ASP HBx A 80 LEU HDx% 1.0 1.8 6.85 1752 776 A 81 ASP HBx A 80 LEU HDy% 1.0 1.8 6.85 1753 777 A 80 LEU HDx% A 80 LEU H 1.0 1.8 6.27 1754 777 A 80 LEU HDy% A 80 LEU H 1.0 1.8 6.27 1755 778 A 80 LEU HA A 80 LEU HDx% 1.0 1.8 5.33 1756 778 A 80 LEU HA A 80 LEU HDy% 1.0 1.8 5.33 1757 779 A 80 LEU HDx% A 81 ASP HA 1.0 1.8 5.97 1758 779 A 80 LEU HDy% A 81 ASP HA 1.0 1.8 5.97 1759 780 A 81 ASP HBy A 80 LEU HDy% 1.0 1.8 6.89 1760 780 A 81 ASP HBy A 80 LEU HDx% 1.0 1.8 6.89 1761 780 A 81 ASP HBx A 80 LEU HDx% 1.0 1.8 6.89 1762 780 A 81 ASP HBx A 80 LEU HDy% 1.0 1.8 6.89 1763 781 A 80 LEU HDx% A 80 LEU HBy 1.0 1.8 5.33 1764 781 A 80 LEU HBx A 80 LEU HDy% 1.0 1.8 5.33 1765 781 A 80 LEU HDy% A 80 LEU HBy 1.0 1.8 5.33 1766 781 A 80 LEU HBx A 80 LEU HDx% 1.0 1.8 5.33 1767 782 A 80 LEU HDy% A 83 ARG H 1.0 1.8 7.91 1768 782 A 80 LEU HDx% A 83 ARG H 1.0 1.8 7.91 1769 783 A 30 LEU HDx% A 31 ARG H 1.0 1.8 7.32 1770 783 A 30 LEU HDy% A 31 ARG H 1.0 1.8 7.32 1771 784 A 34 PHE HDy A 30 LEU HDx% 1.0 1.8 5.71 1772 784 A 34 PHE HDx A 30 LEU HDx% 1.0 1.8 5.71 1773 784 A 34 PHE HDy A 30 LEU HDy% 1.0 1.8 5.71 1774 784 A 34 PHE HDx A 30 LEU HDy% 1.0 1.8 5.71 1775 785 A 30 LEU HDy% A 30 LEU H 1.0 1.8 5.43 1776 785 A 30 LEU HDx% A 30 LEU H 1.0 1.8 5.43 1777 786 A 34 PHE HEx A 30 LEU HDy% 1.0 1.8 5.31 1778 786 A 34 PHE HEy A 30 LEU HDy% 1.0 1.8 5.31 1779 786 A 34 PHE HEx A 30 LEU HDx% 1.0 1.8 5.31 1780 786 A 34 PHE HEy A 30 LEU HDx% 1.0 1.8 5.31 1781 787 A 30 LEU HDx% A 29 THR HB 1.0 1.8 6.73 1782 787 A 30 LEU HDy% A 29 THR HB 1.0 1.8 6.73 1783 788 A 30 LEU HA A 30 LEU HDy% 1.0 1.8 4.46 1784 788 A 30 LEU HA A 30 LEU HDx% 1.0 1.8 4.46 1785 789 A 33 VAL HB A 30 LEU HDx% 1.0 1.8 6.80 1786 789 A 33 VAL HB A 30 LEU HDy% 1.0 1.8 6.80 1787 790 A 30 LEU HBx A 30 LEU HDy% 1.0 1.8 5.04 1788 790 A 30 LEU HBx A 30 LEU HDx% 1.0 1.8 5.04 1789 791 A 30 LEU HBy A 30 LEU HDx% 1.0 1.8 4.75 1790 791 A 30 LEU HBy A 30 LEU HDy% 1.0 1.8 4.75 1791 792 A 25 THR HG2% A 30 LEU HDx% 1.0 1.8 5.47 1792 792 A 25 THR HG2% A 30 LEU HDy% 1.0 1.8 5.47 1793 793 A 60 VAL HGy% A 30 LEU HDx% 1.0 1.8 7.59 1794 793 A 60 VAL HGy% A 30 LEU HDy% 1.0 1.8 7.59 1795 793 A 60 VAL HGx% A 30 LEU HDy% 1.0 1.8 7.59 1796 793 A 60 VAL HGx% A 30 LEU HDx% 1.0 1.8 7.59 1797 794 A 16 LEU HBy A 16 LEU HDy% 1.0 1.8 4.99 1798 794 A 16 LEU HBx A 16 LEU HDx% 1.0 1.8 4.99 1799 794 A 16 LEU HBy A 16 LEU HDx% 1.0 1.8 4.99 1800 794 A 16 LEU HBx A 16 LEU HDy% 1.0 1.8 4.99 1801 795 A 18 VAL HGx% A 18 VAL H 1.0 1.8 5.02 1802 796 A 34 PHE HDy A 18 VAL HGx% 1.0 1.8 6.98 1803 796 A 34 PHE HDx A 18 VAL HGx% 1.0 1.8 6.98 1804 797 A 18 VAL HGx% A 86 ARG H 1.0 1.8 6.26 1805 798 A 25 THR HA A 22 THR HG2% 1.0 1.8 7.11 1806 799 A 22 THR HG2% A 83 ARG HDx 1.0 1.8 4.85 1807 799 A 22 THR HG2% A 83 ARG HDy 1.0 1.8 4.85 1808 800 A 76 ASP HBy A 87 VAL HGx% 1.0 1.8 6.28 1809 800 A 76 ASP HBx A 87 VAL HGy% 1.0 1.8 6.28 1810 800 A 76 ASP HBx A 87 VAL HGx% 1.0 1.8 6.28 1811 800 A 76 ASP HBy A 87 VAL HGy% 1.0 1.8 6.28 1812 801 A 60 VAL HGy% A 18 VAL HGx% 1.0 1.8 7.28 1813 801 A 60 VAL HGx% A 18 VAL HGx% 1.0 1.8 7.28 1814 802 A 85 LEU HDx% A 85 LEU H 1.0 1.8 5.70 1815 802 A 85 LEU HDy% A 85 LEU H 1.0 1.8 5.70 1816 803 A 85 LEU HDx% A 20 ASN HBy 1.0 1.8 5.78 1817 803 A 85 LEU HDy% A 20 ASN HBy 1.0 1.8 5.78 1818 804 A 85 LEU HDx% A 80 LEU HG 1.0 1.8 6.61 1819 804 A 85 LEU HDy% A 80 LEU HG 1.0 1.8 6.61 1820 805 A 85 LEU HDy% A 83 ARG HGx 1.0 1.8 7.08 1821 805 A 85 LEU HDx% A 83 ARG HGx 1.0 1.8 7.08 1822 806 A 85 LEU HDx% A 80 LEU HBx 1.0 1.8 5.87 1823 806 A 85 LEU HDx% A 80 LEU HBy 1.0 1.8 5.87 1824 806 A 85 LEU HDy% A 80 LEU HBy 1.0 1.8 5.87 1825 806 A 85 LEU HDy% A 80 LEU HBx 1.0 1.8 5.87 1826 807 A 85 LEU HDy% A 85 LEU HBy 1.0 1.8 5.73 1827 807 A 85 LEU HDx% A 85 LEU HBy 1.0 1.8 5.73 1828 808 A 85 LEU HDx% A 85 LEU HA 1.0 1.8 4.52 1829 808 A 85 LEU HDy% A 85 LEU HA 1.0 1.8 4.52 1830 809 A 85 LEU HDx% A 20 ASN HBx 1.0 1.8 7.27 1831 809 A 85 LEU HDy% A 20 ASN HBx 1.0 1.8 7.27 1832 810 A 85 LEU HBx A 85 LEU HDx% 1.0 1.8 5.31 1833 810 A 85 LEU HBx A 85 LEU HDy% 1.0 1.8 5.31 1834 811 A 40 VAL HGy% A 35 GLU HA 1.0 1.8 7.78 1835 811 A 40 VAL HGx% A 35 GLU HA 1.0 1.8 7.78 1836 812 A 40 VAL HGx% A 31 ARG HDx 1.0 1.8 7.69 1837 812 A 40 VAL HGy% A 31 ARG HDx 1.0 1.8 7.69 1838 812 A 40 VAL HGx% A 31 ARG HDy 1.0 1.8 7.69 1839 812 A 40 VAL HGy% A 31 ARG HDy 1.0 1.8 7.69 1840 813 A 40 VAL HGx% A 40 VAL H 1.0 1.8 5.62 1841 813 A 40 VAL HGy% A 40 VAL H 1.0 1.8 5.62 1842 814 A 40 VAL HGx% A 31 ARG H 1.0 1.8 7.78 1843 814 A 40 VAL HGy% A 31 ARG H 1.0 1.8 7.78 1844 815 A 40 VAL HGx% A 35 GLU H 1.0 1.8 7.91 1845 815 A 40 VAL HGy% A 35 GLU H 1.0 1.8 7.91 1846 816 A 40 VAL HGx% A 41 GLY HAx 1.0 1.8 7.54 1847 816 A 40 VAL HGy% A 41 GLY HAx 1.0 1.8 7.54 1848 816 A 40 VAL HGy% A 41 GLY HAy 1.0 1.8 7.54 1849 816 A 40 VAL HGx% A 41 GLY HAy 1.0 1.8 7.54 1850 817 A 40 VAL HGy% A 31 ARG HA 1.0 1.8 5.33 1851 817 A 40 VAL HGx% A 31 ARG HA 1.0 1.8 5.33 1852 818 A 40 VAL HGy% A 40 VAL HA 1.0 1.8 5.70 1853 818 A 40 VAL HGx% A 40 VAL HA 1.0 1.8 5.70 1854 819 A 40 VAL HGx% A 43 VAL HGx% 1.0 1.8 5.46 1855 819 A 40 VAL HGy% A 43 VAL HGx% 1.0 1.8 5.46 1856 819 A 40 VAL HGy% A 43 VAL HGy% 1.0 1.8 5.46 1857 819 A 40 VAL HGx% A 43 VAL HGy% 1.0 1.8 5.46 1858 820 A 29 THR HG2% A 30 LEU H 1.0 1.8 5.59 1859 821 A 29 THR HG2% A 29 THR HA 1.0 1.8 4.07 1860 822 A 14 THR HG2% A 15 SER H 1.0 1.8 4.94 1861 823 A 14 THR HG2% A 65 LYS HEy 1.0 1.8 6.81 1862 823 A 14 THR HG2% A 65 LYS HEx 1.0 1.8 6.81 1863 824 A 33 VAL HGx% A 29 THR HB 1.0 1.8 5.53 1864 824 A 33 VAL HGy% A 29 THR HB 1.0 1.8 5.53 1865 825 A 33 VAL HGy% A 33 VAL H 1.0 1.8 4.65 1866 825 A 33 VAL HGx% A 33 VAL H 1.0 1.8 4.65 1867 826 A 33 VAL HGy% A 33 VAL HA 1.0 1.8 4.17 1868 826 A 33 VAL HGx% A 33 VAL HA 1.0 1.8 4.17 1869 827 A 33 VAL HGy% A 32 ARG HDy 1.0 1.8 7.13 1870 827 A 33 VAL HGx% A 32 ARG HDy 1.0 1.8 7.13 1871 827 A 33 VAL HGy% A 32 ARG HDx 1.0 1.8 7.13 1872 827 A 33 VAL HGx% A 32 ARG HDx 1.0 1.8 7.13 1873 828 A 33 VAL HGx% A 32 ARG HBy 1.0 1.8 5.51 1874 828 A 33 VAL HGy% A 32 ARG HBx 1.0 1.8 5.51 1875 828 A 33 VAL HGx% A 32 ARG HBx 1.0 1.8 5.51 1876 828 A 33 VAL HGy% A 32 ARG HBy 1.0 1.8 5.51 1877 829 A 33 VAL HGx% A 32 ARG HGx 1.0 1.8 6.26 1878 829 A 33 VAL HGy% A 32 ARG HGx 1.0 1.8 6.26 1879 829 A 33 VAL HGy% A 32 ARG HGy 1.0 1.8 6.26 1880 829 A 33 VAL HGx% A 32 ARG HGy 1.0 1.8 6.26 1881 830 A 87 VAL HGx% A 87 VAL H 1.0 1.8 5.07 1882 830 A 87 VAL HGy% A 87 VAL H 1.0 1.8 5.07 1883 831 A 75 MET HA A 87 VAL HGy% 1.0 1.8 6.19 1884 831 A 75 MET HA A 87 VAL HGx% 1.0 1.8 6.19 1885 832 A 76 ASP HBy A 87 VAL HGx% 1.0 1.8 6.33 1886 832 A 76 ASP HBx A 87 VAL HGy% 1.0 1.8 6.33 1887 832 A 76 ASP HBx A 87 VAL HGx% 1.0 1.8 6.33 1888 832 A 76 ASP HBy A 87 VAL HGy% 1.0 1.8 6.33 1889 833 A 75 MET HBx A 87 VAL HGx% 1.0 1.8 5.42 1890 833 A 75 MET HBx A 87 VAL HGy% 1.0 1.8 5.42 1891 833 A 75 MET HBy A 87 VAL HGx% 1.0 1.8 5.42 1892 833 A 75 MET HBy A 87 VAL HGy% 1.0 1.8 5.42 1893 834 A 87 VAL HGx% A 72 MET HA 1.0 1.8 5.70 1894 834 A 87 VAL HGy% A 72 MET HA 1.0 1.8 5.70 1895 835 A 43 VAL HGx% A 31 ARG H 1.0 1.8 5.93 1896 835 A 43 VAL HGy% A 31 ARG H 1.0 1.8 5.93 1897 836 A 43 VAL HGx% A 43 VAL H 1.0 1.8 6.31 1898 836 A 43 VAL HGy% A 43 VAL H 1.0 1.8 6.31 1899 837 A 79 VAL HA A 79 VAL HGy% 1.0 1.8 4.31 1900 837 A 79 VAL HA A 79 VAL HGx% 1.0 1.8 4.31 1901 838 A 31 ARG HA A 43 VAL HGx% 1.0 1.8 6.35 1902 838 A 31 ARG HA A 43 VAL HGy% 1.0 1.8 6.35 1903 839 A 43 VAL HGy% A 44 TYR H 1.0 1.8 6.40 1904 839 A 43 VAL HGx% A 44 TYR H 1.0 1.8 6.40 1905 840 A 40 VAL HGx% A 41 GLY H 1.0 1.8 6.40 1906 840 A 40 VAL HGy% A 41 GLY H 1.0 1.8 6.40 1907 841 A 40 VAL HGx% A 38 GLY H 1.0 1.8 7.91 1908 841 A 40 VAL HGy% A 38 GLY H 1.0 1.8 7.91 1909 842 A 40 VAL HGx% A 42 ASP H 1.0 1.8 7.91 1910 842 A 40 VAL HGy% A 42 ASP H 1.0 1.8 7.91 1911 843 A 40 VAL HGy% A 62 PHE HEx 1.0 1.8 6.66 1912 843 A 40 VAL HGx% A 62 PHE HEx 1.0 1.8 6.66 1913 843 A 40 VAL HGx% A 62 PHE HEy 1.0 1.8 6.66 1914 843 A 40 VAL HGy% A 62 PHE HEy 1.0 1.8 6.66 1915 844 A 40 VAL HGx% A 39 ARG HA 1.0 1.8 5.61 1916 844 A 40 VAL HGy% A 39 ARG HA 1.0 1.8 5.61 1917 845 A 40 VAL HGy% A 31 ARG HA 1.0 1.8 5.14 1918 845 A 40 VAL HGx% A 31 ARG HA 1.0 1.8 5.14 1919 846 A 40 VAL HGx% A 31 ARG HDx 1.0 1.8 6.81 1920 846 A 40 VAL HGy% A 31 ARG HDx 1.0 1.8 6.81 1921 846 A 40 VAL HGx% A 31 ARG HDy 1.0 1.8 6.81 1922 846 A 40 VAL HGy% A 31 ARG HDy 1.0 1.8 6.81 1923 847 A 40 VAL HGy% A 35 GLU HBy 1.0 1.8 7.32 1924 847 A 40 VAL HGx% A 35 GLU HBy 1.0 1.8 7.32 1925 847 A 40 VAL HGx% A 35 GLU HBx 1.0 1.8 7.32 1926 847 A 40 VAL HGy% A 35 GLU HBx 1.0 1.8 7.32 1927 848 A 40 VAL HGx% A 60 VAL HGy% 1.0 1.8 7.42 1928 848 A 40 VAL HGx% A 60 VAL HGx% 1.0 1.8 7.42 1929 848 A 40 VAL HGy% A 60 VAL HGy% 1.0 1.8 7.42 1930 848 A 40 VAL HGy% A 60 VAL HGx% 1.0 1.8 7.42 1931 849 A 51 THR HG2% A 50 TYR H 1.0 1.8 5.98 1932 850 A 51 THR HG2% A 50 TYR HBy 1.0 1.8 4.83 1933 850 A 51 THR HG2% A 50 TYR HBx 1.0 1.8 4.83 1934 851 A 33 VAL HGy% A 36 LYS HEy 1.0 1.8 7.70 1935 851 A 33 VAL HGy% A 36 LYS HEx 1.0 1.8 7.70 1936 851 A 33 VAL HGx% A 36 LYS HEx 1.0 1.8 7.70 1937 851 A 33 VAL HGx% A 36 LYS HEy 1.0 1.8 7.70 1938 852 A 79 VAL HGx% A 85 LEU H 1.0 1.8 6.73 1939 852 A 79 VAL HGy% A 85 LEU H 1.0 1.8 6.73 1940 853 A 79 VAL HGx% A 80 LEU H 1.0 1.8 6.16 1941 853 A 79 VAL HGy% A 80 LEU H 1.0 1.8 6.16 1942 854 A 79 VAL HGx% A 79 VAL H 1.0 1.8 4.88 1943 854 A 79 VAL HGy% A 79 VAL H 1.0 1.8 4.88 1944 855 A 84 GLU HA A 79 VAL HGy% 1.0 1.8 4.40 1945 855 A 84 GLU HA A 79 VAL HGx% 1.0 1.8 4.40 1946 856 A 34 PHE HDx A 33 VAL HGx% 1.0 1.8 5.36 1947 856 A 34 PHE HDy A 33 VAL HGy% 1.0 1.8 5.36 1948 856 A 34 PHE HDx A 33 VAL HGy% 1.0 1.8 5.36 1949 856 A 34 PHE HDy A 33 VAL HGx% 1.0 1.8 5.36 1950 857 A 33 VAL HGy% A 34 PHE HEx 1.0 1.8 6.04 1951 857 A 33 VAL HGx% A 34 PHE HEx 1.0 1.8 6.04 1952 857 A 33 VAL HGx% A 34 PHE HEy 1.0 1.8 6.04 1953 857 A 33 VAL HGy% A 34 PHE HEy 1.0 1.8 6.04 1954 858 A 33 VAL HGy% A 37 TYR HEx 1.0 1.8 6.90 1955 858 A 33 VAL HGx% A 37 TYR HEx 1.0 1.8 6.90 1956 858 A 33 VAL HGy% A 37 TYR HEy 1.0 1.8 6.90 1957 858 A 33 VAL HGx% A 37 TYR HEy 1.0 1.8 6.90 1958 859 A 33 VAL HGy% A 33 VAL HA 1.0 1.8 4.96 1959 859 A 33 VAL HGx% A 33 VAL HA 1.0 1.8 4.96 1960 860 A 33 VAL HGx% A 31 ARG H 1.0 1.8 6.84 1961 860 A 33 VAL HGy% A 31 ARG H 1.0 1.8 6.84 1962 861 A 43 VAL HGx% A 43 VAL H 1.0 1.8 5.56 1963 861 A 43 VAL HGy% A 43 VAL H 1.0 1.8 5.56 1964 862 A 43 VAL HGy% A 42 ASP HA 1.0 1.8 5.53 1965 862 A 43 VAL HGx% A 42 ASP HA 1.0 1.8 5.53 1966 863 A 43 VAL HA A 43 VAL HGx% 1.0 1.8 5.78 1967 863 A 43 VAL HA A 43 VAL HGy% 1.0 1.8 5.78 1968 864 A 31 ARG HA A 43 VAL HGx% 1.0 1.8 5.19 1969 864 A 31 ARG HA A 43 VAL HGy% 1.0 1.8 5.19 1970 865 A 18 VAL HGy% A 59 PHE HA 1.0 1.8 7.11 1971 866 A 60 VAL HGx% A 34 PHE H 1.0 1.8 7.89 1972 866 A 60 VAL HGy% A 34 PHE H 1.0 1.8 7.89 1973 867 A 60 VAL HGx% A 42 ASP H 1.0 1.8 6.66 1974 867 A 60 VAL HGy% A 42 ASP H 1.0 1.8 6.66 1975 868 A 60 VAL HGy% A 62 PHE HEx 1.0 1.8 5.90 1976 868 A 60 VAL HGx% A 62 PHE HEy 1.0 1.8 5.90 1977 868 A 60 VAL HGx% A 62 PHE HEx 1.0 1.8 5.90 1978 868 A 60 VAL HGy% A 62 PHE HEy 1.0 1.8 5.90 1979 869 A 60 VAL HGx% A 60 VAL HA 1.0 1.8 5.19 1980 869 A 60 VAL HGy% A 60 VAL HA 1.0 1.8 5.19 1981 870 A 31 ARG HA A 60 VAL HGy% 1.0 1.8 6.80 1982 870 A 31 ARG HA A 60 VAL HGx% 1.0 1.8 6.80 1983 871 A 40 VAL HA A 60 VAL HGx% 1.0 1.8 6.98 1984 871 A 40 VAL HA A 60 VAL HGy% 1.0 1.8 6.98 1985 872 A 30 LEU HBx A 60 VAL HGx% 1.0 1.8 7.77 1986 872 A 30 LEU HBx A 60 VAL HGy% 1.0 1.8 7.77 1987 873 A 60 VAL HGx% A 43 VAL HA 1.0 1.8 5.96 1988 873 A 60 VAL HGy% A 43 VAL HA 1.0 1.8 5.96 1989 874 A 50 TYR HDx A 51 THR HG2% 1.0 1.8 5.78 1990 874 A 50 TYR HDy A 51 THR HG2% 1.0 1.8 5.78 1991 875 A 18 VAL HGy% A 18 VAL H 1.0 1.8 4.43 1992 876 A 34 PHE HDx A 18 VAL HGy% 1.0 1.8 6.86 1993 876 A 34 PHE HDy A 18 VAL HGy% 1.0 1.8 6.86 1994 877 A 34 PHE HEx A 18 VAL HGy% 1.0 1.8 4.99 1995 877 A 34 PHE HEy A 18 VAL HGy% 1.0 1.8 4.99 1996 878 A 34 PHE HZ A 18 VAL HGy% 1.0 1.8 5.00 1997 879 A 87 VAL HA A 18 VAL HGy% 1.0 1.8 5.38 1998 880 A 87 VAL HGx% A 18 VAL HGy% 1.0 1.8 5.34 1999 880 A 87 VAL HGy% A 18 VAL HGy% 1.0 1.8 5.34 2000 881 A 60 VAL HGx% A 18 VAL HGy% 1.0 1.8 6.36 2001 881 A 60 VAL HGy% A 18 VAL HGy% 1.0 1.8 6.36 2002 882 A 81 ASP HBx A 79 VAL HGy% 1.0 1.8 8.82 2003 882 A 81 ASP HBy A 79 VAL HGy% 1.0 1.8 8.82 2004 882 A 81 ASP HBx A 79 VAL HGx% 1.0 1.8 8.82 2005 882 A 81 ASP HBy A 79 VAL HGx% 1.0 1.8 8.82 2006 883 A 83 ARG HDy A 79 VAL HGy% 1.0 1.8 8.82 2007 883 A 83 ARG HDx A 79 VAL HGy% 1.0 1.8 8.82 2008 883 A 83 ARG HDy A 79 VAL HGx% 1.0 1.8 8.82 2009 883 A 83 ARG HDx A 79 VAL HGx% 1.0 1.8 8.82 2010 884 A 79 VAL HGx% A 80 LEU H 1.0 1.8 5.07 2011 884 A 79 VAL HGy% A 80 LEU H 1.0 1.8 5.07 2012 885 A 79 VAL HGy% A 84 GLU H 1.0 1.8 7.87 2013 885 A 79 VAL HGx% A 84 GLU H 1.0 1.8 7.87 2014 886 A 79 VAL HA A 79 VAL HGy% 1.0 1.8 4.76 2015 886 A 79 VAL HA A 79 VAL HGx% 1.0 1.8 4.76 2016 887 A 82 GLY HAx A 79 VAL HGy% 1.0 1.8 5.57 2017 887 A 82 GLY HAy A 79 VAL HGy% 1.0 1.8 5.57 2018 887 A 79 VAL HGx% A 82 GLY HAy 1.0 1.8 5.57 2019 887 A 79 VAL HGx% A 82 GLY HAx 1.0 1.8 5.57 2020 888 A 8 PRO HA A 10 VAL HGx% 1.0 1.8 6.01 2021 888 A 8 PRO HA A 10 VAL HG21 1.0 1.8 6.01 2022 889 A 34 PHE HDy A 60 VAL HGx% 1.0 1.8 6.49 2023 889 A 34 PHE HDy A 60 VAL HGy% 1.0 1.8 6.49 2024 889 A 34 PHE HDx A 60 VAL HGy% 1.0 1.8 6.49 2025 889 A 34 PHE HDx A 60 VAL HGx% 1.0 1.8 6.49 2026 890 A 60 VAL HGy% A 30 LEU H 1.0 1.8 7.91 2027 890 A 60 VAL HGx% A 30 LEU H 1.0 1.8 7.91 2028 891 A 60 VAL HGx% A 62 PHE HZ 1.0 1.8 7.91 2029 891 A 60 VAL HGy% A 62 PHE HZ 1.0 1.8 7.91 2030 892 A 60 VAL HGy% A 34 PHE HEy 1.0 1.8 6.48 2031 892 A 60 VAL HGx% A 34 PHE HEx 1.0 1.8 6.48 2032 892 A 60 VAL HGy% A 34 PHE HEx 1.0 1.8 6.48 