data_nef_c15386_2jt1 save_entry_information _nef_nmr_meta_data.sf_category nef_nmr_meta_data _nef_nmr_meta_data.sf_framecode entry_information _nef_nmr_meta_data.format_name nmr_exchange_format _nef_nmr_meta_data.format_version 1.1 save_ save_assembly _nef_molecular_system.sf_category nef_molecular_system _nef_molecular_system.sf_framecode assembly loop_ _nef_sequence.index _nef_sequence.chain_code _nef_sequence.sequence_code _nef_sequence.residue_name _nef_sequence.linking _nef_sequence.residue_variant _nef_sequence.cis_peptide 1 A 1 MET start . . 2 A 2 SER middle . . 3 A 3 GLU middle . . 4 A 4 SER middle . . 5 A 5 ILE middle . . 6 A 6 VAL middle . . 7 A 7 THR middle . . 8 A 8 LYS middle . . 9 A 9 ILE middle . . 10 A 10 ILE middle . . 11 A 11 SER middle . . 12 A 12 ILE middle . . 13 A 13 VAL middle . . 14 A 14 GLN middle . . 15 A 15 GLU middle . . 16 A 16 ARG middle . . 17 A 17 GLN middle . . 18 A 18 ASN middle . . 19 A 19 MET middle . . 20 A 20 ASP middle . . 21 A 21 ASP middle . . 22 A 22 GLY middle . false 23 A 23 ALA middle . . 24 A 24 PRO middle . false 25 A 25 VAL middle . . 26 A 26 LYS middle . . 27 A 27 THR middle . . 28 A 28 ARG middle . . 29 A 29 ASP middle . . 30 A 30 ILE middle . . 31 A 31 ALA middle . . 32 A 32 ASP middle . . 33 A 33 ALA middle . . 34 A 34 ALA middle . . 35 A 35 GLY middle . false 36 A 36 LEU middle . . 37 A 37 SER middle . . 38 A 38 ILE middle . . 39 A 39 TYR middle . . 40 A 40 GLN middle . . 41 A 41 VAL middle . . 42 A 42 ARG middle . . 43 A 43 LEU middle . . 44 A 44 TYR middle . . 45 A 45 LEU middle . . 46 A 46 GLU middle . . 47 A 47 GLN middle . . 48 A 48 LEU middle . . 49 A 49 HIS middle . . 50 A 50 ASP middle . . 51 A 51 VAL middle . . 52 A 52 GLY middle . false 53 A 53 VAL middle . . 54 A 54 LEU middle . . 55 A 55 GLU middle . . 56 A 56 LYS middle . . 57 A 57 VAL middle . . 58 A 58 ASN middle . . 59 A 59 ALA middle . . 60 A 60 GLY middle . false 61 A 61 LYS middle . . 62 A 62 GLY middle . false 63 A 63 VAL middle . . 64 A 64 PRO middle . false 65 A 65 GLY middle . false 66 A 66 LEU middle . . 67 A 67 TRP middle . . 68 A 68 ARG middle . . 69 A 69 LEU middle . . 70 A 70 LEU middle . . 71 A 71 GLU middle . . 72 A 72 HIS middle . . 73 A 73 HIS middle . . 74 A 74 HIS middle . . 75 A 75 HIS middle . . 76 A 76 HIS middle . . 77 A 77 HIS end . . stop_ save_ save_assigned_chem_shift_list_1 _nef_chemical_shift_list.sf_category nef_chemical_shift_list _nef_chemical_shift_list.sf_framecode assigned_chem_shift_list_1 loop_ _nef_chemical_shift.chain_code _nef_chemical_shift.sequence_code _nef_chemical_shift.residue_name _nef_chemical_shift.atom_name _nef_chemical_shift.element _nef_chemical_shift.isotope_number _nef_chemical_shift.value _nef_chemical_shift.value_uncertainty A 2 SER HA H 1 4.126 0.02 A 2 SER HBx H 1 3.982 0.02 A 2 SER HBy H 1 3.983 0.02 A 2 SER CA C 13 57.564 0.2 A 2 SER CB C 13 63.953 0.2 A 3 GLU HA H 1 4.408 0.02 A 3 GLU HBy H 1 2.092 0.02 A 3 GLU HBx H 1 1.988 0.02 A 3 GLU HGx H 1 2.307 0.02 A 3 GLU HGy H 1 2.307 0.02 A 3 GLU C C 13 176.658 0.2 A 3 GLU CA C 13 56.802 0.2 A 3 GLU CB C 13 30.674 0.2 A 3 GLU CG C 13 36.300 0.2 A 4 SER H H 1 8.650 0.02 A 4 SER HA H 1 4.463 0.02 A 4 SER HBy H 1 4.096 0.02 A 4 SER HBx H 1 3.955 0.02 A 4 SER C C 13 175.949 0.2 A 4 SER CA C 13 58.557 0.2 A 4 SER CB C 13 63.834 0.2 A 4 SER N N 15 118.042 0.2 A 5 ILE H H 1 8.404 0.02 A 5 ILE HA H 1 3.902 0.02 A 5 ILE HB H 1 1.704 0.02 A 5 ILE HD1% H 1 0.869 0.02 A 5 ILE HG1y H 1 1.262 0.02 A 5 ILE HG1x H 1 1.148 0.02 A 5 ILE HG2% H 1 0.384 0.02 A 5 ILE C C 13 176.608 0.2 A 5 ILE CA C 13 62.662 0.2 A 5 ILE CB C 13 37.622 0.2 A 5 ILE CD1 C 13 13.053 0.2 A 5 ILE CG1 C 13 29.087 0.2 A 5 ILE CG2 C 13 17.734 0.2 A 5 ILE N N 15 124.711 0.2 A 6 VAL H H 1 7.602 0.02 A 6 VAL HA H 1 3.293 0.02 A 6 VAL HB H 1 2.029 0.02 A 6 VAL HG1% H 1 0.950 0.02 A 6 VAL HG2% H 1 0.997 0.02 A 6 VAL C C 13 177.088 0.2 A 6 VAL CA C 13 67.180 0.2 A 6 VAL CB C 13 31.517 0.2 A 6 VAL CG1 C 13 22.019 0.2 A 6 VAL CG2 C 13 23.052 0.2 A 6 VAL N N 15 119.974 0.2 A 7 THR H H 1 7.515 0.02 A 7 THR HA H 1 3.823 0.02 A 7 THR HB H 1 4.239 0.02 A 7 THR HG2% H 1 1.255 0.02 A 7 THR C C 13 176.978 0.2 A 7 THR CA C 13 66.257 0.2 A 7 THR CB C 13 68.410 0.2 A 7 THR CG2 C 13 22.394 0.2 A 7 THR N N 15 114.177 0.2 A 8 LYS H H 1 7.807 0.02 A 8 LYS HA H 1 4.066 0.02 A 8 LYS HBy H 1 1.970 0.02 A 8 LYS HBx H 1 1.947 0.02 A 8 LYS HDx H 1 1.687 0.02 A 8 LYS HDy H 1 1.687 0.02 A 8 LYS HEx H 1 2.920 0.02 A 8 LYS HEy H 1 2.920 0.02 A 8 LYS HGy H 1 1.474 0.02 A 8 LYS HGx H 1 1.388 0.02 A 8 LYS C C 13 178.733 0.2 A 8 LYS CA C 13 59.338 0.2 A 8 LYS CB C 13 32.002 0.2 A 8 LYS CD C 13 29.090 0.2 A 8 LYS CE C 13 42.072 0.2 A 8 LYS CG C 13 24.684 0.2 A 8 LYS N N 15 123.387 0.2 A 9 ILE H H 1 8.288 0.02 A 9 ILE HA H 1 3.421 0.02 A 9 ILE HB H 1 1.873 0.02 A 9 ILE HD1% H 1 0.502 0.02 A 9 ILE HG1y H 1 1.578 0.02 A 9 ILE HG1x H 1 0.733 0.02 A 9 ILE HG2% H 1 0.528 0.02 A 9 ILE C C 13 177.187 0.2 A 9 ILE CA C 13 65.772 0.2 A 9 ILE CB C 13 37.183 0.2 A 9 ILE CD1 C 13 13.877 0.2 A 9 ILE CG1 C 13 29.432 0.2 A 9 ILE CG2 C 13 17.100 0.2 A 9 ILE N N 15 119.543 0.2 A 10 ILE H H 1 8.073 0.02 A 10 ILE HA H 1 3.305 0.02 A 10 ILE HB H 1 1.863 0.02 A 10 ILE HD1% H 1 0.806 0.02 A 10 ILE HG1y H 1 1.836 0.02 A 10 ILE HG1x H 1 0.717 0.02 A 10 ILE HG2% H 1 0.856 0.02 A 10 ILE C C 13 177.308 0.2 A 10 ILE CA C 13 66.704 0.2 A 10 ILE CB C 13 37.840 0.2 A 10 ILE CD1 C 13 13.801 0.2 A 10 ILE CG1 C 13 29.746 0.2 A 10 ILE CG2 C 13 17.153 0.2 A 10 ILE N N 15 119.219 0.2 A 11 SER H H 1 7.861 0.02 A 11 SER HA H 1 4.250 0.02 A 11 SER HBx H 1 4.050 0.02 A 11 SER HBy H 1 4.050 0.02 A 11 SER C C 13 176.918 0.2 A 11 SER CA C 13 61.911 0.2 A 11 SER CB C 13 62.998 0.2 A 11 SER N N 15 113.959 0.2 A 12 ILE H H 1 8.250 0.02 A 12 ILE HA H 1 3.801 0.02 A 12 ILE HB H 1 1.990 0.02 A 12 ILE HD1% H 1 0.741 0.02 A 12 ILE HG1y H 1 1.837 0.02 A 12 ILE HG1x H 1 1.038 0.02 A 12 ILE HG2% H 1 0.894 0.02 A 12 ILE C C 13 178.130 0.2 A 12 ILE CA C 13 65.023 0.2 A 12 ILE CB C 13 38.195 0.2 A 12 ILE CD1 C 13 14.524 0.2 A 12 ILE CG1 C 13 29.079 0.2 A 12 ILE CG2 C 13 18.313 0.2 A 12 ILE N N 15 123.767 0.2 A 13 VAL H H 1 8.308 0.02 A 13 VAL HA H 1 3.435 0.02 A 13 VAL HB H 1 2.095 0.02 A 13 VAL HG1% H 1 0.941 0.02 A 13 VAL HG2% H 1 0.875 0.02 A 13 VAL C C 13 177.283 0.2 A 13 VAL CA C 13 67.693 0.2 A 13 VAL CB C 13 31.139 0.2 A 13 VAL CG1 C 13 22.325 0.2 A 13 VAL CG2 C 13 23.005 0.2 A 13 VAL N N 15 120.066 0.2 A 14 GLN H H 1 8.612 0.02 A 14 GLN HA H 1 3.831 0.02 A 14 GLN HBy H 1 2.208 0.02 A 14 GLN HBx H 1 2.148 0.02 A 14 GLN HE21 H 1 7.373 0.02 A 14 GLN HE22 H 1 6.899 0.02 A 14 GLN HGx H 1 2.315 0.02 A 14 GLN HGy H 1 2.315 0.02 A 14 GLN C C 13 178.256 0.2 A 14 GLN CA C 13 59.660 0.2 A 14 GLN CB C 13 29.456 0.2 A 14 GLN CD C 13 179.843 0.2 A 14 GLN CG C 13 34.152 0.2 A 14 GLN N N 15 118.099 0.2 A 14 GLN NE2 N 15 112.194 0.2 A 15 GLU H H 1 8.378 0.02 A 15 GLU HA H 1 4.110 0.02 A 15 GLU HBy H 1 2.201 0.02 A 15 GLU HBx H 1 2.152 0.02 A 15 GLU HGy H 1 2.405 0.02 A 15 GLU HGx H 1 2.306 0.02 A 15 GLU C C 13 179.659 0.2 A 15 GLU CA C 13 59.476 0.2 A 15 GLU CB C 13 29.725 0.2 A 15 GLU CG C 13 36.361 0.2 A 15 GLU N N 15 118.580 0.2 A 16 ARG H H 1 8.439 0.02 A 16 ARG HA H 1 4.157 0.02 A 16 ARG HBy H 1 2.089 0.02 A 16 ARG HBx H 1 2.022 0.02 A 16 ARG HDy H 1 3.261 0.02 A 16 ARG HDx H 1 3.158 0.02 A 16 ARG HE H 1 7.804 0.02 A 16 ARG HGy H 1 1.878 0.02 A 16 ARG HGx H 1 1.722 0.02 A 16 ARG C C 13 179.276 0.2 A 16 ARG CA C 13 58.141 0.2 A 16 ARG CB C 13 29.434 0.2 A 16 ARG CD C 13 42.212 0.2 A 16 ARG CG C 13 27.416 0.2 A 16 ARG N N 15 118.688 0.2 A 16 ARG NE N 15 83.84 0.2 A 17 GLN H H 1 8.861 0.02 A 17 GLN HA H 1 4.236 0.02 A 17 GLN HBy H 1 2.322 0.02 A 17 GLN HBx H 1 2.029 0.02 A 17 GLN HE21 H 1 7.181 0.02 A 17 GLN HE22 H 1 7.026 0.02 A 17 GLN HGx H 1 2.497 0.02 A 17 GLN HGy H 1 2.497 0.02 A 17 GLN C C 13 178.736 0.2 A 17 GLN CA C 13 59.683 0.2 A 17 GLN CB C 13 29.960 0.2 A 17 GLN CD C 13 179.841 0.2 A 17 GLN CG C 13 35.013 0.2 A 17 GLN N N 15 120.427 0.2 A 17 GLN NE2 N 15 109.177 0.2 A 18 ASN H H 1 8.017 0.02 A 18 ASN HA H 1 4.605 0.02 A 18 ASN HBy H 1 3.009 0.02 A 18 ASN HBx H 1 2.941 0.02 A 18 ASN HD21 H 1 7.729 0.02 A 18 ASN HD22 H 1 7.034 0.02 A 18 ASN C C 13 177.906 0.2 A 18 ASN CA C 13 55.375 0.2 A 18 ASN CB C 13 38.383 0.2 A 18 ASN CG C 13 176.518 0.2 A 18 ASN N N 15 117.033 0.2 A 18 ASN ND2 N 15 112.236 0.2 A 19 MET H H 1 7.994 0.02 A 19 MET HA H 1 4.372 0.02 A 19 MET HBx H 1 2.232 0.02 A 19 MET HBy H 1 2.232 0.02 A 19 MET HGy H 1 2.806 0.02 A 19 MET HGx H 1 2.730 0.02 A 19 MET C C 13 176.518 0.2 A 19 MET CA C 13 57.623 0.2 A 19 MET CB C 13 33.248 0.2 A 19 MET CG C 13 32.010 0.2 A 19 MET N N 15 119.320 0.2 A 20 ASP H H 1 7.800 0.02 A 20 ASP HA H 1 4.990 0.02 A 20 ASP HBy H 1 3.021 0.02 A 20 ASP HBx H 1 2.565 0.02 A 20 ASP C C 13 176.082 0.2 A 20 ASP CA C 13 53.796 0.2 A 20 ASP CB C 13 40.409 0.2 A 20 ASP N N 15 119.127 0.2 A 21 ASP H H 1 8.136 0.02 A 21 ASP HA H 1 4.497 0.02 A 21 ASP HBy H 1 3.000 0.02 A 21 ASP HBx H 1 2.633 0.02 A 21 ASP C C 13 176.264 0.2 A 21 ASP CA C 13 55.508 0.2 A 21 ASP CB C 13 40.063 0.2 A 21 ASP N N 15 118.276 0.2 A 22 GLY H H 1 8.728 0.02 A 22 GLY HAy H 1 4.189 0.02 A 22 GLY HAx H 1 3.683 0.02 A 22 GLY C C 13 174.304 0.2 A 22 GLY CA C 13 45.629 0.2 A 22 GLY N N 15 105.878 0.2 A 23 ALA H H 1 7.473 0.02 A 23 ALA HA H 1 4.519 0.02 A 23 ALA HB% H 1 1.541 0.02 A 23 ALA C C 13 174.065 0.2 A 23 ALA CA C 13 51.142 0.2 A 23 ALA CB C 13 18.283 0.2 A 23 ALA N N 15 125.323 0.2 A 24 PRO HA H 1 4.590 0.02 A 24 PRO HBy H 1 1.882 0.02 A 24 PRO HBx H 1 1.828 0.02 A 24 PRO HDy H 1 3.853 0.02 A 24 PRO HDx H 1 3.652 0.02 A 24 PRO HGy H 1 1.997 0.02 A 24 PRO HGx H 1 1.871 0.02 A 24 PRO C C 13 175.253 0.2 A 24 PRO CA C 13 62.186 0.2 A 24 PRO CB C 13 32.931 0.2 A 24 PRO CD C 13 49.816 0.2 A 24 PRO CG C 13 27.755 0.2 A 25 VAL H H 1 9.334 0.02 A 25 VAL HA H 1 4.378 0.02 A 25 VAL HB H 1 2.104 0.02 A 25 VAL HG1% H 1 1.143 0.02 A 25 VAL HG2% H 1 1.221 0.02 A 25 VAL C C 13 176.439 0.2 A 25 VAL CA C 13 61.482 0.2 A 25 VAL CB C 13 34.781 0.2 A 25 VAL CG1 C 13 22.791 0.2 A 25 VAL CG2 C 13 22.609 0.2 A 25 VAL N N 15 120.408 0.2 A 26 LYS H H 1 9.300 0.02 A 26 LYS HA H 1 4.982 0.02 A 26 LYS HBy H 1 2.163 0.02 A 26 LYS HBx H 1 1.842 0.02 A 26 LYS HDy H 1 1.810 0.02 A 26 LYS HDx H 1 1.748 0.02 A 26 LYS HEx H 1 3.058 0.02 A 26 LYS HEy H 1 3.058 0.02 A 26 LYS HGy H 1 1.697 0.02 A 26 LYS HGx H 1 1.587 0.02 A 26 LYS C C 13 179.008 0.2 A 26 LYS CA C 13 56.908 0.2 A 26 LYS CB C 13 34.071 0.2 A 26 LYS CD C 13 29.651 0.2 A 26 LYS CE C 13 42.029 0.2 A 26 LYS CG C 13 25.579 0.2 A 26 LYS N N 15 126.177 0.2 A 27 THR H H 1 8.618 0.02 A 27 THR HA H 1 3.662 0.02 A 27 THR HB H 1 4.434 0.02 A 27 THR HG2% H 1 1.214 0.02 A 27 THR C C 13 176.442 0.2 A 27 THR CA C 13 67.591 0.2 A 27 THR CB C 13 68.868 0.2 A 27 THR CG2 C 13 23.464 0.2 A 27 THR N N 15 119.020 0.2 A 28 ARG H H 1 9.288 0.02 A 28 ARG HA H 1 3.879 0.02 A 28 ARG HBy H 1 2.045 0.02 A 28 ARG HBx H 1 1.757 0.02 A 28 ARG HDy H 1 3.305 0.02 A 28 ARG HDx H 1 3.249 0.02 A 28 ARG HGy H 1 1.804 0.02 A 28 ARG HGx H 1 1.684 0.02 A 28 ARG C C 13 176.884 0.2 A 28 ARG CA C 13 59.431 0.2 A 28 ARG CB C 13 29.953 0.2 A 28 ARG CD C 13 43.326 0.2 A 28 ARG CG C 13 26.615 0.2 A 28 ARG N N 15 119.100 0.2 A 29 ASP H H 1 6.907 0.02 A 29 ASP HA H 1 4.550 0.02 A 29 ASP HBy H 1 2.841 0.02 A 29 ASP HBx H 1 2.632 0.02 A 29 ASP C C 13 179.050 0.2 A 29 ASP CA C 13 57.262 0.2 A 29 ASP CB C 13 40.191 0.2 A 29 ASP N N 15 117.490 0.2 A 30 ILE H H 1 7.554 0.02 A 30 ILE HA H 1 3.595 0.02 A 30 ILE HB H 1 1.886 0.02 A 30 ILE HD1% H 1 0.599 0.02 A 30 ILE HG1y H 1 1.839 0.02 A 30 ILE HG1x H 1 0.621 0.02 A 30 ILE HG2% H 1 0.743 0.02 A 30 ILE C C 13 176.907 0.2 A 30 ILE CA C 13 65.002 0.2 A 30 ILE CB C 13 37.999 0.2 A 30 ILE CD1 C 13 15.391 0.2 A 30 ILE CG1 C 13 29.091 0.2 A 30 ILE CG2 C 13 18.596 0.2 A 30 ILE N N 15 120.978 0.2 A 31 ALA H H 1 8.269 0.02 A 31 ALA HA H 1 3.720 0.02 A 31 ALA HB% H 1 1.465 0.02 A 31 ALA C C 13 179.170 0.2 A 31 ALA CA C 13 56.354 0.2 A 31 ALA CB C 13 17.843 0.2 A 31 ALA N N 15 121.171 0.2 A 32 ASP H H 1 8.293 0.02 A 32 ASP HA H 1 4.422 0.02 A 32 ASP HBy H 1 2.814 0.02 A 32 ASP HBx H 1 2.728 0.02 A 32 ASP C C 13 179.136 0.2 A 32 ASP CA C 13 57.109 0.2 A 32 ASP CB C 13 40.523 0.2 A 32 ASP N N 15 116.467 0.2 A 33 ALA H H 1 7.536 0.02 A 33 ALA HA H 1 4.222 0.02 A 33 ALA HB% H 1 1.529 0.02 A 33 ALA C C 13 179.056 0.2 A 33 ALA CA C 13 54.469 0.2 A 33 ALA CB C 13 19.085 0.2 A 33 ALA N N 15 120.859 0.2 A 34 ALA H H 1 8.296 0.02 A 34 ALA HA H 1 4.101 0.02 A 34 ALA HB% H 1 1.243 0.02 A 34 ALA C C 13 176.912 0.2 A 34 ALA CA C 13 52.380 0.2 A 34 ALA CB C 13 18.817 0.2 A 34 ALA N N 15 118.203 0.2 A 35 GLY H H 1 7.911 0.02 A 35 GLY HAx H 1 3.968 0.02 A 35 GLY HAy H 1 3.968 0.02 A 35 GLY C C 13 174.374 0.2 A 35 GLY CA C 13 46.388 0.2 A 35 GLY N N 15 107.752 0.2 A 36 LEU H H 1 7.758 0.02 A 36 LEU HA H 1 4.887 0.02 A 36 LEU HBy H 1 1.699 0.02 A 36 LEU HBx H 1 1.334 0.02 A 36 LEU HD1% H 1 0.784 0.02 A 36 LEU HD2% H 1 0.966 0.02 A 36 LEU HG H 1 1.536 0.02 A 36 LEU C C 13 175.941 0.2 A 36 LEU CA C 13 52.443 0.2 A 36 LEU CB C 13 47.885 0.2 A 36 LEU CD1 C 13 26.618 0.2 A 36 LEU CD2 C 13 22.855 0.2 A 36 LEU CG C 13 26.364 0.2 A 36 LEU N N 15 118.719 0.2 A 37 SER H H 1 8.603 0.02 A 37 SER HA H 1 4.565 0.02 A 37 SER HBy H 1 4.409 0.02 A 37 SER HBx H 1 4.105 0.02 A 37 SER C C 13 175.512 0.2 A 37 SER CA C 13 57.262 0.2 A 37 SER CB C 13 65.155 0.2 A 37 SER N N 15 115.095 0.2 A 38 ILE H H 1 8.822 0.02 A 38 ILE HA H 1 3.650 0.02 A 38 ILE HB H 1 1.858 0.02 A 38 ILE HD1% H 1 0.868 0.02 A 38 ILE HG1y H 1 1.492 0.02 A 38 ILE HG1x H 1 1.167 0.02 A 38 ILE HG2% H 1 0.854 0.02 A 38 ILE C C 13 176.849 0.2 A 38 ILE CA C 13 64.557 0.2 