2033 892 A 60 VAL HGx% A 34 PHE HEy 1.0 1.8 6.48 2034 893 A 60 VAL HGx% A 43 VAL HA 1.0 1.8 6.35 2035 893 A 60 VAL HGy% A 43 VAL HA 1.0 1.8 6.35 2036 894 A 31 ARG HA A 60 VAL HGy% 1.0 1.8 7.91 2037 894 A 31 ARG HA A 60 VAL HGx% 1.0 1.8 7.91 2038 895 A 60 VAL HGx% A 59 PHE HBy 1.0 1.8 8.29 2039 895 A 60 VAL HGy% A 59 PHE HBy 1.0 1.8 8.29 2040 895 A 60 VAL HGy% A 59 PHE HBx 1.0 1.8 8.29 2041 895 A 60 VAL HGx% A 59 PHE HBx 1.0 1.8 8.29 2042 896 A 60 VAL HGx% A 43 VAL HGy% 1.0 1.8 5.97 2043 896 A 60 VAL HGy% A 43 VAL HGy% 1.0 1.8 5.97 2044 896 A 60 VAL HGy% A 43 VAL HGx% 1.0 1.8 5.97 2045 896 A 60 VAL HGx% A 43 VAL HGx% 1.0 1.8 5.97 2046 897 A 60 VAL HGx% A 59 PHE HA 1.0 1.8 6.43 2047 897 A 60 VAL HGy% A 59 PHE HA 1.0 1.8 6.43 2048 898 A 60 VAL HGy% A 27 PRO HA 1.0 1.8 7.91 2049 898 A 60 VAL HGx% A 27 PRO HA 1.0 1.8 7.91 2050 899 A 60 VAL HGx% A 34 PHE HBx 1.0 1.8 6.67 2051 899 A 60 VAL HGy% A 34 PHE HBx 1.0 1.8 6.67 2052 900 A 78 ALA HB% A 85 LEU H 1.0 1.8 6.42 2053 901 A 74 ALA HB% A 70 ASP HA 1.0 1.8 6.00 2054 902 A 74 ALA HB% A 72 MET HA 1.0 1.8 6.83 2055 903 A 75 MET HBy A 74 ALA HB% 1.0 1.8 6.54 2056 903 A 75 MET HBx A 74 ALA HB% 1.0 1.8 6.54 2057 904 A 10 VAL HGx% A 11 GLU HA 1.0 1.8 5.72 2058 904 A 10 VAL HG21 A 11 GLU HA 1.0 1.8 5.72 2059 905 A 10 VAL HGx% A 9 ASP H 1.0 1.8 6.28 2060 905 A 10 VAL HG21 A 9 ASP H 1.0 1.8 6.28 2061 906 A 34 PHE HDx A 71 ALA HB% 1.0 1.8 4.83 2062 906 A 34 PHE HDy A 71 ALA HB% 1.0 1.8 4.83 2063 907 A 62 PHE HZ A 71 ALA HB% 1.0 1.8 4.72 2064 908 A 71 ALA HB% A 34 PHE HEx 1.0 1.8 4.84 2065 908 A 71 ALA HB% A 34 PHE HEy 1.0 1.8 4.84 2066 909 A 71 ALA HB% A 37 TYR HA 1.0 1.8 6.90 2067 910 A 37 TYR HBx A 71 ALA HB% 1.0 1.8 5.17 2068 911 A 59 PHE HEx A 90 ALA HB% 1.0 1.8 5.97 2069 911 A 59 PHE HEy A 90 ALA HB% 1.0 1.8 5.97 2070 912 A 15 SER HBx A 90 ALA HB% 1.0 1.8 6.28 2071 912 A 15 SER HBy A 90 ALA HB% 1.0 1.8 6.28 2072 913 A 16 LEU HDx% A 68 ALA HB% 1.0 1.8 5.97 2073 913 A 16 LEU HDy% A 68 ALA HB% 1.0 1.8 5.97 2074 914 A 16 LEU HDx% A 68 ALA HB% 1.0 1.8 6.64 2075 914 A 16 LEU HDy% A 68 ALA HB% 1.0 1.8 6.64 2076 915 A 13 MET HE% A 14 THR H 1.0 1.8 6.41 2077 916 A 13 MET HE% A 9 ASP H 1.0 1.8 7.11 2078 917 A 63 HIS HE1 A 13 MET HE% 1.0 1.8 5.27 2079 918 A 13 MET HBy A 13 MET HE% 1.0 1.8 5.33 2080 918 A 13 MET HBx A 13 MET HE% 1.0 1.8 5.33 2081 919 A 13 MET HBy A 13 MET HE% 1.0 1.8 4.76 2082 919 A 13 MET HBx A 13 MET HE% 1.0 1.8 4.76 2083 920 A 68 ALA HB% A 62 PHE HBx 1.0 1.8 4.93 2084 921 A 68 ALA HB% A 15 SER H 1.0 1.8 6.55 2085 922 A 68 ALA HB% A 65 LYS H 1.0 1.8 6.71 2086 923 A 62 PHE HDx A 68 ALA HB% 1.0 1.8 6.12 2087 923 A 62 PHE HDy A 68 ALA HB% 1.0 1.8 6.12 2088 924 A 65 LYS HA A 68 ALA HB% 1.0 1.8 4.61 2089 925 A 68 ALA HB% A 89 MET HE% 1.0 1.8 5.49 2090 926 A 72 MET HE% A 72 MET H 1.0 1.8 5.69 2091 927 A 72 MET HE% A 69 GLU H 1.0 1.8 5.94 2092 928 A 72 MET HE% A 73 ASP HA 1.0 1.8 6.12 2093 929 A 73 ASP HBx A 72 MET HE% 1.0 1.8 5.05 2094 930 A 69 GLU HBy A 72 MET HE% 1.0 1.8 4.18 2095 930 A 69 GLU HBx A 72 MET HE% 1.0 1.8 4.18 2096 931 A 72 MET HE% A 68 ALA HB% 1.0 1.8 7.44 2097 932 A 89 MET H A 89 MET HE% 1.0 1.8 5.36 2098 933 A 89 MET HE% A 72 MET H 1.0 1.8 6.40 2099 934 A 16 LEU HA A 89 MET HE% 1.0 1.8 5.96 2100 935 A 89 MET HA A 89 MET HE% 1.0 1.8 5.12 2101 936 A 89 MET HGx A 89 MET HE% 1.0 1.8 5.02 2102 936 A 89 MET HGy A 89 MET HE% 1.0 1.8 5.02 2103 937 A 16 LEU HBx A 89 MET HE% 1.0 1.8 4.95 2104 937 A 16 LEU HBy A 89 MET HE% 1.0 1.8 4.95 2105 938 A 16 LEU HDy% A 89 MET HE% 1.0 1.8 5.26 2106 938 A 16 LEU HDx% A 89 MET HE% 1.0 1.8 5.26 2107 939 A 57 PHE HEy A 45 ILE HG2% 1.0 1.8 7.91 2108 939 A 57 PHE HEx A 45 ILE HG2% 1.0 1.8 7.91 2109 940 A 47 ARG HA A 45 ILE HG2% 1.0 1.8 4.94 2110 941 A 45 ILE HA A 45 ILE HG2% 1.0 1.8 4.80 2111 942 A 45 ILE HG2% A 46 PRO HA 1.0 1.8 5.92 2112 943 A 46 PRO HDx A 45 ILE HG2% 1.0 1.8 5.50 2113 943 A 46 PRO HDy A 45 ILE HG2% 1.0 1.8 5.50 2114 944 A 75 MET HE% A 35 GLU H 1.0 1.8 7.11 2115 945 A 34 PHE HDx A 75 MET HE% 1.0 1.8 5.62 2116 945 A 34 PHE HDy A 75 MET HE% 1.0 1.8 5.62 2117 946 A 33 VAL HGx% A 75 MET HE% 1.0 1.8 4.77 2118 946 A 33 VAL HGy% A 75 MET HE% 1.0 1.8 4.77 2119 947 A 75 MET HE% A 34 PHE HEx 1.0 1.8 5.10 2120 947 A 75 MET HE% A 34 PHE HEy 1.0 1.8 5.10 2121 948 A 75 MET HE% A 34 PHE HZ 1.0 1.8 5.12 2122 949 A 75 MET HE% A 33 VAL HA 1.0 1.8 6.62 2123 950 A 37 TYR HBy A 75 MET HE% 1.0 1.8 7.11 2124 951 A 75 MET HBx A 75 MET HE% 1.0 1.8 5.31 2125 951 A 75 MET HBy A 75 MET HE% 1.0 1.8 5.31 2126 952 A 45 ILE HD1% A 57 PHE H 1.0 1.8 7.11 2127 953 A 45 ILE HD1% A 28 ASP H 1.0 1.8 6.56 2128 954 A 26 SER HA A 45 ILE HD1% 1.0 1.8 4.99 2129 955 A 45 ILE HA A 45 ILE HD1% 1.0 1.8 5.21 2130 956 A 45 ILE HD1% A 27 PRO HDx 1.0 1.8 4.76 2131 956 A 45 ILE HD1% A 27 PRO HDy 1.0 1.8 4.76 2132 957 A 45 ILE HD1% A 47 ARG HDx 1.0 1.8 7.91 2133 957 A 45 ILE HD1% A 47 ARG HDy 1.0 1.8 7.91 2134 958 A 58 ALA HB% A 45 ILE HD1% 1.0 1.8 5.10 2135 959 A 44 TYR HA A 45 ILE HD1% 1.0 1.8 6.86 2136 960 A 20 ASN HBy A 86 ARG HBx 1.0 1.8 4.87 2137 961 A 61 ARG HA A 15 SER HA 1.0 1.8 6.00 2138 962 A 38 GLY HAy A 67 ASP HBy 1.0 1.8 6.09 2139 962 A 38 GLY HAy A 67 ASP HBx 1.0 1.8 6.09 2140 962 A 38 GLY HAx A 67 ASP HBy 1.0 1.8 6.09 2141 962 A 38 GLY HAx A 67 ASP HBx 1.0 1.8 6.09 2142 963 A 17 LYS HBx A 59 PHE HA 1.0 1.8 4.45 2143 964 A 90 ALA HB% A 91 ARG H 1.0 1.8 7.11 2144 965 A 62 PHE HDy A 40 VAL H 1.0 1.8 6.00 2145 965 A 62 PHE HDx A 40 VAL H 1.0 1.8 6.00 2146 966 A 35 GLU HA A 40 VAL H 1.0 1.8 4.81 2147 967 A 39 ARG HA A 40 VAL H 1.0 1.8 3.36 2148 968 A 34 PHE HBy A 40 VAL H 1.0 1.8 6.00 2149 969 A 35 GLU HGy A 40 VAL H 1.0 1.8 5.46 2150 969 A 35 GLU HGx A 40 VAL H 1.0 1.8 5.46 2151 970 A 35 GLU HGy A 40 VAL H 1.0 1.8 5.63 2152 970 A 35 GLU HGx A 40 VAL H 1.0 1.8 5.63 2153 971 A 40 VAL HB A 40 VAL H 1.0 1.8 4.12 2154 972 A 39 ARG HGy A 40 VAL H 1.0 1.8 5.80 2155 972 A 39 ARG HGx A 40 VAL H 1.0 1.8 5.80 2156 973 A 40 VAL HGx% A 40 VAL H 1.0 1.8 4.83 2157 973 A 40 VAL HGy% A 40 VAL H 1.0 1.8 4.83 2158 974 A 60 VAL HGx% A 40 VAL H 1.0 1.8 7.91 2159 974 A 60 VAL HGy% A 40 VAL H 1.0 1.8 7.91 2160 975 A 40 VAL H A 39 ARG H 1.0 1.8 4.87 2161 976 A 38 GLY HAy A 40 VAL H 1.0 1.8 6.67 2162 976 A 38 GLY HAx A 40 VAL H 1.0 1.8 6.67 2163 977 A 59 PHE HDy A 18 VAL H 1.0 1.8 6.21 2164 977 A 59 PHE HDx A 18 VAL H 1.0 1.8 6.21 2165 978 A 59 PHE HA A 18 VAL H 1.0 1.8 4.66 2166 979 A 87 VAL HA A 18 VAL H 1.0 1.8 5.40 2167 980 A 60 VAL HGx% A 18 VAL H 1.0 1.8 6.61 2168 980 A 60 VAL HGy% A 18 VAL H 1.0 1.8 6.61 2169 981 A 40 VAL H A 38 GLY H 1.0 1.8 6.00 2170 982 A 40 VAL H A 42 ASP H 1.0 1.8 6.00 2171 983 A 59 PHE HBy A 18 VAL H 1.0 1.8 6.67 2172 983 A 59 PHE HBx A 18 VAL H 1.0 1.8 6.67 2173 984 A 17 LYS HBx A 18 VAL H 1.0 1.8 5.07 2174 985 A 44 TYR HBy A 45 ILE H 1.0 1.8 5.82 2175 985 A 44 TYR HBx A 45 ILE H 1.0 1.8 5.82 2176 986 A 45 ILE HG1y A 45 ILE H 1.0 1.8 5.87 2177 986 A 45 ILE HG1x A 45 ILE H 1.0 1.8 5.87 2178 987 A 45 ILE HG2% A 45 ILE H 1.0 1.8 5.84 2179 988 A 35 GLU HBy A 38 GLY H 1.0 1.8 6.67 2180 988 A 35 GLU HBx A 38 GLY H 1.0 1.8 6.67 2181 989 A 45 ILE HD1% A 45 ILE H 1.0 1.8 6.06 2182 990 A 44 TYR HDy A 45 ILE H 1.0 1.8 5.11 2183 990 A 44 TYR HDx A 45 ILE H 1.0 1.8 5.11 2184 991 A 39 ARG H A 38 GLY H 1.0 1.8 4.71 2185 992 A 37 TYR H A 38 GLY H 1.0 1.8 3.59 2186 993 A 37 TYR HDy A 38 GLY H 1.0 1.8 5.34 2187 993 A 37 TYR HDx A 38 GLY H 1.0 1.8 5.34 2188 994 A 62 PHE HEy A 38 GLY H 1.0 1.8 5.15 2189 994 A 62 PHE HEx A 38 GLY H 1.0 1.8 5.15 2190 995 A 35 GLU HA A 38 GLY H 1.0 1.8 4.14 2191 996 A 37 TYR HA A 38 GLY H 1.0 1.8 4.06 2192 997 A 37 TYR HBx A 38 GLY H 1.0 1.8 4.41 2193 998 A 37 TYR HBy A 38 GLY H 1.0 1.8 4.86 2194 999 A 36 LYS HBy A 38 GLY H 1.0 1.8 6.00 2195 1000 A 36 LYS HGy A 38 GLY H 1.0 1.8 6.08 2196 1000 A 36 LYS HGx A 38 GLY H 1.0 1.8 6.08 2197 1001 A 36 LYS HGy A 38 GLY H 1.0 1.8 6.06 2198 1001 A 36 LYS HGx A 38 GLY H 1.0 1.8 6.06 2199 1002 A 83 ARG H A 81 ASP H 1.0 1.8 5.09 2200 1003 A 82 GLY HAy A 81 ASP H 1.0 1.8 5.71 2201 1003 A 82 GLY HAx A 81 ASP H 1.0 1.8 5.71 2202 1004 A 44 TYR HEy A 45 ILE H 1.0 1.8 5.72 2203 1004 A 44 TYR HEx A 45 ILE H 1.0 1.8 5.72 2204 1005 A 82 GLY HAy A 81 ASP H 1.0 1.8 6.16 2205 1005 A 82 GLY HAx A 81 ASP H 1.0 1.8 6.16 2206 1006 A 80 LEU H A 81 ASP H 1.0 1.8 5.39 2207 1007 A 81 ASP HBy A 81 ASP H 1.0 1.8 4.81 2208 1007 A 81 ASP HBx A 81 ASP H 1.0 1.8 4.81 2209 1008 A 81 ASP HBy A 81 ASP H 1.0 1.8 4.63 2210 1008 A 81 ASP HBx A 81 ASP H 1.0 1.8 4.63 2211 1009 A 80 LEU HBy A 81 ASP H 1.0 1.8 5.41 2212 1009 A 80 LEU HBx A 81 ASP H 1.0 1.8 5.41 2213 1010 A 80 LEU HG A 81 ASP H 1.0 1.8 4.96 2214 1011 A 83 ARG HGx A 81 ASP H 1.0 1.8 5.53 2215 1012 A 80 LEU HBy A 81 ASP H 1.0 1.8 5.41 2216 1012 A 80 LEU HBx A 81 ASP H 1.0 1.8 5.41 2217 1013 A 80 LEU HDy% A 81 ASP H 1.0 1.8 4.99 2218 1013 A 80 LEU HDx% A 81 ASP H 1.0 1.8 4.99 2219 1014 A 80 LEU HDy% A 81 ASP H 1.0 1.8 6.61 2220 1014 A 80 LEU HDx% A 81 ASP H 1.0 1.8 6.61 2221 1015 A 79 VAL HGx% A 81 ASP H 1.0 1.8 5.78 2222 1015 A 79 VAL HGy% A 81 ASP H 1.0 1.8 5.78 2223 1016 A 80 LEU H A 79 VAL H 1.0 1.8 5.12 2224 1017 A 85 LEU HBx A 80 LEU H 1.0 1.8 6.00 2225 1018 A 80 LEU H A 83 ARG H 1.0 1.8 4.36 2226 1019 A 79 VAL HA A 80 LEU H 1.0 1.8 3.72 2227 1020 A 80 LEU H A 85 LEU HG 1.0 1.8 4.89 2228 1021 A 80 LEU HBy A 80 LEU H 1.0 1.8 4.15 2229 1021 A 80 LEU HBx A 80 LEU H 1.0 1.8 4.15 2230 1022 A 83 ARG HGy A 80 LEU H 1.0 1.8 5.04 2231 1023 A 80 LEU HG A 80 LEU H 1.0 1.8 5.29 2232 1024 A 83 ARG HGx A 80 LEU H 1.0 1.8 5.75 2233 1025 A 80 LEU HBy A 80 LEU H 1.0 1.8 4.70 2234 1025 A 80 LEU HBx A 80 LEU H 1.0 1.8 4.70 2235 1026 A 85 LEU HDy% A 80 LEU H 1.0 1.8 5.38 2236 1026 A 85 LEU HDx% A 80 LEU H 1.0 1.8 5.38 2237 1027 A 85 LEU HDy% A 80 LEU H 1.0 1.8 6.00 2238 1027 A 85 LEU HDx% A 80 LEU H 1.0 1.8 6.00 2239 1028 A 85 LEU H A 84 GLU H 1.0 1.8 5.21 2240 1029 A 20 ASN HD2x A 85 LEU H 1.0 1.8 6.54 2241 1029 A 20 ASN HD2y A 85 LEU H 1.0 1.8 6.54 2242 1030 A 86 ARG H A 85 LEU H 1.0 1.8 5.12 2243 1031 A 79 VAL HA A 85 LEU H 1.0 1.8 4.69 2244 1032 A 84 GLU HA A 85 LEU H 1.0 1.8 3.53 2245 1033 A 77 GLY HAx A 85 LEU H 1.0 1.8 5.36 2246 1034 A 85 LEU HBx A 85 LEU H 1.0 1.8 4.32 2247 1035 A 84 GLU HBx A 85 LEU H 1.0 1.8 4.77 2248 1036 A 85 LEU H A 85 LEU HG 1.0 1.8 5.10 2249 1037 A 84 GLU HBy A 85 LEU H 1.0 1.8 4.15 2250 1038 A 85 LEU H A 85 LEU HBy 1.0 1.8 4.39 2251 1039 A 85 LEU HDx% A 85 LEU H 1.0 1.8 6.34 2252 1039 A 85 LEU HDy% A 85 LEU H 1.0 1.8 6.34 2253 1040 A 66 ARG H A 65 LYS H 1.0 1.8 4.00 2254 1041 A 64 ASP HA A 65 LYS H 1.0 1.8 3.32 2255 1042 A 64 ASP HBy A 65 LYS H 1.0 1.8 5.28 2256 1042 A 64 ASP HBx A 65 LYS H 1.0 1.8 5.28 2257 1043 A 64 ASP HBy A 65 LYS H 1.0 1.8 4.65 2258 1043 A 64 ASP HBx A 65 LYS H 1.0 1.8 4.65 2259 1044 A 65 LYS HBy A 65 LYS H 1.0 1.8 4.59 2260 1044 A 65 LYS HBx A 65 LYS H 1.0 1.8 4.59 2261 1045 A 65 LYS HBy A 65 LYS H 1.0 1.8 4.10 2262 1045 A 65 LYS HBx A 65 LYS H 1.0 1.8 4.10 2263 1046 A 65 LYS H A 65 LYS HDy 1.0 1.8 5.70 2264 1046 A 65 LYS H A 65 LYS HDx 1.0 1.8 5.70 2265 1047 A 65 LYS H A 66 ARG HGy 1.0 1.8 6.00 2266 1047 A 65 LYS H A 66 ARG HGx 1.0 1.8 6.00 2267 1048 A 65 LYS HGy A 65 LYS H 1.0 1.8 5.37 2268 1048 A 65 LYS HGx A 65 LYS H 1.0 1.8 5.37 2269 1049 A 65 LYS HGy A 65 LYS H 1.0 1.8 5.30 2270 1049 A 65 LYS HGx A 65 LYS H 1.0 1.8 5.30 2271 1050 A 14 THR HG2% A 65 LYS H 1.0 1.8 5.94 2272 1051 A 16 LEU HA A 90 ALA H 1.0 1.8 4.16 2273 1052 A 90 ALA H A 89 MET HA 1.0 1.8 3.58 2274 1053 A 90 ALA H A 90 ALA HB% 1.0 1.8 4.23 2275 1054 A 90 ALA H A 17 LYS H 1.0 1.8 4.39 2276 1055 A 90 ALA H A 89 MET H 1.0 1.8 5.16 2277 1056 A 90 ALA H A 17 LYS HBy 1.0 1.8 5.32 2278 1057 A 89 MET HGy A 90 ALA H 1.0 1.8 6.08 2279 1057 A 89 MET HGx A 90 ALA H 1.0 1.8 6.08 2280 1058 A 43 VAL HA A 44 TYR H 1.0 1.8 3.85 2281 1059 A 60 VAL HA A 44 TYR H 1.0 1.8 4.73 2282 1060 A 43 VAL HB A 44 TYR H 1.0 1.8 5.04 2283 1061 A 60 VAL HGx% A 44 TYR H 1.0 1.8 6.70 2284 1061 A 60 VAL HGy% A 44 TYR H 1.0 1.8 6.70 2285 1062 A 50 TYR HDy A 49 ARG H 1.0 1.8 6.08 2286 1062 A 50 TYR HDx A 49 ARG H 1.0 1.8 6.08 2287 1063 A 48 ASP HA A 49 ARG H 1.0 1.8 3.55 2288 1064 A 49 ARG HBy A 49 ARG H 1.0 1.8 4.42 2289 1064 A 49 ARG HBx A 49 ARG H 1.0 1.8 4.42 2290 1065 A 49 ARG HBy A 49 ARG H 1.0 1.8 4.72 2291 1065 A 49 ARG HBx A 49 ARG H 1.0 1.8 4.72 2292 1066 A 48 ASP HBy A 49 ARG H 1.0 1.8 5.30 2293 1066 A 48 ASP HBx A 49 ARG H 1.0 1.8 5.30 2294 1067 A 44 TYR H A 60 VAL H 1.0 1.8 5.85 2295 1068 A 87 VAL H A 77 GLY H 1.0 1.8 6.00 2296 1069 A 86 ARG HA A 87 VAL H 1.0 1.8 3.55 2297 1070 A 76 ASP HA A 87 VAL H 1.0 1.8 4.25 2298 1071 A 76 ASP HBy A 87 VAL H 1.0 1.8 5.30 2299 1071 A 76 ASP HBx A 87 VAL H 1.0 1.8 5.30 2300 1072 A 76 ASP HBy A 87 VAL H 1.0 1.8 6.26 2301 1072 A 76 ASP HBx A 87 VAL H 1.0 1.8 6.26 2302 1073 A 87 VAL H A 87 VAL HB 1.0 1.8 4.26 2303 1074 A 43 VAL HGy% A 44 TYR H 1.0 1.8 5.38 2304 1074 A 43 VAL HGx% A 44 TYR H 1.0 1.8 5.38 2305 1075 A 59 PHE HDy A 44 TYR H 1.0 1.8 6.33 2306 1075 A 59 PHE HDx A 44 TYR H 1.0 1.8 6.33 2307 1076 A 51 THR H A 49 ARG H 1.0 1.8 5.35 2308 1077 A 52 LYS H A 49 ARG H 1.0 1.8 5.41 2309 1078 A 48 ASP HBy A 49 ARG H 1.0 1.8 5.53 2310 1078 A 48 ASP HBx A 49 ARG H 1.0 1.8 5.53 2311 1079 A 49 ARG H A 49 ARG HGy 1.0 1.8 5.18 2312 1079 A 49 ARG H A 49 ARG HGx 1.0 1.8 5.18 2313 1080 A 81 ASP HBy A 82 GLY H 1.0 1.8 5.53 2314 1080 A 81 ASP HBx A 82 GLY H 1.0 1.8 5.53 2315 1081 A 82 GLY H A 80 LEU H 1.0 1.8 4.94 2316 1082 A 44 TYR H A 45 ILE H 1.0 1.8 4.94 2317 1083 A 82 GLY H A 81 ASP H 1.0 1.8 4.01 2318 1084 A 79 VAL HA A 82 GLY H 1.0 1.8 4.97 2319 1085 A 82 GLY H A 81 ASP HA 1.0 1.8 3.97 2320 1086 A 82 GLY HAy A 82 GLY H 1.0 1.8 3.79 2321 1086 A 82 GLY HAx A 82 GLY H 1.0 1.8 3.79 2322 1087 A 81 ASP HBy A 82 GLY H 1.0 1.8 5.16 