A 38 ILE CB C 13 37.451 0.2 A 38 ILE CD1 C 13 13.086 0.2 A 38 ILE CG1 C 13 29.180 0.2 A 38 ILE CG2 C 13 17.196 0.2 A 38 ILE N N 15 122.026 0.2 A 39 TYR H H 1 7.839 0.02 A 39 TYR HA H 1 4.112 0.02 A 39 TYR HBy H 1 3.122 0.02 A 39 TYR HBx H 1 2.971 0.02 A 39 TYR HDx H 1 7.116 0.02 A 39 TYR HDy H 1 7.116 0.02 A 39 TYR HEx H 1 6.871 0.02 A 39 TYR HEy H 1 6.871 0.02 A 39 TYR C C 13 177.703 0.2 A 39 TYR CA C 13 60.856 0.2 A 39 TYR CB C 13 38.402 0.2 A 39 TYR CDx C 13 133.142 0.2 A 39 TYR CDy C 13 133.142 0.2 A 39 TYR CEx C 13 118.460 0.2 A 39 TYR CEy C 13 118.460 0.2 A 39 TYR N N 15 118.759 0.2 A 40 GLN H H 1 7.687 0.02 A 40 GLN HA H 1 3.865 0.02 A 40 GLN HBy H 1 2.303 0.02 A 40 GLN HBx H 1 2.069 0.02 A 40 GLN HE21 H 1 7.188 0.02 A 40 GLN HE22 H 1 7.032 0.02 A 40 GLN HGy H 1 2.495 0.02 A 40 GLN HGx H 1 2.432 0.02 A 40 GLN C C 13 178.735 0.2 A 40 GLN CA C 13 58.089 0.2 A 40 GLN CB C 13 29.950 0.2 A 40 GLN CD C 13 179.405 0.2 A 40 GLN CG C 13 34.608 0.2 A 40 GLN N N 15 116.772 0.2 A 40 GLN NE2 N 15 112.667 0.2 A 41 VAL H H 1 8.494 0.02 A 41 VAL HA H 1 3.835 0.02 A 41 VAL HB H 1 1.977 0.02 A 41 VAL HG1% H 1 0.982 0.02 A 41 VAL HG2% H 1 0.917 0.02 A 41 VAL C C 13 176.977 0.2 A 41 VAL CA C 13 66.102 0.2 A 41 VAL CB C 13 31.105 0.2 A 41 VAL CG1 C 13 22.414 0.2 A 41 VAL CG2 C 13 24.781 0.2 A 41 VAL N N 15 117.192 0.2 A 42 ARG H H 1 8.179 0.02 A 42 ARG HA H 1 3.708 0.02 A 42 ARG HBy H 1 1.989 0.02 A 42 ARG HBx H 1 1.907 0.02 A 42 ARG HDx H 1 3.313 0.02 A 42 ARG HDy H 1 3.313 0.02 A 42 ARG HGy H 1 1.932 0.02 A 42 ARG HGx H 1 1.759 0.02 A 42 ARG C C 13 177.570 0.2 A 42 ARG CA C 13 60.349 0.2 A 42 ARG CB C 13 30.047 0.2 A 42 ARG CD C 13 43.864 0.2 A 42 ARG CG C 13 28.543 0.2 A 42 ARG N N 15 120.574 0.2 A 43 LEU H H 1 6.982 0.02 A 43 LEU HA H 1 3.939 0.02 A 43 LEU HBy H 1 1.553 0.02 A 43 LEU HBx H 1 1.216 0.02 A 43 LEU HD1% H 1 0.724 0.02 A 43 LEU HD2% H 1 0.656 0.02 A 43 LEU HG H 1 1.475 0.02 A 43 LEU C C 13 180.397 0.2 A 43 LEU CA C 13 58.119 0.2 A 43 LEU CB C 13 41.294 0.2 A 43 LEU CD1 C 13 25.128 0.2 A 43 LEU CD2 C 13 23.030 0.2 A 43 LEU CG C 13 26.385 0.2 A 43 LEU N N 15 117.189 0.2 A 44 TYR H H 1 7.026 0.02 A 44 TYR HA H 1 4.253 0.02 A 44 TYR HBx H 1 2.765 0.02 A 44 TYR HBy H 1 2.765 0.02 A 44 TYR HDx H 1 7.023 0.02 A 44 TYR HDy H 1 7.023 0.02 A 44 TYR HEx H 1 6.759 0.02 A 44 TYR HEy H 1 6.759 0.02 A 44 TYR C C 13 178.411 0.2 A 44 TYR CA C 13 60.941 0.2 A 44 TYR CB C 13 38.889 0.2 A 44 TYR CDx C 13 132.551 0.2 A 44 TYR CDy C 13 132.551 0.2 A 44 TYR CEx C 13 118.250 0.2 A 44 TYR CEy C 13 118.250 0.2 A 44 TYR N N 15 117.020 0.2 A 45 LEU H H 1 8.429 0.02 A 45 LEU HA H 1 3.486 0.02 A 45 LEU HBy H 1 1.029 0.02 A 45 LEU HBx H 1 -0.659 0.02 A 45 LEU HD1% H 1 -0.074 0.02 A 45 LEU HD2% H 1 -0.038 0.02 A 45 LEU HG H 1 1.495 0.02 A 45 LEU C C 13 178.648 0.2 A 45 LEU CA C 13 57.915 0.2 A 45 LEU CB C 13 39.073 0.2 A 45 LEU CD1 C 13 26.434 0.2 A 45 LEU CD2 C 13 22.317 0.2 A 45 LEU CG C 13 25.320 0.2 A 45 LEU N N 15 119.649 0.2 A 46 GLU H H 1 8.309 0.02 A 46 GLU HA H 1 4.286 0.02 A 46 GLU HBy H 1 2.227 0.02 A 46 GLU HBx H 1 2.113 0.02 A 46 GLU HGx H 1 2.575 0.02 A 46 GLU HGy H 1 2.575 0.02 A 46 GLU C C 13 179.577 0.2 A 46 GLU CA C 13 59.570 0.2 A 46 GLU CB C 13 29.034 0.2 A 46 GLU CG C 13 36.216 0.2 A 46 GLU N N 15 117.366 0.2 A 47 GLN H H 1 7.493 0.02 A 47 GLN HA H 1 4.243 0.02 A 47 GLN HBy H 1 2.319 0.02 A 47 GLN HBx H 1 2.264 0.02 A 47 GLN HE21 H 1 7.309 0.02 A 47 GLN HE22 H 1 6.632 0.02 A 47 GLN HGy H 1 2.642 0.02 A 47 GLN HGx H 1 2.425 0.02 A 47 GLN C C 13 178.870 0.2 A 47 GLN CA C 13 59.581 0.2 A 47 GLN CB C 13 28.300 0.2 A 47 GLN CD C 13 179.805 0.2 A 47 GLN CG C 13 34.050 0.2 A 47 GLN N N 15 119.345 0.2 A 47 GLN NE2 N 15 109.772 0.2 A 48 LEU H H 1 8.160 0.02 A 48 LEU HA H 1 4.211 0.02 A 48 LEU HBy H 1 2.086 0.02 A 48 LEU HBx H 1 1.159 0.02 A 48 LEU HD1% H 1 0.727 0.02 A 48 LEU HD2% H 1 0.805 0.02 A 48 LEU HG H 1 1.924 0.02 A 48 LEU C C 13 180.111 0.2 A 48 LEU CA C 13 57.179 0.2 A 48 LEU CB C 13 42.067 0.2 A 48 LEU CD1 C 13 25.409 0.2 A 48 LEU CD2 C 13 22.628 0.2 A 48 LEU CG C 13 27.107 0.2 A 48 LEU N N 15 118.594 0.2 A 49 HIS H H 1 8.864 0.02 A 49 HIS HA H 1 5.162 0.02 A 49 HIS HBy H 1 3.909 0.02 A 49 HIS HBx H 1 3.430 0.02 A 49 HIS HD2 H 1 7.614 0.02 A 49 HIS C C 13 178.801 0.2 A 49 HIS CA C 13 58.397 0.2 A 49 HIS CB C 13 29.631 0.2 A 49 HIS CD2 C 13 122.86 0.2 A 49 HIS N N 15 122.537 0.2 A 50 ASP H H 1 8.683 0.02 A 50 ASP HA H 1 4.356 0.02 A 50 ASP HBy H 1 3.084 0.02 A 50 ASP HBx H 1 2.819 0.02 A 50 ASP C C 13 178.474 0.2 A 50 ASP CA C 13 57.744 0.2 A 50 ASP CB C 13 40.575 0.2 A 50 ASP N N 15 123.169 0.2 A 51 VAL H H 1 7.606 0.02 A 51 VAL HA H 1 4.514 0.02 A 51 VAL HB H 1 2.542 0.02 A 51 VAL HG1% H 1 1.081 0.02 A 51 VAL HG2% H 1 1.160 0.02 A 51 VAL C C 13 176.862 0.2 A 51 VAL CA C 13 61.590 0.2 A 51 VAL CB C 13 31.423 0.2 A 51 VAL CG1 C 13 21.296 0.2 A 51 VAL CG2 C 13 19.733 0.2 A 51 VAL N N 15 109.266 0.2 A 52 GLY H H 1 7.696 0.02 A 52 GLY HAy H 1 4.172 0.02 A 52 GLY HAx H 1 3.938 0.02 A 52 GLY C C 13 174.276 0.2 A 52 GLY CA C 13 46.228 0.2 A 52 GLY N N 15 108.681 0.2 A 53 VAL H H 1 8.046 0.02 A 53 VAL HA H 1 4.079 0.02 A 53 VAL HB H 1 1.940 0.02 A 53 VAL HG1% H 1 0.891 0.02 A 53 VAL HG2% H 1 0.927 0.02 A 53 VAL C C 13 175.949 0.2 A 53 VAL CA C 13 64.063 0.2 A 53 VAL CB C 13 33.160 0.2 A 53 VAL CG1 C 13 21.189 0.2 A 53 VAL CG2 C 13 22.541 0.2 A 53 VAL N N 15 117.892 0.2 A 54 LEU H H 1 6.835 0.02 A 54 LEU HA H 1 5.348 0.02 A 54 LEU HBy H 1 1.806 0.02 A 54 LEU HBx H 1 1.515 0.02 A 54 LEU HD1% H 1 0.782 0.02 A 54 LEU HD2% H 1 0.877 0.02 A 54 LEU HG H 1 1.578 0.02 A 54 LEU C C 13 175.713 0.2 A 54 LEU CA C 13 52.194 0.2 A 54 LEU CB C 13 46.733 0.2 A 54 LEU CD1 C 13 28.461 0.2 A 54 LEU CD2 C 13 25.149 0.2 A 54 LEU CG C 13 27.399 0.2 A 54 LEU N N 15 114.848 0.2 A 55 GLU H H 1 9.549 0.02 A 55 GLU HA H 1 4.826 0.02 A 55 GLU HBx H 1 1.962 0.02 A 55 GLU HBy H 1 1.962 0.02 A 55 GLU HGy H 1 2.259 0.02 A 55 GLU HGx H 1 1.994 0.02 A 55 GLU C C 13 174.661 0.2 A 55 GLU CA C 13 54.637 0.2 A 55 GLU CB C 13 32.891 0.2 A 55 GLU CG C 13 36.073 0.2 A 55 GLU N N 15 121.431 0.2 A 56 LYS H H 1 8.513 0.02 A 56 LYS HA H 1 4.151 0.02 A 56 LYS HBy H 1 1.208 0.02 A 56 LYS HBx H 1 0.788 0.02 A 56 LYS HDx H 1 1.209 0.02 A 56 LYS HDy H 1 1.209 0.02 A 56 LYS HEy H 1 2.577 0.02 A 56 LYS HEx H 1 2.397 0.02 A 56 LYS HGy H 1 0.525 0.02 A 56 LYS HGx H 1 0.039 0.02 A 56 LYS C C 13 176.270 0.2 A 56 LYS CA C 13 54.890 0.2 A 56 LYS CB C 13 33.162 0.2 A 56 LYS CD C 13 29.719 0.2 A 56 LYS CE C 13 41.943 0.2 A 56 LYS CG C 13 25.006 0.2 A 56 LYS N N 15 126.539 0.2 A 57 VAL H H 1 8.279 0.02 A 57 VAL HA H 1 3.820 0.02 A 57 VAL HB H 1 1.648 0.02 A 57 VAL HG1% H 1 0.810 0.02 A 57 VAL HG2% H 1 0.681 0.02 A 57 VAL C C 13 175.108 0.2 A 57 VAL CA C 13 62.834 0.2 A 57 VAL CB C 13 32.549 0.2 A 57 VAL CG1 C 13 20.782 0.2 A 57 VAL CG2 C 13 21.099 0.2 A 57 VAL N N 15 126.540 0.2 A 58 ASN H H 1 8.383 0.02 A 58 ASN HA H 1 4.612 0.02 A 58 ASN HBx H 1 2.758 0.02 A 58 ASN HBy H 1 2.758 0.02 A 58 ASN HD21 H 1 7.511 0.02 A 58 ASN HD22 H 1 6.969 0.02 A 58 ASN C C 13 174.772 0.2 A 58 ASN CA C 13 52.575 0.2 A 58 ASN CB C 13 38.502 0.2 A 58 ASN CG C 13 177.088 0.2 A 58 ASN N N 15 121.767 0.2 A 58 ASN ND2 N 15 112.519 0.2 A 59 ALA H H 1 8.165 0.02 A 59 ALA HA H 1 4.251 0.02 A 59 ALA HB% H 1 1.334 0.02 A 59 ALA C C 13 177.478 0.2 A 59 ALA CA C 13 52.490 0.2 A 59 ALA CB C 13 19.724 0.2 A 59 ALA N N 15 125.082 0.2 A 60 GLY H H 1 8.291 0.02 A 60 GLY HAy H 1 4.165 0.02 A 60 GLY HAx H 1 3.853 0.02 A 60 GLY C C 13 174.171 0.2 A 60 GLY CA C 13 44.994 0.2 A 60 GLY N N 15 108.518 0.2 A 61 LYS H H 1 8.189 0.02 A 61 LYS HA H 1 4.320 0.02 A 61 LYS HBy H 1 1.887 0.02 A 61 LYS HBx H 1 1.808 0.02 A 61 LYS HDx H 1 1.687 0.02 A 61 LYS HDy H 1 1.687 0.02 A 61 LYS HEx H 1 3.015 0.02 A 61 LYS HEy H 1 3.015 0.02 A 61 LYS HGy H 1 1.466 0.02 A 61 LYS HGx H 1 1.376 0.02 A 61 LYS C C 13 177.712 0.2 A 61 LYS CA C 13 56.832 0.2 A 61 LYS CB C 13 32.641 0.2 A 61 LYS CD C 13 29.105 0.2 A 61 LYS CE C 13 42.229 0.2 A 61 LYS CG C 13 24.844 0.2 A 61 LYS N N 15 120.532 0.2 A 62 GLY H H 1 8.767 0.02 A 62 GLY HAy H 1 4.021 0.02 A 62 GLY HAx H 1 3.849 0.02 A 62 GLY C C 13 173.782 0.2 A 62 GLY CA C 13 45.844 0.2 A 62 GLY N N 15 111.547 0.2 A 63 VAL H H 1 7.379 0.02 A 63 VAL HA H 1 4.591 0.02 A 63 VAL HB H 1 2.112 0.02 A 63 VAL HG1% H 1 0.961 0.02 A 63 VAL HG2% H 1 0.779 0.02 A 63 VAL C C 13 174.262 0.2 A 63 VAL CA C 13 59.292 0.2 A 63 VAL CB C 13 32.726 0.2 A 63 VAL CG1 C 13 21.341 0.2 A 63 VAL CG2 C 13 19.659 0.2 A 63 VAL N N 15 117.546 0.2 A 64 PRO HA H 1 4.458 0.02 A 64 PRO HBy H 1 2.435 0.02 A 64 PRO HBx H 1 2.033 0.02 A 64 PRO HDy H 1 3.899 0.02 A 64 PRO HDx H 1 3.714 0.02 A 64 PRO HGy H 1 2.139 0.02 A 64 PRO HGx H 1 2.029 0.02 A 64 PRO C C 13 177.166 0.2 A 64 PRO CA C 13 63.661 0.2 A 64 PRO CB C 13 32.321 0.2 A 64 PRO CD C 13 51.126 0.2 A 64 PRO CG C 13 27.715 0.2 A 65 GLY H H 1 8.463 0.02 A 65 GLY HAy H 1 3.882 0.02 A 65 GLY HAx H 1 3.602 0.02 A 65 GLY C C 13 172.406 0.2 A 65 GLY CA C 13 45.933 0.2 A 65 GLY N N 15 109.819 0.2 A 66 LEU H H 1 7.534 0.02 A 66 LEU HA H 1 4.940 0.02 A 66 LEU HBy H 1 1.358 0.02 A 66 LEU HBx H 1 1.130 0.02 A 66 LEU HD1% H 1 0.790 0.02 A 66 LEU HD2% H 1 0.790 0.02 A 66 LEU HG H 1 1.489 0.02 A 66 LEU C C 13 176.237 0.2 A 66 LEU CA C 13 53.687 0.2 A 66 LEU CB C 13 46.108 0.2 A 66 LEU CD1 C 13 26.091 0.2 A 66 LEU CD2 C 13 25.059 0.2 A 66 LEU CG C 13 27.006 0.2 A 66 LEU N N 15 122.249 0.2 A 67 TRP H H 1 8.916 0.02 A 67 TRP HA H 1 5.526 0.02 A 67 TRP HBy H 1 3.118 0.02 A 67 TRP HBx H 1 2.792 0.02 A 67 TRP HD1 H 1 7.248 0.02 A 67 TRP HE1 H 1 10.189 0.02 A 67 TRP HE3 H 1 7.257 0.02 A 67 TRP HH2 H 1 6.933 0.02 A 67 TRP HZ2 H 1 7.371 0.02 A 67 TRP HZ3 H 1 6.582 0.02 A 67 TRP C C 13 175.670 0.2 A 67 TRP CA C 13 56.241 0.2 A 67 TRP CB C 13 33.314 0.2 A 67 TRP CD1 C 13 128.556 0.2 A 67 TRP CE3 C 13 119.915 0.2 A 67 TRP CH2 C 13 123.666 0.2 A 67 TRP CZ2 C 13 114.393 0.2 A 67 TRP CZ3 C 13 121.347 0.2 A 67 TRP N N 15 121.160 0.2 A 67 TRP NE1 N 15 130.898 0.2 A 68 ARG H H 1 8.772 0.02 A 68 ARG HA H 1 4.832 0.02 A 68 ARG HBy H 1 1.814 0.02 A 68 ARG HBx H 1 1.748 0.02 A 68 ARG HDy H 1 3.171 0.02 A 68 ARG HDx H 1 3.053 0.02 A 68 ARG HE H 1 7.412 0.02 A 68 ARG HGx H 1 1.504 0.02 A 68 ARG HGy H 1 1.504 0.02 A 68 ARG C C 13 174.720 0.2 A 68 ARG CA C 13 54.690 0.2 A 68 ARG CB C 13 35.176 0.2 A 68 ARG CD C 13 43.885 0.2 A 68 ARG CG C 13 27.252 0.2 A 68 ARG N N 15 117.471 0.2 A 68 ARG NE N 15 84.44 0.2 A 69 LEU H H 1 9.355 0.02 A 69 LEU HA H 1 4.557 0.02 A 69 LEU HBy H 1 1.692 0.02 A 69 LEU HBx H 1 1.520 0.02 A 69 LEU HD1% H 1 0.929 0.02 A 69 LEU HD2% H 1 0.893 0.02 A 69 LEU HG H 1 1.643 0.02 A 69 LEU C C 13 177.180 0.2 A 69 LEU CA C 13 55.780 0.2 A 69 LEU CB C 13 42.736 0.2 A 69 LEU CD1 C 13 25.191 0.2 A 69 LEU CD2 C 13 24.948 0.2 A 69 LEU CG C 13 27.588 0.2 A 69 LEU N N 15 125.211 0.2 A 70 LEU H H 1 8.058 0.02 A 70 LEU HA H 1 4.364 0.02 A 70 LEU HBx H 1 1.504 0.02 A 70 LEU HBy H 1 1.504 0.02 A 70 LEU HD1% H 1 0.804 0.02 A 70 LEU HD2% H 1 0.846 0.02 A 70 LEU HG H 1 1.490 0.02 A 70 LEU C C 13 176.808 0.2 A 70 LEU CA C 13 55.257 0.2 A 70 LEU CB C 13 42.413 0.2 A 70 LEU CD1 C 13 25.016 0.2 A 70 LEU CD2 C 13 23.969 0.2 A 70 LEU CG C 13 27.481 0.2 A 70 LEU N N 15 125.525 0.2 A 71 GLU H H 1 8.434 0.02 A 71 GLU HA H 1 4.284 0.02 A 71 GLU HBy H 1 1.929 0.02 A 71 GLU HBx H 1 1.902 0.02 A 71 GLU HGy H 1 2.233 0.02 A 71 GLU HGx H 1 2.154 0.02 A 71 GLU C C 13 175.875 0.2 A 71 GLU CA C 13 56.552 0.2 A 71 GLU CB C 13 30.569 0.2 A 71 GLU CG C 13 36.305 0.2 A 71 GLU N N 15 122.637 0.2 stop_ save_ save_CNS/XPLOR_distance_constraints_2 _nef_distance_restraint_list.sf_category nef_distance_restraint_list _nef_distance_restraint_list.sf_framecode CNS/XPLOR_distance_constraints_2 _nef_distance_restraint_list.restraint_origin noe _nef_distance_restraint_list.potential_type square-well-parabolic loop_ _nef_distance_restraint.index _nef_distance_restraint.restraint_id _nef_distance_restraint.chain_code_1 _nef_distance_restraint.sequence_code_1 _nef_distance_restraint.residue_name_1 _nef_distance_restraint.atom_name_1 _nef_distance_restraint.chain_code_2 _nef_distance_restraint.sequence_code_2 _nef_distance_restraint.residue_name_2 _nef_distance_restraint.atom_name_2 _nef_distance_restraint.weight _nef_distance_restraint.lower_limit _nef_distance_restraint.upper_limit 1 1 A 29 ASP HA A 32 ASP HBy 1.0 1.8 4.81 2 2 A 3 GLU HA A 3 GLU HGx 1.0 1.8 4.35 3 2 A 3 GLU HA A 3 GLU HGy 1.0 1.8 4.35 4 3 A 5 ILE HA A 5 ILE HG2% 1.0 1.8 4.33 5 4 A 6 VAL HA A 6 VAL HG1% 1.0 1.8 3.66 6 5 A 7 THR HA A 7 THR HG2% 1.0 1.8 3.85 7 6 A 8 LYS HA A 8 LYS HGy 1.0 1.8 4.64 8 7 A 9 ILE HA A 9 ILE HG2% 1.0 1.8 3.93 9 8 A 10 ILE HA A 10 ILE HG2% 1.0 1.8 3.70 10 9 A 12 ILE HA A 12 ILE HG2% 1.0 1.8 3.86 11 10 A 13 VAL HA A 13 VAL HG2% 1.0 1.8 3.69 12 11 A 14 GLN HA A 14 GLN HGx 1.0 1.8 3.93 13 11 A 14 GLN HA A 14 GLN HGy 1.0 1.8 3.93 14 12 A 15 GLU HA A 15 GLU HGy 1.0 1.8 4.61 15 13 A 16 ARG HA A 16 ARG HGy 1.0 1.8 4.55 16 14 A 19 MET HA A 19 MET HGy 1.0 1.8 4.50 17 15 A 25 VAL HA A 25 VAL HG1% 1.0 1.8 3.95 18 16 A 28 ARG HA A 28 ARG HGy 1.0 1.8 4.60 19 17 A 40 GLN HA A 40 GLN HGy 1.0 1.8 4.60 20 18 A 41 VAL HA A 41 VAL HG1% 1.0 1.8 4.06 21 19 A 42 ARG HA A 42 ARG HGy 1.0 1.8 4.59 22 20 A 46 GLU HA A 46 GLU HGx 1.0 1.8 4.27 23 20 A 46 GLU HA A 46 GLU HGy 1.0 1.8 4.27 24 21 A 51 VAL HA A 51 VAL HG2% 1.0 1.8 4.13 25 22 A 53 VAL HA A 53 VAL HG1% 1.0 1.8 3.59 26 23 A 57 VAL HA A 57 VAL HG1% 1.0 1.8 3.97 27 24 A 15 GLU HA A 14 GLN HGx 1.0 1.8 5.15 28 24 A 14 GLN HGy A 15 GLU HA 1.0 1.8 5.15 29 25 A 17 GLN HA A 17 GLN HGx 1.0 1.8 3.93 30 25 A 17 GLN HA A 17 GLN HGy 1.0 1.8 3.93 31 26 A 19 MET HA A 19 MET HGx 1.0 1.8 4.50 32 27 A 28 ARG HA A 28 ARG HGx 1.0 1.8 4.60 33 28 A 40 GLN HA A 40 GLN HGx 1.0 1.8 4.60 34 29 A 42 ARG HA A 42 ARG HGx 1.0 1.8 4.59 35 30 A 47 GLN HA A 47 GLN HGx 1.0 1.8 4.55 36 31 A 43 LEU HA A 43 LEU HG 1.0 1.8 4.50 37 32 A 48 LEU HA A 48 LEU HG 1.0 1.8 4.46 38 33 A 48 LEU HA A 53 VAL HB 1.0 1.8 5.05 39 34 A 69 LEU HA A 69 LEU HG 1.0 1.8 4.54 40 35 A 5 ILE HA A 5 ILE HD1% 1.0 1.8 4.37 41 36 A 9 ILE HA A 9 ILE HD1% 1.0 1.8 4.25 42 37 A 10 ILE HA A 10 ILE HD1% 1.0 1.8 4.27 43 38 A 12 ILE HA A 12 ILE HD1% 1.0 1.8 4.50 44 39 A 38 ILE HA A 38 ILE HD1% 1.0 1.8 3.82 45 40 A 39 TYR HA A 39 TYR HD% 1.0 1.8 4.47 46 41 A 43 LEU HA A 43 LEU HD1% 1.0 1.8 4.38 47 42 A 45 LEU HA A 45 LEU HD1% 1.0 1.8 4.46 48 43 A 48 LEU HA A 48 LEU HD2% 1.0 1.8 3.70 49 44 A 67 TRP HA A 67 TRP HE3 1.0 1.8 5.05 50 45 A 69 LEU HA A 69 LEU HD2% 1.0 1.8 5.15 51 46 A 26 LYS HA A 26 LYS HDy 1.0 1.8 5.02 52 47 A 43 LEU HA A 43 LEU HD2% 1.0 1.8 3.75 53 48 A 48 LEU HA A 48 LEU HD1% 1.0 1.8 4.47 54 49 A 54 LEU HA A 54 LEU HD1% 1.0 1.8 5.04 55 50 A 69 LEU HA A 70 LEU HD2% 1.0 1.8 4.46 56 51 A 70 LEU HA A 70 LEU HD1% 1.0 1.8 4.71 57 52 A 26 LYS HA A 26 LYS HDx 1.0 1.8 5.02 58 53 A 28 ARG HA A 28 ARG HDx 1.0 1.8 5.21 59 54 A 61 LYS HA A 61 LYS HDx 1.0 1.8 4.84 60 54 A 61 LYS HA A 61 LYS HDy 1.0 1.8 4.84 61 55 A 9 ILE HA A 9 ILE HG1y 1.0 1.8 4.63 62 56 A 10 ILE HA A 10 ILE HG1y 1.0 1.8 3.96 63 57 A 12 ILE HA A 12 ILE HG1y 1.0 1.8 4.16 64 58 A 30 ILE HA A 30 ILE HG1y 1.0 1.8 4.50 65 59 A 9 ILE HA A 12 ILE HD1% 1.0 1.8 3.75 66 60 A 10 ILE HA A 10 ILE HG1x 1.0 1.8 3.96 67 61 A 12 ILE HA A 12 ILE HG1x 1.0 1.8 4.16 68 62 A 30 ILE HA A 30 ILE HG1x 1.0 1.8 4.50 69 63 A 6 VAL HA A 6 VAL HG2% 1.0 1.8 3.82 70 64 A 13 VAL HA A 13 VAL HG1% 1.0 1.8 3.76 71 65 A 53 VAL HA A 53 VAL HG2% 1.0 1.8 3.55 72 66 A 57 VAL HA A 57 VAL HG2% 1.0 1.8 4.06 73 67 A 63 VAL HA A 63 VAL HG1% 1.0 1.8 3.95 74 68 A 26 LYS HBx A 28 ARG H 1.0 1.8 4.61 75 69 A 47 GLN H A 47 GLN HBy 1.0 1.8 4.36 76 70 A 55 GLU HBx A 55 GLU HGx 1.0 1.8 3.30 77 70 A 55 GLU HBy A 55 GLU HGx 1.0 1.8 3.30 78 71 A 9 ILE HD1% A 9 ILE HB 1.0 1.8 3.73 79 72 A 10 ILE HD1% A 10 ILE HB 1.0 1.8 3.44 80 73 A 12 ILE HB A 30 ILE HG2% 1.0 1.8 4.64 81 74 A 26 LYS HBx A 26 LYS HDy 1.0 1.8 4.41 82 75 A 54 LEU HD1% A 54 LEU HBx 1.0 1.8 4.22 83 76 A 69 LEU HD2% A 69 LEU HBy 1.0 1.8 3.85 84 77 A 70 LEU HD1% A 70 LEU HBx 1.0 1.8 3.59 85 77 A 70 LEU HD1% A 70 LEU HBy 1.0 1.8 3.59 86 78 A 47 GLN HA A 47 GLN HGy 1.0 1.8 4.55 87 79 A 8 LYS HA A 8 LYS HGx 1.0 1.8 4.64 88 80 A 15 GLU HA A 15 GLU HGx 1.0 1.8 4.61 89 81 A 68 ARG HA A 68 ARG HGx 1.0 1.8 4.63 90 81 A 68 ARG HA A 68 ARG HGy 1.0 1.8 4.63 91 82 A 15 GLU H A 15 GLU HGy 1.0 1.8 5.17 92 83 A 15 GLU H A 15 GLU HGx 1.0 1.8 5.17 93 84 A 40 GLN H A 40 GLN HGx 1.0 1.8 5.02 94 85 A 55 GLU HGy A 55 GLU HBx 1.0 1.8 3.30 95 85 A 55 GLU HBy A 55 GLU HGy 1.0 1.8 3.30 96 86 A 54 LEU HD1% A 48 LEU HBy 1.0 1.8 4.38 97 87 A 70 LEU HD2% A 70 LEU HBx 1.0 1.8 3.53 98 87 A 70 LEU HD2% A 70 LEU HBy 1.0 1.8 3.53 99 88 A 44 TYR HD% A 40 GLN HGy 1.0 1.8 6.03 100 89 A 44 TYR HD% A 40 GLN HGx 1.0 1.8 6.03 101 90 A 9 ILE HG2% A 9 ILE HG1y 1.0 1.8 4.00 102 91 A 10 ILE HG2% A 10 ILE HG1y 1.0 1.8 3.81 103 92 A 12 ILE HG2% A 12 ILE HG1y 1.0 1.8 4.03 104 93 A 9 ILE HG2% A 9 ILE HG1x 1.0 1.8 4.00 105 94 A 10 ILE HG2% A 10 ILE HG1x 1.0 1.8 3.81 106 95 A 38 ILE HG2% A 38 ILE HG1x 1.0 1.8 4.28 107 96 A 17 GLN H A 17 GLN HBx 1.0 1.8 4.36 108 97 A 47 GLN H A 47 GLN HBx 1.0 1.8 4.36 109 98 A 55 GLU H A 55 GLU HBx 1.0 1.8 3.85 110 98 A 55 GLU HBy A 55 GLU H 1.0 1.8 3.85 111 99 A 69 LEU H A 69 LEU HBx 1.0 1.8 4.20 112 100 A 43 LEU H A 44 TYR HBx 1.0 1.8 4.81 113 100 A 43 LEU H A 44 TYR HBy 1.0 1.8 4.81 114 101 A 8 LYS HDy A 8 LYS HBx 1.0 1.8 4.52 115 101 A 8 LYS HBx A 8 LYS HDx 1.0 1.8 4.52 116 102 A 69 LEU HD2% A 69 LEU HBx 1.0 1.8 3.85 117 103 A 26 LYS HBx A 26 LYS HDx 1.0 1.8 4.41 118 104 A 26 LYS HGx A 26 LYS HEx 1.0 1.8 3.93 119 104 A 26 LYS HGx A 26 LYS HEy 1.0 1.8 3.93 120 105 A 26 LYS HGy A 26 LYS HEx 1.0 1.8 4.42 121 105 A 26 LYS HEy A 26 LYS HGy 1.0 1.8 4.42 122 106 A 53 VAL HB A 48 LEU HD2% 1.0 1.8 4.18 123 107 A 36 LEU HD1% A 36 LEU HBy 1.0 1.8 4.08 124 108 A 43 LEU HD1% A 43 LEU HBy 1.0 1.8 4.00 125 109 A 45 LEU HD1% A 45 LEU HBy 1.0 1.8 4.07 126 110 A 48 LEU HD2% A 48 LEU HBy 1.0 1.8 4.43 127 111 A 54 LEU HBx A 54 LEU HD2% 1.0 1.8 4.17 128 112 A 66 LEU HBy A 66 LEU HD1% 1.0 1.8 3.83 129 113 A 69 LEU HD1% A 69 LEU HBy 1.0 1.8 3.89 130 114 A 36 LEU HD2% A 36 LEU HBy 1.0 1.8 3.88 131 115 A 43 LEU HD2% A 43 LEU HBy 1.0 1.8 4.39 132 116 A 45 LEU HD2% A 45 LEU HBy 1.0 1.8 4.38 133 117 A 48 LEU HD1% A 48 LEU HBy 1.0 1.8 4.20 134 118 A 36 LEU HD1% A 36 LEU HBx 1.0 1.8 4.08 135 119 A 43 LEU HD1% A 43 LEU HBx 1.0 1.8 4.00 136 120 A 45 LEU HD1% A 45 LEU HBx 1.0 1.8 4.07 137 121 A 48 LEU HD2% A 48 LEU HBx 1.0 1.8 3.82 138 122 A 54 LEU HD2% A 54 LEU HBy 1.0 1.8 3.65 139 123 A 66 LEU HD1% A 66 LEU HBx 1.0 1.8 4.59 140 124 A 69 LEU HD1% A 69 LEU HBx 1.0 1.8 3.89 141 125 A 36 LEU HD2% A 36 LEU HBx 1.0 1.8 3.88 142 126 A 43 LEU HD2% A 43 LEU HBx 1.0 1.8 4.39 143 127 A 45 LEU HD2% A 45 LEU HBx 1.0 1.8 4.38 144 128 A 54 LEU HD1% A 54 LEU HBy 1.0 1.8 4.05 145 129 A 26 LYS HBy A 26 LYS HDx 1.0 1.8 3.21 146 130 A 42 ARG HDy A 42 ARG HBx 1.0 1.8 3.83 147 130 A 42 ARG HBx A 42 ARG HDx 1.0 1.8 3.83 148 131 A 8 LYS HDy A 8 LYS HBy 1.0 1.8 4.52 149 131 A 8 LYS HBy A 8 LYS HDx 1.0 1.8 4.52 150 132 A 26 LYS HBy A 26 LYS HDy 1.0 1.8 3.21 151 133 A 42 ARG HDy A 42 ARG HBy 1.0 1.8 3.83 152 133 A 42 ARG HBy A 42 ARG HDx 1.0 1.8 3.83 153 134 A 63 VAL HB A 64 PRO HDy 1.0 1.8 4.14 154 135 A 5 ILE HD1% A 5 ILE HB 1.0 1.8 3.95 155 136 A 12 ILE HD1% A 12 ILE HB 1.0 1.8 3.86 156 137 A 30 ILE HB A 30 ILE HD1% 1.0 1.8 3.53 157 138 A 38 ILE HD1% A 38 ILE HB 1.0 1.8 4.11 158 139 A 10 ILE HG2% A 10 ILE HD1% 1.0 1.8 2.64 159 140 A 12 ILE HG2% A 12 ILE HD1% 1.0 1.8 3.42 160 141 A 66 LEU HA A 66 LEU HD2% 1.0 1.8 3.66 161 142 A 5 ILE HG2% A 5 ILE HD1% 1.0 1.8 4.26 162 143 A 9 ILE HG2% A 9 ILE HD1% 1.0 1.8 2.64 163 144 A 12 ILE HG2% A 30 ILE HG2% 1.0 1.8 4.00 164 145 A 30 ILE HG2% A 30 ILE HD1% 1.0 1.8 3.41 165 146 A 27 THR HA A 27 THR HG2% 1.0 1.8 3.75 166 147 A 30 ILE HA A 30 ILE HG2% 1.0 1.8 3.93 167 148 A 38 ILE HA A 38 ILE HG2% 1.0 1.8 4.04 168 149 A 63 VAL HA A 63 VAL HG2% 1.0 1.8 4.19 169 150 A 9 ILE HG2% A 13 VAL H 1.0 1.8 5.38 170 151 A 12 ILE HG2% A 34 ALA H 1.0 1.8 4.42 171 152 A 25 VAL HG1% A 26 LYS H 1.0 1.8 3.74 172 153 A 5 ILE HG2% A 5 ILE HG1y 1.0 1.8 4.25 173 154 A 30 ILE HG2% A 30 ILE HG1y 1.0 1.8 3.95 174 155 A 38 ILE HG2% A 38 ILE HG1y 1.0 1.8 4.28 175 156 A 5 ILE HG2% A 5 ILE HG1x 1.0 1.8 4.25 176 157 A 9 ILE HG2% A 30 ILE HG2% 1.0 1.8 3.33 177 158 A 12 ILE HG2% A 12 ILE HG1x 1.0 1.8 4.03 178 159 A 30 ILE HG2% A 30 ILE HG1x 1.0 1.8 3.95 179 160 A 30 ILE HD1% A 30 ILE H 1.0 1.8 4.60 180 161 A 17 GLN HA A 19 MET H 1.0 1.8 5.75 181 162 A 30 ILE HA A 34 ALA H 1.0 1.8 6.05 182 163 A 64 PRO HA A 65 GLY H 1.0 1.8 3.85 183 164 A 24 PRO HBy A 25 VAL H 1.0 1.8 4.66 184 165 A 51 VAL H A 50 ASP HBx 1.0 1.8 4.61 185 166 A 70 LEU H A 69 LEU HBx 1.0 1.8 4.85 186 167 A 25 VAL H A 24 PRO HBx 1.0 1.8 4.76 187 168 A 69 LEU H A 68 ARG HBy 1.0 1.8 4.63 188 169 A 26 LYS H A 25 VAL HB 1.0 1.8 4.52 189 170 A 29 ASP H A 28 ARG HGy 1.0 1.8 5.69 190 171 A 47 GLN H A 46 GLU HGx 1.0 1.8 5.47 191 171 A 46 GLU HGy A 47 GLN H 1.0 1.8 5.47 192 172 A 29 ASP H A 28 ARG HGx 1.0 1.8 5.69 193 173 A 28 ARG HA A 38 ILE HD1% 1.0 1.8 3.70 194 174 A 30 ILE HA A 30 ILE HD1% 1.0 1.8 4.47 195 175 A 54 LEU HA A 54 LEU HD2% 1.0 1.8 3.84 196 176 A 66 LEU HD1% A 66 LEU HA 1.0 1.8 4.41 197 177 A 70 LEU HD2% A 70 LEU HA 1.0 1.8 3.92 198 178 A 36 LEU HD2% A 36 LEU HA 1.0 1.8 3.54 199 179 A 45 LEU HA A 45 LEU HD2% 1.0 1.8 3.90 200 180 A 69 LEU HA A 54 LEU HD2% 1.0 1.8 3.59 201 181 A 13 VAL HA A 25 VAL HG2% 1.0 1.8 4.21 202 182 A 27 THR HA A 30 ILE H 1.0 1.8 5.52 203 183 A 26 LYS HA A 27 THR HA 1.0 1.8 5.75 204 184 A 30 ILE HB A 27 THR HA 1.0 1.8 4.65 205 185 A 6 VAL HA A 9 ILE HD1% 1.0 1.8 4.16 206 186 A 10 ILE HA A 13 VAL HB 1.0 1.8 4.43 207 187 A 7 THR HA A 10 ILE H 1.0 1.8 5.19 208 188 A 41 VAL HA A 44 TYR H 1.0 1.8 4.43 209 189 A 41 VAL HA A 44 TYR HE% 1.0 1.8 5.89 210 190 A 41 VAL HA A 44 TYR HBx 1.0 1.8 4.71 211 190 A 41 VAL HA A 44 TYR HBy 1.0 1.8 4.71 212 191 A 41 VAL HA A 9 ILE HD1% 1.0 1.8 4.64 213 192 A 7 THR HA A 10 ILE HD1% 1.0 1.8 3.94 214 193 A 9 ILE HA A 12 ILE HB 1.0 1.8 4.21 215 194 A 9 ILE HA A 12 ILE HG2% 1.0 1.8 5.09 216 195 A 9 ILE HA A 13 VAL HG2% 1.0 1.8 5.39 217 196 A 9 ILE HA A 34 ALA HB% 1.0 1.8 5.44 218 197 A 39 TYR H A 37 SER HBx 1.0 1.8 5.30 219 198 A 12 ILE HA A 15 GLU HBx 1.0 1.8 4.41 220 199 A 12 ILE HG2% A 30 ILE HA 1.0 1.8 3.70 221 200 A 38 ILE HA A 42 ARG H 1.0 1.8 5.75 222 201 A 38 ILE HA A 41 VAL HB 1.0 1.8 4.69 223 202 A 41 VAL HG1% A 38 ILE HA 1.0 1.8 4.96 224 203 A 53 VAL HA A 70 LEU HG 1.0 1.8 5.15 225 204 A 5 ILE HA A 8 LYS HBy 1.0 1.8 5.14 226 205 A 5 ILE HA A 8 LYS HBx 1.0 1.8 5.14 227 206 A 11 SER HA A 15 GLU HBy 1.0 1.8 4.87 228 207 A 10 ILE HG2% A 11 SER HA 1.0 1.8 4.71 229 208 A 25 VAL HA A 24 PRO HBy 1.0 1.8 5.46 230 209 A 25 VAL HA A 26 LYS HBy 1.0 1.8 5.95 231 210 A 25 VAL HA A 26 LYS HGx 1.0 1.8 6.05 232 211 A 39 TYR HA A 42 ARG HDx 1.0 1.8 5.52 233 211 A 39 TYR HA A 42 ARG HDy 1.0 1.8 5.52 234 212 A 39 TYR HA A 38 ILE HG2% 1.0 1.8 4.94 235 213 A 42 ARG HA A 45 LEU HG 1.0 1.8 5.35 236 214 A 42 ARG HA A 27 THR HG2% 1.0 1.8 5.30 237 215 A 46 GLU HA A 67 TRP HH2 1.0 1.8 5.09 238 216 A 46 GLU HA A 49 HIS HBy 1.0 1.8 4.80 239 217 A 46 GLU HA A 49 HIS HBx 1.0 1.8 4.80 240 218 A 47 GLN HA A 50 ASP HBy 1.0 1.8 4.85 241 219 A 17 GLN HA A 25 VAL HG2% 1.0 1.8 4.61 242 220 A 15 GLU HA A 18 ASN HD22 1.0 1.8 5.49 243 221 A 15 GLU HA A 18 ASN HBy 1.0 1.8 4.71 244 222 A 15 GLU HA A 18 ASN HBx 1.0 1.8 4.71 245 223 A 28 ARG HA A 32 ASP H 1.0 1.8 5.63 246 224 A 28 ARG HA A 31 ALA HB% 1.0 1.8 3.89 247 225 A 28 ARG HA A 27 THR HG2% 1.0 1.8 4.74 248 226 A 63 VAL HA A 64 PRO HDy 1.0 1.8 3.95 249 227 A 54 LEU HBy A 49 HIS HA 1.0 1.8 4.94 250 228 A 53 VAL HG1% A 49 HIS HA 1.0 1.8 6.05 251 229 A 54 LEU HD2% A 49 HIS HA 1.0 1.8 6.05 252 230 A 54 LEU HD1% A 49 HIS HA 1.0 1.8 4.96 253 231 A 16 ARG HA A 18 ASN H 1.0 1.8 5.29 254 232 A 16 ARG HA A 19 MET HBx 1.0 1.8 4.31 255 232 A 16 ARG HA A 19 MET HBy 1.0 1.8 4.31 256 233 A 43 LEU HA A 46 GLU HBx 1.0 1.8 5.08 257 234 A 40 GLN HA A 39 TYR HD% 1.0 1.8 5.49 258 235 A 40 GLN HA A 43 LEU HD1% 1.0 1.8 4.33 259 236 A 45 LEU HA A 48 LEU HBy 1.0 1.8 4.85 260 237 A 48 LEU HG A 45 LEU HA 1.0 1.8 5.33 261 238 A 45 LEU HA A 48 LEU HBx 1.0 1.8 5.10 262 239 A 45 LEU HA A 54 LEU HD1% 1.0 1.8 4.06 263 240 A 9 ILE HG2% A 45 LEU HA 1.0 1.8 5.59 264 241 A 48 LEU HA A 54 LEU HG 1.0 1.8 5.42 265 242 A 48 LEU HA A 53 VAL HG2% 1.0 1.8 4.80 266 243 A 41 VAL HB A 31 ALA HA 1.0 1.8 4.84 267 244 A 31 ALA HA A 36 LEU HBy 1.0 1.8 5.51 268 245 A 34 ALA HB% A 31 ALA HA 1.0 1.8 4.28 269 246 A 30 ILE HG2% A 31 ALA HA 1.0 1.8 4.72 270 247 A 67 TRP HA A 56 LYS HA 1.0 1.8 4.70 271 248 A 21 ASP HA A 23 ALA H 1.0 1.8 5.01 272 249 A 57 VAL HG2% A 56 LYS HA 1.0 1.8 5.15 273 250 A 67 TRP HE3 A 56 LYS HA 1.0 1.8 5.38 274 251 A 12 ILE HD1% A 33 ALA HA 1.0 1.8 5.49 275 252 A 12 ILE HD1% A 34 ALA HA 1.0 1.8 3.89 276 253 A 34 ALA HA A 8 LYS HDx 1.0 1.8 4.99 277 253 A 8 LYS HDy A 34 ALA HA 1.0 1.8 4.99 278 254 A 34 ALA HA A 33 ALA HB% 1.0 1.8 4.83 279 255 A 53 VAL HB A 54 LEU HA 1.0 1.8 5.79 280 256 A 54 LEU HA A 55 GLU HBx 1.0 1.8 6.01 281 256 A 54 LEU HA A 55 GLU HBy 1.0 1.8 6.01 282 257 A 23 ALA HA A 24 PRO HDy 1.0 1.8 3.81 283 258 A 63 VAL HG1% A 64 PRO HDy 1.0 1.8 4.69 284 259 A 63 VAL HG1% A 64 PRO HDx 1.0 1.8 4.69 285 260 A 63 VAL HG2% A 64 PRO HDx 1.0 1.8 5.07 286 261 A 63 VAL HA A 64 PRO HDx 1.0 1.8 3.95 287 262 A 23 ALA HB% A 24 PRO HDy 1.0 1.8 4.20 288 263 A 57 VAL HG1% A 24 PRO HDy 1.0 1.8 6.05 289 264 A 66 LEU HD1% A 24 PRO HDy 1.0 1.8 6.05 290 265 A 57 VAL HG1% A 24 PRO HDx 1.0 1.8 6.05 291 266 A 66 LEU HD1% A 24 PRO HDx 1.0 1.8 6.05 292 267 A 23 ALA HA A 24 PRO HDx 1.0 1.8 3.81 293 268 A 23 ALA H A 24 PRO HDx 1.0 1.8 5.86 294 269 A 69 LEU HA A 54 LEU HA 1.0 1.8 4.17 295 270 A 31 ALA HA A 36 LEU HBx 1.0 1.8 5.51 296 271 A 41 VAL HB A 36 LEU HBy 1.0 1.8 6.05 297 272 A 41 VAL HB A 36 LEU HBx 1.0 1.8 6.05 298 273 A 67 TRP HE3 A 54 LEU HBx 1.0 1.8 4.76 299 274 A 67 TRP HE3 A 54 LEU HBy 1.0 1.8 5.09 300 275 A 54 LEU HBx A 49 HIS HA 1.0 1.8 5.64 301 276 A 66 LEU HBx A 24 PRO HBy 1.0 1.8 4.65 302 277 A 64 PRO HA A 65 GLY HAy 1.0 1.8 5.90 303 278 A 64 PRO HA A 65 GLY HAx 1.0 1.8 5.90 304 279 A 63 VAL HG2% A 60 GLY HAx 1.0 1.8 5.13 305 280 A 63 VAL HG2% A 60 GLY HAy 1.0 1.8 5.13 306 281 A 57 VAL HG2% A 68 ARG HDx 1.0 1.8 5.01 307 282 A 57 VAL HG1% A 68 ARG HDy 1.0 1.8 5.43 308 283 A 57 VAL HG2% A 68 ARG HDy 1.0 1.8 5.01 309 284 A 57 VAL HG1% A 68 ARG HDx 1.0 1.8 5.43 310 285 A 27 THR HG2% A 42 ARG HDx 1.0 1.8 4.82 311 285 A 42 ARG HDy A 27 THR HG2% 1.0 1.8 4.82 312 286 A 41 VAL HG1% A 42 ARG HDx 1.0 1.8 5.92 313 286 A 41 VAL HG1% A 42 ARG HDy 1.0 1.8 5.92 314 287 A 38 ILE HG2% A 42 ARG HDx 1.0 1.8 4.36 315 287 A 38 ILE HG2% A 42 ARG HDy 1.0 1.8 4.36 316 288 A 42 ARG HA A 42 ARG HDx 1.0 1.8 4.84 317 288 A 42 ARG HA A 42 ARG HDy 1.0 1.8 4.84 318 289 A 38 ILE HD1% A 28 ARG HDx 1.0 1.8 4.92 319 290 A 38 ILE HD1% A 28 ARG HDy 1.0 1.8 4.92 320 291 A 28 ARG HA A 28 ARG HDy 1.0 1.8 5.21 321 292 A 55 GLU HBx A 70 LEU HBx 1.0 1.8 5.08 322 292 A 55 GLU HBy A 70 LEU HBx 1.0 1.8 5.08 323 292 A 70 LEU HBy A 55 GLU HBx 1.0 1.8 5.08 324 292 A 55 GLU HBy A 70 LEU HBy 1.0 1.8 5.08 325 293 A 34 ALA HB% A 8 LYS HEx 1.0 1.8 5.07 326 293 A 34 ALA HB% A 8 LYS HEy 1.0 1.8 5.07 327 294 A 12 ILE HD1% A 8 LYS HEx 1.0 1.8 4.72 328 294 A 12 ILE HD1% A 8 LYS HEy 1.0 1.8 4.72 329 295 A 34 ALA HA A 8 