2323 1087 A 81 ASP HBx A 82 GLY H 1.0 1.8 5.16 2324 1088 A 79 VAL HB A 82 GLY H 1.0 1.8 5.64 2325 1089 A 83 ARG HBy A 82 GLY H 1.0 1.8 6.67 2326 1089 A 83 ARG HBx A 82 GLY H 1.0 1.8 6.67 2327 1090 A 80 LEU HDx% A 82 GLY H 1.0 1.8 6.94 2328 1090 A 80 LEU HDy% A 82 GLY H 1.0 1.8 6.94 2329 1091 A 79 VAL HGx% A 82 GLY H 1.0 1.8 6.61 2330 1091 A 79 VAL HGy% A 82 GLY H 1.0 1.8 6.61 2331 1092 A 79 VAL HGx% A 82 GLY H 1.0 1.8 4.50 2332 1092 A 79 VAL HGy% A 82 GLY H 1.0 1.8 4.50 2333 1093 A 59 PHE HBy A 44 TYR H 1.0 1.8 5.20 2334 1093 A 59 PHE HBx A 44 TYR H 1.0 1.8 5.20 2335 1094 A 86 ARG HBy A 19 ASP H 1.0 1.8 4.83 2336 1095 A 18 VAL HGx% A 19 ASP H 1.0 1.8 4.70 2337 1096 A 86 ARG H A 19 ASP H 1.0 1.8 4.58 2338 1097 A 87 VAL HA A 19 ASP H 1.0 1.8 4.61 2339 1098 A 19 ASP HBy A 19 ASP H 1.0 1.8 4.77 2340 1098 A 19 ASP HBx A 19 ASP H 1.0 1.8 4.77 2341 1099 A 18 VAL HB A 19 ASP H 1.0 1.8 5.01 2342 1100 A 86 ARG HBx A 19 ASP H 1.0 1.8 5.67 2343 1101 A 18 VAL HGy% A 19 ASP H 1.0 1.8 5.58 2344 1102 A 60 VAL HGx% A 61 ARG H 1.0 1.8 6.57 2345 1102 A 60 VAL HGy% A 61 ARG H 1.0 1.8 6.57 2346 1103 A 61 ARG HBy A 61 ARG H 1.0 1.8 5.15 2347 1103 A 61 ARG HBx A 61 ARG H 1.0 1.8 5.15 2348 1104 A 60 VAL HGx% A 61 ARG H 1.0 1.8 5.72 2349 1104 A 60 VAL HGy% A 61 ARG H 1.0 1.8 5.72 2350 1105 A 40 VAL HGx% A 61 ARG H 1.0 1.8 6.78 2351 1105 A 40 VAL HGy% A 61 ARG H 1.0 1.8 6.78 2352 1106 A 18 VAL HB A 61 ARG H 1.0 1.8 6.00 2353 1107 A 43 VAL HB A 61 ARG H 1.0 1.8 6.00 2354 1108 A 42 ASP H A 61 ARG H 1.0 1.8 5.01 2355 1109 A 43 VAL HA A 61 ARG H 1.0 1.8 4.69 2356 1110 A 61 ARG HGy A 61 ARG H 1.0 1.8 5.49 2357 1110 A 61 ARG HGx A 61 ARG H 1.0 1.8 5.49 2358 1111 A 59 PHE HEy A 17 LYS H 1.0 1.8 5.93 2359 1111 A 59 PHE HEx A 17 LYS H 1.0 1.8 5.93 2360 1112 A 16 LEU HA A 17 LYS H 1.0 1.8 3.81 2361 1113 A 89 MET HA A 17 LYS H 1.0 1.8 4.78 2362 1114 A 16 LEU HBy A 17 LYS H 1.0 1.8 5.97 2363 1114 A 16 LEU HBx A 17 LYS H 1.0 1.8 5.97 2364 1115 A 17 LYS H A 17 LYS HGy 1.0 1.8 5.25 2365 1115 A 17 LYS H A 17 LYS HGx 1.0 1.8 5.25 2366 1116 A 16 LEU HDx% A 17 LYS H 1.0 1.8 6.09 2367 1116 A 16 LEU HDy% A 17 LYS H 1.0 1.8 6.09 2368 1117 A 17 LYS H A 17 LYS HGy 1.0 1.8 5.37 2369 1117 A 17 LYS H A 17 LYS HGx 1.0 1.8 5.37 2370 1118 A 26 SER H A 30 LEU H 1.0 1.8 5.11 2371 1119 A 26 SER H A 25 THR H 1.0 1.8 5.21 2372 1120 A 26 SER HBy A 26 SER H 1.0 1.8 5.02 2373 1120 A 26 SER HBx A 26 SER H 1.0 1.8 5.02 2374 1121 A 29 THR HB A 26 SER H 1.0 1.8 4.68 2375 1122 A 26 SER HBy A 26 SER H 1.0 1.8 4.35 2376 1122 A 26 SER HBx A 26 SER H 1.0 1.8 4.35 2377 1123 A 29 THR HG2% A 26 SER H 1.0 1.8 5.30 2378 1124 A 25 THR HG2% A 26 SER H 1.0 1.8 4.22 2379 1125 A 21 LEU HDy% A 26 SER H 1.0 1.8 7.91 2380 1125 A 21 LEU HDx% A 26 SER H 1.0 1.8 7.91 2381 1126 A 45 ILE HD1% A 26 SER H 1.0 1.8 7.11 2382 1127 A 27 PRO HDy A 26 SER H 1.0 1.8 5.84 2383 1127 A 27 PRO HDx A 26 SER H 1.0 1.8 5.84 2384 1128 A 30 LEU HG A 26 SER H 1.0 1.8 6.00 2385 1129 A 88 GLN HGy A 17 LYS H 1.0 1.8 5.66 2386 1129 A 88 GLN HGx A 17 LYS H 1.0 1.8 5.66 2387 1130 A 17 LYS HBx A 17 LYS H 1.0 1.8 4.42 2388 1131 A 90 ALA HB% A 17 LYS H 1.0 1.8 5.47 2389 1132 A 48 ASP H A 52 LYS HBy 1.0 1.8 6.31 2390 1132 A 48 ASP H A 52 LYS HBx 1.0 1.8 6.31 2391 1133 A 47 ARG HBy A 48 ASP H 1.0 1.8 5.15 2392 1133 A 47 ARG HBx A 48 ASP H 1.0 1.8 5.15 2393 1134 A 53 GLU H A 48 ASP H 1.0 1.8 4.69 2394 1135 A 52 LYS HA A 48 ASP H 1.0 1.8 4.87 2395 1136 A 48 ASP HBy A 48 ASP H 1.0 1.8 4.75 2396 1136 A 48 ASP HBx A 48 ASP H 1.0 1.8 4.75 2397 1137 A 48 ASP HBy A 48 ASP H 1.0 1.8 4.36 2398 1137 A 48 ASP HBx A 48 ASP H 1.0 1.8 4.36 2399 1138 A 48 ASP H A 52 LYS HBy 1.0 1.8 6.67 2400 1138 A 48 ASP H A 52 LYS HBx 1.0 1.8 6.67 2401 1139 A 47 ARG HGy A 48 ASP H 1.0 1.8 5.39 2402 1139 A 47 ARG HGx A 48 ASP H 1.0 1.8 5.39 2403 1140 A 47 ARG HGy A 48 ASP H 1.0 1.8 4.69 2404 1140 A 47 ARG HGx A 48 ASP H 1.0 1.8 4.69 2405 1141 A 85 LEU H A 78 ALA H 1.0 1.8 4.29 2406 1142 A 77 GLY H A 78 ALA H 1.0 1.8 3.74 2407 1143 A 75 MET HA A 78 ALA H 1.0 1.8 4.97 2408 1144 A 76 ASP HA A 78 ALA H 1.0 1.8 4.42 2409 1145 A 77 GLY HAx A 78 ALA H 1.0 1.8 3.96 2410 1146 A 85 LEU HBx A 78 ALA H 1.0 1.8 4.58 2411 1147 A 75 MET HBy A 78 ALA H 1.0 1.8 6.45 2412 1147 A 75 MET HBx A 78 ALA H 1.0 1.8 6.45 2413 1148 A 85 LEU HG A 78 ALA H 1.0 1.8 6.00 2414 1149 A 78 ALA HB% A 78 ALA H 1.0 1.8 3.84 2415 1150 A 85 LEU HBy A 78 ALA H 1.0 1.8 5.39 2416 1151 A 87 VAL HGx% A 78 ALA H 1.0 1.8 7.81 2417 1151 A 87 VAL HGy% A 78 ALA H 1.0 1.8 7.81 2418 1152 A 85 LEU HDy% A 78 ALA H 1.0 1.8 6.07 2419 1152 A 85 LEU HDx% A 78 ALA H 1.0 1.8 6.07 2420 1153 A 62 PHE H A 16 LEU H 1.0 1.8 4.47 2421 1154 A 15 SER HBy A 16 LEU H 1.0 1.8 6.38 2422 1154 A 15 SER HBx A 16 LEU H 1.0 1.8 6.38 2423 1155 A 61 ARG HGy A 16 LEU H 1.0 1.8 5.88 2424 1155 A 61 ARG HGx A 16 LEU H 1.0 1.8 5.88 2425 1156 A 68 ALA HB% A 16 LEU H 1.0 1.8 6.55 2426 1157 A 90 ALA H A 16 LEU H 1.0 1.8 5.66 2427 1158 A 15 SER HBy A 16 LEU H 1.0 1.8 6.31 2428 1158 A 15 SER HBx A 16 LEU H 1.0 1.8 6.31 2429 1159 A 16 LEU HDx% A 16 LEU H 1.0 1.8 6.61 2430 1159 A 16 LEU HDy% A 16 LEU H 1.0 1.8 6.61 2431 1160 A 61 ARG HA A 16 LEU H 1.0 1.8 5.35 2432 1161 A 17 LYS HA A 16 LEU H 1.0 1.8 5.67 2433 1162 A 89 MET HA A 16 LEU H 1.0 1.8 5.96 2434 1163 A 101 SER H A 101 SER HBy 1.0 1.8 4.38 2435 1163 A 101 SER H A 101 SER HBx 1.0 1.8 4.38 2436 1164 A 101 SER H A 100 HIS HBy 1.0 1.8 4.81 2437 1164 A 100 HIS HBx A 101 SER H 1.0 1.8 4.81 2438 1165 A 18 VAL H A 60 VAL H 1.0 1.8 5.41 2439 1166 A 59 PHE HA A 60 VAL H 1.0 1.8 4.03 2440 1167 A 60 VAL HB A 60 VAL H 1.0 1.8 4.47 2441 1168 A 18 VAL HGy% A 60 VAL H 1.0 1.8 5.75 2442 1169 A 59 PHE HBy A 60 VAL H 1.0 1.8 5.07 2443 1169 A 59 PHE HBx A 60 VAL H 1.0 1.8 5.07 2444 1170 A 60 VAL HGy% A 60 VAL H 1.0 1.8 6.23 2445 1170 A 60 VAL HGx% A 60 VAL H 1.0 1.8 6.23 2446 1171 A 17 LYS HA A 60 VAL H 1.0 1.8 5.37 2447 1172 A 59 PHE HDy A 60 VAL H 1.0 1.8 5.32 2448 1172 A 59 PHE HDx A 60 VAL H 1.0 1.8 5.32 2449 1173 A 19 ASP HA A 60 VAL H 1.0 1.8 5.57 2450 1174 A 60 VAL HGy% A 60 VAL H 1.0 1.8 5.77 2451 1174 A 60 VAL HGx% A 60 VAL H 1.0 1.8 5.77 2452 1175 A 43 VAL HGx% A 60 VAL H 1.0 1.8 7.77 2453 1175 A 43 VAL HGy% A 60 VAL H 1.0 1.8 7.77 2454 1176 A 58 ALA HB% A 60 VAL H 1.0 1.8 7.11 2455 1177 A 18 VAL HGx% A 60 VAL H 1.0 1.8 6.30 2456 1178 A 16 LEU HBy A 62 PHE H 1.0 1.8 5.36 2457 1178 A 16 LEU HBx A 62 PHE H 1.0 1.8 5.36 2458 1179 A 62 PHE H A 62 PHE HBx 1.0 1.8 4.53 2459 1180 A 62 PHE H A 63 HIS H 1.0 1.8 5.24 2460 1181 A 62 PHE HDy A 62 PHE H 1.0 1.8 4.70 2461 1181 A 62 PHE HDx A 62 PHE H 1.0 1.8 4.70 2462 1182 A 62 PHE HEy A 62 PHE H 1.0 1.8 5.80 2463 1182 A 62 PHE HEx A 62 PHE H 1.0 1.8 5.80 2464 1183 A 15 SER HA A 62 PHE H 1.0 1.8 4.63 2465 1184 A 62 PHE HBy A 62 PHE H 1.0 1.8 4.35 2466 1185 A 61 ARG HBy A 62 PHE H 1.0 1.8 5.12 2467 1185 A 61 ARG HBx A 62 PHE H 1.0 1.8 5.12 2468 1186 A 61 ARG HGy A 62 PHE H 1.0 1.8 5.98 2469 1186 A 61 ARG HGx A 62 PHE H 1.0 1.8 5.98 2470 1187 A 68 ALA HB% A 62 PHE H 1.0 1.8 6.94 2471 1188 A 42 ASP HA A 43 VAL H 1.0 1.8 3.68 2472 1189 A 43 VAL HB A 43 VAL H 1.0 1.8 4.30 2473 1190 A 43 VAL H A 44 TYR H 1.0 1.8 5.02 2474 1191 A 42 ASP HBy A 43 VAL H 1.0 1.8 5.58 2475 1191 A 42 ASP HBx A 43 VAL H 1.0 1.8 5.58 2476 1192 A 40 VAL HGy% A 43 VAL H 1.0 1.8 7.31 2477 1192 A 40 VAL HGx% A 43 VAL H 1.0 1.8 7.31 2478 1193 A 10 VAL H A 11 GLU H 1.0 1.8 4.09 2479 1194 A 11 GLU HBy A 11 GLU H 1.0 1.8 3.99 2480 1194 A 11 GLU HBx A 11 GLU H 1.0 1.8 3.99 2481 1195 A 10 VAL HGx% A 11 GLU H 1.0 1.8 5.72 2482 1195 A 10 VAL HG21 A 11 GLU H 1.0 1.8 5.72 2483 1196 A 11 GLU H A 9 ASP HA 1.0 1.8 4.79 2484 1197 A 87 VAL H A 88 GLN H 1.0 1.8 4.87 2485 1198 A 88 GLN HBy A 88 GLN H 1.0 1.8 4.97 2486 1198 A 88 GLN HBx A 88 GLN H 1.0 1.8 4.97 2487 1199 A 17 LYS HBx A 88 GLN H 1.0 1.8 6.00 2488 1200 A 18 VAL HGy% A 88 GLN H 1.0 1.8 5.54 2489 1201 A 37 TYR HEy A 71 ALA H 1.0 1.8 6.67 2490 1201 A 37 TYR HEx A 71 ALA H 1.0 1.8 6.67 2491 1202 A 69 GLU HA A 71 ALA H 1.0 1.8 5.16 2492 1203 A 69 GLU HBy A 71 ALA H 1.0 1.8 6.22 2493 1203 A 69 GLU HBx A 71 ALA H 1.0 1.8 6.22 2494 1204 A 16 LEU HDy% A 71 ALA H 1.0 1.8 6.67 2495 1204 A 16 LEU HDx% A 71 ALA H 1.0 1.8 6.67 2496 1205 A 70 ASP H A 71 ALA H 1.0 1.8 3.70 2497 1206 A 73 ASP H A 71 ALA H 1.0 1.8 4.60 2498 1207 A 37 TYR HDy A 71 ALA H 1.0 1.8 5.45 2499 1207 A 37 TYR HDx A 71 ALA H 1.0 1.8 5.45 2500 1208 A 37 TYR HBx A 71 ALA H 1.0 1.8 5.67 2501 1209 A 70 ASP HBy A 71 ALA H 1.0 1.8 4.10 2502 1210 A 70 ASP HBx A 71 ALA H 1.0 1.8 3.87 2503 1211 A 72 MET HGx A 71 ALA H 1.0 1.8 5.89 2504 1212 A 71 ALA HB% A 71 ALA H 1.0 1.8 3.98 2505 1213 A 74 ALA HB% A 71 ALA H 1.0 1.8 6.71 2506 1214 A 17 LYS H A 88 GLN H 1.0 1.8 4.44 2507 1215 A 87 VAL HA A 88 GLN H 1.0 1.8 3.57 2508 1216 A 17 LYS HBy A 88 GLN H 1.0 1.8 5.78 2509 1217 A 87 VAL HGy% A 88 GLN H 1.0 1.8 4.80 2510 1217 A 87 VAL HGx% A 88 GLN H 1.0 1.8 4.80 2511 1218 A 89 MET H A 88 GLN H 1.0 1.8 4.94 2512 1219 A 88 GLN HGy A 88 GLN H 1.0 1.8 5.03 2513 1219 A 88 GLN HGx A 88 GLN H 1.0 1.8 5.03 2514 1220 A 16 LEU HBy A 88 GLN H 1.0 1.8 6.67 2515 1220 A 16 LEU HBx A 88 GLN H 1.0 1.8 6.67 2516 1221 A 86 ARG HBy A 88 GLN H 1.0 1.8 6.00 2517 1222 A 72 MET HE% A 71 ALA H 1.0 1.8 7.11 2518 1223 A 23 TYR HDy A 23 TYR H 1.0 1.8 4.83 2519 1223 A 23 TYR HDx A 23 TYR H 1.0 1.8 4.83 2520 1224 A 22 THR HB A 23 TYR H 1.0 1.8 4.01 2521 1225 A 23 TYR HBy A 23 TYR H 1.0 1.8 4.73 2522 1225 A 23 TYR HBx A 23 TYR H 1.0 1.8 4.73 2523 1226 A 22 THR HG2% A 23 TYR H 1.0 1.8 5.18 2524 1227 A 22 THR H A 23 TYR H 1.0 1.8 5.32 2525 1228 A 23 TYR HBy A 23 TYR H 1.0 1.8 4.61 2526 1228 A 23 TYR HBx A 23 TYR H 1.0 1.8 4.61 2527 1229 A 89 MET HGy A 89 MET H 1.0 1.8 4.51 2528 1229 A 89 MET HGx A 89 MET H 1.0 1.8 4.51 2529 1230 A 89 MET HGy A 89 MET H 1.0 1.8 5.14 2530 1230 A 89 MET HGx A 89 MET H 1.0 1.8 5.14 2531 1231 A 88 GLN HGy A 89 MET H 1.0 1.8 5.34 2532 1231 A 88 GLN HGx A 89 MET H 1.0 1.8 5.34 2533 1232 A 88 GLN HBy A 89 MET H 1.0 1.8 4.79 2534 1232 A 88 GLN HBx A 89 MET H 1.0 1.8 4.79 2535 1233 A 88 GLN HBy A 89 MET H 1.0 1.8 3.87 2536 1233 A 88 GLN HBx A 89 MET H 1.0 1.8 3.87 2537 1234 A 89 MET H A 89 MET HBy 1.0 1.8 4.08 2538 1234 A 89 MET H A 89 MET HBx 1.0 1.8 4.08 2539 1235 A 16 LEU HDx% A 89 MET H 1.0 1.8 5.66 2540 1235 A 16 LEU HDy% A 89 MET H 1.0 1.8 5.66 2541 1236 A 23 TYR HEy A 23 TYR H 1.0 1.8 6.03 2542 1236 A 23 TYR HEx A 23 TYR H 1.0 1.8 6.03 2543 1237 A 3 TYR H A 4 GLY H 1.0 1.8 5.07 2544 1238 A 3 TYR HDy A 3 TYR H 1.0 1.8 4.89 2545 1238 A 3 TYR HDx A 3 TYR H 1.0 1.8 4.89 2546 1239 A 2 SER HA A 3 TYR H 1.0 1.8 4.04 2547 1240 A 2 SER HBy A 2 SER H 1.0 1.8 4.55 2548 1240 A 2 SER HBx A 2 SER H 1.0 1.8 4.55 2549 1241 A 2 SER HBy A 3 TYR H 1.0 1.8 5.03 2550 1241 A 2 SER HBx A 3 TYR H 1.0 1.8 5.03 2551 1242 A 3 TYR H A 3 TYR HBy 1.0 1.8 4.80 2552 1242 A 3 TYR H A 3 TYR HBx 1.0 1.8 4.80 2553 1243 A 3 TYR H A 3 TYR HBy 1.0 1.8 4.22 2554 1243 A 3 TYR H A 3 TYR HBx 1.0 1.8 4.22 2555 1244 A 3 TYR HEy A 3 TYR H 1.0 1.8 6.00 2556 1244 A 3 TYR HEx A 3 TYR H 1.0 1.8 6.00 2557 1245 A 20 ASN HBy A 84 GLU H 1.0 1.8 5.78 2558 1246 A 84 GLU H A 83 ARG H 1.0 1.8 4.89 2559 1247 A 95 PRO HDy A 94 ARG H 1.0 1.8 5.78 2560 1247 A 95 PRO HDx A 94 ARG H 1.0 1.8 5.78 2561 1248 A 84 GLU H A 80 LEU H 1.0 1.8 5.92 2562 1249 A 20 ASN HD2x A 84 GLU H 1.0 1.8 4.87 2563 1249 A 20 ASN HD2y A 84 GLU H 1.0 1.8 4.87 2564 1250 A 84 GLU H A 83 ARG HGy 1.0 1.8 4.30 2565 1251 A 83 ARG HGx A 84 GLU H 1.0 1.8 4.37 2566 1252 A 20 ASN HD2x A 84 GLU H 1.0 1.8 4.65 2567 1252 A 20 ASN HD2y A 84 GLU H 1.0 1.8 4.65 2568 1253 A 83 ARG HA A 84 GLU H 1.0 1.8 3.25 2569 1254 A 83 ARG HDy A 84 GLU H 1.0 1.8 4.53 2570 1254 A 83 ARG HDx A 84 GLU H 1.0 1.8 4.53 2571 1255 A 84 GLU HBx A 84 GLU H 1.0 1.8 3.55 2572 1256 A 83 ARG HBy A 84 GLU H 1.0 1.8 3.72 2573 1256 A 83 ARG HBx A 84 GLU H 1.0 1.8 3.72 2574 1257 A 79 VAL HGy% A 84 GLU H 1.0 1.8 6.82 2575 1257 A 79 VAL HGx% A 84 GLU H 1.0 1.8 6.82 2576 1258 A 85 LEU HDx% A 84 GLU H 1.0 1.8 6.40 2577 1258 A 85 LEU HDy% A 84 GLU H 1.0 1.8 6.40 2578 1259 A 55 ARG H A 54 SER H 1.0 1.8 4.68 2579 1260 A 55 ARG H A 56 GLY H 1.0 1.8 4.20 2580 1261 A 55 ARG H A 57 PHE H 1.0 1.8 5.50 2581 1262 A 55 ARG H A 54 SER HA 1.0 1.8 3.99 2582 1263 A 55 ARG H A 47 ARG HDy 1.0 1.8 6.07 2583 1263 A 55 ARG H A 47 ARG HDx 1.0 1.8 6.07 2584 1264 A 55 ARG HDy A 55 ARG H 1.0 1.8 6.53 2585 1264 A 55 ARG HDx A 55 ARG H 1.0 1.8 6.53 2586 1265 A 55 ARG H A 55 ARG HGy 1.0 1.8 5.09 2587 1265 A 55 ARG H A 55 ARG HGx 1.0 1.8 5.09 2588 1266 A 2 SER H A 3 TYR HBy 1.0 1.8 6.67 2589 1266 A 2 SER H A 3 TYR HBx 1.0 1.8 6.67 2590 1267 A 86 ARG H A 87 VAL H 1.0 1.8 5.72 2591 1268 A 85 LEU HA A 86 ARG H 1.0 1.8 3.94 2592 1269 A 85 LEU HBx A 86 ARG H 1.0 1.8 5.08 2593 1270 A 86 ARG HBy A 86 ARG H 1.0 1.8 4.64 2594 1271 A 86 ARG HGy A 86 ARG H 1.0 1.8 6.17 2595 1271 A 86 ARG HGx A 86 ARG H 1.0 1.8 6.17 2596 1272 A 85 LEU HDx% A 86 ARG H 1.0 1.8 5.93 2597 1272 A 85 LEU HDy% A 86 ARG H 1.0 1.8 5.93 2598 1273 A 86 ARG H A 85 LEU HBy 1.0 1.8 4.78 2599 1274 A 94 ARG H A 93 GLY H 1.0 1.8 4.68 2600 1275 A 94 ARG HDy A 94 ARG H 1.0 1.8 6.43 2601 1275 A 94 ARG HDx A 94 ARG H 1.0 1.8 6.43 2602 1276 A 94 ARG H A 95 PRO HGy 1.0 1.8 6.67 2603 1276 A 94 ARG H A 95 PRO HGx 1.0 1.8 6.67 2604 1277 A 19 ASP HBy A 86 ARG H 1.0 1.8 6.67 2605 1277 A 19 ASP HBx A 86 ARG H 1.0 1.8 6.67 2606 1278 A 93 GLY HAy A 94 ARG H 1.0 1.8 3.84 2607 1278 A 93 GLY HAx A 94 ARG H 1.0 1.8 3.84 2608 1279 A 94 ARG HGy A 94 ARG H 1.0 1.8 4.20 2609 1279 A 94 ARG HGx A 94 ARG H 1.0 1.8 4.20 2610 1280 A 94 ARG HBy A 94 ARG H 1.0 1.8 4.19 2611 1280 A 94 ARG HBx A 94 ARG H 1.0 1.8 4.19 2612 1281 A 70 ASP H A 68 ALA H 1.0 1.8 5.28 2613 1282 A 3 TYR HDy A 2 SER H 1.0 1.8 5.53 2614 1282 A 3 TYR HDx A 2 SER H 1.0 1.8 5.53 2615 1283 A 37 TYR HDy A 70 ASP H 1.0 1.8 6.67 2616 1283 A 37 TYR HDx A 70 ASP H 1.0 1.8 6.67 2617 1284 A 70 ASP H A 72 MET H 1.0 1.8 5.16 2618 1285 A 66 ARG HA A 70 ASP H 1.0 1.8 5.10 2619 1286 A 70 ASP HBy A 70 ASP H 1.0 1.8 4.08 2620 1287 A 70 ASP H A 70 ASP HBx 1.0 1.8 3.83 2621 1288 A 69 GLU HGy A 70 ASP H 1.0 1.8 6.04 2622 1288 A 69 GLU HGx A 70 ASP H 1.0 1.8 6.04 2623 1289 A 69 GLU HBy A 70 ASP H 1.0 1.8 4.34 2624 1289 A 69 GLU HBx A 70 ASP H 1.0 1.8 4.34 2625 1290 A 70 ASP H A 66 ARG HGy 1.0 1.8 6.67 2626 1290 A 70 ASP H A 66 ARG HGx 1.0 1.8 6.67 2627 1291 A 71 ALA HB% A 70 ASP H 1.0 1.8 5.65 2628 1292 A 82 GLY H A 83 ARG H 1.0 1.8 3.90 2629 1293 A 79 VAL HA A 83 ARG H 1.0 1.8 5.08 2630 1294 A 83 ARG H A 81 ASP HA 1.0 1.8 5.69 2631 1295 A 82 GLY HAy A 83 ARG H 1.0 1.8 4.44 2632 1295 A 82 GLY HAx A 83 ARG H 1.0 1.8 4.44 2633 1296 A 84 GLU HA A 83 ARG H 1.0 1.8 5.94 2634 1297 A 82 GLY HAy A 83 ARG H 1.0 1.8 4.46 2635 1297 A 82 GLY HAx A 83 ARG H 1.0 1.8 4.46 2636 1298 A 83 ARG HDy A 83 ARG H 1.0 1.8 5.14 2637 1298 A 83 ARG HDx A 83 ARG H 1.0 1.8 5.14 2638 1299 A 83 ARG HBy A 83 ARG H 1.0 1.8 4.56 2639 1299 A 83 ARG HBx A 83 ARG H 1.0 1.8 4.56 2640 1300 A 83 ARG HGy A 83 ARG H 1.0 1.8 3.97 2641 1301 A 83 ARG HGx A 83 ARG H 1.0 1.8 3.84 2642 1302 A 22 THR HG2% A 83 ARG H 1.0 1.8 6.25 2643 1303 A 79 VAL HGy% A 83 ARG H 1.0 1.8 6.30 2644 1303 A 79 VAL HGx% A 83 ARG H 1.0 1.8 6.30 2645 1304 A 85 LEU HDy% A 83 ARG H 1.0 1.8 7.20 2646 1304 A 85 LEU HDx% A 83 ARG H 1.0 1.8 7.20 2647 1305 A 79 VAL HGy% A 83 ARG H 1.0 1.8 5.39 2648 1305 A 79 VAL HGx% A 83 ARG H 1.0 1.8 5.39 2649 1306 A 92 TYR HDy A 92 TYR H 1.0 1.8 4.83 2650 1306 A 92 TYR HDx A 92 TYR H 1.0 1.8 4.83 2651 1307 A 92 TYR H A 92 TYR HBy 1.0 1.8 4.91 2652 1307 A 92 TYR H A 92 TYR HBx 1.0 1.8 4.91 2653 1308 A 92 TYR H A 92 TYR HBy 1.0 1.8 4.93 2654 1308 A 92 TYR H A 92 TYR HBx 1.0 1.8 4.93 2655 1309 A 91 ARG HBy A 92 TYR H 1.0 1.8 4.54 2656 1309 A 91 ARG HBx A 92 TYR H 1.0 1.8 4.54 2657 1310 A 6 PRO HDy A 5 ARG H 1.0 1.8 5.14 2658 1310 A 6 PRO HDx A 5 ARG H 1.0 1.8 5.14 2659 1311 A 5 ARG H A 5 ARG HDy 1.0 1.8 5.72 2660 1311 A 5 ARG H A 5 ARG HDx 1.0 1.8 5.72 2661 1312 A 5 ARG H A 5 ARG HGy 1.0 1.8 4.42 2662 1312 A 5 ARG H A 5 ARG HGx 1.0 1.8 4.42 2663 1313 A 5 ARG HBy A 5 ARG H 1.0 1.8 4.15 2664 1313 A 5 ARG HBx A 5 ARG H 1.0 1.8 4.15 2665 1314 A 75 MET HGy A 76 ASP H 1.0 1.8 5.64 2666 1314 A 75 MET HGx A 76 ASP H 1.0 1.8 5.64 2667 1315 A 76 ASP H A 75 MET H 1.0 1.8 3.96 2668 1316 A 74 ALA H A 76 ASP H 1.0 1.8 4.69 2669 1317 A 86 ARG HA A 76 ASP H 1.0 1.8 6.00 2670 1318 A 74 ALA HA A 76 ASP H 1.0 1.8 6.00 2671 1319 A 72 MET HA A 76 ASP H 1.0 1.8 4.50 2672 1320 A 76 ASP HBy A 76 ASP H 1.0 1.8 4.11 2673 1320 A 76 ASP HBx A 76 ASP H 1.0 1.8 4.11 2674 1321 A 76 ASP HBy A 76 ASP H 1.0 1.8 4.05 2675 1321 A 76 ASP HBx A 76 ASP H 1.0 1.8 4.05 2676 1322 A 72 MET HGy A 76 ASP H 1.0 1.8 5.80 2677 1323 A 75 MET HBy A 76 ASP H 1.0 1.8 4.37 2678 1323 A 75 MET HBx A 76 ASP H 1.0 1.8 4.37 2679 1324 A 78 ALA HB% A 76 ASP H 1.0 1.8 6.50 2680 1325 A 87 VAL HGx% A 76 ASP H 1.0 1.8 5.15 2681 1325 A 87 VAL HGy% A 76 ASP H 1.0 1.8 5.15 2682 1326 A 87 VAL H A 76 ASP H 1.0 1.8 5.64 2683 1327 A 72 MET HGx A 76 ASP H 1.0 1.8 6.00 2684 1328 A 48 ASP H A 47 ARG H 1.0 1.8 5.24 2685 1329 A 47 ARG H A 45 ILE H 1.0 1.8 5.83 2686 1330 A 44 TYR HEy A 47 ARG H 1.0 1.8 6.67 2687 1330 A 44 TYR HEx A 47 ARG H 1.0 1.8 6.67 2688 1331 A 47 ARG H A 46 PRO HA 1.0 1.8 3.63 2689 1332 A 46 PRO HBy A 47 ARG H 1.0 1.8 5.10 2690 1332 A 46 PRO HBx A 47 ARG H 1.0 1.8 5.10 2691 1333 A 46 PRO HGy A 47 ARG H 1.0 1.8 6.48 2692 1333 A 46 PRO HGx A 47 ARG H 1.0 1.8 6.48 2693 1334 A 47 ARG HGy A 47 ARG H 1.0 1.8 6.67 2694 1334 A 47 ARG HGx A 47 ARG H 1.0 1.8 6.67 2695 1335 A 47 ARG HBy A 47 ARG H 1.0 1.8 4.37 2696 1335 A 47 ARG HBx A 47 ARG H 1.0 1.8 4.37 2697 1336 A 47 ARG HGy A 47 ARG H 1.0 1.8 5.70 2698 1336 A 47 ARG HGx A 47 ARG H 1.0 1.8 5.70 2699 1337 A 45 ILE HA A 47 ARG H 1.0 1.8 5.47 2700 1338 A 47 ARG HDy A 47 ARG H 1.0 1.8 5.81 2701 1338 A 47 ARG HDx A 47 ARG H 1.0 1.8 5.81 2702 1339 A 45 ILE HG2% A 47 ARG H 1.0 1.8 6.25 2703 1340 A 41 GLY HAy A 63 HIS H 1.0 1.8 5.48 2704 1340 A 41 GLY HAx A 63 HIS H 1.0 1.8 5.48 2705 1341 A 62 PHE HBy A 63 HIS H 1.0 1.8 4.31 2706 1342 A 64 ASP H A 65 LYS H 1.0 1.8 5.20 2707 1343 A 64 ASP H A 63 HIS H 1.0 1.8 4.12 2708 1344 A 62 PHE HDy A 64 ASP H 1.0 1.8 5.38 2709 1344 A 62 PHE HDx A 64 ASP H 1.0 1.8 5.38 2710 1345 A 62 PHE HA A 64 ASP H 1.0 1.8 4.94 2711 1346 A 62 PHE HBy A 64 ASP H 1.0 1.8 4.31 2712 1347 A 63 HIS HBy A 64 ASP H 1.0 1.8 4.82 2713 1347 A 63 HIS HBx A 64 ASP H 1.0 1.8 4.82 2714 1348 A 64 ASP H A 64 ASP HBy 1.0 1.8 4.36 2715 1348 A 64 ASP H A 64 ASP HBx 1.0 1.8 4.36 2716 1349 A 68 ALA HB% A 64 ASP H 1.0 1.8 6.16 2717 1350 A 64 ASP H A 63 HIS HD2 1.0 1.8 6.00 2718 1351 A 64 ASP H A 62 PHE HBx 1.0 1.8 5.25 2719 1352 A 97 ASP H A 97 ASP HBy 1.0 1.8 3.98 2720 1352 A 97 ASP H A 97 ASP HBx 1.0 1.8 3.98 2721 1353 A 97 ASP H A 96 PRO HBy 1.0 1.8 4.59 2722 1353 A 97 ASP H A 96 PRO HBx 1.0 1.8 4.59 2723 1354 A 62 PHE HDy A 63 HIS H 1.0 1.8 5.10 2724 1354 A 62 PHE HDx A 63 HIS H 1.0 1.8 5.10 2725 1355 A 62 PHE HA A 63 HIS H 1.0 1.8 3.97 2726 1356 A 63 HIS HBy A 63 HIS H 1.0 1.8 4.59 2727 1356 A 63 HIS HBx A 63 HIS H 1.0 1.8 4.59 2728 1357 A 63 HIS H A 62 PHE HBx 1.0 1.8 5.16 2729 1358 A 64 ASP HBy A 63 HIS H 1.0 1.8 6.67 2730 1358 A 64 ASP HBx A 63 HIS H 1.0 1.8 6.67 2731 1359 A 63 HIS HBy A 63 HIS H 1.0 1.8 4.78 2732 1359 A 63 HIS HBx A 63 HIS H 1.0 1.8 4.78 2733 1360 A 65 LYS H A 67 ASP H 1.0 1.8 5.04 2734 1361 A 62 PHE HBy A 67 ASP H 1.0 1.8 6.00 2735 1362 A 69 GLU HGy A 68 ALA H 1.0 1.8 6.67 2736 1362 A 69 GLU HGx A 68 ALA H 1.0 1.8 6.67 2737 1363 A 64 ASP H A 67 ASP H 1.0 1.8 5.54 2738 1364 A 69 GLU H A 67 ASP H 1.0 1.8 5.00 2739 1365 A 62 PHE HDy A 67 ASP H 1.0 1.8 6.62 2740 1365 A 62 PHE HDx A 67 ASP H 1.0 1.8 6.62 2741 1366 A 68 ALA H A 67 ASP H 1.0 1.8 3.80 2742 1367 A 64 ASP HA A 67 ASP H 1.0 1.8 5.54 2743 1368 A 38 GLY HAy A 67 ASP H 1.0 1.8 6.27 2744 1368 A 38 GLY HAx A 67 ASP H 1.0 1.8 6.27 2745 1369 A 65 LYS HA A 67 ASP H 1.0 1.8 5.19 2746 1370 A 66 ARG HDy A 67 ASP H 1.0 1.8 5.63 2747 1370 A 66 ARG HDx A 67 ASP H 1.0 1.8 5.63 2748 1371 A 67 ASP HBy A 67 ASP H 1.0 1.8 4.69 2749 1371 A 67 ASP HBx A 67 ASP H 1.0 1.8 4.69 2750 1372 A 64 ASP HBy A 67 ASP H 1.0 1.8 4.50 2751 1372 A 64 ASP HBx A 67 ASP H 1.0 1.8 4.50 2752 1373 A 67 ASP HBy A 67 ASP H 1.0 1.8 5.03 2753 1373 A 67 ASP HBx A 67 ASP H 1.0 1.8 5.03 2754 1374 A 66 ARG HBy A 67 ASP H 1.0 1.8 4.45 2755 1374 A 66 ARG HBx A 67 ASP H 1.0 1.8 4.45 2756 1375 A 66 ARG HGy A 67 ASP H 1.0 1.8 4.50 2757 1375 A 66 ARG HGx A 67 ASP H 1.0 1.8 4.50 2758 1376 A 68 ALA HB% A 67 ASP H 1.0 1.8 5.51 2759 1377 A 68 ALA H A 64 ASP H 1.0 1.8 5.76 2760 1378 A 62 PHE HBy A 68 ALA H 1.0 1.8 4.95 2761 1379 A 65 LYS HBy A 68 ALA H 1.0 1.8 6.67 2762 1379 A 65 LYS HBx A 68 ALA H 1.0 1.8 6.67 2763 1380 A 69 GLU HBy A 68 ALA H 1.0 1.8 6.67 2764 1380 A 69 GLU HBx A 68 ALA H 1.0 1.8 6.67 2765 1381 A 68 ALA H A 89 MET HE% 1.0 1.8 7.11 2766 1382 A 66 ARG H A 68 ALA H 1.0 1.8 4.77 2767 1383 A 68 ALA H A 69 GLU H 1.0 1.8 3.88 2768 1384 A 66 ARG HA A 68 ALA H 1.0 1.8 5.05 2769 1385 A 65 LYS HA A 68 ALA H 1.0 1.8 4.83 2770 1386 A 69 GLU HGy A 68 ALA H 1.0 1.8 5.92 2771 1386 A 69 GLU HGx A 68 ALA H 1.0 1.8 5.92 2772 1387 A 66 ARG HBy A 68 ALA H 1.0 1.8 6.30 2773 1387 A 66 ARG HBx A 68 ALA H 1.0 1.8 6.30 2774 1388 A 68 ALA HB% A 68 ALA H 1.0 1.8 4.09 2775 1389 A 14 THR HG2% A 68 ALA H 1.0 1.8 5.99 2776 1390 A 16 LEU HDx% A 68 ALA H 1.0 1.8 7.78 2777 1390 A 16 LEU HDy% A 68 ALA H 1.0 1.8 7.78 2778 1391 A 14 THR H A 14 THR HB 1.0 1.8 4.49 2779 1392 A 13 MET HBy A 14 THR H 1.0 1.8 5.94 2780 1392 A 13 MET HBx A 14 THR H 1.0 1.8 5.94 2781 1393 A 14 THR HG2% A 14 THR H 1.0 1.8 5.82 2782 1394 A 37 TYR HDy A 35 GLU H 1.0 1.8 5.63 2783 1394 A 37 TYR HDx A 35 GLU H 1.0 1.8 5.63 2784 1395 A 32 ARG HA A 35 GLU H 1.0 1.8 4.28 2785 1396 A 34 PHE HBy A 35 GLU H 1.0 1.8 4.41 2786 1397 A 35 GLU HGy A 35 GLU H 1.0 1.8 5.07 2787 1397 A 35 GLU HGx A 35 GLU H 1.0 1.8 5.07 2788 1398 A 35 GLU HGy A 35 GLU H 1.0 1.8 5.47 2789 1398 A 35 GLU HGx A 35 GLU H 1.0 1.8 5.47 2790 1399 A 35 GLU HBy A 35 GLU H 1.0 1.8 4.22 2791 1399 A 35 GLU HBx A 35 GLU H 1.0 1.8 4.22 2792 1400 A 35 GLU HBy A 35 GLU H 1.0 1.8 4.22 2793 1400 A 35 GLU HBx A 35 GLU H 1.0 1.8 4.22 2794 1401 A 40 VAL HGx% A 35 GLU H 1.0 1.8 5.26 2795 1401 A 40 VAL HGy% A 35 GLU H 1.0 1.8 5.26 2796 1402 A 35 GLU H A 32 ARG H 1.0 1.8 5.20 2797 1403 A 33 VAL HA A 35 GLU H 1.0 1.8 4.90 2798 1404 A 36 LYS HBy A 35 GLU H 1.0 1.8 5.66 2799 1405 A 24 ARG HBy A 25 THR H 1.0 1.8 4.82 2800 1406 A 24 ARG HBx A 25 THR H 1.0 1.8 4.61 2801 1407 A 21 LEU HDy% A 25 THR H 1.0 1.8 7.91 2802 1407 A 21 LEU HDx% A 25 THR H 1.0 1.8 7.91 2803 1408 A 22 THR H A 25 THR H 1.0 1.8 4.78 2804 1409 A 25 THR HB A 25 THR H 1.0 1.8 3.59 2805 1410 A 22 THR HG2% A 25 THR H 1.0 1.8 5.44 2806 1411 A 21 LEU HBy A 25 THR H 1.0 1.8 5.42 2807 1411 A 21 LEU HBx A 25 THR H 1.0 1.8 5.42 2808 1412 A 25 THR HG2% A 25 THR H 1.0 1.8 5.22 2809 1413 A 35 GLU H A 34 PHE H 1.0 1.8 3.89 2810 1414 A 35 GLU H A 38 GLY H 1.0 1.8 5.86 2811 1415 A 31 ARG HA A 35 GLU H 1.0 1.8 4.92 2812 1416 A 34 PHE HBx A 35 GLU H 1.0 1.8 4.44 2813 1417 A 33 VAL HGx% A 35 GLU H 1.0 1.8 6.43 2814 1417 A 33 VAL HGy% A 35 GLU H 1.0 1.8 6.43 2815 1418 A 29 THR HA A 31 ARG H 1.0 1.8 5.16 2816 1419 A 53 GLU H A 54 SER H 1.0 1.8 4.17 2817 1420 A 53 GLU HGy A 53 GLU H 1.0 1.8 4.48 2818 1420 A 53 GLU HGx A 53 GLU H 1.0 1.8 4.48 2819 1421 A 53 GLU HGy A 53 GLU H 1.0 1.8 4.64 2820 1421 A 53 GLU HGx A 53 GLU H 1.0 1.8 4.64 2821 1422 A 53 GLU H A 51 THR H 1.0 1.8 4.97 2822 1423 A 53 GLU H A 53 GLU HBy 1.0 1.8 4.88 2823 1423 A 53 GLU H A 53 GLU HBx 1.0 1.8 4.88 2824 1424 A 53 GLU H A 53 GLU HBy 1.0 1.8 4.62 2825 1424 A 53 GLU H A 53 GLU HBx 1.0 1.8 4.62 2826 1425 A 23 TYR H A 25 THR H 1.0 1.8 5.37 2827 1426 A 21 LEU HDy% A 25 THR H 1.0 1.8 6.75 2828 1426 A 21 LEU HDx% A 25 THR H 1.0 1.8 6.75 2829 1427 A 31 ARG H A 32 ARG H 1.0 1.8 3.76 2830 1428 A 31 ARG H A 30 LEU H 1.0 1.8 4.14 2831 1429 A 31 ARG H A 28 ASP HA 1.0 1.8 4.21 2832 1430 A 31 ARG HDy A 31 ARG H 1.0 1.8 6.44 2833 1430 A 31 ARG HDx A 31 ARG H 1.0 1.8 6.44 2834 1431 A 28 ASP HBy A 31 ARG H 1.0 1.8 6.44 2835 1431 A 28 ASP HBx A 31 ARG H 1.0 1.8 6.44 2836 1432 A 31 ARG HBy A 31 ARG H 1.0 1.8 3.90 2837 1432 A 31 ARG HBx A 31 ARG H 1.0 1.8 3.90 2838 1433 A 30 LEU HBx A 31 ARG H 1.0 1.8 3.88 2839 1434 A 30 LEU HBy A 31 ARG H 1.0 1.8 4.75 2840 1435 A 33 VAL HGx% A 31 ARG H 1.0 1.8 7.91 2841 1435 A 33 VAL HGy% A 31 ARG H 1.0 1.8 7.91 2842 1436 A 43 VAL HGx% A 31 ARG H 1.0 1.8 6.03 2843 1436 A 43 VAL HGy% A 31 ARG H 1.0 1.8 6.03 2844 1437 A 48 ASP HBy A 53 GLU H 1.0 1.8 5.03 2845 1437 A 48 ASP HBx A 53 GLU H 1.0 1.8 5.03 2846 1438 A 48 ASP HBy A 53 GLU H 1.0 1.8 4.72 2847 1438 A 48 ASP HBx A 53 GLU H 1.0 1.8 4.72 2848 1439 A 47 ARG HGy A 53 GLU H 1.0 1.8 5.69 2849 1439 A 47 ARG HGx A 53 GLU H 1.0 1.8 5.69 2850 1440 A 51 THR HG2% A 53 GLU H 1.0 1.8 6.67 2851 1441 A 28 ASP HBy A 30 LEU H 1.0 1.8 6.46 2852 1441 A 28 ASP HBx A 30 LEU H 1.0 1.8 6.46 2853 1442 A 11 GLU HBy A 13 MET H 1.0 1.8 6.34 2854 1442 A 11 GLU HBx A 13 MET H 1.0 1.8 6.34 2855 1443 A 30 LEU HBy A 30 LEU H 1.0 1.8 4.26 2856 1444 A 33 VAL HGy% A 30 LEU H 1.0 1.8 7.71 2857 1444 A 33 VAL HGx% A 30 LEU H 1.0 1.8 7.71 2858 1445 A 43 VAL HGy% A 30 LEU H 1.0 1.8 7.91 2859 1445 A 43 VAL HGx% A 30 LEU H 1.0 1.8 7.91 2860 1446 A 30 LEU HDy% A 30 LEU H 1.0 1.8 5.65 2861 1446 A 30 LEU HDx% A 30 LEU H 1.0 1.8 5.65 2862 1447 A 30 LEU HBx A 30 LEU H 1.0 1.8 4.09 2863 1448 A 30 LEU HG A 30 LEU H 1.0 1.8 4.29 2864 1449 A 25 THR HG2% A 30 LEU H 1.0 1.8 5.48 2865 1450 A 33 VAL HGy% A 30 LEU H 1.0 1.8 6.85 2866 1450 A 33 VAL HGx% A 30 LEU H 1.0 1.8 6.85 2867 1451 A 85 LEU H A 79 VAL H 1.0 1.8 6.00 2868 1452 A 10 VAL H A 11 GLU HGy 1.0 1.8 6.12 2869 1452 A 10 VAL H A 11 GLU HGx 1.0 1.8 6.12 2870 1453 A 29 THR HB A 30 LEU H 1.0 1.8 4.08 2871 1454 A 31 ARG HA A 30 LEU H 1.0 1.8 5.92 2872 1455 A 45 ILE HD1% A 30 LEU H 1.0 1.8 7.11 2873 1456 A 79 VAL H A 78 ALA H 1.0 1.8 5.01 2874 1457 A 78 ALA HA A 79 VAL H 1.0 1.8 3.26 2875 1458 A 79 VAL HB A 79 VAL H 1.0 1.8 3.28 2876 1459 A 78 ALA HB% A 79 VAL H 1.0 1.8 3.86 2877 1460 A 79 VAL HGx% A 79 VAL H 1.0 1.8 5.85 2878 1460 A 79 VAL HGy% A 79 VAL H 1.0 1.8 5.85 2879 1461 A 65 LYS HBy A 66 ARG H 1.0 1.8 4.81 2880 1461 A 65 LYS HBx A 66 ARG H 1.0 1.8 4.81 2881 1462 A 66 ARG HBy A 66 ARG H 1.0 1.8 3.60 2882 1462 A 66 ARG HBx A 66 ARG H 1.0 1.8 3.60 2883 1463 A 66 ARG H A 66 ARG HGy 1.0 1.8 3.79 2884 1463 A 66 ARG H A 66 ARG HGx 1.0 1.8 3.79 2885 1464 A 66 ARG H A 67 ASP H 1.0 1.8 3.72 2886 1465 A 66 ARG H A 66 ARG HDy 1.0 1.8 5.16 2887 1465 A 66 ARG H A 66 ARG HDx 1.0 1.8 5.16 2888 1466 A 66 ARG H A 64 ASP HBy 1.0 1.8 5.00 2889 1466 A 66 ARG H A 64 ASP HBx 1.0 1.8 5.00 2890 1467 A 68 ALA HB% A 66 ARG H 1.0 1.8 6.47 2891 1468 A 70 ASP HA A 72 MET H 1.0 1.8 5.21 2892 1469 A 70 ASP HBy A 72 MET H 1.0 1.8 5.82 2893 1470 A 71 ALA H A 72 MET H 1.0 1.8 4.06 2894 1471 A 73 ASP H A 72 MET H 1.0 1.8 3.86 2895 1472 A 74 ALA H A 72 MET H 1.0 1.8 4.66 2896 1473 A 73 ASP HA A 72 MET H 1.0 1.8 5.76 2897 1474 A 73 ASP HBy A 72 MET H 1.0 1.8 5.36 2898 1475 A 73 ASP HBx A 72 MET H 1.0 1.8 5.51 2899 1476 A 72 MET HGy A 72 MET H 1.0 1.8 4.69 2900 1477 A 72 MET HGx A 72 MET H 1.0 1.8 3.59 2901 1478 A 72 MET HBy A 72 MET H 1.0 1.8 4.06 2902 1478 A 72 MET HBx A 72 MET H 1.0 1.8 4.06 2903 1479 A 71 ALA HB% A 72 MET H 1.0 1.8 4.34 2904 1480 A 16 LEU HDx% A 72 MET H 1.0 1.8 5.77 2905 1480 A 16 LEU HDy% A 72 MET H 1.0 1.8 5.77 2906 1481 