LYS HEx 1.0 1.8 4.79 330 295 A 34 ALA HA A 8 LYS HEy 1.0 1.8 4.79 331 296 A 48 LEU HBy A 54 LEU HG 1.0 1.8 5.07 332 297 A 48 LEU HBx A 54 LEU HG 1.0 1.8 4.68 333 298 A 54 LEU HD2% A 48 LEU HBx 1.0 1.8 5.53 334 299 A 53 VAL HG1% A 48 LEU HBy 1.0 1.8 5.70 335 300 A 48 LEU HBy A 54 LEU HD2% 1.0 1.8 6.05 336 301 A 25 VAL HG1% A 16 ARG HDx 1.0 1.8 5.17 337 302 A 25 VAL HG1% A 16 ARG HDy 1.0 1.8 5.17 338 303 A 16 ARG HA A 16 ARG HDy 1.0 1.8 4.48 339 304 A 16 ARG HA A 16 ARG HDx 1.0 1.8 4.48 340 305 A 26 LYS HBx A 26 LYS HEx 1.0 1.8 5.16 341 305 A 26 LYS HBx A 26 LYS HEy 1.0 1.8 5.16 342 306 A 66 LEU HD2% A 26 LYS HEx 1.0 1.8 4.74 343 306 A 26 LYS HEy A 66 LEU HD2% 1.0 1.8 4.74 344 307 A 47 GLN HA A 50 ASP HBx 1.0 1.8 4.85 345 308 A 51 VAL HG1% A 50 ASP HBy 1.0 1.8 4.84 346 309 A 51 VAL HG1% A 50 ASP HBx 1.0 1.8 4.84 347 310 A 29 ASP HA A 32 ASP HBx 1.0 1.8 4.81 348 311 A 23 ALA HB% A 20 ASP HBy 1.0 1.8 4.46 349 312 A 26 LYS HBy A 29 ASP HBx 1.0 1.8 5.49 350 313 A 26 LYS HBy A 29 ASP HBy 1.0 1.8 5.49 351 314 A 25 VAL HG1% A 29 ASP HBx 1.0 1.8 4.96 352 315 A 25 VAL HG1% A 29 ASP HBy 1.0 1.8 4.96 353 316 A 45 LEU HG A 44 TYR HBx 1.0 1.8 5.29 354 316 A 44 TYR HBy A 45 LEU HG 1.0 1.8 5.29 355 317 A 36 LEU HD1% A 44 TYR HBx 1.0 1.8 5.50 356 317 A 44 TYR HBy A 36 LEU HD1% 1.0 1.8 5.50 357 318 A 63 VAL HG2% A 58 ASN HBx 1.0 1.8 5.79 358 318 A 63 VAL HG2% A 58 ASN HBy 1.0 1.8 5.79 359 319 A 6 VAL HG1% A 44 TYR HBx 1.0 1.8 5.26 360 319 A 6 VAL HG1% A 44 TYR HBy 1.0 1.8 5.26 361 320 A 41 VAL HG1% A 44 TYR HBx 1.0 1.8 5.61 362 320 A 41 VAL HG1% A 44 TYR HBy 1.0 1.8 5.61 363 321 A 7 THR HA A 10 ILE HB 1.0 1.8 4.68 364 322 A 6 VAL HA A 9 ILE HB 1.0 1.8 4.31 365 323 A 70 LEU HD2% A 55 GLU HGy 1.0 1.8 5.41 366 324 A 70 LEU HD2% A 55 GLU HGx 1.0 1.8 5.41 367 325 A 43 LEU HA A 46 GLU HGx 1.0 1.8 5.06 368 325 A 46 GLU HGy A 43 LEU HA 1.0 1.8 5.06 369 326 A 24 PRO HA A 68 ARG HBx 1.0 1.8 6.05 370 327 A 24 PRO HA A 68 ARG HBy 1.0 1.8 6.05 371 328 A 55 GLU HBx A 68 ARG HBx 1.0 1.8 5.18 372 328 A 55 GLU HBy A 68 ARG HBx 1.0 1.8 5.18 373 329 A 55 GLU HBy A 68 ARG HBy 1.0 1.8 5.18 374 329 A 68 ARG HBy A 55 GLU HBx 1.0 1.8 5.18 375 330 A 57 VAL HG2% A 68 ARG HBy 1.0 1.8 5.21 376 331 A 57 VAL HG2% A 68 ARG HBx 1.0 1.8 5.21 377 332 A 24 PRO HA A 17 GLN HGx 1.0 1.8 5.31 378 332 A 17 GLN HGy A 24 PRO HA 1.0 1.8 5.31 379 333 A 36 LEU HD1% A 40 GLN HGx 1.0 1.8 5.44 380 334 A 36 LEU HD1% A 40 GLN HGy 1.0 1.8 5.44 381 335 A 11 SER HA A 14 GLN HGx 1.0 1.8 5.44 382 335 A 14 GLN HGy A 11 SER HA 1.0 1.8 5.44 383 336 A 69 LEU HD2% A 14 GLN HGx 1.0 1.8 4.19 384 336 A 14 GLN HGy A 69 LEU HD2% 1.0 1.8 4.19 385 337 A 26 LYS HBy A 26 LYS HEx 1.0 1.8 5.38 386 337 A 26 LYS HEy A 26 LYS HBy 1.0 1.8 5.38 387 338 A 54 LEU HD1% A 67 TRP HBy 1.0 1.8 5.03 388 339 A 54 LEU HD1% A 67 TRP HBx 1.0 1.8 5.03 389 340 A 53 VAL HB A 48 LEU HBx 1.0 1.8 4.37 390 341 A 66 LEU HBx A 24 PRO HBx 1.0 1.8 4.92 391 342 A 57 VAL HG2% A 24 PRO HBy 1.0 1.8 4.70 392 343 A 63 VAL HB A 59 ALA HB% 1.0 1.8 5.29 393 344 A 63 VAL HB A 64 PRO HDx 1.0 1.8 4.14 394 345 A 24 PRO HBy A 57 VAL HB 1.0 1.8 5.20 395 346 A 66 LEU HBy A 57 VAL HB 1.0 1.8 4.46 396 347 A 66 LEU HBx A 57 VAL HB 1.0 1.8 4.83 397 348 A 16 ARG HA A 19 MET HGy 1.0 1.8 5.53 398 349 A 16 ARG HA A 19 MET HGx 1.0 1.8 5.53 399 350 A 48 LEU HA A 51 VAL HB 1.0 1.8 5.71 400 351 A 42 ARG HA A 41 VAL HB 1.0 1.8 4.69 401 352 A 69 LEU HD2% A 14 GLN HBx 1.0 1.8 4.65 402 353 A 69 LEU HD2% A 14 GLN HBy 1.0 1.8 4.65 403 354 A 10 ILE H A 10 ILE HG1y 1.0 1.8 4.53 404 355 A 8 LYS HA A 8 LYS HDx 1.0 1.8 4.66 405 355 A 8 LYS HA A 8 LYS HDy 1.0 1.8 4.66 406 356 A 9 ILE HA A 9 ILE HG1x 1.0 1.8 4.63 407 357 A 67 TRP HE3 A 54 LEU HD1% 1.0 1.8 4.88 408 358 A 48 LEU HG A 54 LEU HD1% 1.0 1.8 5.56 409 359 A 53 VAL HB A 54 LEU HD1% 1.0 1.8 5.82 410 360 A 54 LEU HD1% A 48 LEU HBx 1.0 1.8 4.64 411 361 A 53 VAL HB A 54 LEU HG 1.0 1.8 5.17 412 362 A 25 VAL HG1% A 16 ARG HGx 1.0 1.8 4.75 413 363 A 66 LEU HD1% A 24 PRO HGx 1.0 1.8 4.81 414 364 A 66 LEU HD1% A 24 PRO HGy 1.0 1.8 4.81 415 365 A 48 LEU HG A 53 VAL HG2% 1.0 1.8 4.84 416 366 A 16 ARG HGy A 25 VAL HG1% 1.0 1.8 4.64 417 367 A 42 ARG HA A 45 LEU HD1% 1.0 1.8 4.31 418 368 A 45 LEU HD1% A 67 TRP HD1 1.0 1.8 5.52 419 369 A 45 LEU HD1% A 27 THR HG2% 1.0 1.8 4.07 420 370 A 45 LEU HD1% A 30 ILE HG2% 1.0 1.8 4.26 421 371 A 45 LEU HD1% A 30 ILE HD1% 1.0 1.8 4.09 422 372 A 41 VAL HA A 36 LEU HD1% 1.0 1.8 4.58 423 373 A 26 LYS HGx A 66 LEU HD1% 1.0 1.8 4.41 424 374 A 26 LYS HGx A 66 LEU HD2% 1.0 1.8 4.41 425 375 A 26 LYS HGy A 66 LEU HD2% 1.0 1.8 4.36 426 376 A 45 LEU HA A 48 LEU HD1% 1.0 1.8 4.69 427 377 A 54 LEU HD2% A 70 LEU H 1.0 1.8 4.81 428 378 A 66 LEU HD2% A 24 PRO HBy 1.0 1.8 3.76 429 379 A 66 LEU HD2% A 66 LEU H 1.0 1.8 5.13 430 380 A 41 VAL HA A 41 VAL HG2% 1.0 1.8 3.75 431 381 A 31 ALA HA A 41 VAL HG2% 1.0 1.8 3.92 432 382 A 69 LEU HA A 69 LEU HD1% 1.0 1.8 4.32 433 383 A 44 TYR HD% A 41 VAL HG2% 1.0 1.8 5.48 434 384 A 69 LEU HD1% A 14 GLN HGx 1.0 1.8 4.84 435 384 A 14 GLN HGy A 69 LEU HD1% 1.0 1.8 4.84 436 385 A 26 LYS HBx A 66 LEU HD2% 1.0 1.8 4.62 437 386 A 70 LEU HD2% A 55 GLU HBx 1.0 1.8 4.06 438 386 A 70 LEU HD2% A 55 GLU HBy 1.0 1.8 4.06 439 387 A 10 ILE HA A 13 VAL HG2% 1.0 1.8 5.01 440 388 A 13 VAL HG2% A 9 ILE HB 1.0 1.8 5.46 441 389 A 13 VAL HG2% A 14 GLN H 1.0 1.8 5.32 442 390 A 41 VAL HG1% A 31 ALA HA 1.0 1.8 4.04 443 391 A 41 VAL HG1% A 42 ARG HA 1.0 1.8 4.49 444 392 A 6 VAL HG2% A 44 TYR HE% 1.0 1.8 4.82 445 393 A 53 VAL HG2% A 54 LEU H 1.0 1.8 5.36 446 394 A 51 VAL HG2% A 48 LEU HA 1.0 1.8 3.67 447 395 A 51 VAL HG2% A 53 VAL HB 1.0 1.8 4.52 448 396 A 51 VAL HG2% A 48 LEU HD2% 1.0 1.8 3.78 449 397 A 51 VAL HG2% A 53 VAL HG2% 1.0 1.8 3.54 450 398 A 12 ILE HG2% A 34 ALA HB% 1.0 1.8 4.80 451 399 A 12 ILE HD1% A 34 ALA HB% 1.0 1.8 3.32 452 400 A 34 ALA HB% A 8 LYS HDx 1.0 1.8 4.68 453 400 A 8 LYS HDy A 34 ALA HB% 1.0 1.8 4.68 454 401 A 34 ALA HB% A 36 LEU HG 1.0 1.8 3.84 455 402 A 30 ILE HG2% A 33 ALA HB% 1.0 1.8 4.49 456 403 A 30 ILE HG2% A 27 THR HG2% 1.0 1.8 4.98 457 404 A 30 ILE HG2% A 34 ALA HB% 1.0 1.8 5.13 458 405 A 30 ILE HG2% A 41 VAL HG2% 1.0 1.8 4.05 459 406 A 9 ILE HA A 30 ILE HG2% 1.0 1.8 4.89 460 407 A 30 ILE HG2% A 34 ALA H 1.0 1.8 5.26 461 408 A 12 ILE HG2% A 33 ALA HB% 1.0 1.8 3.63 462 409 A 12 ILE HG2% A 13 VAL HA 1.0 1.8 5.48 463 410 A 12 ILE HG2% A 33 ALA H 1.0 1.8 5.25 464 411 A 38 ILE HA A 31 ALA HB% 1.0 1.8 3.70 465 412 A 30 ILE H A 31 ALA HB% 1.0 1.8 5.30 466 413 A 31 ALA HB% A 33 ALA H 1.0 1.8 5.85 467 414 A 31 ALA HB% A 36 LEU H 1.0 1.8 5.54 468 415 A 41 VAL HB A 31 ALA HB% 1.0 1.8 4.22 469 416 A 30 ILE HB A 31 ALA HB% 1.0 1.8 4.43 470 417 A 27 THR HG2% A 31 ALA HB% 1.0 1.8 4.18 471 418 A 41 VAL HG1% A 31 ALA HB% 1.0 1.8 3.62 472 419 A 31 ALA HB% A 41 VAL HG2% 1.0 1.8 3.63 473 420 A 5 ILE HG2% A 6 VAL HG2% 1.0 1.8 4.19 474 421 A 5 ILE HG2% A 6 VAL HA 1.0 1.8 5.33 475 422 A 5 ILE HG2% A 44 TYR HD% 1.0 1.8 5.27 476 423 A 5 ILE HG2% A 44 TYR HE% 1.0 1.8 4.68 477 424 A 38 ILE HG2% A 27 THR HG2% 1.0 1.8 3.83 478 425 A 9 ILE HG2% A 13 VAL HG2% 1.0 1.8 3.79 479 426 A 9 ILE HG2% A 10 ILE HA 1.0 1.8 4.76 480 427 A 9 ILE HG2% A 44 TYR HBx 1.0 1.8 5.18 481 427 A 9 ILE HG2% A 44 TYR HBy 1.0 1.8 5.18 482 428 A 13 VAL HG2% A 30 ILE HD1% 1.0 1.8 3.50 483 429 A 25 VAL HG1% A 30 ILE HD1% 1.0 1.8 3.87 484 430 A 30 ILE HD1% A 25 VAL HB 1.0 1.8 4.38 485 431 A 12 ILE HD1% A 30 ILE HA 1.0 1.8 5.35 486 432 A 12 ILE HD1% A 8 LYS HDx 1.0 1.8 4.77 487 432 A 12 ILE HD1% A 8 LYS HDy 1.0 1.8 4.77 488 433 A 12 ILE HD1% A 33 ALA HB% 1.0 1.8 3.58 489 434 A 9 ILE HD1% A 44 TYR HBx 1.0 1.8 3.98 490 434 A 9 ILE HD1% A 44 TYR HBy 1.0 1.8 3.98 491 435 A 9 ILE HD1% A 34 ALA HB% 1.0 1.8 4.50 492 436 A 10 ILE HD1% A 7 THR HB 1.0 1.8 5.56 493 437 A 38 ILE HD1% A 27 THR HB 1.0 1.8 4.85 494 438 A 41 VAL HG1% A 45 LEU HD1% 1.0 1.8 3.90 495 439 A 9 ILE HB A 45 LEU HD2% 1.0 1.8 4.93 496 440 A 54 LEU HD1% A 45 LEU HD2% 1.0 1.8 3.45 497 441 A 9 ILE HG2% A 45 LEU HD2% 1.0 1.8 3.74 498 442 A 13 VAL HG2% A 45 LEU HD2% 1.0 1.8 4.19 499 443 A 54 LEU HD2% A 45 LEU HD2% 1.0 1.8 4.63 500 444 A 9 ILE HD1% A 44 TYR HE% 1.0 1.8 5.63 501 445 A 45 LEU HD2% A 27 THR HG2% 1.0 1.8 5.10 502 446 A 45 LEU HD2% A 44 TYR HBx 1.0 1.8 5.73 503 446 A 44 TYR HBy A 45 LEU HD2% 1.0 1.8 5.73 504 447 A 48 LEU HBy A 45 LEU HD2% 1.0 1.8 5.40 505 448 A 30 ILE HD1% A 27 THR HA 1.0 1.8 4.23 506 449 A 57 VAL HG2% A 66 LEU HBx 1.0 1.8 4.55 507 450 A 57 VAL HG2% A 55 GLU HGx 1.0 1.8 5.80 508 451 A 57 VAL HG2% A 24 PRO HBx 1.0 1.8 3.84 509 452 A 57 VAL HG2% A 68 ARG HGx 1.0 1.8 4.19 510 452 A 57 VAL HG2% A 68 ARG HGy 1.0 1.8 4.19 511 453 A 57 VAL HG2% A 66 LEU HBy 1.0 1.8 4.63 512 454 A 57 VAL HG2% A 55 GLU HGy 1.0 1.8 5.80 513 455 A 57 VAL HG2% A 24 PRO HA 1.0 1.8 5.70 514 456 A 67 TRP HA A 57 VAL HG2% 1.0 1.8 5.08 515 457 A 63 VAL HG2% A 64 PRO HDy 1.0 1.8 5.07 516 458 A 48 LEU HD1% A 48 LEU HBx 1.0 1.8 4.02 517 459 A 66 LEU HBx A 66 LEU HD2% 1.0 1.8 3.87 518 460 A 36 LEU HD1% A 36 LEU HA 1.0 1.8 4.91 519 461 A 48 LEU HD2% A 53 VAL HG2% 1.0 1.8 3.28 520 462 A 7 THR HG2% A 10 ILE HD1% 1.0 1.8 4.93 521 463 A 57 VAL HG1% A 66 LEU HBy 1.0 1.8 4.62 522 464 A 57 VAL HG1% A 24 PRO HBx 1.0 1.8 4.27 523 465 A 57 VAL HG1% A 66 LEU HG 1.0 1.8 6.05 524 466 A 57 VAL HG1% A 68 ARG HGx 1.0 1.8 6.05 525 466 A 57 VAL HG1% A 68 ARG HGy 1.0 1.8 6.05 526 467 A 28 ARG HA A 38 ILE HG2% 1.0 1.8 5.18 527 468 A 53 VAL HG1% A 54 LEU HA 1.0 1.8 5.52 528 469 A 53 VAL HG1% A 54 LEU HG 1.0 1.8 4.25 529 470 A 53 VAL HG1% A 48 LEU HBx 1.0 1.8 4.31 530 471 A 34 ALA HB% A 41 VAL HG2% 1.0 1.8 4.18 531 472 A 13 VAL HG1% A 17 GLN HGx 1.0 1.8 4.35 532 472 A 17 GLN HGy A 13 VAL HG1% 1.0 1.8 4.35 533 473 A 41 VAL HG1% A 45 LEU HG 1.0 1.8 4.16 534 474 A 51 VAL HA A 51 VAL HG1% 1.0 1.8 3.77 535 475 A 48 LEU HA A 51 VAL HG1% 1.0 1.8 4.50 536 476 A 13 VAL HA A 25 VAL HG1% 1.0 1.8 4.95 537 477 A 16 ARG HGy A 25 VAL HG2% 1.0 1.8 5.82 538 478 A 24 PRO HBx A 25 VAL HG2% 1.0 1.8 6.05 539 479 A 25 VAL HG2% A 17 GLN HGx 1.0 1.8 4.27 540 479 A 17 GLN HGy A 25 VAL HG2% 1.0 1.8 4.27 541 480 A 25 VAL HA A 25 VAL HG2% 1.0 1.8 3.89 542 481 A 25 VAL H A 25 VAL HG2% 1.0 1.8 3.51 543 482 A 12 ILE HB A 34 ALA HB% 1.0 1.8 6.05 544 483 A 7 THR HG2% A 8 LYS HA 1.0 1.8 4.81 545 484 A 63 VAL HG2% A 59 ALA HB% 1.0 1.8 4.13 546 485 A 63 VAL HG1% A 59 ALA HB% 1.0 1.8 4.80 547 486 A 59 ALA HB% A 58 ASN HA 1.0 1.8 5.56 548 487 A 31 ALA HB% A 37 SER HA 1.0 1.8 5.41 549 488 A 31 ALA HB% A 32 ASP HA 1.0 1.8 5.44 550 489 A 55 GLU HBy A 68 ARG HGx 1.0 1.8 5.37 551 489 A 55 GLU HBx A 68 ARG HGx 1.0 1.8 5.37 552 489 A 68 ARG HGy A 55 GLU HBx 1.0 1.8 5.37 553 489 A 55 GLU HBy A 68 ARG HGy 1.0 1.8 5.37 554 490 A 70 LEU HG A 55 GLU HBx 1.0 1.8 6.05 555 490 A 55 GLU HBy A 70 LEU HG 1.0 1.8 6.05 556 491 A 24 PRO HA A 68 ARG HGx 1.0 1.8 5.80 557 491 A 68 ARG HGy A 24 PRO HA 1.0 1.8 5.80 558 492 A 69 LEU HA A 68 ARG HGx 1.0 1.8 6.05 559 492 A 69 LEU HA A 68 ARG HGy 1.0 1.8 6.05 560 493 A 54 LEU HA A 70 LEU HG 1.0 1.8 5.47 561 494 A 54 LEU HD1% A 45 LEU HG 1.0 1.8 4.74 562 495 A 30 ILE HA A 33 ALA HB% 1.0 1.8 4.17 563 496 A 23 ALA HB% A 24 PRO HDx 1.0 1.8 4.20 564 497 A 23 ALA HB% A 20 ASP HBx 1.0 1.8 4.46 565 498 A 12 ILE HG2% A 16 ARG HGx 1.0 1.8 4.73 566 499 A 9 ILE HG2% A 12 ILE HB 1.0 1.8 5.31 567 500 A 63 VAL HA A 64 PRO HGy 1.0 1.8 5.59 568 501 A 63 VAL HA A 64 PRO HGx 1.0 1.8 5.59 569 502 A 43 LEU HA A 46 GLU HBy 1.0 1.8 5.08 570 503 A 67 TRP HZ3 A 49 HIS HBx 1.0 1.8 4.81 571 504 A 13 VAL HA A 30 ILE HD1% 1.0 1.8 6.00 572 505 A 14 GLN HA A 13 VAL HG1% 1.0 1.8 4.25 573 506 A 14 GLN HA A 69 LEU HD1% 1.0 1.8 4.69 574 507 A 39 TYR HA A 42 ARG H 1.0 1.8 5.33 575 508 A 9 ILE HD1% A 41 VAL HG2% 1.0 1.8 3.79 576 509 A 41 VAL HG1% A 30 ILE HB 1.0 1.8 4.18 577 510 A 41 VAL HG2% A 36 LEU HBx 1.0 1.8 4.26 578 511 A 41 VAL HG2% A 36 LEU HBy 1.0 1.8 4.26 579 512 A 66 LEU HD1% A 67 TRP H 1.0 1.8 5.40 580 513 A 36 LEU HD1% A 34 ALA HB% 1.0 1.8 4.00 581 514 A 26 LYS HA A 66 LEU HD2% 1.0 1.8 4.28 582 515 A 41 VAL HG1% A 27 THR HA 1.0 1.8 5.07 583 516 A 38 ILE HG2% A 27 THR HB 1.0 1.8 5.49 584 517 A 38 ILE HD1% A 27 THR HG2% 1.0 1.8 4.51 585 518 A 41 VAL HG1% A 27 THR HG2% 1.0 1.8 3.45 586 519 A 25 VAL HG2% A 24 PRO HA 1.0 1.8 4.62 587 520 A 45 LEU HD1% A 67 TRP HE1 1.0 1.8 4.92 588 521 A 46 GLU HA A 67 TRP HZ3 1.0 1.8 5.65 589 522 A 36 LEU HD1% A 41 VAL HB 1.0 1.8 5.33 590 523 A 38 ILE HB A 39 TYR H 1.0 1.8 4.18 591 524 A 67 TRP HD1 A 67 TRP H 1.0 1.8 4.36 592 525 A 44 TYR HD% A 44 TYR HA 1.0 1.8 3.99 593 526 A 6 VAL HG2% A 44 TYR HD% 1.0 1.8 4.17 594 527 A 44 TYR HD% A 36 LEU HD1% 1.0 1.8 4.28 595 528 A 9 ILE HD1% A 44 TYR HD% 1.0 1.8 4.23 596 529 A 41 VAL HA A 44 TYR HD% 1.0 1.8 3.89 597 530 A 43 LEU HD1% A 39 TYR HE% 1.0 1.8 4.65 598 531 A 36 LEU HD1% A 44 TYR HE% 1.0 1.8 4.63 599 532 A 6 VAL HG1% A 44 TYR HE% 1.0 1.8 5.82 600 533 A 36 LEU HD2% A 44 TYR HE% 1.0 1.8 6.05 601 534 A 39 TYR HD% A 39 TYR H 1.0 1.8 4.66 602 535 A 66 LEU HA A 67 TRP HD1 1.0 1.8 4.46 603 536 A 30 ILE HD1% A 67 TRP HD1 1.0 1.8 4.26 604 537 A 67 TRP HZ3 A 49 HIS HBy 1.0 1.8 4.81 605 538 A 67 TRP HH2 A 46 GLU HGx 1.0 1.8 4.59 606 538 A 46 GLU HGy A 67 TRP HH2 1.0 1.8 4.59 607 539 A 27 THR HA A 67 TRP HD1 1.0 1.8 4.80 608 540 A 67 TRP HE1 A 27 THR H 1.0 1.8 5.47 609 541 A 5 ILE HB A 5 ILE H 1.0 1.8 4.39 610 542 A 6 VAL H A 6 VAL HB 1.0 1.8 3.97 611 543 A 7 THR HB A 7 THR H 1.0 1.8 4.10 612 544 A 9 ILE HB A 9 ILE H 1.0 1.8 3.59 613 545 A 9 ILE HB A 10 ILE H 1.0 1.8 3.73 614 546 A 10 ILE HB A 10 ILE H 1.0 1.8 3.97 615 547 A 12 ILE HB A 12 ILE H 1.0 1.8 3.67 616 548 A 13 VAL H A 13 VAL HB 1.0 1.8 3.86 617 549 A 23 ALA H A 23 ALA HB% 1.0 1.8 3.26 618 550 A 25 VAL H A 25 VAL HB 1.0 1.8 4.08 619 551 A 27 THR HB A 27 THR H 1.0 1.8 4.36 620 552 A 30 ILE