A 16 LEU HDx% A 72 MET H 1.0 1.8 6.26 2907 1481 A 16 LEU HDy% A 72 MET H 1.0 1.8 6.26 2908 1482 A 10 VAL H A 9 ASP HA 1.0 1.8 3.81 2909 1483 A 9 ASP HBy A 10 VAL H 1.0 1.8 4.93 2910 1483 A 9 ASP HBx A 10 VAL H 1.0 1.8 4.93 2911 1484 A 10 VAL H A 10 VAL HB 1.0 1.8 4.34 2912 1485 A 10 VAL H A 9 ASP H 1.0 1.8 4.21 2913 1486 A 10 VAL H A 11 GLU HBy 1.0 1.8 6.26 2914 1486 A 10 VAL H A 11 GLU HBx 1.0 1.8 6.26 2915 1487 A 10 VAL H A 8 PRO HBy 1.0 1.8 6.34 2916 1487 A 10 VAL H A 8 PRO HBx 1.0 1.8 6.34 2917 1488 A 10 VAL H A 13 MET HE% 1.0 1.8 7.11 2918 1489 A 10 VAL H A 10 VAL HGx% 1.0 1.8 4.73 2919 1489 A 10 VAL H A 10 VAL HG21 1.0 1.8 4.73 2920 1490 A 14 THR HG2% A 66 ARG H 1.0 1.8 6.67 2921 1491 A 13 MET HBy A 13 MET H 1.0 1.8 5.02 2922 1491 A 13 MET HBx A 13 MET H 1.0 1.8 5.02 2923 1492 A 10 VAL HGx% A 13 MET H 1.0 1.8 7.91 2924 1492 A 10 VAL HG21 A 13 MET H 1.0 1.8 7.91 2925 1493 A 35 GLU HGy A 36 LYS H 1.0 1.8 6.67 2926 1493 A 35 GLU HGx A 36 LYS H 1.0 1.8 6.67 2927 1494 A 36 LYS H A 35 GLU H 1.0 1.8 3.85 2928 1495 A 36 LYS H A 37 TYR H 1.0 1.8 3.84 2929 1496 A 36 LYS H A 38 GLY H 1.0 1.8 4.60 2930 1497 A 37 TYR HDy A 36 LYS H 1.0 1.8 4.74 2931 1497 A 37 TYR HDx A 36 LYS H 1.0 1.8 4.74 2932 1498 A 37 TYR HEy A 36 LYS H 1.0 1.8 6.12 2933 1498 A 37 TYR HEx A 36 LYS H 1.0 1.8 6.12 2934 1499 A 34 PHE HA A 36 LYS H 1.0 1.8 4.46 2935 1500 A 37 TYR HA A 36 LYS H 1.0 1.8 5.96 2936 1501 A 36 LYS HA A 36 LYS H 1.0 1.8 3.41 2937 1502 A 35 GLU HBy A 36 LYS H 1.0 1.8 5.45 2938 1502 A 35 GLU HBx A 36 LYS H 1.0 1.8 5.45 2939 1503 A 35 GLU HBy A 36 LYS H 1.0 1.8 5.34 2940 1503 A 35 GLU HBx A 36 LYS H 1.0 1.8 5.34 2941 1504 A 36 LYS HBy A 36 LYS H 1.0 1.8 3.38 2942 1505 A 36 LYS HGy A 36 LYS H 1.0 1.8 4.38 2943 1505 A 36 LYS HGx A 36 LYS H 1.0 1.8 4.38 2944 1506 A 33 VAL HGy% A 36 LYS H 1.0 1.8 7.63 2945 1506 A 33 VAL HGx% A 36 LYS H 1.0 1.8 7.63 2946 1507 A 40 VAL HGx% A 36 LYS H 1.0 1.8 7.37 2947 1507 A 40 VAL HGy% A 36 LYS H 1.0 1.8 7.37 2948 1508 A 36 LYS H A 34 PHE H 1.0 1.8 5.14 2949 1509 A 21 LEU HG A 58 ALA H 1.0 1.8 5.32 2950 1510 A 21 LEU HBy A 58 ALA H 1.0 1.8 6.67 2951 1510 A 21 LEU HBx A 58 ALA H 1.0 1.8 6.67 2952 1511 A 57 PHE HDy A 58 ALA H 1.0 1.8 4.71 2953 1511 A 57 PHE HDx A 58 ALA H 1.0 1.8 4.71 2954 1512 A 57 PHE HA A 58 ALA H 1.0 1.8 3.79 2955 1513 A 19 ASP HA A 58 ALA H 1.0 1.8 4.53 2956 1514 A 57 PHE HBy A 58 ALA H 1.0 1.8 4.74 2957 1514 A 57 PHE HBx A 58 ALA H 1.0 1.8 4.74 2958 1515 A 57 PHE HBy A 58 ALA H 1.0 1.8 5.43 2959 1515 A 57 PHE HBx A 58 ALA H 1.0 1.8 5.43 2960 1516 A 58 ALA HB% A 58 ALA H 1.0 1.8 4.69 2961 1517 A 21 LEU HDx% A 58 ALA H 1.0 1.8 5.54 2962 1517 A 21 LEU HDy% A 58 ALA H 1.0 1.8 5.54 2963 1518 A 57 PHE HEy A 58 ALA H 1.0 1.8 6.67 2964 1518 A 57 PHE HEx A 58 ALA H 1.0 1.8 6.67 2965 1519 A 27 PRO HA A 29 THR H 1.0 1.8 5.22 2966 1520 A 31 ARG HBy A 29 THR H 1.0 1.8 6.03 2967 1520 A 31 ARG HBx A 29 THR H 1.0 1.8 6.03 2968 1521 A 30 LEU HG A 29 THR H 1.0 1.8 4.98 2969 1522 A 29 THR H A 31 ARG H 1.0 1.8 4.86 2970 1523 A 29 THR H A 26 SER H 1.0 1.8 4.65 2971 1524 A 26 SER HA A 29 THR H 1.0 1.8 5.37 2972 1525 A 26 SER HBy A 29 THR H 1.0 1.8 4.90 2973 1525 A 26 SER HBx A 29 THR H 1.0 1.8 4.90 2974 1526 A 27 PRO HDy A 29 THR H 1.0 1.8 6.16 2975 1526 A 27 PRO HDx A 29 THR H 1.0 1.8 6.16 2976 1527 A 43 VAL HGx% A 29 THR H 1.0 1.8 7.91 2977 1527 A 43 VAL HGy% A 29 THR H 1.0 1.8 7.91 2978 1528 A 29 THR H A 30 LEU H 1.0 1.8 3.84 2979 1529 A 28 ASP HBy A 29 THR H 1.0 1.8 4.50 2980 1529 A 28 ASP HBx A 29 THR H 1.0 1.8 4.50 2981 1530 A 29 THR HG2% A 29 THR H 1.0 1.8 4.91 2982 1531 A 75 MET HBy A 74 ALA H 1.0 1.8 5.24 2983 1531 A 75 MET HBx A 74 ALA H 1.0 1.8 5.24 2984 1532 A 74 ALA H A 75 MET H 1.0 1.8 3.78 2985 1533 A 73 ASP H A 74 ALA H 1.0 1.8 3.82 2986 1534 A 37 TYR HEy A 74 ALA H 1.0 1.8 5.69 2987 1534 A 37 TYR HEx A 74 ALA H 1.0 1.8 5.69 2988 1535 A 75 MET HA A 74 ALA H 1.0 1.8 5.43 2989 1536 A 73 ASP HA A 74 ALA H 1.0 1.8 4.06 2990 1537 A 72 MET HA A 74 ALA H 1.0 1.8 5.07 2991 1538 A 71 ALA HA A 74 ALA H 1.0 1.8 4.69 2992 1539 A 73 ASP HBy A 74 ALA H 1.0 1.8 4.06 2993 1540 A 72 MET HGx A 74 ALA H 1.0 1.8 6.00 2994 1541 A 71 ALA HB% A 74 ALA H 1.0 1.8 6.46 2995 1542 A 74 ALA HB% A 74 ALA H 1.0 1.8 3.78 2996 1543 A 49 ARG HBy A 50 TYR H 1.0 1.8 5.58 2997 1543 A 49 ARG HBx A 50 TYR H 1.0 1.8 5.58 2998 1544 A 50 TYR H A 49 ARG HGy 1.0 1.8 6.07 2999 1544 A 50 TYR H A 49 ARG HGx 1.0 1.8 6.07 3000 1545 A 51 THR H A 50 TYR H 1.0 1.8 3.70 3001 1546 A 50 TYR H A 49 ARG H 1.0 1.8 4.23 3002 1547 A 52 LYS H A 50 TYR H 1.0 1.8 4.37 3003 1548 A 48 ASP HA A 50 TYR H 1.0 1.8 4.72 3004 1549 A 51 THR HA A 50 TYR H 1.0 1.8 5.38 3005 1550 A 52 LYS HA A 50 TYR H 1.0 1.8 5.09 3006 1551 A 48 ASP HBy A 50 TYR H 1.0 1.8 4.46 3007 1551 A 48 ASP HBx A 50 TYR H 1.0 1.8 4.46 3008 1552 A 50 TYR HBy A 50 TYR H 1.0 1.8 4.66 3009 1552 A 50 TYR HBx A 50 TYR H 1.0 1.8 4.66 3010 1553 A 48 ASP HBy A 50 TYR H 1.0 1.8 5.41 3011 1553 A 48 ASP HBx A 50 TYR H 1.0 1.8 5.41 3012 1554 A 76 ASP HBy A 77 GLY H 1.0 1.8 5.78 3013 1554 A 76 ASP HBx A 77 GLY H 1.0 1.8 5.78 3014 1555 A 76 ASP HBy A 77 GLY H 1.0 1.8 5.38 3015 1555 A 76 ASP HBx A 77 GLY H 1.0 1.8 5.38 3016 1556 A 85 LEU HDx% A 77 GLY H 1.0 1.8 7.91 3017 1556 A 85 LEU HDy% A 77 GLY H 1.0 1.8 7.91 3018 1557 A 85 LEU HDx% A 77 GLY H 1.0 1.8 7.91 3019 1557 A 85 LEU HDy% A 77 GLY H 1.0 1.8 7.91 3020 1558 A 77 GLY H A 85 LEU H 1.0 1.8 4.31 3021 1559 A 77 GLY H A 76 ASP H 1.0 1.8 5.00 3022 1560 A 86 ARG HA A 77 GLY H 1.0 1.8 4.94 3023 1561 A 76 ASP HA A 77 GLY H 1.0 1.8 3.78 3024 1562 A 85 LEU HBx A 77 GLY H 1.0 1.8 4.77 3025 1563 A 75 MET HBy A 77 GLY H 1.0 1.8 6.36 3026 1563 A 75 MET HBx A 77 GLY H 1.0 1.8 6.36 3027 1564 A 78 ALA HB% A 77 GLY H 1.0 1.8 5.92 3028 1565 A 87 VAL HGy% A 77 GLY H 1.0 1.8 6.49 3029 1565 A 87 VAL HGx% A 77 GLY H 1.0 1.8 6.49 3030 1566 A 9 ASP HBy A 9 ASP H 1.0 1.8 4.23 3031 1566 A 9 ASP HBx A 9 ASP H 1.0 1.8 4.23 3032 1567 A 10 VAL HA A 9 ASP H 1.0 1.8 5.74 3033 1568 A 66 ARG HGy A 69 GLU H 1.0 1.8 6.67 3034 1568 A 66 ARG HGx A 69 GLU H 1.0 1.8 6.67 3035 1569 A 71 ALA H A 69 GLU H 1.0 1.8 5.53 3036 1570 A 66 ARG H A 69 GLU H 1.0 1.8 5.45 3037 1571 A 66 ARG HA A 69 GLU H 1.0 1.8 4.54 3038 1572 A 65 LYS HA A 69 GLU H 1.0 1.8 4.94 3039 1573 A 69 GLU HGy A 69 GLU H 1.0 1.8 4.19 3040 1573 A 69 GLU HGx A 69 GLU H 1.0 1.8 4.19 3041 1574 A 69 GLU HGy A 69 GLU H 1.0 1.8 3.97 3042 1574 A 69 GLU HGx A 69 GLU H 1.0 1.8 3.97 3043 1575 A 69 GLU HBy A 69 GLU H 1.0 1.8 3.97 3044 1575 A 69 GLU HBx A 69 GLU H 1.0 1.8 3.97 3045 1576 A 68 ALA HB% A 69 GLU H 1.0 1.8 4.36 3046 1577 A 16 LEU HDy% A 69 GLU H 1.0 1.8 7.91 3047 1577 A 16 LEU HDx% A 69 GLU H 1.0 1.8 7.91 3048 1578 A 16 LEU HDy% A 69 GLU H 1.0 1.8 7.71 3049 1578 A 16 LEU HDx% A 69 GLU H 1.0 1.8 7.71 3050 1579 A 74 ALA HB% A 73 ASP H 1.0 1.8 5.90 3051 1580 A 73 ASP H A 75 MET H 1.0 1.8 4.78 3052 1581 A 74 ALA HA A 73 ASP H 1.0 1.8 5.86 3053 1582 A 73 ASP H A 73 ASP HBy 1.0 1.8 3.54 3054 1583 A 73 ASP HBx A 73 ASP H 1.0 1.8 3.63 3055 1584 A 73 ASP H A 72 MET HGy 1.0 1.8 4.45 3056 1585 A 72 MET HGx A 73 ASP H 1.0 1.8 3.87 3057 1586 A 72 MET HE% A 73 ASP H 1.0 1.8 5.15 3058 1587 A 72 MET HBy A 73 ASP H 1.0 1.8 4.56 3059 1587 A 72 MET HBx A 73 ASP H 1.0 1.8 4.56 3060 1588 A 71 ALA HB% A 73 ASP H 1.0 1.8 5.90 3061 1589 A 75 MET HE% A 34 PHE H 1.0 1.8 6.06 3062 1590 A 47 ARG HA A 54 SER H 1.0 1.8 4.82 3063 1591 A 54 SER H A 53 GLU HA 1.0 1.8 3.91 3064 1592 A 52 LYS HA A 54 SER H 1.0 1.8 4.27 3065 1593 A 54 SER HBy A 54 SER H 1.0 1.8 4.96 3066 1593 A 54 SER HBx A 54 SER H 1.0 1.8 4.96 3067 1594 A 54 SER HBy A 54 SER H 1.0 1.8 4.31 3068 1594 A 54 SER HBx A 54 SER H 1.0 1.8 4.31 3069 1595 A 53 GLU HGy A 54 SER H 1.0 1.8 6.18 3070 1595 A 53 GLU HGx A 54 SER H 1.0 1.8 6.18 3071 1596 A 53 GLU HGy A 54 SER H 1.0 1.8 4.97 3072 1596 A 53 GLU HGx A 54 SER H 1.0 1.8 4.97 3073 1597 A 53 GLU HBy A 54 SER H 1.0 1.8 5.48 3074 1597 A 53 GLU HBx A 54 SER H 1.0 1.8 5.48 3075 1598 A 45 ILE HG2% A 54 SER H 1.0 1.8 7.11 3076 1599 A 37 TYR HDy A 34 PHE H 1.0 1.8 5.87 3077 1599 A 37 TYR HDx A 34 PHE H 1.0 1.8 5.87 3078 1600 A 40 VAL HGx% A 34 PHE H 1.0 1.8 6.26 3079 1600 A 40 VAL HGy% A 34 PHE H 1.0 1.8 6.26 3080 1601 A 34 PHE HDy A 34 PHE H 1.0 1.8 4.04 3081 1601 A 34 PHE HDx A 34 PHE H 1.0 1.8 4.04 3082 1602 A 34 PHE HEy A 34 PHE H 1.0 1.8 6.65 3083 1602 A 34 PHE HEx A 34 PHE H 1.0 1.8 6.65 3084 1603 A 30 LEU HA A 34 PHE H 1.0 1.8 4.61 3085 1604 A 31 ARG HA A 34 PHE H 1.0 1.8 4.85 3086 1605 A 34 PHE HBy A 34 PHE H 1.0 1.8 4.11 3087 1606 A 34 PHE HBx A 34 PHE H 1.0 1.8 3.97 3088 1607 A 32 ARG HBy A 34 PHE H 1.0 1.8 6.35 3089 1607 A 32 ARG HBx A 34 PHE H 1.0 1.8 6.35 3090 1608 A 30 LEU HBy A 34 PHE H 1.0 1.8 5.45 3091 1609 A 33 VAL HGy% A 34 PHE H 1.0 1.8 6.23 3092 1609 A 33 VAL HGx% A 34 PHE H 1.0 1.8 6.23 3093 1610 A 33 VAL HGy% A 34 PHE H 1.0 1.8 5.27 3094 1610 A 33 VAL HGx% A 34 PHE H 1.0 1.8 5.27 3095 1611 A 47 ARG HDy A 54 SER H 1.0 1.8 6.09 3096 1611 A 47 ARG HDx A 54 SER H 1.0 1.8 6.09 3097 1612 A 53 GLU HBy A 54 SER H 1.0 1.8 5.84 3098 1612 A 53 GLU HBx A 54 SER H 1.0 1.8 5.84 3099 1613 A 35 GLU HA A 34 PHE H 1.0 1.8 5.55 3100 1614 A 97 ASP HA A 98 SER H 1.0 1.8 3.48 3101 1615 A 98 SER HBy A 98 SER H 1.0 1.8 4.41 3102 1615 A 98 SER HBx A 98 SER H 1.0 1.8 4.41 3103 1616 A 97 ASP HBy A 98 SER H 1.0 1.8 4.94 3104 1616 A 97 ASP HBx A 98 SER H 1.0 1.8 4.94 3105 1617 A 97 ASP H A 98 SER H 1.0 1.8 4.89 3106 1618 A 34 PHE HBx A 32 ARG H 1.0 1.8 5.77 3107 1619 A 44 TYR H A 59 PHE H 1.0 1.8 4.71 3108 1620 A 57 PHE HEy A 59 PHE H 1.0 1.8 6.67 3109 1620 A 57 PHE HEx A 59 PHE H 1.0 1.8 6.67 3110 1621 A 59 PHE HDy A 59 PHE H 1.0 1.8 5.38 3111 1621 A 59 PHE HDx A 59 PHE H 1.0 1.8 5.38 3112 1622 A 58 ALA HA A 59 PHE H 1.0 1.8 3.77 3113 1623 A 45 ILE HA A 59 PHE H 1.0 1.8 4.48 3114 1624 A 46 PRO HDy A 59 PHE H 1.0 1.8 5.06 3115 1624 A 46 PRO HDx A 59 PHE H 1.0 1.8 5.06 3116 1625 A 59 PHE HBy A 59 PHE H 1.0 1.8 4.48 3117 1625 A 59 PHE HBx A 59 PHE H 1.0 1.8 4.48 3118 1626 A 58 ALA HB% A 59 PHE H 1.0 1.8 4.58 3119 1627 A 30 LEU HDx% A 59 PHE H 1.0 1.8 7.64 3120 1627 A 30 LEU HDy% A 59 PHE H 1.0 1.8 7.64 3121 1628 A 45 ILE HG2% A 59 PHE H 1.0 1.8 7.11 3122 1629 A 60 VAL HGy% A 59 PHE H 1.0 1.8 6.94 3123 1629 A 60 VAL HGx% A 59 PHE H 1.0 1.8 6.94 3124 1630 A 60 VAL H A 59 PHE H 1.0 1.8 5.31 3125 1631 A 40 VAL HGy% A 39 ARG H 1.0 1.8 7.31 3126 1631 A 40 VAL HGx% A 39 ARG H 1.0 1.8 7.31 3127 1632 A 29 THR HA A 32 ARG H 1.0 1.8 4.43 3128 1633 A 31 ARG HDy A 32 ARG H 1.0 1.8 6.67 3129 1633 A 31 ARG HDx A 32 ARG H 1.0 1.8 6.67 3130 1634 A 32 ARG HDy A 32 ARG H 1.0 1.8 5.60 3131 1634 A 32 ARG HDx A 32 ARG H 1.0 1.8 5.60 3132 1635 A 31 ARG HBy A 32 ARG H 1.0 1.8 4.08 3133 1635 A 31 ARG HBx A 32 ARG H 1.0 1.8 4.08 3134 1636 A 32 ARG HGy A 32 ARG H 1.0 1.8 5.91 3135 1636 A 32 ARG HGx A 32 ARG H 1.0 1.8 5.91 3136 1637 A 38 GLY HAy A 39 ARG H 1.0 1.8 4.05 3137 1637 A 38 GLY HAx A 39 ARG H 1.0 1.8 4.05 3138 1638 A 67 ASP HA A 39 ARG H 1.0 1.8 6.00 3139 1639 A 39 ARG H A 67 ASP HBy 1.0 1.8 5.87 3140 1639 A 39 ARG H A 67 ASP HBx 1.0 1.8 5.87 3141 1640 A 39 ARG HBy A 39 ARG H 1.0 1.8 4.10 3142 1640 A 39 ARG HBx A 39 ARG H 1.0 1.8 4.10 3143 1641 A 39 ARG HGy A 39 ARG H 1.0 1.8 4.07 3144 1641 A 39 ARG HGx A 39 ARG H 1.0 1.8 4.07 3145 1642 A 29 THR HG2% A 28 ASP H 1.0 1.8 7.11 3146 1643 A 32 ARG H A 28 ASP HA 1.0 1.8 5.52 3147 1644 A 28 ASP HBy A 32 ARG H 1.0 1.8 6.67 3148 1644 A 28 ASP HBx A 32 ARG H 1.0 1.8 6.67 3149 1645 A 29 THR HG2% A 32 ARG H 1.0 1.8 6.52 3150 1646 A 33 VAL HGy% A 32 ARG H 1.0 1.8 5.97 3151 1646 A 33 VAL HGx% A 32 ARG H 1.0 1.8 5.97 3152 1647 A 60 VAL HA A 42 ASP H 1.0 1.8 5.83 3153 1648 A 62 PHE HA A 42 ASP H 1.0 1.8 5.00 3154 1649 A 40 VAL HA A 42 ASP H 1.0 1.8 5.09 3155 1650 A 29 THR H A 28 ASP H 1.0 1.8 3.78 3156 1651 A 28 ASP H A 30 LEU H 1.0 1.8 5.22 3157 1652 A 26 SER HA A 28 ASP H 1.0 1.8 5.24 3158 1653 A 26 SER HBy A 28 ASP H 1.0 1.8 4.24 3159 1653 A 26 SER HBx A 28 ASP H 1.0 1.8 4.24 3160 1654 A 27 PRO HDy A 28 ASP H 1.0 1.8 5.41 3161 1654 A 27 PRO HDx A 28 ASP H 1.0 1.8 5.41 3162 1655 A 28 ASP HBy A 28 ASP H 1.0 1.8 3.67 3163 1655 A 28 ASP HBx A 28 ASP H 1.0 1.8 3.67 3164 1656 A 27 PRO HGy A 28 ASP H 1.0 1.8 4.80 3165 1656 A 27 PRO HGx A 28 ASP H 1.0 1.8 4.80 3166 1657 A 43 VAL HGx% A 28 ASP H 1.0 1.8 7.91 3167 1657 A 43 VAL HGy% A 28 ASP H 1.0 1.8 7.91 3168 1658 A 41 GLY H A 42 ASP H 1.0 1.8 4.44 3169 1659 A 43 VAL H A 42 ASP H 1.0 1.8 5.00 3170 1660 A 42 ASP HBy A 42 ASP H 1.0 1.8 5.15 3171 1660 A 42 ASP HBx A 42 ASP H 1.0 1.8 5.15 3172 1661 A 61 ARG HGy A 42 ASP H 1.0 1.8 5.44 3173 1661 A 61 ARG HGx A 42 ASP H 1.0 1.8 5.44 3174 1662 A 43 VAL HGy% A 42 ASP H 1.0 1.8 6.84 3175 1662 A 43 VAL HGx% A 42 ASP H 1.0 1.8 6.84 3176 1663 A 40 VAL HGx% A 42 ASP H 1.0 1.8 4.75 3177 1663 A 40 VAL HGy% A 42 ASP H 1.0 1.8 4.75 3178 1664 A 30 LEU HDx% A 28 ASP H 1.0 1.8 7.91 3179 1664 A 30 LEU HDy% A 28 ASP H 1.0 1.8 7.91 3180 1665 A 40 VAL HB A 41 GLY H 1.0 1.8 4.96 3181 1666 A 62 PHE HDy A 41 GLY H 1.0 1.8 6.17 3182 1666 A 62 PHE HDx A 41 GLY H 1.0 1.8 6.17 3183 1667 A 62 PHE HA A 41 GLY H 1.0 1.8 4.79 3184 1668 A 40 VAL HA A 41 GLY H 1.0 1.8 3.97 3185 1669 A 39 ARG HGy A 41 GLY H 1.0 1.8 5.62 3186 1669 A 39 ARG HGx A 41 GLY H 1.0 1.8 5.62 3187 1670 A 40 VAL HGx% A 41 GLY H 1.0 1.8 5.35 3188 1670 A 40 VAL HGy% A 41 GLY H 1.0 1.8 5.35 3189 1671 A 39 ARG HGy A 41 GLY H 1.0 1.8 5.75 3190 1671 A 39 ARG HGx A 41 GLY H 1.0 1.8 5.75 3191 1672 A 40 VAL H A 41 GLY H 1.0 1.8 5.32 3192 1673 A 31 ARG HA A 33 VAL H 1.0 1.8 5.87 3193 1674 A 35 GLU H A 33 VAL H 1.0 1.8 4.57 3194 1675 A 34 PHE H A 33 VAL H 1.0 1.8 3.90 3195 1676 A 33 VAL H A 30 LEU H 1.0 1.8 5.54 3196 1677 A 30 LEU HA A 33 VAL H 1.0 1.8 4.48 3197 1678 A 32 ARG HDy A 33 VAL