HB A 30 ILE H 1.0 1.8 3.48 621 553 A 31 ALA HB% A 31 ALA H 1.0 1.8 3.45 622 554 A 33 ALA HB% A 33 ALA H 1.0 1.8 3.27 623 555 A 34 ALA H A 34 ALA HB% 1.0 1.8 3.40 624 556 A 38 ILE HB A 38 ILE H 1.0 1.8 3.77 625 557 A 41 VAL HB A 41 VAL H 1.0 1.8 3.64 626 558 A 51 VAL H A 51 VAL HB 1.0 1.8 4.46 627 559 A 53 VAL HB A 53 VAL H 1.0 1.8 3.83 628 560 A 57 VAL HB A 57 VAL H 1.0 1.8 4.28 629 561 A 63 VAL HB A 63 VAL H 1.0 1.8 4.35 630 562 A 14 GLN H A 14 GLN HBy 1.0 1.8 3.74 631 563 A 15 GLU H A 15 GLU HBy 1.0 1.8 3.32 632 564 A 17 GLN H A 17 GLN HBy 1.0 1.8 4.36 633 565 A 18 ASN H A 18 ASN HBy 1.0 1.8 3.94 634 566 A 20 ASP H A 20 ASP HBy 1.0 1.8 4.49 635 567 A 21 ASP H A 20 ASP HBy 1.0 1.8 5.03 636 568 A 26 LYS HBx A 26 LYS H 1.0 1.8 4.53 637 569 A 28 ARG H A 28 ARG HBy 1.0 1.8 3.97 638 570 A 29 ASP H A 29 ASP HBy 1.0 1.8 4.29 639 571 A 32 ASP H A 32 ASP HBy 1.0 1.8 3.99 640 572 A 36 LEU H A 36 LEU HBy 1.0 1.8 4.42 641 573 A 37 SER H A 37 SER HBy 1.0 1.8 4.47 642 574 A 39 TYR H A 39 TYR HBy 1.0 1.8 3.92 643 575 A 40 GLN H A 40 GLN HBy 1.0 1.8 4.13 644 576 A 42 ARG H A 41 VAL HB 1.0 1.8 3.78 645 577 A 42 ARG H A 42 ARG HBy 1.0 1.8 4.32 646 578 A 43 LEU H A 43 LEU HBy 1.0 1.8 3.95 647 579 A 45 LEU H A 45 LEU HBy 1.0 1.8 4.54 648 580 A 46 GLU H A 46 GLU HBy 1.0 1.8 4.17 649 581 A 48 LEU HBy A 48 LEU H 1.0 1.8 3.97 650 582 A 49 HIS H A 49 HIS HBy 1.0 1.8 4.02 651 583 A 50 ASP H A 50 ASP HBy 1.0 1.8 4.21 652 584 A 56 LYS H A 56 LYS HBy 1.0 1.8 4.46 653 585 A 56 LYS H A 56 LYS HDx 1.0 1.8 5.03 654 585 A 56 LYS H A 56 LYS HDy 1.0 1.8 5.03 655 586 A 66 LEU HBy A 66 LEU H 1.0 1.8 4.40 656 587 A 54 LEU HBx A 68 ARG H 1.0 1.8 4.73 657 588 A 69 LEU H A 69 LEU HBy 1.0 1.8 4.20 658 589 A 8 LYS H A 8 LYS HBy 1.0 1.8 4.02 659 590 A 8 LYS H A 8 LYS HBx 1.0 1.8 4.02 660 591 A 14 GLN H A 14 GLN HBx 1.0 1.8 3.74 661 592 A 15 GLU H A 15 GLU HBx 1.0 1.8 3.53 662 593 A 18 ASN H A 18 ASN HBx 1.0 1.8 3.94 663 594 A 20 ASP H A 20 ASP HBx 1.0 1.8 4.49 664 595 A 26 LYS HBy A 26 LYS H 1.0 1.8 4.21 665 596 A 28 ARG H A 28 ARG HBx 1.0 1.8 3.97 666 597 A 29 ASP H A 29 ASP HBx 1.0 1.8 4.29 667 598 A 32 ASP H A 32 ASP HBx 1.0 1.8 3.99 668 599 A 36 LEU H A 36 LEU HBx 1.0 1.8 4.42 669 600 A 37 SER H A 37 SER HBx 1.0 1.8 4.47 670 601 A 39 TYR H A 39 TYR HBx 1.0 1.8 3.92 671 602 A 40 GLN H A 40 GLN HBx 1.0 1.8 4.13 672 603 A 43 LEU H A 43 LEU HBx 1.0 1.8 3.95 673 604 A 45 LEU H A 45 LEU HBx 1.0 1.8 4.54 674 605 A 46 GLU H A 46 GLU HBx 1.0 1.8 4.17 675 606 A 48 LEU HBx A 48 LEU H 1.0 1.8 4.21 676 607 A 49 HIS H A 49 HIS HBx 1.0 1.8 4.02 677 608 A 50 ASP H A 50 ASP HBx 1.0 1.8 4.21 678 609 A 54 LEU HBy A 54 LEU H 1.0 1.8 4.16 679 610 A 56 LYS H A 56 LYS HBx 1.0 1.8 4.46 680 611 A 69 LEU H A 68 ARG HGx 1.0 1.8 4.28 681 611 A 68 ARG HGy A 69 LEU H 1.0 1.8 4.28 682 612 A 6 VAL H A 7 THR H 1.0 1.8 4.26 683 613 A 7 THR H A 8 LYS H 1.0 1.8 4.04 684 614 A 9 ILE H A 8 LYS H 1.0 1.8 4.09 685 615 A 10 ILE H A 9 ILE H 1.0 1.8 4.32 686 616 A 10 ILE H A 11 SER H 1.0 1.8 4.11 687 617 A 13 VAL H A 12 ILE H 1.0 1.8 3.31 688 618 A 13 VAL H A 14 GLN H 1.0 1.8 4.02 689 619 A 17 GLN H A 16 ARG H 1.0 1.8 3.98 690 620 A 19 MET H A 20 ASP H 1.0 1.8 3.90 691 621 A 23 ALA H A 22 GLY H 1.0 1.8 3.92 692 622 A 28 ARG H A 29 ASP H 1.0 1.8 4.27 693 623 A 34 ALA H A 33 ALA H 1.0 1.8 3.76 694 624 A 34 ALA H A 35 GLY H 1.0 1.8 3.70 695 625 A 40 GLN H A 37 SER H 1.0 1.8 5.08 696 626 A 40 GLN H A 39 TYR H 1.0 1.8 4.10 697 627 A 42 ARG H A 41 VAL H 1.0 1.8 4.02 698 628 A 44 TYR H A 45 LEU H 1.0 1.8 3.94 699 629 A 45 LEU H A 46 GLU H 1.0 1.8 4.23 700 630 A 47 GLN H A 46 GLU H 1.0 1.8 4.08 701 631 A 48 LEU H A 49 HIS H 1.0 1.8 4.18 702 632 A 51 VAL H A 52 GLY H 1.0 1.8 3.87 703 633 A 54 LEU H A 53 VAL H 1.0 1.8 3.73 704 634 A 65 GLY H A 66 LEU H 1.0 1.8 5.18 705 635 A 66 LEU H A 67 TRP H 1.0 1.8 5.53 706 636 A 12 ILE HA A 15 GLU H 1.0 1.8 4.75 707 637 A 25 VAL H A 24 PRO HA 1.0 1.8 3.69 708 638 A 25 VAL HA A 26 LYS H 1.0 1.8 3.59 709 639 A 26 LYS HA A 27 THR H 1.0 1.8 3.61 710 640 A 29 ASP HA A 33 ALA H 1.0 1.8 5.69 711 641 A 36 LEU HA A 37 SER H 1.0 1.8 3.49 712 642 A 37 SER HA A 38 ILE H 1.0 1.8 3.66 713 643 A 40 GLN H A 37 SER HBx 1.0 1.8 5.39 714 644 A 46 GLU HA A 49 HIS H 1.0 1.8 4.68 715 645 A 47 GLN HA A 49 HIS H 1.0 1.8 5.37 716 646 A 54 LEU HA A 55 GLU H 1.0 1.8 3.64 717 647 A 56 LYS HA A 57 VAL H 1.0 1.8 3.81 718 648 A 67 TRP HA A 68 ARG H 1.0 1.8 3.62 719 649 A 68 ARG HA A 69 LEU H 1.0 1.8 3.67 720 650 A 69 LEU HA A 70 LEU H 1.0 1.8 3.54 721 651 A 36 LEU HG A 36 LEU H 1.0 1.8 4.20 722 652 A 43 LEU HG A 43 LEU H 1.0 1.8 3.61 723 653 A 45 LEU HG A 45 LEU H 1.0 1.8 3.76 724 654 A 48 LEU HG A 48 LEU H 1.0 1.8 3.82 725 655 A 54 LEU HG A 54 LEU H 1.0 1.8 4.25 726 656 A 66 LEU H A 66 LEU HG 1.0 1.8 4.83 727 657 A 69 LEU HG A 69 LEU H 1.0 1.8 4.16 728 658 A 5 ILE HG2% A 5 ILE H 1.0 1.8 4.80 729 659 A 6 VAL HG1% A 6 VAL H 1.0 1.8 4.35 730 660 A 7 THR HG2% A 7 THR H 1.0 1.8 4.39 731 661 A 8 LYS H A 8 LYS HGy 1.0 1.8 5.13 732 662 A 9 ILE HG2% A 9 ILE H 1.0 1.8 4.36 733 663 A 10 ILE HG2% A 10 ILE H 1.0 1.8 4.17 734 664 A 12 ILE HG2% A 12 ILE H 1.0 1.8 4.17 735 665 A 13 VAL HG2% A 13 VAL H 1.0 1.8 3.48 736 666 A 16 ARG HGy A 16 ARG H 1.0 1.8 4.28 737 667 A 19 MET H A 19 MET HGy 1.0 1.8 4.57 738 668 A 25 VAL HG1% A 25 VAL H 1.0 1.8 5.04 739 669 A 66 LEU HBx A 25 VAL H 1.0 1.8 5.26 740 670 A 26 LYS HGx A 26 LYS H 1.0 1.8 4.26 741 671 A 27 THR HG2% A 27 THR H 1.0 1.8 4.89 742 672 A 28 ARG H A 28 ARG HGy 1.0 1.8 4.60 743 673 A 30 ILE HG2% A 30 ILE H 1.0 1.8 4.30 744 674 A 38 ILE HG2% A 38 ILE H 1.0 1.8 4.35 745 675 A 40 GLN H A 40 GLN HGy 1.0 1.8 5.02 746 676 A 41 VAL HG1% A 41 VAL H 1.0 1.8 4.28 747 677 A 42 ARG H A 42 ARG HBx 1.0 1.8 4.32 748 678 A 42 ARG H A 42 ARG HGy 1.0 1.8 5.08 749 679 A 47 GLN H A 47 GLN HGy 1.0 1.8 4.69 750 680 A 51 VAL HG2% A 51 VAL H 1.0 1.8 3.61 751 681 A 53 VAL HG1% A 53 VAL H 1.0 1.8 4.33 752 682 A 57 VAL H A 56 LYS HBx 1.0 1.8 5.38 753 683 A 57 VAL HG1% A 57 VAL H 1.0 1.8 5.29 754 684 A 63 VAL HG2% A 63 VAL H 1.0 1.8 3.64 755 685 A 8 LYS H A 8 LYS HGx 1.0 1.8 5.13 756 686 A 15 GLU H A 14 GLN HGx 1.0 1.8 4.39 757 686 A 14 GLN HGy A 15 GLU H 1.0 1.8 4.39 758 687 A 16 ARG HGx A 16 ARG H 1.0 1.8 4.55 759 688 A 19 MET H A 19 MET HGx 1.0 1.8 4.57 760 689 A 26 LYS HGy A 26 LYS H 1.0 1.8 4.80 761 690 A 28 ARG H A 28 ARG HGx 1.0 1.8 4.60 762 691 A 42 ARG H A 42 ARG HGx 1.0 1.8 5.08 763 692 A 47 GLN H A 47 GLN HGx 1.0 1.8 4.69 764 693 A 9 ILE HD1% A 9 ILE H 1.0 1.8 4.09 765 694 A 10 ILE HD1% A 10 ILE H 1.0 1.8 4.10 766 695 A 12 ILE HD1% A 12 ILE H 1.0 1.8 4.22 767 696 A 36 LEU HD1% A 36 LEU H 1.0 1.8 4.62 768 697 A 38 ILE HD1% A 38 ILE H 1.0 1.8 4.03 769 698 A 43 LEU HD1% A 43 LEU H 1.0 1.8 4.65 770 699 A 45 LEU HD1% A 45 LEU H 1.0 1.8 4.54 771 700 A 48 LEU HD2% A 48 LEU H 1.0 1.8 4.52 772 701 A 53 VAL HG1% A 54 LEU H 1.0 1.8 4.44 773 702 A 54 LEU HD2% A 54 LEU H 1.0 1.8 4.77 774 703 A 66 LEU HD1% A 66 LEU H 1.0 1.8 4.60 775 704 A 69 LEU H A 69 LEU HD1% 1.0 1.8 4.41 776 705 A 26 LYS H A 26 LYS HDy 1.0 1.8 4.30 777 706 A 36 LEU HD2% A 36 LEU H 1.0 1.8 4.50 778 707 A 43 LEU HD2% A 43 LEU H 1.0 1.8 4.61 779 708 A 45 LEU HD2% A 45 LEU H 1.0 1.8 4.51 780 709 A 48 LEU HD1% A 48 LEU H 1.0 1.8 4.40 781 710 A 54 LEU HD1% A 54 LEU H 1.0 1.8 4.50 782 711 A 69 LEU HD2% A 69 LEU H 1.0 1.8 4.29 783 712 A 26 LYS H A 26 LYS HDx 1.0 1.8 4.30 784 713 A 5 ILE H A 5 ILE HG1y 1.0 1.8 5.53 785 714 A 9 ILE H A 9 ILE HG1y 1.0 1.8 3.97 786 715 A 12 ILE H A 12 ILE HG1y 1.0 1.8 4.35 787 716 A 38 ILE H A 38 ILE HG1y 1.0 1.8 4.27 788 717 A 5 ILE H A 5 ILE HG1x 1.0 1.8 5.53 789 718 A 9 ILE H A 9 ILE HG1x 1.0 1.8 3.97 790 719 A 10 ILE H A 10 ILE HG1x 1.0 1.8 4.53 791 720 A 12 ILE H A 12 ILE HG1x 1.0 1.8 4.35 792 721 A 38 ILE H A 38 ILE HG1x 1.0 1.8 4.27 793 722 A 6 VAL HG2% A 6 VAL H 1.0 1.8 3.84 794 723 A 13 VAL HG1% A 13 VAL H 1.0 1.8 4.17 795 724 A 41 VAL HG2% A 41 VAL H 1.0 1.8 4.15 796 725 A 51 VAL H A 51 VAL HG1% 1.0 1.8 3.87 797 726 A 53 VAL HG2% A 53 VAL H 1.0 1.8 3.86 798 727 A 57 VAL HG2% A 57 VAL H 1.0 1.8 4.10 799 728 A 63 VAL HG1% A 63 VAL H 1.0 1.8 4.42 800 729 A 5 ILE H A 6 VAL H 1.0 1.8 4.87 801 730 A 12 ILE H A 11 SER H 1.0 1.8 3.99 802 731 A 15 GLU H A 14 GLN H 1.0 1.8 4.05 803 732 A 15 GLU H A 16 ARG H 1.0 1.8 3.07 804 733 A 17 GLN H A 18 ASN H 1.0 1.8 4.04 805 734 A 20 ASP H A 21 ASP H 1.0 1.8 4.50 806 735 A 21 ASP H A 22 GLY H 1.0 1.8 4.20 807 736 A 28 ARG H A 27 THR H 1.0 1.8 4.50 808 737 A 30 ILE H A 29 ASP H 1.0 1.8 3.82 809 738 A 30 ILE H A 31 ALA H 1.0 1.8 3.63 810 739 A 36 LEU H A 35 GLY H 1.0 1.8 3.76 811 740 A 36 LEU H A 37 SER H 1.0 1.8 5.36 812 741 A 39 TYR H A 38 ILE H 1.0 1.8 4.42 813 742 A 40 GLN H A 41 VAL H 1.0 1.8 3.95 814 743 A 43 LEU H A 42 ARG H 1.0 1.8 4.03 815 744 A 47 GLN H A 48 LEU H 1.0 1.8 4.00 816 745 A 49 HIS H A 50 ASP H 1.0 1.8 4.25 817 746 A 51 VAL H A 50 ASP H 1.0 1.8 4.19 818 747 A 53 VAL H A 52 GLY H 1.0 1.8 4.02 819 748 A 57 VAL H A 58 ASN H 1.0 1.8 5.10 820 749 A 69 LEU H A 68 ARG H 1.0 1.8 5.39 821 750 A 69 LEU H A 70 LEU H 1.0 1.8 5.64 822 751 A 6 VAL HA A 9 ILE H 1.0 1.8 4.58 823 752 A 10 ILE H A 11 SER HA 1.0 1.8 5.92 824 753 A 7 THR HA A 11 SER H 1.0 1.8 6.05 825 754 A 12 ILE HA A 11 SER H 1.0 1.8 6.05 826 755 A 9 ILE HA A 12 ILE H 1.0 1.8 4.61 827 756 A 15 GLU HA A 14 GLN H 1.0 1.8 5.70 828 757 A 38 ILE H A 37 SER HBx 1.0 1.8 4.66 829 758 A 38 ILE HA A 41 VAL H 1.0 1.8 4.76 830 759 A 23 ALA HB% A 22 GLY H 1.0 1.8 5.15 831 760 A 26 LYS HBy A 29 ASP H 1.0 1.8 3.97 832 761 A 34 ALA HB% A 33 ALA H 1.0 1.8 5.35 833 762 A 53 VAL HB A 52 GLY H 1.0 1.8 5.42 834 763 A 27 THR HG2% A 42 ARG H 1.0 1.8 4.85 835 764 A 68 ARG H A 68 ARG HGx 1.0 1.8 4.61 836 764 A 68 ARG HGy A 68 ARG H 1.0 1.8 4.61 837 765 A 5 ILE HB A 6 VAL H 1.0 1.8 4.86 838 766 A 6 VAL HB A 7 THR H 1.0 1.8 4.37 839 767 A 7 THR HB A 8 LYS H 1.0 1.8 4.20 840 768 A 10 ILE HB A 11 SER H 1.0 1.8 3.84 841 769 A 12 ILE HB A 13 VAL H 1.0 1.8 4.16 842 770 A 13 VAL HB A 14 GLN H 1.0 1.8 3.79 843 771 A 28 ARG H A 27 THR HB 1.0 1.8 4.04 844 772 A 30 ILE HB A 31 ALA H 1.0 1.8 3.86 845 773 A 32 ASP H A 31 ALA HB% 1.0 1.8 3.63 846 774 A 34 ALA H A 33 ALA HB% 1.0 1.8 3.79 847 775 A 34 ALA HB% A 35 GLY H 1.0 1.8 4.08 848 776 A 51 VAL HB A 52 GLY H 1.0 1.8 5.60 849 777 A 53 VAL HB A 54 LEU H 1.0 1.8 4.36 850 778 A 5 ILE H A 4 SER HBy 1.0 1.8 5.28 851 779 A 15 GLU HBy A 16 ARG H 1.0 1.8 4.13 852 780 A 18 ASN H A 17 GLN HBy 1.0 1.8 4.41 853 781 A 19 MET H A 18 ASN HBy 1.0 1.8 4.50 854 782 A 26 LYS HBx A 27 THR H 1.0 1.8 4.79 855 783 A 33 ALA H A 32 ASP HBy 1.0 1.8 4.22 856 784 A 37 SER H A 36 LEU HBy 1.0 1.8 4.46 857 785 A 38 ILE H A 37 SER HBy 1.0 1.8 4.66 858 786 A 40 GLN H A 39 TYR HBy 1.0 1.8 4.59 859 787 A 41 VAL H A 40 GLN HBy 1.0 1.8 4.44 860 788 A 43 LEU H A 42 ARG HBy 1.0 1.8 4.38 861 789 A 44 TYR H A 43 LEU HBy 1.0 1.8 4.42 862 790 A 46 GLU H A 45 LEU HBy 1.0 1.8 4.73 863 791 A 47 GLN H A 46 GLU HBy 1.0 1.8 4.26 864 792 A 48 LEU HBy A 49 HIS H 1.0 1.8 4.75 865 793 A 50 ASP H A 49 HIS HBy 1.0 1.8 4.72 866 794 A 51 VAL H A 50 ASP HBy 1.0 1.8 4.61 867 795 A 54 LEU HBx A 55 GLU H 1.0 1.8 4.39 868 796 A 57 VAL H A 56 LYS HBy 1.0 1.8 5.38 869 797 A 65 GLY H A 64 PRO HBy 1.0 1.8 5.08 870 798 A 66 LEU HBy A 67 TRP H 1.0 1.8 5.42 871 799 A 68 ARG H A 67 TRP HBy 1.0 1.8 4.98 872 800 A 70 LEU H A 69 LEU HBy 1.0 1.8 4.85 873 801 A 5 ILE H A 4 SER HBx 1.0 1.8 5.28 874 802 A 15 GLU HBx A 16 ARG H 1.0 1.8 3.85 875 803 A 18 ASN H A 17 GLN HBx 1.0 1.8 4.41 876 804 A 19 MET H A 18 ASN HBx 1.0 1.8 4.50 877 805 A 21 ASP H A 20 ASP HBx 1.0 1.8 5.03 878 806 A 26 LYS HBy A 27 THR H 1.0 1.8 4.82 879 807 A 33 ALA H A 32 ASP HBx 1.0 1.8 4.22 880 808 A 37 SER H A 36 LEU HBx 1.0 1.8 4.46 881 809 A 40 GLN H A 39 TYR HBx 1.0 1.8 4.59 882 810 A 41 VAL H A 40 GLN HBx 1.0 1.8 4.44 883 811 A 43 LEU H A 42 ARG HBx 1.0 1.8 4.38 884 812 A 44 TYR H A 43 LEU HBx 1.0 1.8 4.42 885 813 A 46 GLU H A 45 LEU HBx 1.0 1.8 4.73 886 814 A 47 GLN H A 46 GLU HBx 1.0 1.8 4.26 887 815 A 48 LEU HBx A 49 HIS H 1.0 1.8 5.08 888 816 A 50 ASP H A 49 HIS HBx 1.0 1.8 4.72 889 817 A 55 GLU H A 54 LEU HBy 1.0 1.8 4.19 890 818 A 65 GLY H A 64 PRO HBx 1.0 1.8 5.08 891 819 A 66 LEU HBx A 67 TRP H 1.0 1.8 4.82 892 820 A 68 ARG H A 67 TRP HBx 1.0 1.8 4.98 893 821 A 69 LEU H A 68 ARG HBx 1.0 1.8 4.63 894 822 A 33 ALA H A 35 GLY H 1.0 1.8 5.29 895 823 A 32 ASP HA A 35 GLY H 1.0 1.8 4.81 896 824 A 33 ALA HA A 35 GLY H 1.0 1.8 5.39 897 825 A 33 ALA HB% A 35 GLY H 1.0 1.8 5.21 898 826 A 36 LEU HG A 35 GLY H 1.0 1.8 5.57 899 827 A 36 LEU HD2% A 35 GLY H 1.0 1.8 5.81 900 828 A 12 ILE HD1% A 35 GLY H 1.0 1.8 5.21 901 829 A 5 ILE HG2% A 6 VAL H 1.0 1.8 4.33 902 830 A 6 VAL HG1% A 7 THR H 1.0 1.8 4.33 903 831 A 11 SER H A 11 SER HBx 1.0 1.8 3.51 904 831 A 11 SER H A 11 SER HBy 1.0 1.8 3.51 905 832 A 10 ILE HG2% A 11 SER H 1.0 1.8 4.18 906 833 A 9 ILE HG2% A 11 SER H 1.0 1.8 5.43 907 834 A 12 ILE HD1% A 11 SER H 1.0 1.8 5.76 908 835 A 5 ILE HA A 8 LYS H 1.0 1.8 4.46 909 836 A 7 THR HG2% A 8 LYS H 1.0 1.8 4.73 910 837 A 12 ILE HD1% A 8 LYS H 1.0 1.8 5.65 911 838 A 10 ILE HA A 13 VAL H 1.0 1.8 4.97 912 839 A 11 SER HA A 14 GLN H 1.0 1.8 5.03 913 840 A 14 GLN H A 14 GLN HGx 1.0 1.8 4.42 914 840 A 14 GLN HGy A 14 GLN H 1.0 1.8 4.42 915 841 A 69 LEU HD2% A 14 GLN H 1.0 1.8 4.50 916 842 A 15 GLU H A 11 SER HA 1.0 1.8 5.19 917 843 A 45 LEU HA A 48 LEU H 1.0 1.8 4.70 918 844 A 48 LEU H A 47 GLN HBx 1.0 1.8 4.36 919 845 A 53 VAL HG2% A 48 LEU H 1.0 1.8 5.65 920 846 A 14 GLN HA A 17 GLN H 1.0 1.8 4.96 921 847 A 17 GLN H A 17 GLN HGx 1.0 1.8 4.04 922 847 A 17 GLN HGy A 17 GLN H 1.0 1.8 4.04 923 848 A 16 ARG HGy A 17 GLN H 1.0 1.8 5.32 924 849 A 17 GLN H A 16 ARG HBx 1.0 1.8 4.22 925 850 A 16 ARG HGy A 15 GLU H 1.0 1.8 5.85 926 851 A 12 ILE HG2% A 15 GLU H 1.0 1.8 