H 1.0 1.8 5.41 3198 1678 A 32 ARG HDx A 33 VAL H 1.0 1.8 5.41 3199 1679 A 33 VAL HB A 33 VAL H 1.0 1.8 4.15 3200 1680 A 32 ARG HBy A 33 VAL H 1.0 1.8 4.39 3201 1680 A 32 ARG HBx A 33 VAL H 1.0 1.8 4.39 3202 1681 A 32 ARG HGy A 33 VAL H 1.0 1.8 5.41 3203 1681 A 32 ARG HGx A 33 VAL H 1.0 1.8 5.41 3204 1682 A 31 ARG HGy A 33 VAL H 1.0 1.8 6.67 3205 1682 A 31 ARG HGx A 33 VAL H 1.0 1.8 6.67 3206 1683 A 29 THR HG2% A 33 VAL H 1.0 1.8 6.26 3207 1684 A 33 VAL HGy% A 33 VAL H 1.0 1.8 5.49 3208 1684 A 33 VAL HGx% A 33 VAL H 1.0 1.8 5.49 3209 1685 A 34 PHE HBx A 33 VAL H 1.0 1.8 5.58 3210 1686 A 22 THR H A 21 LEU H 1.0 1.8 5.06 3211 1687 A 57 PHE HA A 21 LEU H 1.0 1.8 4.94 3212 1688 A 57 PHE HBy A 21 LEU H 1.0 1.8 6.39 3213 1688 A 57 PHE HBx A 21 LEU H 1.0 1.8 6.39 3214 1689 A 21 LEU HG A 21 LEU H 1.0 1.8 4.50 3215 1690 A 21 LEU HBy A 21 LEU H 1.0 1.8 4.56 3216 1690 A 21 LEU HBx A 21 LEU H 1.0 1.8 4.56 3217 1691 A 21 LEU HBy A 21 LEU H 1.0 1.8 4.92 3218 1691 A 21 LEU HBx A 21 LEU H 1.0 1.8 4.92 3219 1692 A 34 PHE HA A 33 VAL H 1.0 1.8 6.00 3220 1693 A 20 ASN H A 21 LEU H 1.0 1.8 4.21 3221 1694 A 19 ASP HA A 21 LEU H 1.0 1.8 5.29 3222 1695 A 20 ASN HBy A 21 LEU H 1.0 1.8 5.11 3223 1696 A 19 ASP HBy A 21 LEU H 1.0 1.8 6.24 3224 1696 A 19 ASP HBx A 21 LEU H 1.0 1.8 6.24 3225 1697 A 20 ASN HBx A 21 LEU H 1.0 1.8 5.92 3226 1698 A 21 LEU HDy% A 21 LEU H 1.0 1.8 5.30 3227 1698 A 21 LEU HDx% A 21 LEU H 1.0 1.8 5.30 3228 1699 A 35 GLU H A 37 TYR H 1.0 1.8 4.97 3229 1700 A 37 TYR HDy A 37 TYR H 1.0 1.8 4.08 3230 1700 A 37 TYR HDx A 37 TYR H 1.0 1.8 4.08 3231 1701 A 62 PHE HEy A 37 TYR H 1.0 1.8 5.90 3232 1701 A 62 PHE HEx A 37 TYR H 1.0 1.8 5.90 3233 1702 A 37 TYR HEy A 37 TYR H 1.0 1.8 5.36 3234 1702 A 37 TYR HEx A 37 TYR H 1.0 1.8 5.36 3235 1703 A 35 GLU HA A 37 TYR H 1.0 1.8 4.77 3236 1704 A 34 PHE HA A 37 TYR H 1.0 1.8 4.68 3237 1705 A 37 TYR HBx A 37 TYR H 1.0 1.8 4.13 3238 1706 A 37 TYR HBy A 37 TYR H 1.0 1.8 4.31 3239 1707 A 36 LYS HBy A 37 TYR H 1.0 1.8 4.44 3240 1708 A 71 ALA HB% A 37 TYR H 1.0 1.8 7.08 3241 1709 A 36 LYS HGy A 37 TYR H 1.0 1.8 5.18 3242 1709 A 36 LYS HGx A 37 TYR H 1.0 1.8 5.18 3243 1710 A 36 LYS HGy A 37 TYR H 1.0 1.8 5.85 3244 1710 A 36 LYS HGx A 37 TYR H 1.0 1.8 5.85 3245 1711 A 40 VAL HGy% A 37 TYR H 1.0 1.8 7.91 3246 1711 A 40 VAL HGx% A 37 TYR H 1.0 1.8 7.91 3247 1712 A 38 GLY HAy A 37 TYR H 1.0 1.8 6.21 3248 1712 A 38 GLY HAx A 37 TYR H 1.0 1.8 6.21 3249 1713 A 24 ARG H A 23 TYR H 1.0 1.8 4.56 3250 1714 A 23 TYR HDy A 24 ARG H 1.0 1.8 5.28 3251 1714 A 23 TYR HDx A 24 ARG H 1.0 1.8 5.28 3252 1715 A 24 ARG HBy A 24 ARG H 1.0 1.8 4.44 3253 1716 A 24 ARG HGy A 24 ARG H 1.0 1.8 4.54 3254 1716 A 24 ARG HGx A 24 ARG H 1.0 1.8 4.54 3255 1717 A 25 THR HG2% A 24 ARG H 1.0 1.8 7.11 3256 1718 A 24 ARG H A 22 THR H 1.0 1.8 5.40 3257 1719 A 22 THR HB A 24 ARG H 1.0 1.8 4.28 3258 1720 A 25 THR HB A 24 ARG H 1.0 1.8 5.72 3259 1721 A 24 ARG HDy A 24 ARG H 1.0 1.8 4.86 3260 1721 A 24 ARG HDx A 24 ARG H 1.0 1.8 4.86 3261 1722 A 24 ARG HBx A 24 ARG H 1.0 1.8 3.95 3262 1723 A 22 THR HG2% A 24 ARG H 1.0 1.8 5.58 3263 1724 A 24 ARG H A 23 TYR HBy 1.0 1.8 5.43 3264 1724 A 24 ARG H A 23 TYR HBx 1.0 1.8 5.43 3265 1725 A 52 LYS H A 50 TYR HA 1.0 1.8 5.56 3266 1726 A 48 ASP HBy A 52 LYS H 1.0 1.8 5.16 3267 1726 A 48 ASP HBx A 52 LYS H 1.0 1.8 5.16 3268 1727 A 48 ASP HA A 52 LYS H 1.0 1.8 5.36 3269 1728 A 49 ARG HA A 52 LYS H 1.0 1.8 5.37 3270 1729 A 52 LYS H A 51 THR H 1.0 1.8 4.04 3271 1730 A 52 LYS H A 53 GLU H 1.0 1.8 4.03 3272 1731 A 48 ASP HBy A 52 LYS H 1.0 1.8 4.66 3273 1731 A 48 ASP HBx A 52 LYS H 1.0 1.8 4.66 3274 1732 A 52 LYS H A 52 LYS HBy 1.0 1.8 4.80 3275 1732 A 52 LYS H A 52 LYS HBx 1.0 1.8 4.80 3276 1733 A 52 LYS H A 52 LYS HBy 1.0 1.8 5.23 3277 1733 A 52 LYS H A 52 LYS HBx 1.0 1.8 5.23 3278 1734 A 47 ARG HGy A 52 LYS H 1.0 1.8 6.13 3279 1734 A 47 ARG HGx A 52 LYS H 1.0 1.8 6.13 3280 1735 A 51 THR HG2% A 52 LYS H 1.0 1.8 5.94 3281 1736 A 52 LYS H A 48 ASP H 1.0 1.8 4.85 3282 1737 A 52 LYS H A 53 GLU HBy 1.0 1.8 6.67 3283 1737 A 52 LYS H A 53 GLU HBx 1.0 1.8 6.67 3284 1738 A 57 PHE H A 58 ALA H 1.0 1.8 4.82 3285 1739 A 57 PHE HDy A 57 PHE H 1.0 1.8 4.51 3286 1739 A 57 PHE HDx A 57 PHE H 1.0 1.8 4.51 3287 1740 A 55 ARG HA A 57 PHE H 1.0 1.8 5.41 3288 1741 A 45 ILE HG1y A 57 PHE H 1.0 1.8 6.67 3289 1741 A 45 ILE HG1x A 57 PHE H 1.0 1.8 6.67 3290 1742 A 45 ILE HG2% A 57 PHE H 1.0 1.8 5.54 3291 1743 A 21 LEU HDx% A 57 PHE H 1.0 1.8 6.00 3292 1743 A 21 LEU HDy% A 57 PHE H 1.0 1.8 6.00 3293 1744 A 57 PHE H A 56 GLY H 1.0 1.8 3.96 3294 1745 A 57 PHE HEy A 57 PHE H 1.0 1.8 6.24 3295 1745 A 57 PHE HEx A 57 PHE H 1.0 1.8 6.24 3296 1746 A 55 ARG HGy A 57 PHE H 1.0 1.8 6.48 3297 1746 A 55 ARG HGx A 57 PHE H 1.0 1.8 6.48 3298 1747 A 88 GLN HE2y A 88 GLN HGy 1.0 1.8 5.20 3299 1747 A 88 GLN HE2x A 88 GLN HGy 1.0 1.8 5.20 3300 1747 A 88 GLN HE2x A 88 GLN HGx 1.0 1.8 5.20 3301 1747 A 88 GLN HE2y A 88 GLN HGx 1.0 1.8 5.20 3302 1748 A 88 GLN HE2y A 88 GLN HBy 1.0 1.8 6.11 3303 1748 A 88 GLN HBx A 88 GLN HE2x 1.0 1.8 6.11 3304 1748 A 88 GLN HBx A 88 GLN HE2y 1.0 1.8 6.11 3305 1748 A 88 GLN HE2x A 88 GLN HBy 1.0 1.8 6.11 3306 1749 A 73 ASP HA A 75 MET H 1.0 1.8 5.62 3307 1750 A 72 MET HA A 75 MET H 1.0 1.8 4.62 3308 1751 A 75 MET HBy A 75 MET H 1.0 1.8 4.26 3309 1751 A 75 MET HBx A 75 MET H 1.0 1.8 4.26 3310 1752 A 75 MET HGy A 75 MET H 1.0 1.8 4.78 3311 1752 A 75 MET HGx A 75 MET H 1.0 1.8 4.78 3312 1753 A 75 MET HGy A 75 MET H 1.0 1.8 4.99 3313 1753 A 75 MET HGx A 75 MET H 1.0 1.8 4.99 3314 1754 A 74 ALA HB% A 75 MET H 1.0 1.8 4.19 3315 1755 A 88 GLN HE2x A 88 GLN H 1.0 1.8 5.91 3316 1755 A 88 GLN HE2y A 88 GLN H 1.0 1.8 5.91 3317 1756 A 88 GLN HE2x A 18 VAL HA 1.0 1.8 5.05 3318 1756 A 88 GLN HE2y A 18 VAL HA 1.0 1.8 5.05 3319 1757 A 88 GLN HE2x A 86 ARG HDy 1.0 1.8 6.70 3320 1757 A 88 GLN HE2y A 86 ARG HDy 1.0 1.8 6.70 3321 1757 A 88 GLN HE2x A 86 ARG HDx 1.0 1.8 6.70 3322 1757 A 88 GLN HE2y A 86 ARG HDx 1.0 1.8 6.70 3323 1758 A 88 GLN HE2y A 88 GLN HGy 1.0 1.8 4.90 3324 1758 A 88 GLN HE2x A 88 GLN HGy 1.0 1.8 4.90 3325 1758 A 88 GLN HE2x A 88 GLN HGx 1.0 1.8 4.90 3326 1758 A 88 GLN HE2y A 88 GLN HGx 1.0 1.8 4.90 3327 1759 A 88 GLN HE2y A 88 GLN HBy 1.0 1.8 5.88 3328 1759 A 88 GLN HBx A 88 GLN HE2x 1.0 1.8 5.88 3329 1759 A 88 GLN HBx A 88 GLN HE2y 1.0 1.8 5.88 3330 1759 A 88 GLN HE2x A 88 GLN HBy 1.0 1.8 5.88 3331 1760 A 88 GLN HE2y A 88 GLN HBy 1.0 1.8 6.77 3332 1760 A 88 GLN HBx A 88 GLN HE2x 1.0 1.8 6.77 3333 1760 A 88 GLN HBx A 88 GLN HE2y 1.0 1.8 6.77 3334 1760 A 88 GLN HE2x A 88 GLN HBy 1.0 1.8 6.77 3335 1761 A 88 GLN HE2x A 87 VAL HGy% 1.0 1.8 8.82 3336 1761 A 88 GLN HE2x A 87 VAL HGx% 1.0 1.8 8.82 3337 1761 A 88 GLN HE2y A 87 VAL HGy% 1.0 1.8 8.82 3338 1761 A 88 GLN HE2y A 87 VAL HGx% 1.0 1.8 8.82 3339 1762 A 88 GLN HE2x A 87 VAL HGy% 1.0 1.8 8.82 3340 1762 A 88 GLN HE2x A 87 VAL HGx% 1.0 1.8 8.82 3341 1762 A 88 GLN HE2y A 87 VAL HGy% 1.0 1.8 8.82 3342 1762 A 88 GLN HE2y A 87 VAL HGx% 1.0 1.8 8.82 3343 1763 A 88 GLN HE2x A 18 VAL HA 1.0 1.8 5.14 3344 1763 A 88 GLN HE2y A 18 VAL HA 1.0 1.8 5.14 3345 1764 A 88 GLN HE2x A 86 ARG HDy 1.0 1.8 7.16 3346 1764 A 88 GLN HE2y A 86 ARG HDy 1.0 1.8 7.16 3347 1764 A 88 GLN HE2x A 86 ARG HDx 1.0 1.8 7.16 3348 1764 A 88 GLN HE2y A 86 ARG HDx 1.0 1.8 7.16 3349 1765 A 37 TYR HEy A 75 MET H 1.0 1.8 5.67 3350 1765 A 37 TYR HEx A 75 MET H 1.0 1.8 5.67 3351 1766 A 76 ASP HBy A 75 MET H 1.0 1.8 5.62 3352 1766 A 76 ASP HBx A 75 MET H 1.0 1.8 5.62 3353 1767 A 71 ALA HA A 75 MET H 1.0 1.8 5.05 3354 1768 A 71 ALA HB% A 75 MET H 1.0 1.8 6.50 3355 1769 A 19 ASP HBy A 20 ASN H 1.0 1.8 5.30 3356 1769 A 19 ASP HBx A 20 ASN H 1.0 1.8 5.30 3357 1770 A 57 PHE HA A 20 ASN H 1.0 1.8 5.18 3358 1771 A 81 ASP HBy A 22 THR H 1.0 1.8 6.65 3359 1771 A 81 ASP HBx A 22 THR H 1.0 1.8 6.65 3360 1772 A 20 ASN HD2x A 21 LEU H 1.0 1.8 6.28 3361 1772 A 20 ASN HD2y A 21 LEU H 1.0 1.8 6.28 3362 1773 A 20 ASN HD2x A 20 ASN HBy 1.0 1.8 4.48 3363 1773 A 20 ASN HD2y A 20 ASN HBy 1.0 1.8 4.48 3364 1774 A 20 ASN HD2x A 83 ARG HGy 1.0 1.8 6.03 3365 1774 A 20 ASN HD2y A 83 ARG HGy 1.0 1.8 6.03 3366 1775 A 20 ASN HD2x A 20 ASN HA 1.0 1.8 5.09 3367 1775 A 20 ASN HD2y A 20 ASN HA 1.0 1.8 5.09 3368 1776 A 20 ASN HD2x A 85 LEU HA 1.0 1.8 5.72 3369 1776 A 20 ASN HD2y A 85 LEU HA 1.0 1.8 5.72 3370 1777 A 20 ASN HD2x A 85 LEU H 1.0 1.8 6.67 3371 1777 A 20 ASN HD2y A 85 LEU H 1.0 1.8 6.67 3372 1778 A 20 ASN HD2x A 20 ASN HA 1.0 1.8 5.12 3373 1778 A 20 ASN HD2y A 20 ASN HA 1.0 1.8 5.12 3374 1779 A 20 ASN HD2x A 20 ASN HBy 1.0 1.8 4.59 3375 1779 A 20 ASN HD2y A 20 ASN HBy 1.0 1.8 4.59 3376 1780 A 20 ASN HD2x A 83 ARG HDx 1.0 1.8 5.84 3377 1780 A 20 ASN HD2y A 83 ARG HDy 1.0 1.8 5.84 3378 1780 A 20 ASN HD2y A 83 ARG HDx 1.0 1.8 5.84 3379 1780 A 20 ASN HD2x A 83 ARG HDy 1.0 1.8 5.84 3380 1781 A 20 ASN HD2x A 84 GLU HBx 1.0 1.8 4.61 3381 1781 A 20 ASN HD2y A 84 GLU HBx 1.0 1.8 4.61 3382 1782 A 20 ASN HD2x A 83 ARG HGy 1.0 1.8 6.01 3383 1782 A 20 ASN HD2y A 83 ARG HGy 1.0 1.8 6.01 3384 1783 A 20 ASN HD2y A 85 LEU HDx% 1.0 1.8 8.10 3385 1783 A 20 ASN HD2x A 85 LEU HDy% 1.0 1.8 8.10 3386 1783 A 20 ASN HD2x A 85 LEU HDx% 1.0 1.8 8.10 3387 1783 A 20 ASN HD2y A 85 LEU HDy% 1.0 1.8 8.10 3388 1784 A 20 ASN HD2x A 83 ARG HBy 1.0 1.8 5.51 3389 1784 A 20 ASN HD2y A 83 ARG HBy 1.0 1.8 5.51 3390 1784 A 20 ASN HD2y A 83 ARG HBx 1.0 1.8 5.51 3391 1784 A 20 ASN HD2x A 83 ARG HBx 1.0 1.8 5.51 3392 1785 A 20 ASN HD2x A 84 GLU HBy 1.0 1.8 5.44 3393 1785 A 20 ASN HD2y A 84 GLU HBy 1.0 1.8 5.44 3394 1786 A 25 THR HB A 22 THR H 1.0 1.8 4.80 3395 1787 A 21 LEU HA A 22 THR H 1.0 1.8 3.46 3396 1788 A 24 ARG HBx A 22 THR H 1.0 1.8 6.00 3397 1789 A 22 THR H A 83 ARG HGy 1.0 1.8 6.00 3398 1790 A 21 LEU HG A 22 THR H 1.0 1.8 6.00 3399 1791 A 80 LEU HG A 22 THR H 1.0 1.8 6.00 3400 1792 A 83 ARG HGx A 22 THR H 1.0 1.8 6.00 3401 1793 A 22 THR HG2% A 22 THR H 1.0 1.8 4.07 3402 1794 A 21 LEU HBy A 22 THR H 1.0 1.8 4.77 3403 1794 A 21 LEU HBx A 22 THR H 1.0 1.8 4.77 3404 1795 A 25 THR HG2% A 22 THR H 1.0 1.8 6.13 3405 1796 A 21 LEU HDy% A 22 THR H 1.0 1.8 5.04 3406 1796 A 21 LEU HDx% A 22 THR H 1.0 1.8 5.04 3407 1797 A 21 LEU HDy% A 22 THR H 1.0 1.8 7.01 3408 1797 A 21 LEU HDx% A 22 THR H 1.0 1.8 7.01 3409 1798 A 20 ASN HD2y A 85 LEU HDx% 1.0 1.8 7.25 3410 1798 A 20 ASN HD2x A 85 LEU HDy% 1.0 1.8 7.25 3411 1798 A 20 ASN HD2x A 85 LEU HDx% 1.0 1.8 7.25 3412 1798 A 20 ASN HD2y A 85 LEU HDy% 1.0 1.8 7.25 3413 1799 A 20 ASN HD2x A 83 ARG HDx 1.0 1.8 6.13 3414 1799 A 20 ASN HD2y A 83 ARG HDy 1.0 1.8 6.13 3415 1799 A 20 ASN HD2y A 83 ARG HDx 1.0 1.8 6.13 3416 1799 A 20 ASN HD2x A 83 ARG HDy 1.0 1.8 6.13 3417 1800 A 20 ASN HD2x A 20 ASN HBx 1.0 1.8 4.74 3418 1800 A 20 ASN HD2y A 20 ASN HBx 1.0 1.8 4.74 3419 1801 A 20 ASN HD2x A 84 GLU HBx 1.0 1.8 4.82 3420 1801 A 20 ASN HD2y A 84 GLU HBx 1.0 1.8 4.82 3421 1802 A 20 ASN HD2x A 83 ARG HBy 1.0 1.8 5.79 3422 1802 A 20 ASN HD2y A 83 ARG HBy 1.0 1.8 5.79 3423 1802 A 20 ASN HD2y A 83 ARG HBx 1.0 1.8 5.79 3424 1802 A 20 ASN HD2x A 83 ARG HBx 1.0 1.8 5.79 3425 1803 A 20 ASN HD2x A 84 GLU HBy 1.0 1.8 5.90 3426 1803 A 20 ASN HD2y A 84 GLU HBy 1.0 1.8 5.90 3427 1804 A 20 ASN HD2x A 86 ARG H 1.0 1.8 6.39 3428 1804 A 20 ASN HD2y A 86 ARG H 1.0 1.8 6.39 3429 1805 A 52 LYS HA A 47 ARG HE 1.0 1.8 5.86 3430 1806 A 45 ILE HG2% A 47 ARG HE 1.0 1.8 6.54 3431 1807 A 66 ARG H A 66 ARG HE 1.0 1.8 5.45 3432 1808 A 66 ARG HA A 66 ARG HE 1.0 1.8 5.34 3433 1809 A 66 ARG HBy A 66 ARG HE 1.0 1.8 4.61 3434 1809 A 66 ARG HBx A 66 ARG HE 1.0 1.8 4.61 3435 1810 A 66 ARG HGy A 66 ARG HE 1.0 1.8 4.37 3436 1810 A 66 ARG HGx A 66 ARG HE 1.0 1.8 4.37 3437 1811 A 51 THR HB A 51 THR H 1.0 1.8 4.54 3438 1812 A 52 LYS HA A 51 THR H 1.0 1.8 4.72 3439 1813 A 48 ASP HBy A 51 THR H 1.0 1.8 5.03 3440 1813 A 48 ASP HBx A 51 THR H 1.0 1.8 5.03 3441 1814 A 50 TYR HBy A 51 THR H 1.0 1.8 5.25 3442 1814 A 50 TYR HBx A 51 THR H 1.0 1.8 5.25 3443 1815 A 48 ASP HBy A 51 THR H 1.0 1.8 5.41 3444 1815 A 48 ASP HBx A 51 THR H 1.0 1.8 5.41 3445 1816 A 51 THR HG2% A 51 THR H 1.0 1.8 4.32 3446 1817 A 24 ARG HBy A 24 ARG HE 1.0 1.8 5.48 3447 1818 A 24 ARG HBx A 24 ARG HE 1.0 1.8 5.21 3448 1819 A 86 ARG HA A 86 ARG HE 1.0 1.8 5.17 3449 1820 A 20 ASN HBx A 86 ARG HE 1.0 1.8 6.00 3450 1821 A 86 ARG HBx A 86 ARG HE 1.0 1.8 5.29 3451 1822 A 3 TYR HA A 4 GLY H 1.0 1.8 3.37 3452 1823 A 94 ARG HBy A 94 ARG HE 1.0 1.8 5.14 3453 1823 A 94 ARG HBx A 94 ARG HE 1.0 1.8 5.14 3454 1824 A 5 ARG H A 4 GLY H 1.0 1.8 4.97 3455 1825 A 3 TYR HDy A 4 GLY H 1.0 1.8 5.83 3456 1825 A 3 TYR HDx A 4 GLY H 1.0 1.8 5.83 3457 1826 A 4 GLY H A 3 TYR HBy 1.0 1.8 5.14 3458 1826 A 4 GLY H A 3 TYR HBx 1.0 1.8 5.14 3459 1827 A 4 GLY H A 3 TYR HBy 1.0 1.8 5.34 3460 1827 A 4 GLY H A 3 TYR HBx 1.0 1.8 5.34 3461 1828 A 92 TYR HDy A 93 GLY H 1.0 1.8 5.72 3462 1828 A 92 TYR HDx A 93 GLY H 1.0 1.8 5.72 3463 1829 A 92 TYR HA A 93 GLY H 1.0 1.8 3.95 3464 1830 A 93 GLY H A 92 TYR HBy 1.0 1.8 5.07 3465 1830 A 93 GLY H A 92 TYR HBx 1.0 1.8 5.07 3466 1831 A 93 GLY H A 92 TYR HBy 1.0 1.8 5.10 3467 1831 A 93 GLY H A 92 TYR HBx 1.0 1.8 5.10 3468 1832 A 83 ARG HA A 83 ARG HE 1.0 1.8 6.00 3469 1833 A 22 THR HG2% A 83 ARG HE 1.0 1.8 6.00 3470 1834 A 83 ARG HBy A 83 ARG HE 1.0 1.8 6.08 3471 1834 A 83 ARG HBx A 83 ARG HE 1.0 1.8 6.08 3472 1835 A 94 ARG HBy A 93 GLY H 1.0 1.8 6.53 3473 1835 A 94 ARG HBx A 93 GLY H 1.0 1.8 6.53 3474 1836 A 55 ARG HBy A 55 ARG HE 1.0 1.8 5.92 3475 1836 A 55 ARG HBx A 55 ARG HE 1.0 1.8 5.92 3476 1837 A 31 ARG HA A 31 ARG HE 1.0 1.8 5.93 3477 1838 A 31 ARG HBy A 31 ARG HE 1.0 1.8 5.35 3478 1838 A 31 ARG HBx A 31 ARG HE 1.0 1.8 5.35 3479 1839 A 43 VAL HGy% A 31 ARG HE 1.0 1.8 7.29 3480 1839 A 43 VAL HGx% A 31 ARG HE 1.0 1.8 7.29 3481 1840 A 31 ARG HGy A 31 ARG HE 1.0 1.8 5.18 3482 1840 A 31 ARG HGx A 31 ARG HE 1.0 1.8 5.18 3483 1841 A 10 VAL HB A 12 GLY H 1.0 1.8 6.00 3484 1842 A 13 MET HBy A 12 GLY H 1.0 1.8 6.67 3485 1842 A 13 MET HBx A 12 GLY H 1.0 1.8 6.67 3486 1843 A 13 MET H A 12 GLY H 1.0 1.8 4.27 3487 1844 A 9 ASP HA A 12 GLY H 1.0 1.8 5.73 3488 1845 A 11 GLU HBy A 12 GLY H 1.0 1.8 4.56 3489 1845 A 11 GLU HBx A 12 GLY H 1.0 1.8 4.56 3490 1846 A 10 VAL HGx% A 12 GLY H 1.0 1.8 7.55 3491 1846 A 10 VAL HG21 A 12 GLY H 1.0 1.8 7.55 3492 1847 A 11 GLU H A 12 GLY H 1.0 1.8 4.27 3493 1848 A 10 VAL HA A 12 GLY H 1.0 1.8 4.50 3494 1849 A 13 MET HBy A 12 GLY H 1.0 1.8 5.80 3495 1849 A 13 MET HBx A 12 GLY H 1.0 1.8 5.80 3496 1850 A 11 GLU HGy A 12 GLY H 1.0 1.8 5.20 3497 1850 A 11 GLU HGx A 12 GLY H 1.0 1.8 5.20 3498 1851 A 47 ARG HDy A 56 GLY H 1.0 1.8 6.67 3499 1851 A 47 ARG HDx A 56 GLY H 1.0 1.8 6.67 3500 1852 A 55 ARG HDy A 56 GLY H 1.0 1.8 6.67 3501 1852 A 55 ARG HDx A 56 GLY H 1.0 1.8 6.67 3502 1853 A 57 PHE HDy A 56 GLY H 1.0 1.8 5.81 3503 1853 A 57 PHE HDx A 56 GLY H 1.0 1.8 5.81 3504 1854 A 54 SER HBy A 56 GLY H 1.0 1.8 6.01 3505 1854 A 54 SER HBx A 56 GLY H 1.0 1.8 6.01 3506 1855 A 54 SER HBy A 56 GLY H 1.0 1.8 6.63 3507 1855 A 54 SER HBx A 56 GLY H 1.0 1.8 6.63 3508 1856 A 55 ARG HBy A 56 GLY H 1.0 1.8 5.92 3509 1856 A 55 ARG HBx A 56 GLY H 1.0 1.8 5.92 3510 1857 A 18 VAL H A 17 LYS HGy 1.0 1.8 5.55 3511 1857 A 18 VAL H A 17 LYS HGx 1.0 1.8 5.55 3512 1858 A 20 ASN H A 19 ASP H 1.0 1.8 5.18 3513 1859 A 22 THR HB A 25 THR H 1.0 1.8 5.45 3514 1860 A 23 TYR HA A 25 THR H 1.0 1.8 5.67 3515 1861 A 62 PHE HEy A 39 ARG H 1.0 1.8 6.29 3516 1861 A 62 PHE HEx A 39 ARG H 1.0 1.8 6.29 3517 1862 A 60 VAL HGy% A 31 ARG H 1.0 1.8 7.91 3518 1862 A 60 VAL HGx% A 31 ARG H 1.0 1.8 7.91 3519 1863 A 68 ALA H A 67 ASP HBy 1.0 1.8 4.99 3520 1863 A 68 ALA H A 67 ASP HBx 1.0 1.8 4.99 3521 1864 A 70 ASP H A 67 ASP H 1.0 1.8 5.57 3522 1865 A 86 ARG HBy A 87 VAL H 1.0 1.8 4.87 3523 1866 A 58 ALA H A 59 PHE H 1.0 1.8 5.09 3524 1867 A 63 HIS HE1 A 41 GLY HAy 1.0 1.8 6.67 3525 1867 A 63 HIS HE1 A 41 GLY HAx 1.0 1.8 6.67 3526 1868 A 63 HIS HE1 A 63 HIS HBy 1.0 1.8 6.30 3527 1868 A 63 HIS HE1 A 63 HIS HBx 1.0 1.8 6.30 3528 1869 A 99 HIS HBy A 99 HIS HE1 1.0 1.8 6.10 3529 1869 A 99 HIS HBx A 99 HIS HE1 1.0 1.8 6.10 3530 1870 A 92 TYR HDy A 92 TYR HA 1.0 1.8 4.60 3531 1870 A 92 TYR HDx A 92 TYR HA 1.0 1.8 4.60 3532 1871 A 50 TYR HDy A 51 THR H 1.0 1.8 5.29 3533 1871 A 50 TYR HDx A 51 THR H 1.0 1.8 5.29 3534 1872 A 50 TYR HDy A 50 TYR H 1.0 1.8 4.62 3535 1872 A 50 TYR HDx A 50 TYR H 1.0 1.8 4.62 3536 1873 A 50 TYR HDy A 50 TYR HA 1.0 1.8 3.96 3537 1873 A 50 TYR HDx A 50 TYR HA 1.0 1.8 3.96 3538 1874 A 3 TYR HDy A 3 TYR HA 1.0 1.8 4.06 3539 1874 A 3 TYR HDx A 3 TYR HA 1.0 1.8 4.06 3540 1875 A 3 TYR HDy A 2 SER HA 1.0 1.8 6.17 3541 1875 A 3 TYR HDx A 2 SER HA 1.0 1.8 6.17 3542 1876 A 3 TYR HDx A 2 SER HBy 1.0 1.8 6.14 3543 1876 A 3 TYR HDy A 2 SER HBx 1.0 1.8 6.14 3544 1876 A 3 TYR HDx A 2 SER HBx 1.0 1.8 6.14 3545 1876 A 3 TYR HDy A 2 SER HBy 1.0 1.8 6.14 3546 1877 A 37 TYR HDy A 34 PHE HA 1.0 1.8 4.42 3547 1877 A 37 TYR HDx A 34 PHE HA 1.0 1.8 4.42 3548 1878 A 37 TYR HDx A 75 MET HE% 1.0 1.8 6.38 3549 1878 A 37 TYR HDy A 75 MET HE% 1.0 1.8 6.38 3550 1879 A 24 ARG HDy A 23 TYR HDy 1.0 1.8 5.22 3551 1879 A 24 ARG HDx A 23 TYR HDy 1.0 1.8 5.22 3552 1879 A 24 ARG HDy A 23 TYR HDx 1.0 1.8 5.22 3553 1879 A 24 ARG HDx A 23 TYR HDx 1.0 1.8 5.22 3554 1880 A 22 THR HG2% A 23 TYR HDx 1.0 1.8 7.04 3555 1880 A 22 THR HG2% A 23 TYR HDy 1.0 1.8 7.04 3556 1881 A 24 ARG HGy A 23 TYR HDy 1.0 1.8 7.30 3557 1881 A 24 ARG HGx A 23 TYR HDy 1.0 1.8 7.30 3558 1881 A 24 ARG HGy A 23 TYR HDx 1.0 1.8 7.30 3559 1881 A 24 ARG HGx A 23 TYR HDx 1.0 1.8 7.30 3560 1882 A 24 ARG HGy A 23 TYR HDy 1.0 1.8 6.71 3561 1882 A 24 ARG HGx A 23 TYR HDy 1.0 1.8 6.71 3562 1882 A 24 ARG HGy A 23 TYR HDx 1.0 1.8 6.71 3563 1882 A 24 ARG HGx A 23 TYR HDx 1.0 1.8 6.71 3564 1883 A 57 PHE HDy A 20 ASN H 1.0 1.8 6.56 3565 1883 A 57 PHE HDx A 20 ASN H 1.0 1.8 6.56 3566 1884 A 57 PHE HA A 57 PHE HDy 1.0 1.8 5.17 3567 1884 A 57 PHE HA A 57 PHE HDx 1.0 1.8 5.17 3568 1885 A 34 PHE HDy A 35 GLU H 1.0 1.8 5.94 3569 1885 A 34 PHE HDx A 35 GLU H 1.0 1.8 5.94 3570 1886 A 34 PHE HDy A 34 PHE HA 1.0 1.8 4.90 3571 1886 A 34 PHE HDx A 34 PHE HA 1.0 1.8 4.90 3572 1887 A 34 PHE HDy A 30 LEU HBy 1.0 1.8 4.46 3573 1887 A 34 PHE HDx A 30 LEU HBy 1.0 1.8 4.46 3574 1888 A 62 PHE HDy A 39 ARG H 1.0 1.8 5.67 3575 1888 A 62 PHE HDx A 39 ARG H 1.0 1.8 5.67 3576 1889 A 62 PHE HDy A 68 ALA H 1.0 1.8 5.72 3577 1889 A 62 PHE HDx A 68 ALA H 1.0 1.8 5.72 3578 1890 A 62 PHE HDx A 38 GLY HAy 1.0 1.8 5.98 3579 1890 A 62 PHE HDy A 38 GLY HAy 1.0 1.8 5.98 3580 1890 A 62 PHE HDy A 38 GLY HAx 1.0 1.8 5.98 3581 1890 A 62 PHE HDx A 38 GLY HAx 1.0 1.8 5.98 3582 1891 A 62 PHE HDx A 38 GLY HAy 1.0 1.8 7.43 3583 1891 A 62 PHE HDy A 38 GLY HAy 1.0 1.8 7.43 3584 1891 A 62 PHE HDy A 38 GLY HAx 1.0 1.8 7.43 3585 1891 A 62 PHE HDx A 38 GLY HAx 1.0 1.8 7.43 3586 1892 A 62 PHE HDy A 67 ASP HBx 1.0 1.8 5.96 3587 1892 A 62 PHE HDy A 67 ASP HBy 1.0 1.8 5.96 3588 1892 A 62 PHE HDx A 67 ASP HBy 1.0 1.8 5.96 3589 1892 A 62 PHE HDx A 67 ASP HBx 1.0 1.8 5.96 3590 1893 A 62 PHE HDy A 67 ASP HBx 1.0 1.8 5.80 3591 1893 A 62 PHE HDy A 67 ASP HBy 1.0 1.8 5.80 3592 1893 A 62 PHE HDx A 67 ASP HBy 1.0 1.8 5.80 3593 1893 A 62 PHE HDx A 67 ASP HBx 1.0 1.8 5.80 3594 1894 A 62 PHE HDx A 71 ALA HB% 1.0 1.8 6.81 3595 1894 A 62 PHE HDy A 71 ALA HB% 1.0 1.8 6.81 3596 1895 A 62 PHE HDy A 16 LEU HDy% 1.0 1.8 6.46 3597 1895 A 62 PHE HDy A 16 LEU HDx% 1.0 1.8 6.46 3598 1895 A 62 PHE HDx A 16 LEU HDx% 1.0 1.8 6.46 3599 1895 A 62 PHE HDx A 16 LEU HDy% 1.0 1.8 6.46 3600 1896 A 40 VAL HGx% A 62 PHE HDx 1.0 1.8 8.10 3601 1896 A 40 VAL HGx% A 62 PHE HDy 1.0 1.8 8.10 3602 1896 A 40 VAL HGy% A 62 PHE HDx 1.0 1.8 8.10 3603 1896 A 40 VAL HGy% A 62 PHE HDy 1.0 1.8 8.10 3604 1897 A 62 PHE HDy A 61 ARG HA 1.0 1.8 5.79 3605 1897 A 62 PHE HDx A 61 ARG HA 1.0 1.8 5.79 3606 1898 A 59 PHE HDy A 17 LYS HA 1.0 1.8 5.23 3607 1898 A 59 PHE HDx A 17 LYS HA 1.0 1.8 5.23 3608 1899 A 44 TYR HDy A 44 TYR H 1.0 1.8 5.72 3609 1899 A 44 TYR HDx A 44 TYR H 1.0 1.8 5.72 3610 1900 A 62 PHE HEx A 38 GLY HAy 1.0 1.8 6.09 3611 1900 A 62 PHE HEy A 38 GLY HAy 1.0 1.8 6.09 3612 1900 A 62 PHE HEy A 38 GLY HAx 1.0 1.8 6.09 3613 1900 A 62 PHE HEx A 38 GLY HAx 1.0 1.8 6.09 3614 1901 A 34 PHE HBy A 62 PHE HEy 1.0 1.8 5.70 3615 1901 A 34 PHE HBy A 62 PHE HEx 1.0 1.8 5.70 3616 1902 A 62 PHE HEy A 67 ASP HBx 1.0 1.8 6.72 3617 1902 A 62 PHE HEy A 67 ASP HBy 1.0 1.8 6.72 3618 1902 A 62 PHE HEx A 67 ASP HBy 1.0 1.8 6.72 3619 1902 A 62 PHE HEx A 67 ASP HBx 1.0 1.8 6.72 3620 1903 A 17 LYS HBx A 59 PHE HDy 1.0 1.8 4.92 3621 1903 A 17 LYS HBx A 59 PHE HDx 1.0 1.8 4.92 3622 1904 A 57 PHE HEy A 59 PHE HDx 1.0 1.8 5.91 3623 1904 A 57 PHE HEy A 59 PHE HDy 1.0 1.8 5.91 3624 1904 A 57 PHE HEx A 59 PHE HDy 1.0 1.8 5.91 3625 1904 A 57 PHE HEx A 59 PHE HDx 1.0 1.8 5.91 3626 1905 A 34 PHE HEy A 75 MET HA 1.0 1.8 6.67 3627 1905 A 34 PHE HEx A 75 MET HA 1.0 1.8 6.67 3628 1906 A 34 PHE HEy A 72 MET HA 1.0 1.8 6.52 3629 1906 A 34 PHE HEx A 72 MET HA 1.0 1.8 6.52 3630 1907 A 34 PHE HEy A 18 VAL HGx% 1.0 1.8 4.81 3631 1907 A 34 PHE HEx A 18 VAL HGx% 1.0 1.8 4.81 3632 1908 A 34 PHE HDy A 62 PHE HZ 1.0 1.8 4.84 3633 1908 A 34 PHE HDx A 62 PHE HZ 1.0 1.8 4.84 3634 1909 A 62 PHE HZ A 16 LEU HDx% 1.0 1.8 6.49 3635 1909 A 62 PHE HZ A 16 LEU HDy% 1.0 1.8 6.49 3636 1910 A 60 VAL HGx% A 62 PHE HZ 1.0 1.8 6.16 3637 1910 A 60 VAL HGy% A 62 PHE HZ 1.0 1.8 6.16 3638 1911 A 34 PHE HDy A 34 PHE HZ 1.0 1.8 4.99 3639 1911 A 34 PHE HDx A 34 PHE HZ 1.0 1.8 4.99 3640 1912 A 34 PHE HZ A 18 VAL HGx% 1.0 1.8 4.60 3641 1913 A 60 VAL HGx% A 34 PHE HZ 1.0 1.8 7.04 3642 1913 A 60 VAL HGy% A 34 PHE HZ 1.0 1.8 7.04 3643 1914 A 63 HIS HD2 A 63 HIS H 1.0 1.8 4.81 3644 1915 A 62 PHE HA A 63 HIS HD2 1.0 1.8 5.53 3645 1916 A 41 GLY HAy A 63 HIS HD2 1.0 1.8 4.79 3646 1916 A 41 GLY HAx A 63 HIS HD2 1.0 1.8 4.79 3647 1917 A 63 HIS HBy A 63 HIS HD2 1.0 1.8 4.81 3648 1917 A 63 HIS HBx A 63 HIS HD2 1.0 1.8 4.81 3649 1918 A 63 HIS HD2 A 39 ARG HDy 1.0 1.8 5.27 3650 1918 A 63 HIS HD2 A 39 ARG HDx 1.0 1.8 5.27 3651 1919 A 39 ARG HGy A 63 HIS HD2 1.0 1.8 5.14 3652 1919 A 39 ARG HGx A 63 HIS HD2 1.0 1.8 5.14 3653 1920 A 63 HIS HD2 A 41 GLY H 1.0 1.8 5.06 3654 1921 A 100 HIS HBy A 100 HIS HD2 1.0 1.8 4.35 3655 1921 A 100 HIS HBx A 100 HIS HD2 1.0 1.8 4.35 3656 1922 A 99 HIS HBy A 99 HIS HD2 1.0 1.8 4.09 3657 1922 A 99 HIS HBx A 99 HIS HD2 1.0 1.8 4.09 3658 1923 A 75 MET HBx A 37 TYR HEy 1.0 1.8 6.98 3659 1923 A 75 MET HBy A 37 TYR HEy 1.0 1.8 6.98 3660 1923 A 75 MET HBy A 37 TYR HEx 1.0 1.8 6.98 3661 1923 A 75 MET HBx A 37 TYR HEx 1.0 1.8 6.98 3662 1924 A 49 ARG HBy A 50 TYR HEy 1.0 1.8 7.43 3663 1924 A 49 ARG HBy A 50 TYR HEx 1.0 1.8 7.43 3664 1924 A 49 ARG HBx A 50 TYR HEy 1.0 1.8 7.43 3665 1924 A 49 ARG HBx A 50 TYR HEx 1.0 1.8 7.43 3666 1925 A 50 TYR HEy A 51 THR HG2% 1.0 1.8 7.91 3667 1925 A 50 TYR HEx A 51 THR HG2% 1.0 1.8 7.91 3668 1926 A 50 TYR HEx A 49 ARG HGy 1.0 1.8 6.23 3669 1926 A 50 TYR HEy A 49 ARG HGx 1.0 1.8 6.23 3670 1926 A 50 TYR HEx A 49 ARG HGx 1.0 1.8 6.23 3671 1926 A 50 TYR HEy A 49 ARG HGy 1.0 1.8 6.23 3672 1927 A 91 ARG HBy A 92 TYR HEx 1.0 1.8 6.61 3673 1927 A 91 ARG HBy A 92 TYR HEy 1.0 1.8 6.61 3674 1927 A 91 ARG HBx A 92 TYR HEy 1.0 1.8 6.61 3675 1927 A 91 ARG HBx A 92 TYR HEx 1.0 1.8 6.61 3676 1928 A 44 TYR HEy A 46 PRO HA 1.0 1.8 5.89 3677 1928 A 44 TYR HEx A 46 PRO HA 1.0 1.8 5.89 3678 1929 A 62 PHE HEy A 18 VAL HB 1.0 1.8 5.87 3679 1929 A 62 PHE HEx A 18 VAL HB 1.0 1.8 5.87 3680 1930 A 57 PHE HDy A 21 LEU HDy% 1.0 1.8 8.02 3681 1930 A 57 PHE HDx A 21 LEU HDy% 1.0 1.8 8.02 3682 1930 A 57 PHE HDy A 21 LEU HDx% 1.0 1.8 8.02 3683 1930 A 57 PHE HDx A 21 LEU HDx% 1.0 1.8 8.02 3684 1931 A 34 PHE HZ A 30 LEU HBy 1.0 1.8 6.00 3685 1932 A 71 ALA HB% A 34 PHE HZ 1.0 1.8 7.11 3686 1933 B 102 U H1' B 102 U H2' 1.0 1.8 4.50 3687 1934 B 102 U H1' B 102 U H3' 1.0 1.8 5.50 3688 1935 B 102 U H1' B 102 U H4' 1.0 1.8 4.50 3689 1936 B 102 U H1' B 102 U H5'' 1.0 1.8 6.67 3690 1936 B 102 U H1' B 102 U H5' 1.0 1.8 6.67 3691 1937 B 102 U H1' B 102 U H5 1.0 1.8 5.00 3692 1938 B 102 U H2' B 102 U H3' 1.0 1.8 4.00 3693 1939 B 102 U H3' B 102 U H4' 1.0 1.8 4.50 3694 1940 B 102 U H1' B 102 U H6 1.0 1.8 3.50 3695 1941 B 102 U H2' B 102 U H6 1.0 1.8 4.50 3696 1942 B 102 U H3' B 102 U H6 1.0 1.8 6.00 3697 1943 B 102 U H4' B 102 U H6 1.0 1.8 5.50 3698 1944 B 102 U H5'' B 102 U H6 1.0 1.8 6.67 3699 1944 B 102 U H5' B 102 U H6 1.0 1.8 6.67 3700 1945 B 102 U H5 B 102 U H6 1.0 1.8 3.00 3701 1946 B 102 U H3' B 102 U H5'' 1.0 1.8 5.55 3702 1946 B 102 U H3' B 102 U H5' 1.0 1.8 5.55 3703 1947 B 102 U H4' B 102 U H5'' 1.0 1.8 4.43 3704 1947 B 102 U H4' B 102 U H5' 1.0 1.8 4.43 3705 1948 B 103 C H1' B 103 C H2' 1.0 1.8 4.50 3706 1949 B 103 C H1' B 103 C H3' 1.0 1.8 5.50 3707 1950 B 103 C H1' B 103 C H4' 1.0 1.8 5.00 3708 1951 B 103 C H1' B 103 C H6 1.0 1.8 5.50 3709 1952 B 103 C H2' B 103 C H3' 1.0 1.8 4.00 3710 1953 B 103 C H2' B 103 C H5 1.0 1.8 4.50 3711 1954 B 103 C H2' B 103 C H6 1.0 1.8 3.50 3712 1955 B 103 C H3' B 103 C H6 1.0 1.8 5.00 3713 1956 B 103 C H3' B 103 C H5'' 1.0 1.8 5.55 3714 1956 B 103 C H3' B 103 C H5' 1.0 1.8 5.55 3715 1957 B 103 C H6 B 103 C H5 1.0 1.8 3.00 3716 1958 B 103 C H1' B 104 C H5 1.0 1.8 3.50 3717 1959 B 103 C H1' B 104 C H6 1.0 1.8 5.00 3718 1960 B 104 C H1' B 104 C H2' 1.0 1.8 5.00 3719 1961 B 104 C H1' B 104 C H3' 1.0 1.8 5.50 3720 1962 B 104 C H1' B 104 C H4' 1.0 1.8 5.50 3721 1963 B 104 C H1' B 104 C H5'' 1.0 1.8 6.11 3722 1963 B 104 C H1' B 104 C H5' 1.0 1.8 6.11 3723 1964 B 104 C H5 B 104 C H1' 1.0 1.8 6.00 3724 1965 B 104 C H6 B 104 C H1' 1.0 1.8 5.50 3725 1966 B 104 C H5 B 104 C H2' 1.0 1.8 5.00 3726 1967 B 104 C H6 B 104 C H2' 1.0 1.8 3.50 3727 1968 B 104 C H6 B 104 C H3' 1.0 1.8 4.50 3728 1969 B 104 C H3' B 104 C H5'' 1.0 1.8 6.11 3729 1969 B 104 C H3' B 104 C H5' 1.0 1.8 6.11 3730 1970 B 104 C H6 B 104 C H4' 1.0 1.8 5.50 3731 1971 B 104 C H4' B 104 C H5'' 1.0 1.8 5.55 3732 1971 B 104 C H4' B 104 C H5' 1.0 1.8 5.55 3733 1972 B 104 C H5 B 104 C H6 1.0 1.8 3.00 3734 1973 B 104 C H3' B 105 A H8 1.0 1.8 5.50 3735 1974 B 104 C H2' B 105 A H8 1.0 1.8 6.00 3736 1975 B 104 C H3' B 105 A H2' 1.0 1.8 5.00 3737 1976 B 105 A H2' B 105 A H1' 1.0 1.8 4.00 3738 1977 B 105 A H1' B 105 A H3' 1.0 1.8 5.50 3739 1978 B 105 A H1' B 105 A H4' 1.0 1.8 6.00 3740 1979 B 105 A H1' B 105 A H5'' 1.0 1.8 6.67 3741 1979 B 105 A H1' B 105 A H5' 1.0 1.8 6.67 3742 1980 B 105 A H1' B 105 A H2 1.0 1.8 6.00 3743 1981 B 105 A H8 B 105 A H1' 1.0 1.8 4.50 3744 1982 B 105 A H2' B 105 A H4' 1.0 1.8 5.50 3745 1983 B 105 A H2' B 105 A H5'' 1.0 1.8 5.55 3746 1983 B 105 A H2' B 105 A H5' 1.0 1.8 5.55 3747 1984 B 105 A H8 B 105 A H2' 1.0 1.8 4.00 3748 1985 B 105 A H3' B 105 A H4' 1.0 1.8 5.00 3749 1986 B 105 A H3' B 105 A H5'' 1.0 1.8 5.55 3750 1986 B 105 A H3' B 105 A H5' 1.0 1.8 5.55 3751 1987 B 105 A H8 B 105 A H3' 1.0 1.8 5.50 3752 1988 B 105 A H8 B 105 A H4' 1.0 1.8 6.00 3753 1989 B 105 A H8 B 105 A H5'' 1.0 1.8 6.11 3754 1989 B 105 A H8 B 105 A H5' 1.0 1.8 6.11 3755 1990 B 105 A H2' B 106 G H8 1.0 1.8 5.00 3756 1991 B 105 A H3' B 106 G H8 1.0 1.8 5.00 3757 1992 B 105 A H4' B 106 G H8 1.0 1.8 5.50 3758 1993 B 106 G H1' B 106 G H2' 1.0 1.8 4.00 3759 1994 B 106 G H1' B 106 G H3' 1.0 1.8 5.00 3760 1995 B 106 G H1' B 106 G H4' 1.0 1.8 4.50 3761 1996 B 106 G H8 B 106 G H1' 1.0 1.8 5.00 3762 1997 B 106 G H8 B 106 G H2' 1.0 1.8 3.50 3763 1998 B 106 G H8 B 106 G H3' 1.0 1.8 4.00 3764 1999 B 106 G H8 B 106 G H4' 1.0 1.8 5.50 3765 2000 B 107 U H1' B 107 U H2' 1.0 1.8 4.50 3766 2001 B 107 U H1' B 107 U H3' 1.0 1.8 4.50 3767 2002 B 107 U H1' B 107 U H6 1.0 1.8 