6.05 927 852 A 14 GLN H A 16 ARG H 1.0 1.8 5.18 928 853 A 12 ILE HA A 16 ARG H 1.0 1.8 5.69 929 854 A 14 GLN HA A 16 ARG H 1.0 1.8 6.05 930 855 A 13 VAL HA A 16 ARG H 1.0 1.8 5.02 931 856 A 25 VAL HG2% A 16 ARG H 1.0 1.8 4.98 932 857 A 12 ILE HG2% A 16 ARG H 1.0 1.8 4.98 933 858 A 17 GLN H A 25 VAL HG2% 1.0 1.8 4.33 934 859 A 13 VAL HG1% A 17 GLN H 1.0 1.8 5.32 935 860 A 69 LEU HD2% A 14 GLN HE21 1.0 1.8 5.53 936 861 A 69 LEU HD2% A 14 GLN HE22 1.0 1.8 5.53 937 862 A 18 ASN HD21 A 14 GLN HGx 1.0 1.8 4.99 938 862 A 14 GLN HGy A 18 ASN HD21 1.0 1.8 4.99 939 863 A 18 ASN HD22 A 14 GLN HGx 1.0 1.8 4.99 940 863 A 14 GLN HGy A 18 ASN HD22 1.0 1.8 4.99 941 864 A 58 ASN HD22 A 58 ASN HBx 1.0 1.8 4.44 942 864 A 58 ASN HBy A 58 ASN HD22 1.0 1.8 4.44 943 865 A 58 ASN HD21 A 58 ASN HBx 1.0 1.8 4.44 944 865 A 58 ASN HBy A 58 ASN HD21 1.0 1.8 4.44 945 866 A 63 VAL HG2% A 58 ASN HD21 1.0 1.8 4.39 946 867 A 63 VAL HG2% A 58 ASN HD22 1.0 1.8 4.39 947 868 A 15 GLU HA A 18 ASN H 1.0 1.8 4.76 948 869 A 18 ASN H A 17 GLN HGx 1.0 1.8 5.10 949 869 A 17 GLN HGy A 18 ASN H 1.0 1.8 5.10 950 870 A 18 ASN H A 19 MET HBx 1.0 1.8 5.46 951 870 A 18 ASN H A 19 MET HBy 1.0 1.8 5.46 952 871 A 43 LEU HA A 47 GLN H 1.0 1.8 5.50 953 872 A 48 LEU HG A 47 GLN H 1.0 1.8 5.70 954 873 A 9 ILE HG2% A 10 ILE H 1.0 1.8 4.53 955 874 A 16 ARG HA A 19 MET H 1.0 1.8 4.58 956 875 A 19 MET H A 19 MET HBx 1.0 1.8 3.52 957 875 A 19 MET H A 19 MET HBy 1.0 1.8 3.52 958 876 A 20 ASP H A 22 GLY H 1.0 1.8 5.68 959 877 A 17 GLN HA A 20 ASP H 1.0 1.8 5.16 960 878 A 20 ASP H A 19 MET HBx 1.0 1.8 4.17 961 878 A 19 MET HBy A 20 ASP H 1.0 1.8 4.17 962 879 A 23 ALA H A 21 ASP H 1.0 1.8 5.48 963 880 A 23 ALA H A 24 PRO HDy 1.0 1.8 5.86 964 881 A 23 ALA H A 20 ASP HBy 1.0 1.8 4.97 965 882 A 23 ALA H A 20 ASP HBx 1.0 1.8 4.97 966 883 A 25 VAL H A 67 TRP H 1.0 1.8 4.48 967 884 A 66 LEU HD2% A 25 VAL H 1.0 1.8 5.26 968 885 A 67 TRP HD1 A 27 THR H 1.0 1.8 4.91 969 886 A 66 LEU HD2% A 27 THR H 1.0 1.8 4.82 970 887 A 38 ILE HD1% A 28 ARG H 1.0 1.8 4.82 971 888 A 28 ARG H A 27 THR HG2% 1.0 1.8 4.68 972 889 A 26 LYS HA A 28 ARG H 1.0 1.8 5.49 973 890 A 29 ASP H A 32 ASP H 1.0 1.8 6.05 974 891 A 67 TRP HE3 A 68 ARG H 1.0 1.8 5.05 975 892 A 43 LEU H A 46 GLU H 1.0 1.8 6.05 976 893 A 44 TYR H A 46 GLU H 1.0 1.8 6.05 977 894 A 25 VAL HG1% A 29 ASP H 1.0 1.8 5.51 978 895 A 30 ILE HD1% A 29 ASP H 1.0 1.8 5.67 979 896 A 25 VAL HG1% A 30 ILE H 1.0 1.8 4.93 980 897 A 12 ILE HG2% A 30 ILE H 1.0 1.8 5.42 981 898 A 29 ASP H A 31 ALA H 1.0 1.8 5.32 982 899 A 28 ARG HA A 31 ALA H 1.0 1.8 4.68 983 900 A 27 THR HG2% A 31 ALA H 1.0 1.8 4.97 984 901 A 41 VAL HG1% A 31 ALA H 1.0 1.8 4.35 985 902 A 30 ILE HG2% A 31 ALA H 1.0 1.8 4.47 986 903 A 30 ILE HD1% A 31 ALA H 1.0 1.8 5.14 987 904 A 24 PRO HBx A 67 TRP H 1.0 1.8 6.05 988 905 A 66 LEU HD2% A 67 TRP H 1.0 1.8 4.69 989 906 A 34 ALA H A 31 ALA HA 1.0 1.8 5.01 990 907 A 12 ILE HD1% A 34 ALA H 1.0 1.8 4.07 991 908 A 34 ALA H A 36 LEU H 1.0 1.8 5.09 992 909 A 31 ALA HA A 36 LEU H 1.0 1.8 4.66 993 910 A 34 ALA HB% A 36 LEU H 1.0 1.8 4.04 994 911 A 37 SER H A 40 GLN HBy 1.0 1.8 4.74 995 912 A 37 SER H A 40 GLN HBx 1.0 1.8 4.74 996 913 A 36 LEU HD2% A 37 SER H 1.0 1.8 4.20 997 914 A 36 LEU HD1% A 37 SER H 1.0 1.8 4.96 998 915 A 36 LEU HG A 37 SER H 1.0 1.8 5.30 999 916 A 39 TYR H A 37 SER HBy 1.0 1.8 5.30 1000 917 A 38 ILE HG2% A 39 TYR H 1.0 1.8 4.13 1001 918 A 40 GLN H A 42 ARG H 1.0 1.8 5.31 1002 919 A 39 TYR HD% A 40 GLN H 1.0 1.8 5.14 1003 920 A 40 GLN H A 37 SER HBy 1.0 1.8 5.39 1004 921 A 40 GLN H A 41 VAL HG2% 1.0 1.8 5.17 1005 922 A 43 LEU H A 41 VAL H 1.0 1.8 5.18 1006 923 A 36 LEU HD1% A 41 VAL H 1.0 1.8 4.99 1007 924 A 41 VAL H A 36 LEU HBy 1.0 1.8 5.36 1008 925 A 31 ALA HB% A 41 VAL H 1.0 1.8 4.91 1009 926 A 41 VAL HG1% A 43 LEU H 1.0 1.8 5.26 1010 927 A 44 TYR H A 44 TYR HBx 1.0 1.8 3.76 1011 927 A 44 TYR HBy A 44 TYR H 1.0 1.8 3.76 1012 928 A 43 LEU HD1% A 44 TYR H 1.0 1.8 5.32 1013 929 A 9 ILE HD1% A 44 TYR H 1.0 1.8 5.62 1014 930 A 41 VAL HG1% A 44 TYR H 1.0 1.8 5.48 1015 931 A 47 GLN H A 49 HIS H 1.0 1.8 5.53 1016 932 A 67 TRP HZ3 A 49 HIS H 1.0 1.8 5.83 1017 933 A 54 LEU HD1% A 49 HIS H 1.0 1.8 4.69 1018 934 A 48 LEU HG A 49 HIS H 1.0 1.8 5.67 1019 935 A 53 VAL HB A 49 HIS H 1.0 1.8 6.05 1020 936 A 54 LEU HBy A 49 HIS H 1.0 1.8 5.41 1021 937 A 47 GLN HA A 50 ASP H 1.0 1.8 4.44 1022 938 A 51 VAL HG2% A 50 ASP H 1.0 1.8 5.12 1023 939 A 51 VAL H A 53 VAL H 1.0 1.8 5.26 1024 940 A 48 LEU HA A 51 VAL H 1.0 1.8 4.60 1025 941 A 69 LEU HD2% A 17 GLN HE21 1.0 1.8 5.51 1026 942 A 69 LEU HD2% A 17 GLN HE22 1.0 1.8 5.51 1027 943 A 17 GLN HE21 A 68 ARG HGx 1.0 1.8 5.46 1028 943 A 68 ARG HGy A 17 GLN HE21 1.0 1.8 5.46 1029 944 A 17 GLN HE22 A 68 ARG HGx 1.0 1.8 5.46 1030 944 A 68 ARG HGy A 17 GLN HE22 1.0 1.8 5.46 1031 945 A 54 LEU H A 52 GLY H 1.0 1.8 5.25 1032 946 A 49 HIS HA A 52 GLY H 1.0 1.8 5.21 1033 947 A 52 GLY H A 50 ASP HA 1.0 1.8 5.39 1034 948 A 51 VAL HG2% A 52 GLY H 1.0 1.8 4.63 1035 949 A 53 VAL HG2% A 52 GLY H 1.0 1.8 5.10 1036 950 A 51 VAL HG1% A 52 GLY H 1.0 1.8 4.81 1037 951 A 49 HIS HA A 53 VAL H 1.0 1.8 5.18 1038 952 A 51 VAL HG2% A 53 VAL H 1.0 1.8 4.32 1039 953 A 48 LEU HD2% A 53 VAL H 1.0 1.8 4.98 1040 954 A 49 HIS HA A 54 LEU H 1.0 1.8 4.29 1041 955 A 48 LEU HBx A 54 LEU H 1.0 1.8 4.91 1042 956 A 51 VAL HG2% A 54 LEU H 1.0 1.8 5.64 1043 957 A 55 GLU H A 68 ARG H 1.0 1.8 4.61 1044 958 A 55 GLU H A 70 LEU H 1.0 1.8 5.63 1045 959 A 69 LEU HA A 55 GLU H 1.0 1.8 5.07 1046 960 A 55 GLU H A 54 LEU HD2% 1.0 1.8 4.27 1047 961 A 67 TRP HA A 57 VAL H 1.0 1.8 5.03 1048 962 A 56 LYS H A 55 GLU HA 1.0 1.8 3.61 1049 963 A 56 LYS H A 55 GLU HGy 1.0 1.8 5.04 1050 964 A 56 LYS H A 55 GLU HBx 1.0 1.8 4.73 1051 964 A 55 GLU HBy A 56 LYS H 1.0 1.8 4.73 1052 965 A 56 LYS H A 55 GLU HGx 1.0 1.8 5.04 1053 966 A 66 LEU HBy A 57 VAL H 1.0 1.8 5.26 1054 967 A 71 GLU H A 71 GLU HBy 1.0 1.8 4.59 1055 968 A 71 GLU H A 71 GLU HBx 1.0 1.8 4.59 1056 969 A 71 GLU H A 70 LEU HBx 1.0 1.8 4.33 1057 969 A 70 LEU HBy A 71 GLU H 1.0 1.8 4.33 1058 970 A 70 LEU HD2% A 71 GLU H 1.0 1.8 4.85 1059 971 A 70 LEU H A 71 GLU H 1.0 1.8 5.02 1060 972 A 54 LEU HA A 70 LEU H 1.0 1.8 4.38 1061 973 A 70 LEU H A 70 LEU HBx 1.0 1.8 3.81 1062 973 A 70 LEU HBy A 70 LEU H 1.0 1.8 3.81 1063 974 A 70 LEU H A 70 LEU HG 1.0 1.8 3.83 1064 975 A 69 LEU HD1% A 70 LEU H 1.0 1.8 4.02 1065 976 A 63 VAL HG2% A 59 ALA H 1.0 1.8 5.16 1066 977 A 59 ALA HB% A 59 ALA H 1.0 1.8 3.87 1067 978 A 59 ALA H A 58 ASN HBx 1.0 1.8 4.88 1068 978 A 58 ASN HBy A 59 ALA H 1.0 1.8 4.88 1069 979 A 58 ASN H A 59 ALA H 1.0 1.8 5.44 1070 980 A 58 ASN HA A 59 ALA H 1.0 1.8 3.92 1071 981 A 61 LYS HA A 63 VAL H 1.0 1.8 5.25 1072 982 A 57 VAL HB A 66 LEU H 1.0 1.8 5.19 1073 983 A 56 LYS HA A 68 ARG H 1.0 1.8 5.51 1074 984 A 68 ARG H A 55 GLU HBx 1.0 1.8 4.76 1075 984 A 55 GLU HBy A 68 ARG H 1.0 1.8 4.76 1076 985 A 54 LEU HD2% A 68 ARG H 1.0 1.8 5.15 1077 986 A 57 VAL HG2% A 68 ARG H 1.0 1.8 4.74 1078 987 A 70 LEU HD2% A 70 LEU H 1.0 1.8 4.13 1079 988 A 41 VAL HG1% A 42 ARG H 1.0 1.8 3.92 1080 989 A 38 ILE HD1% A 42 ARG H 1.0 1.8 5.62 1081 990 A 61 LYS H A 61 LYS HGx 1.0 1.8 5.38 1082 991 A 42 ARG H A 42 ARG HDx 1.0 1.8 5.24 1083 991 A 42 ARG HDy A 42 ARG H 1.0 1.8 5.24 1084 992 A 61 LYS H A 61 LYS HGy 1.0 1.8 5.38 1085 993 A 27 THR HG2% A 67 TRP HE1 1.0 1.8 4.79 1086 994 A 66 LEU HD2% A 26 LYS H 1.0 1.8 4.98 1087 995 A 12 ILE H A 11 SER HBx 1.0 1.8 4.15 1088 995 A 12 ILE H A 11 SER HBy 1.0 1.8 4.15 1089 996 A 58 ASN H A 58 ASN HBx 1.0 1.8 4.19 1090 996 A 58 ASN HBy A 58 ASN H 1.0 1.8 4.19 1091 997 A 57 VAL HB A 58 ASN H 1.0 1.8 5.16 1092 998 A 57 VAL HG1% A 58 ASN H 1.0 1.8 4.43 1093 999 A 57 VAL HG2% A 58 ASN H 1.0 1.8 5.21 1094 1000 A 27 THR HA A 67 TRP HE1 1.0 1.8 4.99 1095 1001 A 66 LEU HA A 67 TRP HE1 1.0 1.8 5.54 1096 1002 A 17 GLN H A 16 ARG HBy 1.0 1.8 4.22 1097 1003 A 18 ASN H A 16 ARG H 1.0 1.8 5.24 1098 1004 A 43 LEU HA A 46 GLU H 1.0 1.8 4.89 1099 1005 A 42 ARG HA A 46 GLU H 1.0 1.8 5.22 1100 1006 A 46 GLU H A 46 GLU HGx 1.0 1.8 4.25 1101 1006 A 46 GLU HGy A 46 GLU H 1.0 1.8 4.25 1102 1007 A 45 LEU HG A 46 GLU H 1.0 1.8 5.44 1103 1008 A 29 ASP HA A 32 ASP H 1.0 1.8 4.84 1104 1009 A 66 LEU H A 57 VAL H 1.0 1.8 5.39 1105 1010 A 48 LEU H A 50 ASP H 1.0 1.8 5.30 1106 1011 A 8 LYS HA A 10 ILE H 1.0 1.8 5.38 1107 1012 A 15 GLU HA A 18 ASN HD21 1.0 1.8 5.49 1108 1013 A 12 ILE HD1% A 33 ALA H 1.0 1.8 5.68 1109 1014 A 30 ILE HG2% A 33 ALA H 1.0 1.8 6.05 1110 1015 A 32 ASP H A 33 ALA H 1.0 1.8 3.51 1111 1016 A 26 LYS HBx A 29 ASP H 1.0 1.8 4.58 1112 1017 A 7 THR HG2% A 11 SER H 1.0 1.8 5.61 1113 1018 A 41 VAL H A 36 LEU HBx 1.0 1.8 5.36 1114 1019 A 45 LEU H A 44 TYR HBx 1.0 1.8 4.26 1115 1019 A 44 TYR HBy A 45 LEU H 1.0 1.8 4.26 1116 1020 A 48 LEU H A 47 GLN HBy 1.0 1.8 4.36 1117 1021 A 41 VAL HG2% A 31 ALA H 1.0 1.8 4.39 1118 1022 A 68 ARG HE A 68 ARG HGx 1.0 1.8 4.42 1119 1022 A 68 ARG HGy A 68 ARG HE 1.0 1.8 4.42 1120 1023 A 26 LYS HA A 67 TRP H 1.0 1.8 4.96 1121 1024 A 54 LEU HD1% A 55 GLU H 1.0 1.8 5.22 1122 1025 A 42 ARG HA A 45 LEU H 1.0 1.8 4.75 1123 1026 A 40 GLN HA A 43 LEU H 1.0 1.8 4.31 1124 1027 A 43 LEU H A 44 TYR H 1.0 1.8 2.79 1125 1028 A 5 ILE H A 5 ILE HG1y 1.0 1.8 4.73 1126 1028 A 5 ILE H A 5 ILE HG1x 1.0 1.8 4.73 1127 1029 A 5 ILE HA A 8 LYS HBx 1.0 1.8 4.35 1128 1029 A 5 ILE HA A 8 LYS HBy 1.0 1.8 4.35 1129 1030 A 8 LYS H A 8 LYS HBx 1.0 1.8 3.41 1130 1030 A 8 LYS H A 8 LYS HBy 1.0 1.8 3.41 1131 1031 A 8 LYS HA A 8 LYS HGx 1.0 1.8 4.06 1132 1031 A 8 LYS HA A 8 LYS HGy 1.0 1.8 4.06 1133 1032 A 8 LYS HBy A 8 LYS HDx 1.0 1.8 3.77 1134 1032 A 8 LYS HBx A 8 LYS HDx 1.0 1.8 3.77 1135 1032 A 8 LYS HDy A 8 LYS HBx 1.0 1.8 3.77 1136 1032 A 8 LYS HDy A 8 LYS HBy 1.0 1.8 3.77 1137 1033 A 8 LYS HBx A 8 LYS HEx 1.0 1.8 5.05 1138 1033 A 8 LYS HBy A 8 LYS HEx 1.0 1.8 5.05 1139 1033 A 8 LYS HEy A 8 LYS HBx 1.0 1.8 5.05 1140 1033 A 8 LYS HEy A 8 LYS HBy 1.0 1.8 5.05 1141 1034 A 9 ILE H A 8 LYS HBx 1.0 1.8 3.62 1142 1034 A 9 ILE H A 8 LYS HBy 1.0 1.8 3.62 1143 1035 A 34 ALA HB% A 8 LYS HBx 1.0 1.8 5.53 1144 1035 A 34 ALA HB% A 8 LYS HBy 1.0 1.8 5.53 1145 1036 A 12 ILE HG2% A 8 LYS HGx 1.0 1.8 5.28 1146 1036 A 12 ILE HG2% A 8 LYS HGy 1.0 1.8 5.28 1147 1037 A 12 ILE HD1% A 8 LYS HGx 1.0 1.8 4.48 1148 1037 A 12 ILE HD1% A 8 LYS HGy 1.0 1.8 4.48 1149 1038 A 34 ALA HA A 8 LYS HGx 1.0 1.8 5.30 1150 1038 A 34 ALA HA A 8 LYS HGy 1.0 1.8 5.30 1151 1039 A 9 ILE HA A 9 ILE HG1y 1.0 1.8 4.04 1152 1039 A 9 ILE HA A 9 ILE HG1x 1.0 1.8 4.04 1153 1040 A 9 ILE HA A 12 ILE HG1y 1.0 1.8 5.35 1154 1040 A 9 ILE HA A 12 ILE HG1x 1.0 1.8 5.35 1155 1041 A 34 ALA HB% A 9 ILE HG1y 1.0 1.8 4.92 1156 1041 A 34 ALA HB% A 9 ILE HG1x 1.0 1.8 4.92 1157 1042 A 41 VAL HG2% A 9 ILE HG1y 1.0 1.8 4.97 1158 1042 A 41 VAL HG2% A 9 ILE HG1x 1.0 1.8 4.97 1159 1043 A 10 ILE H A 10 ILE HG1y 1.0 1.8 3.78 1160 1043 A 10 ILE H A 10 ILE HG1x 1.0 1.8 3.78 1161 1044 A 11 SER H A 10 ILE HG1y 1.0 1.8 5.08 1162 1044 A 11 SER H A 10 ILE HG1x 1.0 1.8 5.08 1163 1045 A 12 ILE H A 12 ILE HG1y 1.0 1.8 3.64 1164 1045 A 12 ILE H A 12 ILE HG1x 1.0 1.8 3.64 1165 1046 A 12 ILE HG2% A 16 ARG HDx 1.0 1.8 4.60 1166 1046 A 12 ILE HG2% A 16 ARG HDy 1.0 1.8 4.60 1167 1047 A 12 ILE HG2% A 30 ILE HG1y 1.0 1.8 4.70 1168 1047 A 12 ILE HG2% A 30 ILE HG1x 1.0 1.8 4.70 1169 1048 A 33 ALA HB% A 12 ILE HG1y 1.0 1.8 4.63 1170 1048 A 33 ALA HB% A 12 ILE HG1x 1.0 1.8 4.63 1171 1049 A 34 ALA HB% A 12 ILE HG1y 1.0 1.8 5.01 1172 1049 A 34 ALA HB% A 12 ILE HG1x 1.0 1.8 5.01 1173 1050 A 13 VAL HA A 30 ILE HG1y 1.0 1.8 5.57 1174 1050 A 13 VAL HA A 30 ILE HG1x 1.0 1.8 5.57 1175 1051 A 13 VAL HG1% A 17 GLN HBx 1.0 1.8 5.10 1176 1051 A 13 VAL HG1% A 17 GLN HBy 1.0 1.8 5.10 1177 1052 A 13 VAL HG2% A 30 ILE HG1y 1.0 1.8 5.87 1178 1052 A 13 VAL HG2% A 30 ILE HG1x 1.0 1.8 5.87 1179 1053 A 14 GLN HA A 14 GLN HE21 1.0 1.8 5.37 1180 1053 A 14 GLN HA A 14 GLN HE22 1.0 1.8 5.37 1181 1054 A 14 GLN HE22 A 14 GLN HBx 1.0 1.8 4.68 1182 1054 A 14 GLN HE21 A 14 GLN HBx 1.0 1.8 4.68 1183 1054 A 14 GLN HE21 A 14 GLN HBy 1.0 1.8 4.68 1184 1054 A 14 GLN HE22 A 14 GLN HBy 1.0 1.8 4.68 1185 1055 A 15 GLU H A 14 GLN HBx 1.0 1.8 3.51 1186 1055 A 15 GLU H A 14 GLN HBy 1.0 1.8 3.51 1187 1056 A 18 ASN HD21 A 14 GLN HGx 1.0 1.8 4.31 1188 1056 A 18 ASN HD22 A 14 GLN HGx 1.0 1.8 4.31 1189 1056 A 14 GLN HGy A 18 ASN HD21 1.0 1.8 4.31 1190 1056 A 14 GLN HGy A 18 ASN HD22 1.0 1.8 4.31 1191 1057 A 69 LEU HD2% A 14 GLN HE21 1.0 1.8 4.66 1192 1057 A 69 LEU HD2% A 14 GLN HE22 1.0 1.8 4.66 1193 1058 A 15 GLU H A 15 GLU HGx 1.0 1.8 4.52 1194 1058 A 15 GLU H A 15 GLU HGy 1.0 1.8 4.52 1195 1059 A 15 GLU HA A 15 GLU HGx 1.0 1.8 4.05 1196 1059 A 15 GLU HA A 15 GLU HGy 1.0 1.8 4.05 1197 1060 A 15 GLU HA A 18 ASN HBx 1.0 1.8 4.13 1198 1060 A 15 GLU HA A 18 ASN HBy 1.0 1.8 4.13 1199 1061 A 15 GLU HA A 18 ASN HD21 1.0 1.8 4.81 1200 1061 A 15 GLU HA A 18 ASN HD22 1.0 1.8 4.81 1201 1062 A 16 ARG H A 16 ARG HBx 1.0 1.8 3.67 1202 1062 A 16 ARG H A 16 ARG HBy 1.0 1.8 3.67 1203 1063 A 16 ARG HA A 19 MET HGx 1.0 1.8 4.83 1204 1063 A 16 ARG HA A 19 MET HGy 1.0 1.8 4.83 1205 1064 A 17 GLN H A 16 ARG HBx 1.0 1.8 3.60 1206 1064 A 17 GLN H A 16 ARG HBy 1.0 1.8 3.60 1207 1065 A 25 VAL HG1% A 16 ARG HBx 1.0 1.8 4.04 1208 1065 A 25 VAL HG1% A 16 ARG HBy 1.0 1.8 4.04 1209 1066 A 25 VAL HG2% A 16 ARG HBx 1.0 1.8 3.99 1210 1066 A 25 VAL HG2% A 16 ARG HBy 1.0 1.8 3.99 1211 1067 A 17 GLN H A 17 GLN HBx 1.0 1.8 3.64 1212 1067 A 17 GLN H A 17 GLN HBy 1.0 1.8 3.64 1213 1068 A 17 GLN HA A 17 GLN HE21 1.0 1.8 5.51 1214 1068 A 17 GLN HA A 17 GLN HE22 1.0 1.8 5.51 1215 1069 A 17 GLN HE21 A 17 GLN HBx 1.0 1.8 4.38 1216 1069 A 17 GLN HE22 A 17 GLN HBy 1.0 1.8 4.38 1217 1069 A 17 GLN HE22 A 17 GLN HBx 1.0 1.8 4.38 1218 1069 A 17 GLN HE21 A 17 GLN HBy 1.0 1.8 4.38 1219 1070 A 17 GLN HE21 A 68 ARG HBy 1.0 1.8 4.58 1220 1070 A 17 GLN HE21 A 68 ARG HBx 1.0 1.8 4.58 1221 1070 A 17 GLN HE22 A 68 ARG HBy 1.0 1.8 4.58 1222 1070 A 17 GLN HE22 A 68 ARG HBx 1.0 1.8 4.58 1223 1071 A 68 ARG HGy A 17 GLN HE21 1.0 1.8 4.71 1224 1071 A 17 GLN HE21 A 68 ARG HGx 1.0 1.8 4.71 1225 1071 A 68 ARG HGy A 17 GLN HE22 1.0 1.8 4.71 1226 1071 A 17 GLN HE22 A 68 ARG HGx 1.0 1.8 4.71 1227 1072 A 69 LEU H A 17 GLN HE21 1.0 1.8 4.72 1228 1072 A 69 LEU H A 17 GLN HE22 1.0 1.8 4.72 1229 1073 A 17 GLN HE21 A 69 LEU HBy 1.0 1.8 4.54 1230 1073 A 17 GLN HE21 A 69 LEU HBx 1.0 1.8 4.54 1231 1073 A 17 GLN HE22 A 69 LEU HBy 1.0 1.8 4.54 1232 1073 A 17 GLN HE22 A 69 LEU HBx 1.0 1.8 4.54 1233 1074 A 69 LEU HD1% A 17 GLN HE21 1.0 1.8 5.04 1234 1074 A 69 LEU HD1% A 17 GLN HE22 1.0 1.8 5.04 1235 1075 A 18 ASN H A 18 ASN HBx 1.0 1.8 3.38 1236 1075 A 18 ASN H A 18 ASN HBy 1.0 1.8 3.38 1237 1076 A 18 ASN HD22 A 18 ASN HBy 1.0 1.8 3.49 1238 1076 A 18 ASN HD21 A 18 ASN HBx 1.0 1.8 3.49 1239 1076 A 18 ASN HD22 A 18 ASN HBx 1.0 1.8 3.49 1240 1076 A 18 ASN HD21 A 18 ASN HBy 1.0 1.8 3.49 1241 1077 A 19 MET H A 18 ASN HBx 1.0 1.8 3.89 1242 1077 A 19 MET H A 18 ASN HBy 1.0 1.8 3.89 1243 1078 A 19 MET H A 19 MET HGx 1.0 1.8 3.87 1244 1078 A 19 MET H A 19 MET HGy 1.0 1.8 3.87 1245 1079 A 19 MET HA A 19 MET HGx 1.0 1.8 3.85 1246 1079 A 19 MET HA A 19 MET HGy 1.0 1.8 3.85 1247 1080 A 20 ASP H A 20 ASP HBx 1.0 1.8 3.70 1248 1080 A 20 ASP H A 20 ASP HBy 1.0 1.8 3.70 1249 1081 A 21 ASP H A 20 ASP HBx 1.0 1.8 4.30 1250 1081 A 21 ASP H A 20 ASP HBy 1.0 1.8 4.30 1251 1082 A 22 GLY H A 20 ASP HBx 1.0 1.8 5.39 1252 1082 A 22 GLY H A 20 ASP HBy 1.0 1.8 5.39 1253 1083 A 23 ALA H A 20 ASP HBx 1.0 1.8 4.23 1254 1083 A 23 ALA H A 20 ASP HBy 1.0 1.8 4.23 1255 1084 A 23 ALA HB% A 20 ASP HBx 1.0 1.8 3.77 1256 1084 A 23 ALA HB% A 20 ASP HBy 1.0 1.8 3.77 1257 1085 A 21 ASP H A 21 ASP HBy 1.0 1.8 3.90 1258 1085 A 21 ASP H A 21 ASP HBx 1.0 1.8 3.90 1259 1086 A 23 ALA H A 24 PRO HDx 1.0 1.8 5.02 1260 1086 A 23 ALA H A 24 PRO HDy 1.0 1.8 5.02 1261 1087 A 23 ALA HA A 24 PRO HDx 1.0 1.8 3.28 1262 1087 A 23 ALA HA A 24 PRO HDy 1.0 1.8 3.28 1263 1088 A 23 ALA HB% A 24 PRO HGx 1.0 1.8 5.10 1264 1088 A 23 ALA HB% A 24 PRO HGy 1.0 1.8 5.10 1265 1089 A 23 ALA HB% A 24 PRO HDx 1.0 1.8 3.55 1266 1089 A 23 ALA HB% A 24 PRO HDy 1.0 1.8 3.55 1267 1090 A 25 VAL H A 24 PRO HGx 1.0 1.8 4.65 1268 1090 A 25 VAL H A 24 PRO HGy 1.0 1.8 4.65 1269 1091 A 57 VAL HG1% A 24 PRO HGx 1.0 1.8 4.41 1270 1091 A 57 VAL HG1% A 24 PRO HGy 1.0 1.8 4.41 1271 1092 A 57 VAL HG2% A 24 PRO HGx 1.0 1.8 4.89 1272 1092 A 57 VAL HG2% A 24 PRO HGy 1.0 1.8 4.89 1273 1093 A 66 LEU HBy A 24 PRO HGx 1.0 1.8 4.82 1274 1093 A 66 LEU HBy A 24 PRO HGy 1.0 1.8 4.82 1275 1094 A 66 LEU HBx A 24 PRO HGx 1.0 1.8 5.21 1276 1094 A 66 LEU HBx A 24 PRO HGy 1.0 1.8 5.21 1277 1095 A 66 LEU HD1% A 24 PRO HGx 1.0 1.8 4.13 1278 1095 A 66 LEU HD1% A 24 PRO HGy 1.0 1.8 4.13 1279 1096 A 66 LEU HD2% A 24 PRO HGx 1.0 1.8 3.74 1280 1096 A 66 LEU HD2% A 24 PRO HGy 1.0 1.8 3.74 1281 1097 A 67 TRP H A 24 PRO HGx 1.0 1.8 5.89 1282 1097 A 67 TRP H A 24 PRO HGy 1.0 1.8 5.89 1283 1098 A 66 LEU HD2% A 24 PRO HDx 1.0 1.8 5.89 1284 1098 A 66 LEU HD2% A 24 PRO HDy 1.0 1.8 5.89 1285 1099 A 25 VAL HB A 67 TRP HBx 1.0 1.8 5.17 1286 1099 A 25 VAL HB A 67 TRP HBy 1.0 1.8 5.17 1287 1100 A 25 VAL HG1% A 29 ASP HBx 1.0 1.8 4.31 1288 1100 A 25 VAL HG1% A 29 ASP HBy 1.0 1.8 4.31 1289 1101 A 25 VAL HG1% A 30 ILE HG1y 1.0 1.8 3.84 1290 1101 A 25 VAL HG1% A 30 ILE HG1x 1.0 1.8 3.84 1291 1102 A 26 LYS H A 29 ASP HBx 1.0 1.8 5.25 1292 1102 A 26 LYS H A 29 ASP HBy 1.0 1.8 5.25 1293 1103 A 26 LYS HBy A 26 LYS HDx 1.0 1.8 2.78 1294 1103 A 26 LYS HBy A 26 LYS HDy 1.0 1.8 2.78 1295 1104 A 26 LYS HBy A 29 ASP HBx 1.0 1.8 4.73 1296 1104 A 26 LYS HBy A 29 ASP HBy 1.0 1.8 4.73 1297 1105 A 26 LYS HBx A 26 LYS HDx 1.0 1.8 3.69 1298 1105 A 26 LYS HBx A 26 LYS HDy 1.0 1.8 3.69 1299 1106 A 26 LYS HGx A 26 LYS HDx 1.0 1.8 2.90 1300 1106 A 26 LYS HGx A 26 LYS HDy 1.0 1.8 2.90 1301 1107 A 27 THR H A 26 LYS HDx 1.0 1.8 5.87 1302 1107 A 27 THR H A 26 LYS HDy 1.0 1.8 5.87 1303 1108 A 27 THR HG2% A 42 ARG HGx 1.0 1.8 4.83 1304 1108 A 27 THR HG2% A 42 ARG HGy 1.0 1.8 4.83 1305 1109 A 28 ARG H A 28 ARG HGx 1.0 1.8 3.69 1306 1109 A 28 ARG H A 28 ARG HGy 1.0 1.8 3.69 1307 1110 A 28 ARG HA A 28 ARG HGx 1.0 1.8 3.92 1308 1110 A 28 ARG HA A 28 ARG HGy 1.0 1.8 3.92 1309 1111 A 28 ARG HA A 38 ILE HG1y 1.0 1.8 5.10 1310 1111 A 28 ARG HA A 38 ILE HG1x 1.0 1.8 5.10 1311 1112 A 28 ARG HBx A 28 ARG HGx 1.0 1.8 2.56 1312 1112 A 28 ARG HBy A 28 ARG HGx 1.0 1.8 2.56 1313 1112 A 28 ARG HGy A 28 ARG HBx 1.0 1.8 2.56 1314 1112 A 28 ARG HGy A 28 ARG HBy 1.0 1.8 2.56 1315 1113 A 28 ARG HBy A 28 ARG HDx 1.0 1.8 3.44 1316 1113 A 28 ARG HBx A 28 ARG HDx 1.0 1.8 3.44 1317 1113 A 28 ARG HDy A 28 ARG HBx 1.0 1.8 3.44 1318 1113 A 28 ARG HBy A 28 ARG HDy 1.0 1.8 3.44 1319 1114 A 29 ASP H A 28 ARG HBx 1.0 1.8 4.06 1320 1114 A 29 ASP H A 28 ARG HBy 1.0 1.8 4.06 1321 1115 A 38 ILE HD1% A 28 ARG HGx 1.0 1.8 4.89 1322 1115 A 38 ILE HD1% A 28 ARG HGy 1.0 1.8 4.89 1323 1116 A 28 ARG HDy A 38 ILE HG1y 1.0 1.8 5.70 1324 1116 A 28 ARG HDx A 38 ILE HG1y 1.0 1.8 5.70 1325 1116 A 38 ILE HG1x A 28 ARG HDx 1.0 1.8 5.70 1326 1116 A 38 ILE HG1x A 28 ARG HDy 1.0 1.8 5.70 1327 1117 A 38 ILE HD1% A 28 ARG HDx 1.0 1.8 4.29 1328 1117 A 38 ILE HD1% A 28 ARG HDy 1.0 1.8 4.29 1329 1118 A 29 ASP H A 29 ASP HBx 1.0 1.8 3.62 1330 1118 A 29 ASP H A 29 ASP HBy 1.0 1.8 3.62 1331 1119 A 29 ASP HA A 32 ASP HBx 1.0 1.8 4.10 1332 1119 A 29 ASP HA A 32 ASP HBy 1.0 1.8 4.10 1333 1120 A 30 ILE H A 29 ASP HBx 1.0 1.8 4.07 1334 1120 A 30 ILE H A 29 ASP HBy 1.0 1.8 4.07 1335 1121 A 29 ASP HBx A 30 ILE HG1y 1.0 1.8 5.10 1336 1121 A 29 ASP HBy A 30 ILE HG1y 1.0 1.8 5.10 1337 1121 A 30 ILE HG1x A 29 ASP HBx 1.0 1.8 5.10 1338 1121 A 30 ILE HG1x A 29 ASP HBy 1.0 1.8 5.10 1339 1122 A 30 ILE H A 30 ILE HG1y 1.0 1.8 3.34 1340 1122 A 30 ILE H A 30 ILE HG1x 1.0 1.8 3.34 1341 1123 A 30 ILE HB A 30 ILE HG1y 1.0 1.8 2.73 1342 1123 A 30 ILE HB A 30 ILE HG1x 1.0 1.8 2.73 1343 1124 A 30 ILE HG2% A 30 ILE HG1y 1.0 1.8 3.44 1344 1124 A 30 ILE HG2% A 30 ILE HG1x 1.0 1.8 3.44 1345 1125 A 30 ILE HD1% A 67 TRP HBx 1.0 1.8 4.59 1346 1125 A 30 ILE HD1% A 67 TRP HBy 1.0 1.8 4.59 1347 1126 A 31 ALA HA A 36 LEU HBx 1.0 1.8 4.83 1348 1126 A 31 ALA HA A 36 LEU HBy 1.0 1.8 4.83 1349 1127 A 31 ALA HB% A 32 ASP HBx 1.0 1.8 5.29 1350 1127 A 31 ALA HB% A 32 ASP HBy 1.0 1.8 5.29 1351 1128 A 32 ASP H A 32 ASP HBx 1.0 1.8 3.39 1352 1128 A 32 ASP H A 32 ASP HBy 1.0 1.8 3.39 1353 1129 A 33 ALA H A 32 ASP HBx 1.0 1.8 3.63 1354 1129 A 33 ALA H A 32 ASP HBy 1.0 1.8 3.63 1355 1130 A 33 ALA HB% A 32 ASP HBx 1.0 1.8 5.17 1356 1130 A 33 ALA HB% A 32 ASP HBy 1.0 1.8 5.17 1357 1131 A 36 LEU H A 36 LEU HBx 1.0 1.8 3.72 1358 1131 A 36 LEU H A 36 LEU HBy 1.0 1.8 3.72 1359 1132 A 36 LEU HD1% A 36 LEU HBx 1.0 1.8 3.47 1360 1132 A 36 LEU HD1% A 36 LEU HBy 1.0 1.8 3.47 1361 1133 A 36 LEU HD2% A 36 LEU HBx 1.0 1.8 3.38 1362 1133 A 36 LEU HD2% A 36 LEU HBy 1.0 1.8 3.38 1363 1134 A 37 SER H A 36 LEU HBx 1.0 1.8 3.73 1364 1134 A 37 SER H A 36 LEU HBy 1.0 1.8 3.73 1365 1135 A 36 LEU HBy A 40 GLN HBx 1.0 1.8 4.40 1366 1135 A 36 LEU HBx A 40 GLN HBx 1.0 1.8 4.40 1367 1135 A 40 GLN HBy A 36 LEU HBx 1.0 1.8 4.40 1368 1135 A 36 LEU HBy A 40 GLN HBy 1.0 1.8 4.40 1369 1136 A 41 VAL H A 36 LEU HBx 1.0 1.8 4.68 1370 1136 A 41 VAL H A 36 LEU HBy 1.0 1.8 4.68 1371 1137 A 41 VAL HB A 36 LEU HBx 1.0 1.8 5.08 1372 1137 A 41 VAL HB A 36 LEU HBy 1.0 1.8 5.08 1373 1138 A 41 VAL HG2% A 36 LEU HBx 1.0 1.8 3.73 1374 1138 A 41 VAL HG2% A 36 LEU HBy 1.0 1.8 3.73 1375 1139 A 36 LEU HD1% A 40 GLN HGx 1.0 1.8 4.79 1376 1139 A 36 LEU HD1% A 40 GLN HGy 1.0 1.8 4.79 1377 1140 A 36 LEU HD2% A 40 GLN HBx 1.0 1.8 4.66 1378 1140 A 36 LEU HD2% A 40 GLN HBy 1.0 1.8 4.66 1379 1141 A 36 LEU HD2% A 40 GLN HGx 1.0 1.8 4.81 1380 1141 A 36 LEU HD2% A 40 GLN HGy 1.0 1.8 4.81 1381 1142 A 36 LEU HD2% A 40 GLN HE21 1.0 1.8 5.14 1382 1142 A 36 LEU HD2% A 40 GLN HE22 1.0 1.8 5.14 1383 1143 A 37 SER H A 37 SER HBy 1.0 1.8 3.78 1384 1143 A 37 SER H A 37 SER HBx 1.0 1.8 3.78 1385 1144 A 37 SER H A 40 GLN HBx 1.0 1.8 4.00 1386 1144 A 37 SER H A 40 GLN HBy 1.0 1.8 4.00 1387 1145 A 37 SER H A 40 GLN HGx 1.0 1.8 5.07 1388 1145 A 37 SER H A 40 GLN HGy 1.0 1.8 5.07 1389 1146 A 38 ILE H A 37 SER HBy 1.0 1.8 3.93 1390 1146 A 38 ILE H A 37 SER HBx 1.0 1.8 3.93 1391 1147 A 39 TYR H A 37 SER HBy 1.0 1.8 4.36 1392 1147 A 39 TYR H A 37 SER HBx 1.0 1.8 4.36 1393 1148 A 40 GLN H A 37 SER HBy 1.0 1.8 4.62 1394 1148 A 40 GLN H A 37 SER HBx 1.0 1.8 4.62 1395 1149 A 38 ILE HA A 38 ILE HG1y 1.0 1.8 4.00 1396 1149 A 38 ILE HA A 38 ILE HG1x 1.0 1.8 4.00 1397 1150 A 38 ILE HG2% A 38 ILE HG1y 1.0 1.8 3.74 1398 1150 A 38 ILE HG2% A 38 ILE HG1x 1.0 1.8 3.74 1399 1151 A 39 TYR H A 38 ILE HG1y 1.0 1.8 4.61 1400 1151 A 39 TYR H A 38 ILE HG1x 1.0 1.8 4.61 1401 1152 A 39 TYR HA A 42 ARG HGx 1.0 1.8 5.26 1402 1152 A 39 TYR HA A 42 ARG HGy 1.0 1.8 5.26 1403 1153 A 40 GLN H A 39 TYR HBx 1.0 1.8 3.99 1404 1153 A 40 GLN H A 39 TYR HBy 1.0 1.8 3.99 1405 1154 A 40 GLN H A 40 GLN HBx 1.0 1.8 3.56 1406 1154 A 40 GLN H A 40 GLN HBy 1.0 1.8 3.56 1407 1155 A 40 GLN HA A 40 GLN HGx 1.0 1.8 3.95 1408 1155 A 40 GLN HA A 40 GLN HGy 1.0 1.8 3.95 1409 1156 A 41 VAL HG2% A 40 GLN HBx 1.0 1.8 4.79 1410 1156 A 41 VAL HG2% A 40 GLN HBy 1.0 1.8 4.79 1411 1157 A 40 GLN HE21 A 40 GLN HGx 1.0 1.8 3.49 1412 1157 A 40 GLN HE22 A 40 GLN HGx 1.0 1.8 3.49 1413 1157 A 40 GLN HGy A 40 GLN HE21 1.0 1.8 3.49 1414 1157 A 40 GLN HGy A 40 GLN HE22 1.0 1.8 3.49 1415 1158 A 41 VAL HG2% A 40 GLN HGx 1.0 1.8 5.33 1416 1158 A 41 VAL HG2% A 40 GLN HGy 1.0 1.8 5.33 1417 1159 A 44 TYR HD% A 40 GLN HGx 1.0 1.8 5.10 1418 1159 A 44 TYR HD% A 40 GLN HGy 1.0 1.8 5.10 1419 1160 A 42 ARG H A 42 ARG HBx 1.0 1.8 3.69 1420 1160 A 42 ARG H A 42 ARG HBy 1.0 1.8 3.69 1421 1161 A 42 ARG H A 42 ARG HGx 1.0 1.8 4.33 1422 1161 A 42 ARG H A 42 ARG HGy 1.0 1.8 4.33 1423 1162 A 42 ARG HA A 45 LEU HBx 1.0 1.8 4.06 1424 1162 A 42 ARG HA A 45 LEU HBy 1.0 1.8 4.06 1425 1163 A 42 ARG HBy A 42 ARG HDx 1.0 1.8 3.36 1426 1163 A 42 ARG HBx A 42 ARG HDx 1.0 1.8 3.36 1427 1163 A 42 ARG HDy A 42 ARG HBx 1.0 1.8 3.36 1428 1163 A 42 ARG HDy A 42 ARG HBy 1.0 1.8 3.36 1429 1164 A 43 LEU H A 42 ARG HBx 1.0 1.8 3.84 1430 1164 A 43 LEU H A 42 ARG HBy 1.0 1.8 3.84 1431 1165 A 45 LEU HD1% A 42 ARG HBx 1.0 1.8 5.87 1432 1165 A 45 LEU HD1% A 42 ARG HBy 1.0 1.8 5.87 1433 1166 A 43 LEU H A 42 ARG HGx 1.0 1.8 5.67 1434 1166 A 43 LEU H A 42 ARG HGy 1.0 1.8 5.67 1435 1167 A 45 LEU HD1% A 42 ARG HGx 1.0 1.8 5.87 1436 1167 A 45 LEU HD1% A 42 ARG HGy 1.0 1.8 5.87 1437 1168 A 43 LEU H A 43 LEU HBx 1.0 1.8 3.30 1438 1168 A 43 LEU H A 43 LEU HBy 1.0 1.8 3.30 1439 1169 A 43 LEU HG A 43 LEU HBx 1.0 1.8 2.78 1440 1169 A 43 LEU HG A 43 LEU HBy 1.0 1.8 2.78 1441 1170 A 44 TYR H A 43 LEU HBx 1.0 1.8 3.78 1442 1170 A 44 TYR H A 43 LEU HBy 1.0 1.8 3.78 1443 1171 A 45 LEU H A 45 LEU HBx 1.0 1.8 3.82 1444 1171 A 45 LEU H A 45 LEU HBy 1.0 1.8 3.82 1445 1172 A 45 LEU H A 46 GLU HBx 1.0 1.8 4.68 1446 1172 A 45 LEU H A 46 GLU HBy 1.0 1.8 4.68 1447 1173 A 45 LEU HD2% A 45 LEU HBx 1.0 1.8 3.69 1448 1173 A 45 LEU HD2% A 45 LEU HBy 1.0 1.8 3.69 1449 1174 A 46 GLU H A 45 LEU HBx 1.0 1.8 4.04 1450 1174 A 46 GLU H A 45 LEU HBy 1.0 1.8 4.04 1451 1175 A 54 LEU HD1% A 45 LEU HBx 1.0 1.8 5.81 1452 1175 A 54 LEU HD1% A 45 LEU HBy 1.0 1.8 5.81 1453 1176 A 45 LEU HD2% A 67 TRP HBx 1.0 1.8 5.87 1454 1176 A 45 LEU HD2% A 67 TRP HBy 1.0 1.8 5.87 1455 1177 A 46 GLU H A 46 GLU HBx 1.0 1.8 3.56 1456 1177 A 46 GLU H A 46 GLU HBy 1.0 1.8 3.56 1457 1178 A 46 GLU HA A 49 HIS HBx 1.0 1.8 4.10 1458 1178 A 46 GLU HA A 49 HIS HBy 1.0 1.8 4.10 1459 1179 A 47 GLN H A 46 GLU HBx 1.0 1.8 3.69 1460 1179 A 47 GLN H A 46 GLU HBy 1.0 1.8 3.69 1461 1180 A 47 GLN H A 47 GLN HGx 1.0 1.8 3.83 1462 1180 A 47 GLN H A 47 GLN HGy 1.0 1.8 3.83 1463 1181 A 47 GLN HA A 47 GLN HGx 1.0 1.8 3.82 1464 1181 A 47 GLN HA A 47 GLN HGy 1.0 1.8 3.82 1465 1182 A 47 GLN HA A 50 ASP HBx 1.0 1.8 3.98 1466 1182 A 47 GLN HA A 50 ASP HBy 1.0 1.8 3.98 1467 1183 A 48 LEU H A 47 GLN HBx 1.0 1.8 3.79 1468 1183 A 48 LEU H A 47 GLN HBy 1.0 1.8 3.79 1469 1184 A 50 ASP H A 49 HIS HBx 1.0 1.8 3.96 1470 1184 A 50 ASP H A 49 HIS HBy 1.0 1.8 3.96 1471 1185 A 50 ASP H A 50 ASP HBx 1.0 1.8 3.53 1472 1185 A 50 ASP H A 50 ASP HBy 1.0 1.8 3.53 1473 1186 A 51 VAL H A 50 ASP HBx 1.0 1.8 3.99 1474 1186 A 51 VAL H A 50 ASP HBy 1.0 1.8 3.99 1475 1187 A 51 VAL HG1% A 50 ASP HBx 1.0 1.8 4.22 1476 1187 A 51 VAL HG1% A 50 ASP HBy 1.0 1.8 4.22 1477 1188 A 70 LEU HD1% A 52 GLY HAy 1.0 1.8 5.87 1478 1188 A 70 LEU HD1% A 52 GLY HAx 1.0 1.8 5.87 1479 1189 A 70 LEU HD2% A 52 GLY HAy 1.0 1.8 4.96 1480 1189 A 70 LEU HD2% A 52 GLY HAx 1.0 1.8 4.96 1481 1190 A 54 LEU HD1% A 67 TRP HBx 1.0 1.8 4.38 1482 1190 A 54 LEU HD1% A 67 TRP HBy 1.0 1.8 4.38 1483 1191 A 54 LEU HD2% A 67 TRP HBx 1.0 1.8 4.64 1484 1191 A 54 LEU HD2% A 67 TRP HBy 1.0 1.8 4.64 1485 1192 A 55 GLU HBx A 55 GLU HGx 1.0 1.8 2.66 1486 1192 A 55 GLU HBy A 55 GLU HGx 1.0 1.8 2.66 1487 1192 A 55 GLU HGy A 55 GLU HBx 1.0 1.8 2.66 1488 1192 A 55 GLU HBy A 55 GLU HGy 1.0 1.8 2.66 1489 1193 A 55 GLU HBx A 68 ARG HBx 1.0 1.8 4.41 1490 1193 A 55 GLU HBy A 68 ARG HBx 1.0 1.8 4.41 1491 1193 A 68 ARG HBy A 55 GLU HBx 1.0 1.8 4.41 1492 1193 A 55 GLU HBy A 68 ARG HBy 1.0 1.8 4.41 1493 1194 A 56 LYS H A 55 GLU HGx 1.0 1.8 4.43 1494 1194 A 56 LYS H A 55 GLU HGy 1.0 1.8 4.43 1495 1195 A 57 VAL HG2% A 55 GLU HGx 1.0 1.8 4.84 1496 1195 A 57 VAL HG2% A 55 GLU HGy 1.0 1.8 4.84 1497 1196 A 55 GLU HGy A 68 ARG HGx 1.0 1.8 5.04 1498 1196 A 55 GLU HGx A 68 ARG HGx 1.0 1.8 5.04 1499 1196 A 68 ARG HGy A 55 GLU HGx 