3.50 3768 2003 B 107 U H2' B 107 U H6 1.0 1.8 3.50 3769 2004 B 107 U H3' B 107 U H6 1.0 1.8 5.00 3770 2005 B 107 U H6 B 107 U H5 1.0 1.8 3.00 3771 2006 A 56 GLY HAx B 102 U H5 1.0 1.8 5.00 3772 2007 A 56 GLY HAy B 102 U H5 1.0 1.8 5.00 3773 2008 A 57 PHE HDy B 102 U H1' 1.0 1.8 6.11 3774 2008 A 57 PHE HDx B 102 U H1' 1.0 1.8 6.11 3775 2009 A 57 PHE HEy B 102 U H1' 1.0 1.8 6.11 3776 2009 A 57 PHE HEx B 102 U H1' 1.0 1.8 6.11 3777 2010 A 57 PHE HEy B 102 U H6 1.0 1.8 6.11 3778 2010 A 57 PHE HEx B 102 U H6 1.0 1.8 6.11 3779 2011 A 17 LYS HDy B 103 C H1' 1.0 1.8 6.67 3780 2011 A 17 LYS HDx B 103 C H1' 1.0 1.8 6.67 3781 2012 A 17 LYS HEx B 103 C H2' 1.0 1.8 5.50 3782 2013 A 17 LYS HEx B 103 C H3' 1.0 1.8 6.00 3783 2014 A 17 LYS HEx B 103 C H4' 1.0 1.8 5.00 3784 2015 A 17 LYS HEx B 103 C H5'' 1.0 1.8 6.67 3785 2015 A 17 LYS HEx B 103 C H5' 1.0 1.8 6.67 3786 2016 A 17 LYS HGx B 103 C H5 1.0 1.8 5.50 3787 2017 A 17 LYS HDy B 103 C H5 1.0 1.8 5.55 3788 2017 A 17 LYS HDx B 103 C H5 1.0 1.8 5.55 3789 2018 A 17 LYS HEx B 103 C H5 1.0 1.8 5.50 3790 2019 A 17 LYS HDy B 103 C H6 1.0 1.8 6.11 3791 2019 A 17 LYS HDx B 103 C H6 1.0 1.8 6.11 3792 2020 A 17 LYS HEx B 103 C H6 1.0 1.8 4.50 3793 2021 A 17 LYS HEy B 103 C H6 1.0 1.8 4.50 3794 2022 A 59 PHE HDy B 103 C H1' 1.0 1.8 6.67 3795 2022 A 59 PHE HDx B 103 C H1' 1.0 1.8 6.67 3796 2023 A 59 PHE HEy B 103 C H1' 1.0 1.8 5.55 3797 2023 A 59 PHE HEx B 103 C H1' 1.0 1.8 5.55 3798 2024 A 59 PHE HEy B 103 C H4' 1.0 1.8 4.99 3799 2024 A 59 PHE HEx B 103 C H4' 1.0 1.8 4.99 3800 2025 A 59 PHE HEy B 103 C H5' 1.0 1.8 6.17 3801 2025 A 59 PHE HEy B 103 C H5'' 1.0 1.8 6.17 3802 2025 A 59 PHE HEx B 103 C H5'' 1.0 1.8 6.17 3803 2025 A 59 PHE HEx B 103 C H5' 1.0 1.8 6.17 3804 2026 A 90 ALA HB% B 103 C H1' 1.0 1.8 6.50 3805 2027 A 91 ARG HGy B 103 C H1' 1.0 1.8 6.67 3806 2027 A 91 ARG HGx B 103 C H1' 1.0 1.8 6.67 3807 2028 B 103 C H1' A 91 ARG HDy 1.0 1.8 6.11 3808 2028 B 103 C H1' A 91 ARG HDx 1.0 1.8 6.11 3809 2029 A 91 ARG HGy B 103 C H5 1.0 1.8 6.67 3810 2029 A 91 ARG HGx B 103 C H5 1.0 1.8 6.67 3811 2030 B 103 C H5 A 91 ARG HDy 1.0 1.8 5.55 3812 2030 B 103 C H5 A 91 ARG HDx 1.0 1.8 5.55 3813 2031 A 92 TYR HBy B 103 C H1' 1.0 1.8 6.11 3814 2031 A 92 TYR HBx B 103 C H1' 1.0 1.8 6.11 3815 2032 A 92 TYR HDy B 103 C H1' 1.0 1.8 5.55 3816 2032 A 92 TYR HDx B 103 C H1' 1.0 1.8 5.55 3817 2033 A 92 TYR HEy B 103 C H1' 1.0 1.8 5.55 3818 2033 A 92 TYR HEx B 103 C H1' 1.0 1.8 5.55 3819 2034 A 92 TYR HEy B 103 C H2' 1.0 1.8 6.11 3820 2034 A 92 TYR HEx B 103 C H2' 1.0 1.8 6.11 3821 2035 A 44 TYR HA B 104 C H1' 1.0 1.8 6.00 3822 2036 A 44 TYR HBy B 104 C H1' 1.0 1.8 6.11 3823 2036 A 44 TYR HBx B 104 C H1' 1.0 1.8 6.11 3824 2037 A 44 TYR HDy B 104 C H1' 1.0 1.8 4.99 3825 2037 A 44 TYR HDx B 104 C H1' 1.0 1.8 4.99 3826 2038 A 44 TYR HEy B 104 C H1' 1.0 1.8 4.43 3827 2038 A 44 TYR HEx B 104 C H1' 1.0 1.8 4.43 3828 2039 A 44 TYR HEy B 104 C H2' 1.0 1.8 6.11 3829 2039 A 44 TYR HEx B 104 C H2' 1.0 1.8 6.11 3830 2040 A 44 TYR HEy B 104 C H3' 1.0 1.8 6.11 3831 2040 A 44 TYR HEx B 104 C H3' 1.0 1.8 6.11 3832 2041 A 44 TYR HEy B 104 C H4' 1.0 1.8 6.11 3833 2041 A 44 TYR HEx B 104 C H4' 1.0 1.8 6.11 3834 2042 A 46 PRO HBy B 104 C H1' 1.0 1.8 6.11 3835 2042 A 46 PRO HBx B 104 C H1' 1.0 1.8 6.11 3836 2043 A 46 PRO HBy B 104 C H4' 1.0 1.8 5.55 3837 2043 A 46 PRO HBx B 104 C H4' 1.0 1.8 5.55 3838 2044 A 46 PRO HGy B 104 C H1' 1.0 1.8 5.55 3839 2044 A 46 PRO HGx B 104 C H1' 1.0 1.8 5.55 3840 2045 A 46 PRO HGy B 104 C H4' 1.0 1.8 5.55 3841 2045 A 46 PRO HGx B 104 C H4' 1.0 1.8 5.55 3842 2046 A 59 PHE HDy B 104 C H1' 1.0 1.8 6.67 3843 2046 A 59 PHE HDx B 104 C H1' 1.0 1.8 6.67 3844 2047 A 59 PHE HEy B 104 C H1' 1.0 1.8 5.55 3845 2047 A 59 PHE HEx B 104 C H1' 1.0 1.8 5.55 3846 2048 A 59 PHE HEy B 104 C H5' 1.0 1.8 6.80 3847 2048 A 59 PHE HEy B 104 C H5'' 1.0 1.8 6.80 3848 2048 A 59 PHE HEx B 104 C H5'' 1.0 1.8 6.80 3849 2048 A 59 PHE HEx B 104 C H5' 1.0 1.8 6.80 3850 2049 A 59 PHE HDy B 104 C H5 1.0 1.8 6.67 3851 2049 A 59 PHE HDx B 104 C H5 1.0 1.8 6.67 3852 2050 A 59 PHE HEy B 104 C H5 1.0 1.8 6.11 3853 2050 A 59 PHE HEx B 104 C H5 1.0 1.8 6.11 3854 2051 A 90 ALA HB% B 104 C H5 1.0 1.8 6.50 3855 2052 A 92 TYR HBx B 104 C H5 1.0 1.8 5.50 3856 2053 A 92 TYR HBy B 104 C H5 1.0 1.8 5.50 3857 2054 A 92 TYR HDy B 104 C H5 1.0 1.8 6.11 3858 2054 A 92 TYR HDx B 104 C H5 1.0 1.8 6.11 3859 2055 A 94 ARG HGy B 104 C H2' 1.0 1.8 5.55 3860 2055 A 94 ARG HGx B 104 C H2' 1.0 1.8 5.55 3861 2056 A 94 ARG HGy B 104 C H3' 1.0 1.8 5.55 3862 2056 A 94 ARG HGx B 104 C H3' 1.0 1.8 5.55 3863 2057 A 94 ARG HDy B 104 C H2' 1.0 1.8 6.11 3864 2057 A 94 ARG HDx B 104 C H2' 1.0 1.8 6.11 3865 2058 A 94 ARG HDy B 104 C H3' 1.0 1.8 6.67 3866 2058 A 94 ARG HDx B 104 C H3' 1.0 1.8 6.67 3867 2059 A 95 PRO HGy B 104 C H1' 1.0 1.8 6.11 3868 2059 A 95 PRO HGx B 104 C H1' 1.0 1.8 6.11 3869 2060 A 95 PRO HGy B 104 C H2' 1.0 1.8 4.99 3870 2060 A 95 PRO HGx B 104 C H2' 1.0 1.8 4.99 3871 2061 A 95 PRO HGy B 104 C H3' 1.0 1.8 4.99 3872 2061 A 95 PRO HGx B 104 C H3' 1.0 1.8 4.99 3873 2062 A 95 PRO HGy B 104 C H5 1.0 1.8 6.11 3874 2062 A 95 PRO HGx B 104 C H5 1.0 1.8 6.11 3875 2063 A 95 PRO HGy B 104 C H6 1.0 1.8 5.55 3876 2063 A 95 PRO HGx B 104 C H6 1.0 1.8 5.55 3877 2064 A 95 PRO HDx B 104 C H1' 1.0 1.8 6.00 3878 2065 A 95 PRO HDy B 104 C H1' 1.0 1.8 6.00 3879 2066 A 95 PRO HDx B 104 C H2' 1.0 1.8 4.50 3880 2067 A 95 PRO HDy B 104 C H2' 1.0 1.8 4.50 3881 2068 A 95 PRO HDx B 104 C H3' 1.0 1.8 5.50 3882 2069 A 95 PRO HDy B 104 C H3' 1.0 1.8 5.50 3883 2070 A 95 PRO HDx B 104 C H5 1.0 1.8 5.50 3884 2071 A 95 PRO HDy B 104 C H5 1.0 1.8 5.50 3885 2072 A 95 PRO HDx B 104 C H6 1.0 1.8 5.00 3886 2073 A 95 PRO HDy B 104 C H6 1.0 1.8 5.00 3887 2074 A 46 PRO HGy B 105 A H8 1.0 1.8 6.11 3888 2074 A 46 PRO HGx B 105 A H8 1.0 1.8 6.11 3889 2075 A 48 ASP HA B 105 A H2 1.0 1.8 5.00 3890 2076 A 48 ASP HBy B 105 A H2 1.0 1.8 6.11 3891 2076 A 48 ASP HBx B 105 A H2 1.0 1.8 6.11 3892 2077 A 49 ARG HBy B 105 A H1' 1.0 1.8 6.11 3893 2077 A 49 ARG HBx B 105 A H1' 1.0 1.8 6.11 3894 2078 A 49 ARG HBy B 105 A H2 1.0 1.8 6.67 3895 2078 A 49 ARG HBx B 105 A H2 1.0 1.8 6.67 3896 2079 A 49 ARG HBy B 105 A H8 1.0 1.8 6.11 3897 2079 A 49 ARG HBx B 105 A H8 1.0 1.8 6.11 3898 2080 A 49 ARG HDy B 105 A H1' 1.0 1.8 6.11 3899 2080 A 49 ARG HDx B 105 A H1' 1.0 1.8 6.11 3900 2081 A 49 ARG HDy B 105 A H2 1.0 1.8 5.55 3901 2081 A 49 ARG HDx B 105 A H2 1.0 1.8 5.55 3902 2082 A 49 ARG HDy B 105 A H8 1.0 1.8 6.11 3903 2082 A 49 ARG HDx B 105 A H8 1.0 1.8 6.11 3904 2083 A 50 TYR HEy B 105 A H2 1.0 1.8 5.55 3905 2083 A 50 TYR HEx B 105 A H2 1.0 1.8 5.55 3906 2084 A 95 PRO HGy B 105 A H1' 1.0 1.8 6.67 3907 2084 A 95 PRO HGx B 105 A H1' 1.0 1.8 6.67 3908 2085 A 95 PRO HGy B 105 A H8 1.0 1.8 5.55 3909 2085 A 95 PRO HGx B 105 A H8 1.0 1.8 5.55 3910 2086 A 98 SER HBy B 105 A H1' 1.0 1.8 5.55 3911 2086 A 98 SER HBx B 105 A H1' 1.0 1.8 5.55 3912 2087 A 98 SER HBy B 105 A H2 1.0 1.8 5.55 3913 2087 A 98 SER HBx B 105 A H2 1.0 1.8 5.55 3914 2088 A 98 SER HBy B 105 A H8 1.0 1.8 6.11 3915 2088 A 98 SER HBx B 105 A H8 1.0 1.8 6.11 3916 2089 A 99 HIS HBy B 105 A H1' 1.0 1.8 6.11 3917 2089 A 99 HIS HBx B 105 A H1' 1.0 1.8 6.11 3918 2090 A 99 HIS HBy B 105 A H2 1.0 1.8 5.55 3919 2090 A 99 HIS HBx B 105 A H2 1.0 1.8 5.55 3920 2091 A 99 HIS HBy B 105 A H8 1.0 1.8 6.11 3921 2091 A 99 HIS HBx B 105 A H8 1.0 1.8 6.11 3922 2092 A 44 TYR HDy B 106 G H1' 1.0 1.8 6.11 3923 2092 A 44 TYR HDx B 106 G H1' 1.0 1.8 6.11 3924 2093 A 44 TYR HEy B 106 G H1' 1.0 1.8 4.99 3925 2093 A 44 TYR HEx B 106 G H1' 1.0 1.8 4.99 3926 2094 A 44 TYR HEy B 106 G H8 1.0 1.8 6.11 3927 2094 A 44 TYR HEx B 106 G H8 1.0 1.8 6.11 3928 2095 A 3 TYR HBx B 106 G H1' 1.0 1.8 5.00 3929 2096 A 3 TYR HBy B 106 G H1' 1.0 1.8 5.00 3930 2097 A 4 GLY HAy B 106 G H1' 1.0 1.8 5.55 3931 2097 A 4 GLY HAx B 106 G H1' 1.0 1.8 5.55 3932 2098 A 5 ARG HA B 106 G H1' 1.0 1.8 5.00 3933 2099 A 5 ARG HBy B 106 G H1' 1.0 1.8 6.11 3934 2099 A 5 ARG HBx B 106 G H1' 1.0 1.8 6.11 3935 2100 A 6 PRO HDy B 106 G H1' 1.0 1.8 5.55 3936 2100 A 6 PRO HDx B 106 G H1' 1.0 1.8 5.55 3937 2101 A 4 GLY HAy B 107 U H1' 1.0 1.8 6.11 3938 2101 A 4 GLY HAx B 107 U H1' 1.0 1.8 6.11 3939 2102 A 4 GLY HAy B 107 U H2' 1.0 1.8 5.55 3940 2102 A 4 GLY HAx B 107 U H2' 1.0 1.8 5.55 3941 2103 A 4 GLY HAy B 107 U H3' 1.0 1.8 5.55 3942 2103 A 4 GLY HAx B 107 U H3' 1.0 1.8 5.55 3943 2104 A 4 GLY HAy B 107 U H6 1.0 1.8 6.67 3944 2104 A 4 GLY HAx B 107 U H6 1.0 1.8 6.67 3945 2105 A 5 ARG HGy B 107 U H1' 1.0 1.8 5.55 3946 2105 A 5 ARG HGx B 107 U H1' 1.0 1.8 5.55 3947 2106 A 5 ARG HGy B 107 U H2' 1.0 1.8 5.55 3948 2106 A 5 ARG HGx B 107 U H2' 1.0 1.8 5.55 3949 2107 A 5 ARG HGy B 107 U H3' 1.0 1.8 4.99 3950 2107 A 5 ARG HGx B 107 U H3' 1.0 1.8 4.99 3951 2108 A 5 ARG HGy B 107 U H6 1.0 1.8 6.67 3952 2108 A 5 ARG HGx B 107 U H6 1.0 1.8 6.67 3953 2109 A 5 ARG HDy B 107 U H1' 1.0 1.8 4.99 3954 2109 A 5 ARG HDx B 107 U H1' 1.0 1.8 4.99 3955 2110 A 5 ARG HDy B 107 U H2' 1.0 1.8 5.55 3956 2110 A 5 ARG HDx B 107 U H2' 1.0 1.8 5.55 3957 2111 A 5 ARG HDy B 107 U H3' 1.0 1.8 4.99 3958 2111 A 5 ARG HDx B 107 U H3' 1.0 1.8 4.99 3959 2112 A 5 ARG HDy B 107 U H6 1.0 1.8 6.11 3960 2112 A 5 ARG HDx B 107 U H6 1.0 1.8 6.11 3961 2113 A 3 TYR HDy A 43 VAL HGx% 1.0 1.8 7.91 3962 2113 A 3 TYR HDx A 43 VAL HGx% 1.0 1.8 7.91 3963 2114 A 40 VAL HGy% A 3 TYR HEx 1.0 1.8 8.59 3964 2114 A 40 VAL HGy% A 3 TYR HEy 1.0 1.8 8.59 3965 2115 A 3 TYR HEx A 43 VAL HGx% 1.0 1.8 7.24 3966 2115 A 3 TYR HEy A 43 VAL HGx% 1.0 1.8 7.24 3967 2116 A 43 VAL HGx% A 4 GLY HAx 1.0 1.8 8.59 3968 2116 A 43 VAL HGx% A 4 GLY HAy 1.0 1.8 8.59 3969 2117 A 3 TYR HDx A 31 ARG HBy 1.0 1.8 6.80 3970 2117 A 3 TYR HDy A 31 ARG HBy 1.0 1.8 6.80 3971 2117 A 3 TYR HDy A 31 ARG HBx 1.0 1.8 6.80 3972 2117 A 3 TYR HDx A 31 ARG HBx 1.0 1.8 6.80 3973 2118 A 3 TYR HEx A 31 ARG HBy 1.0 1.8 6.17 3974 2118 A 3 TYR HEy A 31 ARG HBy 1.0 1.8 6.17 3975 2118 A 3 TYR HEy A 31 ARG HBx 1.0 1.8 6.17 3976 2118 A 3 TYR HEx A 31 ARG HBx 1.0 1.8 6.17 stop_ save_ save_AMBER_distance_constraints_3 _nef_distance_restraint_list.sf_category nef_distance_restraint_list _nef_distance_restraint_list.sf_framecode AMBER_distance_constraints_3 _nef_distance_restraint_list.restraint_origin hbond _nef_distance_restraint_list.potential_type square-well-parabolic loop_ _nef_distance_restraint.index _nef_distance_restraint.restraint_id _nef_distance_restraint.chain_code_1 _nef_distance_restraint.sequence_code_1 _nef_distance_restraint.residue_name_1 _nef_distance_restraint.atom_name_1 _nef_distance_restraint.chain_code_2 _nef_distance_restraint.sequence_code_2 _nef_distance_restraint.residue_name_2 _nef_distance_restraint.atom_name_2 _nef_distance_restraint.weight _nef_distance_restraint.lower_limit _nef_distance_restraint.upper_limit 1 1 A 30 LEU H A 26 SER O 1.0 1.8 2.90 2 2 A 26 SER O A 30 LEU N 1.0 2.4 3.90 3 3 A 31 ARG H A 27 PRO O 1.0 1.8 2.90 4 4 A 27 PRO O A 31 ARG N 1.0 2.4 3.90 5 5 A 32 ARG H A 28 ASP O 1.0 1.8 2.90 6 6 A 28 ASP O A 32 ARG N 1.0 2.4 3.90 7 7 A 33 VAL H A 29 THR O 1.0 1.8 2.90 8 8 A 29 THR O A 33 VAL N 1.0 2.4 3.90 9 9 A 34 PHE H A 30 LEU O 1.0 1.8 2.90 10 10 A 30 LEU O A 34 PHE N 1.0 2.4 3.90 11 11 A 35 GLU H A 31 ARG O 1.0 1.8 2.90 12 12 A 31 ARG O A 35 GLU N 1.0 2.4 3.90 13 13 A 68 ALA H A 64 ASP O 1.0 1.8 2.90 14 14 A 64 ASP O A 68 ALA N 1.0 2.4 3.90 15 15 A 69 GLU H A 65 LYS O 1.0 1.8 2.90 16 16 A 65 LYS O A 69 GLU N 1.0 2.4 3.90 17 17 A 70 ASP H A 66 ARG O 1.0 1.8 2.90 18 18 A 66 ARG O A 70 ASP N 1.0 2.4 3.90 19 19 A 71 ALA H A 67 ASP O 1.0 1.8 2.90 20 20 A 67 ASP O A 71 ALA N 1.0 2.4 3.90 21 21 A 72 MET H A 68 ALA O 1.0 1.8 2.90 22 22 A 68 ALA O A 72 MET N 1.0 2.4 3.90 23 23 A 73 ASP H A 69 GLU O 1.0 1.8 2.90 24 24 A 69 GLU O A 73 ASP N 1.0 2.4 3.90 25 25 A 74 ALA H A 70 ASP O 1.0 1.8 2.90 26 26 A 70 ASP O A 74 ALA N 1.0 2.4 3.90 27 27 A 75 MET H A 71 ALA O 1.0 1.8 2.90 28 28 A 71 ALA O A 75 MET N 1.0 2.4 3.90 29 29 A 76 ASP H A 72 MET O 1.0 1.8 2.90 30 30 A 72 MET O A 76 ASP N 1.0 2.4 3.90 31 31 A 17 LYS H A 88 GLN O 1.0 1.8 2.90 32 32 A 88 GLN O A 17 LYS N 1.0 2.4 3.90 33 33 A 88 GLN H A 17 LYS O 1.0 1.8 2.90 34 34 A 17 LYS O A 88 GLN N 1.0 2.4 3.90 35 35 A 19 ASP H A 86 ARG O 1.0 1.8 2.90 36 36 A 86 ARG O A 19 ASP N 1.0 2.4 3.90 37 37 A 86 ARG H A 19 ASP O 1.0 1.8 2.90 38 38 A 19 ASP O A 86 ARG N 1.0 2.4 3.90 39 39 A 16 LEU H A 62 PHE O 1.0 1.8 2.90 40 40 A 62 PHE O A 16 LEU N 1.0 2.4 3.90 41 41 A 62 PHE H A 16 LEU O 1.0 1.8 2.90 42 42 A 16 LEU O A 62 PHE N 1.0 2.4 3.90 43 43 A 18 VAL H A 60 VAL O 1.0 1.8 2.90 44 44 A 60 VAL O A 18 VAL N 1.0 2.4 3.90 45 45 A 60 VAL H A 18 VAL O 1.0 1.8 2.90 46 46 A 18 VAL O A 60 VAL N 1.0 2.4 3.90 47 47 A 61 ARG H A 42 ASP O 1.0 1.8 2.90 48 48 A 42 ASP O A 61 ARG N 1.0 2.4 3.90 49 49 A 42 ASP H A 61 ARG O 1.0 1.8 2.90 50 50 A 61 ARG O A 42 ASP N 1.0 2.4 3.90 51 51 A 59 PHE H A 44 TYR O 1.0 1.8 2.90 52 52 A 44 TYR O A 59 PHE N 1.0 2.4 3.90 53 53 A 44 TYR H A 59 PHE O 1.0 1.8 2.90 54 54 A 59 PHE O A 44 TYR N 1.0 2.4 3.90 55 55 A 91 ARG H B 103 C N3 1.0 1.8 2.90 56 56 B 103 C N3 A 91 ARG N 1.0 2.4 3.90 57 57 A 42 ASP OD1 B 106 G H1 1.0 1.8 2.90 58 58 A 42 ASP OD1 B 106 G N1 1.0 2.4 3.90 59 59 A 61 ARG NHy B 104 C O2 1.0 2.4 3.90 60 60 B 104 C O2 A 61 ARG HH2y 1.0 1.8 3.19 61 60 B 104 C O2 A 61 ARG HH2x 1.0 1.8 3.19 62 61 A 61 ARG NHx B 104 C N3 1.0 2.4 3.90 63 62 B 104 C N3 A 61 ARG HH1y 1.0 1.8 3.19 64 62 B 104 C N3 A 61 ARG HH1x 1.0 1.8 3.19 stop_ save_ save_AMBER_dihedral_5 _nef_dihedral_restraint_list.sf_category nef_dihedral_restraint_list _nef_dihedral_restraint_list.sf_framecode AMBER_dihedral_5 _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 2 SER CA A 2 SER N A 1 MET C A 1 MET CA 1.0 170.0 190.0 OMEGA stop_ save_