1.0 1.8 5.04 1500 1196 A 68 ARG HGy A 55 GLU HGy 1.0 1.8 5.04 1501 1197 A 70 LEU HD2% A 55 GLU HGx 1.0 1.8 4.50 1502 1197 A 70 LEU HD2% A 55 GLU HGy 1.0 1.8 4.50 1503 1198 A 56 LYS H A 56 LYS HBx 1.0 1.8 3.92 1504 1198 A 56 LYS H A 56 LYS HBy 1.0 1.8 3.92 1505 1199 A 56 LYS HBy A 56 LYS HDx 1.0 1.8 4.03 1506 1199 A 56 LYS HBx A 56 LYS HDx 1.0 1.8 4.03 1507 1199 A 56 LYS HDy A 56 LYS HBx 1.0 1.8 4.03 1508 1199 A 56 LYS HDy A 56 LYS HBy 1.0 1.8 4.03 1509 1200 A 56 LYS HBx A 56 LYS HEy 1.0 1.8 4.59 1510 1200 A 56 LYS HBy A 56 LYS HEy 1.0 1.8 4.59 1511 1200 A 56 LYS HEx A 56 LYS HBx 1.0 1.8 4.59 1512 1200 A 56 LYS HBy A 56 LYS HEx 1.0 1.8 4.59 1513 1201 A 57 VAL H A 56 LYS HBx 1.0 1.8 4.61 1514 1201 A 57 VAL H A 56 LYS HBy 1.0 1.8 4.61 1515 1202 A 57 VAL HG2% A 68 ARG HDx 1.0 1.8 4.38 1516 1202 A 57 VAL HG2% A 68 ARG HDy 1.0 1.8 4.38 1517 1203 A 61 LYS H A 61 LYS HBy 1.0 1.8 3.99 1518 1203 A 61 LYS H A 61 LYS HBx 1.0 1.8 3.99 1519 1204 A 61 LYS HA A 61 LYS HGx 1.0 1.8 4.08 1520 1204 A 61 LYS HA A 61 LYS HGy 1.0 1.8 4.08 1521 1205 A 63 VAL HG2% A 62 GLY HAy 1.0 1.8 5.25 1522 1205 A 63 VAL HG2% A 62 GLY HAx 1.0 1.8 5.25 1523 1206 A 63 VAL H A 64 PRO HDx 1.0 1.8 5.61 1524 1206 A 63 VAL H A 64 PRO HDy 1.0 1.8 5.61 1525 1207 A 63 VAL HA A 64 PRO HGx 1.0 1.8 4.83 1526 1207 A 63 VAL HA A 64 PRO HGy 1.0 1.8 4.83 1527 1208 A 63 VAL HA A 64 PRO HDx 1.0 1.8 3.33 1528 1208 A 63 VAL HA A 64 PRO HDy 1.0 1.8 3.33 1529 1209 A 63 VAL HG1% A 64 PRO HDx 1.0 1.8 4.08 1530 1209 A 63 VAL HG1% A 64 PRO HDy 1.0 1.8 4.08 1531 1210 A 63 VAL HG2% A 64 PRO HDx 1.0 1.8 4.38 1532 1210 A 63 VAL HG2% A 64 PRO HDy 1.0 1.8 4.38 1533 1211 A 64 PRO HA A 65 GLY HAx 1.0 1.8 5.13 1534 1211 A 64 PRO HA A 65 GLY HAy 1.0 1.8 5.13 1535 1212 A 66 LEU HBy A 65 GLY HAx 1.0 1.8 5.33 1536 1212 A 66 LEU HBy A 65 GLY HAy 1.0 1.8 5.33 1537 1213 A 66 LEU HD1% A 65 GLY HAx 1.0 1.8 5.87 1538 1213 A 66 LEU HD1% A 65 GLY HAy 1.0 1.8 5.87 1539 1214 A 66 LEU HD2% A 65 GLY HAx 1.0 1.8 5.87 1540 1214 A 66 LEU HD2% A 65 GLY HAy 1.0 1.8 5.87 1541 1215 A 67 TRP HA A 68 ARG HBx 1.0 1.8 5.87 1542 1215 A 67 TRP HA A 68 ARG HBy 1.0 1.8 5.87 1543 1216 A 68 ARG H A 67 TRP HBx 1.0 1.8 4.22 1544 1216 A 68 ARG H A 67 TRP HBy 1.0 1.8 4.22 1545 1217 A 68 ARG HBy A 68 ARG HDx 1.0 1.8 3.66 1546 1217 A 68 ARG HBx A 68 ARG HDx 1.0 1.8 3.66 1547 1217 A 68 ARG HDy A 68 ARG HBx 1.0 1.8 3.66 1548 1217 A 68 ARG HBy A 68 ARG HDy 1.0 1.8 3.66 1549 1218 A 69 LEU HA A 68 ARG HBx 1.0 1.8 5.87 1550 1218 A 69 LEU HA A 68 ARG HBy 1.0 1.8 5.87 1551 1219 A 69 LEU H A 69 LEU HBx 1.0 1.8 3.66 1552 1219 A 69 LEU H A 69 LEU HBy 1.0 1.8 3.66 1553 1220 A 69 LEU HG A 69 LEU HBx 1.0 1.8 2.84 1554 1220 A 69 LEU HG A 69 LEU HBy 1.0 1.8 2.84 1555 1221 A 69 LEU HD2% A 69 LEU HBx 1.0 1.8 3.36 1556 1221 A 69 LEU HD2% A 69 LEU HBy 1.0 1.8 3.36 1557 1222 A 70 LEU H A 69 LEU HBx 1.0 1.8 3.96 1558 1222 A 70 LEU H A 69 LEU HBy 1.0 1.8 3.96 1559 1223 A 71 GLU H A 71 GLU HBx 1.0 1.8 3.92 1560 1223 A 71 GLU H A 71 GLU HBy 1.0 1.8 3.92 1561 1224 A 71 GLU H A 71 GLU HGy 1.0 1.8 4.87 1562 1224 A 71 GLU H A 71 GLU HGx 1.0 1.8 4.87 stop_ save_ save_CNS/XPLOR_distance_constraints_4 _nef_distance_restraint_list.sf_category nef_distance_restraint_list _nef_distance_restraint_list.sf_framecode CNS/XPLOR_distance_constraints_4 _nef_distance_restraint_list.restraint_origin hbond _nef_distance_restraint_list.potential_type square-well-parabolic loop_ _nef_distance_restraint.index _nef_distance_restraint.restraint_id _nef_distance_restraint.chain_code_1 _nef_distance_restraint.sequence_code_1 _nef_distance_restraint.residue_name_1 _nef_distance_restraint.atom_name_1 _nef_distance_restraint.chain_code_2 _nef_distance_restraint.sequence_code_2 _nef_distance_restraint.residue_name_2 _nef_distance_restraint.atom_name_2 _nef_distance_restraint.weight _nef_distance_restraint.lower_limit _nef_distance_restraint.upper_limit 1 1 A 6 VAL O A 10 ILE N 1.0 2.4 3.3 2 2 A 10 ILE H A 6 VAL O 1.0 1.5 2.3 3 3 A 7 THR O A 11 SER N 1.0 2.4 3.3 4 4 A 11 SER H A 7 THR O 1.0 1.5 2.3 5 5 A 8 LYS O A 12 ILE N 1.0 2.4 3.3 6 6 A 12 ILE H A 8 LYS O 1.0 1.5 2.3 7 7 A 9 ILE O A 13 VAL N 1.0 2.4 3.3 8 8 A 13 VAL H A 9 ILE O 1.0 1.5 2.3 9 9 A 10 ILE O A 14 GLN N 1.0 2.4 3.3 10 10 A 14 GLN H A 10 ILE O 1.0 1.5 2.3 11 11 A 11 SER O A 15 GLU N 1.0 2.4 3.3 12 12 A 15 GLU H A 11 SER O 1.0 1.5 2.3 13 13 A 12 ILE O A 16 ARG N 1.0 2.4 3.3 14 14 A 16 ARG H A 12 ILE O 1.0 1.5 2.3 15 15 A 13 VAL O A 17 GLN N 1.0 2.4 3.3 16 16 A 17 GLN H A 13 VAL O 1.0 1.5 2.3 17 17 A 14 GLN O A 18 ASN N 1.0 2.4 3.3 18 18 A 18 ASN H A 14 GLN O 1.0 1.5 2.3 19 19 A 15 GLU O A 19 MET N 1.0 2.4 3.3 20 20 A 19 MET H A 15 GLU O 1.0 1.5 2.3 21 21 A 28 ARG O A 32 ASP N 1.0 2.4 3.3 22 22 A 32 ASP H A 28 ARG O 1.0 1.5 2.3 23 23 A 29 ASP O A 33 ALA N 1.0 2.4 3.3 24 24 A 33 ALA H A 29 ASP O 1.0 1.5 2.3 25 25 A 30 ILE O A 34 ALA N 1.0 2.4 3.3 26 26 A 34 ALA H A 30 ILE O 1.0 1.5 2.3 27 27 A 38 ILE O A 42 ARG N 1.0 2.4 3.3 28 28 A 42 ARG H A 38 ILE O 1.0 1.5 2.3 29 29 A 40 GLN O A 44 TYR N 1.0 2.4 3.3 30 30 A 44 TYR H A 40 GLN O 1.0 1.5 2.3 31 31 A 41 VAL O A 45 LEU N 1.0 2.4 3.3 32 32 A 45 LEU H A 41 VAL O 1.0 1.5 2.3 33 33 A 42 ARG O A 46 GLU N 1.0 2.4 3.3 34 34 A 46 GLU H A 42 ARG O 1.0 1.5 2.3 35 35 A 43 LEU O A 47 GLN N 1.0 2.4 3.3 36 36 A 47 GLN H A 43 LEU O 1.0 1.5 2.3 37 37 A 44 TYR O A 48 LEU N 1.0 2.4 3.3 38 38 A 48 LEU H A 44 TYR O 1.0 1.5 2.3 39 39 A 45 LEU O A 49 HIS N 1.0 2.4 3.3 40 40 A 49 HIS H A 45 LEU O 1.0 1.5 2.3 41 41 A 55 GLU O A 68 ARG N 1.0 2.4 3.3 42 42 A 68 ARG H A 55 GLU O 1.0 1.5 2.3 43 43 A 57 VAL O A 66 LEU N 1.0 2.4 3.3 44 44 A 66 LEU H A 57 VAL O 1.0 1.5 2.3 45 45 A 66 LEU O A 57 VAL N 1.0 2.4 3.3 46 46 A 57 VAL H A 66 LEU O 1.0 1.5 2.3 47 47 A 68 ARG O A 55 GLU N 1.0 2.4 3.3 48 48 A 55 GLU H A 68 ARG O 1.0 1.5 2.3 49 49 A 67 TRP O A 25 VAL N 1.0 2.4 3.3 50 50 A 25 VAL H A 67 TRP O 1.0 1.5 2.3 51 51 A 25 VAL O A 67 TRP N 1.0 2.4 3.3 52 52 A 67 TRP H A 25 VAL O 1.0 1.5 2.3 stop_ save_ save_CNS/XPLOR_dihedral_3 _nef_dihedral_restraint_list.sf_category nef_dihedral_restraint_list _nef_dihedral_restraint_list.sf_framecode CNS/XPLOR_dihedral_3 _nef_dihedral_restraint_list.potential_type square-well-parabolic _nef_dihedral_restraint_list.restraint_origin . loop_ _nef_dihedral_restraint.index _nef_dihedral_restraint.restraint_id _nef_dihedral_restraint.chain_code_1 _nef_dihedral_restraint.sequence_code_1 _nef_dihedral_restraint.residue_name_1 _nef_dihedral_restraint.atom_name_1 _nef_dihedral_restraint.chain_code_2 _nef_dihedral_restraint.sequence_code_2 _nef_dihedral_restraint.residue_name_2 _nef_dihedral_restraint.atom_name_2 _nef_dihedral_restraint.chain_code_3 _nef_dihedral_restraint.sequence_code_3 _nef_dihedral_restraint.residue_name_3 _nef_dihedral_restraint.atom_name_3 _nef_dihedral_restraint.chain_code_4 _nef_dihedral_restraint.sequence_code_4 _nef_dihedral_restraint.residue_name_4 _nef_dihedral_restraint.atom_name_4 _nef_dihedral_restraint.weight _nef_dihedral_restraint.lower_limit _nef_dihedral_restraint.upper_limit _nef_dihedral_restraint.name 1 1 A 4 SER C A 5 ILE N A 5 ILE CA A 5 ILE C 1.0 -102.30 -22.30 PHI 2 2 A 5 ILE N A 5 ILE CA A 5 ILE C A 6 VAL N 1.0 -86.98 13.02 PSI 3 3 A 5 ILE C A 6 VAL N A 6 VAL CA A 6 VAL C 1.0 -100.84 -20.84 PHI 4 4 A 6 VAL N A 6 VAL CA A 6 VAL C A 7 THR N 1.0 -95.52 4.48 PSI 5 5 A 6 VAL C A 7 THR N A 7 THR CA A 7 THR C 1.0 -101.16 -21.16 PHI 6 6 A 7 THR N A 7 THR CA A 7 THR C A 8 LYS N 1.0 -94.19 5.81 PSI 7 7 A 7 THR C A 8 LYS N A 8 LYS CA A 8 LYS C 1.0 -106.67 -26.67 PHI 8 8 A 8 LYS N A 8 LYS CA A 8 LYS C A 9 ILE N 1.0 -90.06 9.94 PSI 9 9 A 8 LYS C A 9 ILE N A 9 ILE CA A 9 ILE C 1.0 -103.91 -23.91 PHI 10 10 A 9 ILE N A 9 ILE CA A 9 ILE C A 10 ILE N 1.0 -94.46 5.54 PSI 11 11 A 9 ILE C A 10 ILE N A 10 ILE CA A 10 ILE C 1.0 -103.82 -23.82 PHI 12 12 A 10 ILE N A 10 ILE CA A 10 ILE C A 11 SER N 1.0 -93.63 6.37 PSI 13 13 A 10 ILE C A 11 SER N A 11 SER CA A 11 SER C 1.0 -102.51 -22.51 PHI 14 14 A 11 SER N A 11 SER CA A 11 SER C A 12 ILE N 1.0 -86.48 13.52 PSI 15 15 A 11 SER C A 12 ILE N A 12 ILE CA A 12 ILE C 1.0 -107.28 -27.28 PHI 16 16 A 12 ILE N A 12 ILE CA A 12 ILE C A 13 VAL N 1.0 -94.14 5.86 PSI 17 17 A 12 ILE C A 13 VAL N A 13 VAL CA A 13 VAL C 1.0 -103.33 -23.33 PHI 18 18 A 13 VAL N A 13 VAL CA A 13 VAL C A 14 GLN N 1.0 -96.01 3.99 PSI 19 19 A 13 VAL C A 14 GLN N A 14 GLN CA A 14 GLN C 1.0 -98.52 -18.52 PHI 20 20 A 14 GLN N A 14 GLN CA A 14 GLN C A 15 GLU N 1.0 -91.62 8.38 PSI 21 21 A 14 GLN C A 15 GLU N A 15 GLU CA A 15 GLU C 1.0 -103.26 -23.26 PHI 22 22 A 15 GLU N A 15 GLU CA A 15 GLU C A 16 ARG N 1.0 -94.50 5.50 PSI 23 23 A 15 GLU C A 16 ARG N A 16 ARG CA A 16 ARG C 1.0 -104.89 -24.89 PHI 24 24 A 16 ARG N A 16 ARG CA A 16 ARG C A 17 GLN N 1.0 -93.11 6.89 PSI 25 25 A 16 ARG C A 17 GLN N A 17 GLN CA A 17 GLN C 1.0 -103.67 -23.67 PHI 26 26 A 17 GLN N A 17 GLN CA A 17 GLN C A 18 ASN N 1.0 -90.44 9.56 PSI 27 27 A 17 GLN C A 18 ASN N A 18 ASN CA A 18 ASN C 1.0 -107.43 -27.43 PHI 28 28 A 18 ASN N A 18 ASN CA A 18 ASN C A 19 MET N 1.0 -87.88 12.12 PSI 29 29 A 18 ASN C A 19 MET N A 19 MET CA A 19 MET C 1.0 -108.54 -28.54 PHI 30 30 A 19 MET N A 19 MET CA A 19 MET C A 20 ASP N 1.0 -75.53 24.47 PSI 31 31 A 26 LYS C A 27 THR N A 27 THR CA A 27 THR C 1.0 -98.62 -18.62 PHI 32 32 A 27 THR N A 27 THR CA A 27 THR C A 28 ARG N 1.0 -90.54 9.46 PSI 33 33 A 27 THR C A 28 ARG N A 28 ARG CA A 28 ARG C 1.0 -99.72 -19.72 PHI 34 34 A 28 ARG N A 28 ARG CA A 28 ARG C A 29 ASP N 1.0 -95.40 4.60 PSI 35 35 A 28 ARG C A 29 ASP N A 29 ASP CA A 29 ASP C 1.0 -104.02 -24.02 PHI 36 36 A 29 ASP N A 29 ASP CA A 29 ASP C A 30 ILE N 1.0 -89.22 10.78 PSI 37 37 A 29 ASP C A 30 ILE N A 30 ILE CA A 30 ILE C 1.0 -105.51 -25.51 PHI 38 38 A 30 ILE N A 30 ILE CA A 30 ILE C A 31 ALA N 1.0 -95.00 5.00 PSI 39 39 A 30 ILE C A 31 ALA N A 31 ALA CA A 31 ALA C 1.0 -100.83 -20.83 PHI 40 40 A 31 ALA N A 31 ALA CA A 31 ALA C A 32 ASP N 1.0 -90.61 9.39 PSI 41 41 A 31 ALA C A 32 ASP N A 32 ASP CA A 32 ASP C 1.0 -102.36 -22.36 PHI 42 42 A 32 ASP N A 32 ASP CA A 32 ASP C A 33 ALA N 1.0 -90.89 9.11 PSI 43 43 A 32 ASP C A 33 ALA N A 33 ALA CA A 33 ALA C 1.0 -108.22 -28.22 PHI 44 44 A 33 ALA N A 33 ALA CA A 33 ALA C A 34 ALA N 1.0 -74.06 25.94 PSI 45 45 A 33 ALA C A 34 ALA N A 34 ALA CA A 34 ALA C 1.0 -128.01 -48.01 PHI 46 46 A 34 ALA N A 34 ALA CA A 34 ALA C A 35 GLY N 1.0 -51.03 48.97 PSI 47 47 A 37 SER C A 38 ILE N A 38 ILE CA A 38 ILE C 1.0 -101.48 -21.48 PHI 48 48 A 38 ILE N A 38 ILE CA A 38 ILE C A 39 TYR N 1.0 -89.30 10.70 PSI 49 49 A 38 ILE C A 39 TYR N A 39 TYR CA A 39 TYR C 1.0 -101.85 -21.85 PHI 50 50 A 39 TYR N A 39 TYR CA A 39 TYR C A 40 GLN N 1.0 -91.35 8.65 PSI 51 51 A 39 TYR C A 40 GLN N A 40 GLN CA A 40 GLN C 1.0 -103.54 -23.54 PHI 52 52 A 40 GLN N A 40 GLN CA A 40 GLN C A 41 VAL N 1.0 -90.09 9.91 PSI 53 53 A 40 GLN C A 41 VAL N A 41 VAL CA A 41 VAL C 1.0 -105.75 -25.75 PHI 54 54 A 41 VAL N A 41 VAL CA A 41 VAL C A 42 ARG N 1.0 -94.45 5.55 PSI 55 55 A 41 VAL C A 42 ARG N A 42 ARG CA A 42 ARG C 1.0 -99.35 -19.35 PHI 56 56 A 42 ARG N A 42 ARG CA A 42 ARG C A 43 LEU N 1.0 -94.68 5.32 PSI 57 57 A 42 ARG C A 43 LEU N A 43 LEU CA A 43 LEU C 1.0 -99.97 -19.97 PHI 58 58 A 43 LEU N A 43 LEU CA A 43 LEU C A 44 TYR N 1.0 -90.65 9.35 PSI 59 59 A 43 LEU C A 44 TYR N A 44 TYR CA A 44 TYR C 1.0 -105.76 -25.76 PHI 60 60 A 44 TYR N A 44 TYR CA A 44 TYR C A 45 LEU N 1.0 -93.67 6.33 PSI 61 61 A 44 TYR C A 45 LEU N A 45 LEU CA A 45 LEU C 1.0 -102.55 -22.55 PHI 62 62 A 45 LEU N A 45 LEU CA A 45 LEU C A 46 GLU N 1.0 -92.55 7.45 PSI 63 63 A 45 LEU C A 46 GLU N A 46 GLU CA A 46 GLU C 1.0 -102.74 -22.74 PHI 64 64 A 46 GLU N A 46 GLU CA A 46 GLU C A 47 GLN N 1.0 -90.73 9.27 PSI 65 65 A 46 GLU C A 47 GLN N A 47 GLN CA A 47 GLN C 1.0 -105.14 -25.14 PHI 66 66 A 47 GLN N A 47 GLN CA A 47 GLN C A 48 LEU N 1.0 -92.90 7.10 PSI 67 67 A 47 GLN C A 48 LEU N A 48 LEU CA A 48 LEU C 1.0 -105.69 -25.69 PHI 68 68 A 48 LEU N A 48 LEU CA A 48 LEU C A 49 HIS N 1.0 -88.34 11.66 PSI 69 69 A 48 LEU C A 49 HIS N A 49 HIS CA A 49 HIS C 1.0 -108.15 -28.15 PHI 70 70 A 49 HIS N A 49 HIS CA A 49 HIS C A 50 ASP N 1.0 -92.85 7.15 PSI 71 71 A 49 HIS C A 50 ASP N A 50 ASP CA A 50 ASP C 1.0 -104.12 -24.12 PHI 72 72 A 50 ASP N A 50 ASP CA A 50 ASP C A 51 VAL N 1.0 -78.93 21.07 PSI 73 73 A 50 ASP C A 51 VAL N A 51 VAL CA A 51 VAL C 1.0 -135.74 -55.74 PHI 74 74 A 51 VAL N A 51 VAL CA A 51 VAL C A 52 GLY N 1.0 -47.64 52.36 PSI 75 75 A 53 VAL C A 54 LEU N A 54 LEU CA A 54 LEU C 1.0 -169.49 -89.49 PHI 76 76 A 54 LEU N A 54 LEU CA A 54 LEU C A 55 GLU N 1.0 98.33 198.33 PSI 77 77 A 54 LEU C A 55 GLU N A 55 GLU CA A 55 GLU C 1.0 -172.53 -92.53 PHI 78 78 A 55 GLU N A 55 GLU CA A 55 GLU C A 56 LYS N 1.0 84.99 184.99 PSI 79 79 A 55 GLU C A 56 LYS N A 56 LYS CA A 56 LYS C 1.0 -137.56 -57.56 PHI 80 80 A 56 LYS N A 56 LYS CA A 56 LYS C A 57 VAL N 1.0 80.20 180.20 PSI 81 81 A 65 GLY C A 66 LEU N A 66 LEU CA A 66 LEU C 1.0 -152.78 -72.78 PHI 82 82 A 66 LEU N A 66 LEU CA A 66 LEU C A 67 TRP N 1.0 90.89 190.89 PSI 83 83 A 66 LEU C A 67 TRP N A 67 TRP CA A 67 TRP C 1.0 -160.51 -80.51 PHI 84 84 A 67 TRP N A 67 TRP CA A 67 TRP C A 68 ARG N 1.0 92.02 192.02 PSI 85 85 A 67 TRP C A 68 ARG N A 68 ARG CA A 68 ARG C 1.0 -183.28 -103.28 PHI 86 86 A 68 ARG N A 68 ARG CA A 68 ARG C A 69 LEU N 1.0 101.39 201.39 PSI 87 87 A 68 ARG C A 69 LEU N A 69 LEU CA A 69 LEU C 1.0 -124.94 -44.94 PHI 88 88 A 69 LEU N A 69 LEU CA A 69 LEU C A 70 LEU N 1.0 77.14 177.14 PSI 89 89 A 24 PRO C A 25 VAL N A 25 VAL CA A 25 VAL C 1.0 -160.70 -80.70 PHI 90 90 A 25 VAL N A 25 VAL CA A 25 VAL C A 26 LYS N 1.0 85.80 185.80 PSI 91 91 A 25 VAL C A 26 LYS N A 26 LYS CA A 26 LYS C 1.0 -119.55 -39.55 PHI 92 92 A 26 LYS N A 26 LYS CA A 26 LYS C A 27 THR N 1.0 99.40 199.40 PSI stop_ save_