data_nef_c19879_2mn4 save_entry_information _nef_nmr_meta_data.sf_category nef_nmr_meta_data _nef_nmr_meta_data.sf_framecode entry_information _nef_nmr_meta_data.format_name nmr_exchange_format _nef_nmr_meta_data.format_version 1.1 loop_ _nef_related_entries.database_name _nef_related_entries.database_accession_code PDB 2MN4 stop_ save_ save_assembly _nef_molecular_system.sf_category nef_molecular_system _nef_molecular_system.sf_framecode assembly loop_ _nef_sequence.index _nef_sequence.chain_code _nef_sequence.sequence_code _nef_sequence.residue_name _nef_sequence.linking _nef_sequence.residue_variant _nef_sequence.cis_peptide 1 A -5 HIS start . . 2 A -4 HIS middle . . 3 A -3 HIS middle . . 4 A -2 HIS middle . . 5 A -1 HIS middle . . 6 A 0 HIS middle . . 7 A 1 MET middle . . 8 A 2 THR middle . . 9 A 3 PRO middle . false 10 A 4 GLU middle . . 11 A 5 GLN middle . . 12 A 6 ARG middle . . 13 A 7 GLU middle . . 14 A 8 PHE middle . . 15 A 9 LEU middle . . 16 A 10 PRO middle . false 17 A 11 GLU middle . . 18 A 12 ILE middle . . 19 A 13 LEU middle . . 20 A 14 ALA middle . . 21 A 15 GLU middle . . 22 A 16 ILE middle . . 23 A 17 ILE middle . . 24 A 18 ALA middle . . 25 A 19 ASN middle . . 26 A 20 LEU middle . . 27 A 21 ASP middle . . 28 A 22 PRO middle . false 29 A 23 THR middle . . 30 A 24 LYS middle . . 31 A 25 ILE middle . . 32 A 26 LEU middle . . 33 A 27 GLU middle . . 34 A 28 GLU middle . . 35 A 29 LEU middle . . 36 A 30 LEU middle . . 37 A 31 ARG middle . . 38 A 32 ARG middle . . 39 A 33 GLY middle . false 40 A 34 LEU middle . . 41 A 35 LEU middle . . 42 A 36 THR middle . . 43 A 37 PRO middle . false 44 A 38 ALA middle . . 45 A 39 GLU middle . . 46 A 40 LEU middle . . 47 A 41 GLN middle . . 48 A 42 GLU middle . . 49 A 43 VAL middle . . 50 A 44 LEU middle . . 51 A 45 ASP middle . . 52 A 46 LEU middle . . 53 A 47 LYS middle . . 54 A 48 THR middle . . 55 A 49 PRO middle . false 56 A 50 GLU middle . . 57 A 51 GLU middle . . 58 A 52 GLN middle . . 59 A 53 ALA middle . . 60 A 54 LYS middle . . 61 A 55 LYS middle . . 62 A 56 LEU middle . . 63 A 57 ILE middle . . 64 A 58 ASP middle . . 65 A 59 PHE middle . . 66 A 60 ILE middle . . 67 A 61 LEU middle . . 68 A 62 LYS middle . . 69 A 63 LEU middle . . 70 A 64 SER middle . . 71 A 65 PRO middle . false 72 A 66 ALA middle . . 73 A 67 ASP middle . . 74 A 68 VAL middle . . 75 A 69 GLN middle . . 76 A 70 ALA middle . . 77 A 71 ARG middle . . 78 A 72 ILE middle . . 79 A 73 ASN middle . . 80 A 74 VAL middle . . 81 A 75 LEU middle . . 82 A 76 ARG middle . . 83 A 77 ALA middle . . 84 A 78 HIS middle . . 85 A 79 GLY middle . false 86 A 80 TYR middle . . 87 A 81 GLN middle . . 88 A 82 ALA middle . . 89 A 83 LEU middle . . 90 A 84 ALA middle . . 91 A 85 ASP middle . . 92 A 86 LYS middle . . 93 A 87 LEU middle . . 94 A 88 ASN middle . . 95 A 89 LYS middle . . 96 A 90 TYR middle . . 97 A 91 LEU middle . . 98 A 92 THR middle . . 99 A 93 LEU middle . . 100 A 94 GLU middle . . 101 A 95 HIS middle . . 102 A 96 HIS middle . . 103 A 97 HIS middle . . 104 A 98 HIS middle . . 105 A 99 HIS middle . . 106 A 100 HIS end . . stop_ save_ save_assigned_chem_shift_list_1 _nef_chemical_shift_list.sf_category nef_chemical_shift_list _nef_chemical_shift_list.sf_framecode assigned_chem_shift_list_1 loop_ _nef_chemical_shift.chain_code _nef_chemical_shift.sequence_code _nef_chemical_shift.residue_name _nef_chemical_shift.atom_name _nef_chemical_shift.element _nef_chemical_shift.isotope_number _nef_chemical_shift.value _nef_chemical_shift.value_uncertainty A 1 MET H H 1 8.289 0.002 A 1 MET HA H 1 4.601 0.004 A 1 MET HBx H 1 2.009 0.021 A 1 MET HBy H 1 2.009 0.021 A 1 MET HGy H 1 2.646 0.001 A 1 MET HGx H 1 2.476 0.006 A 1 MET CA C 13 55.216 0.090 A 1 MET CB C 13 34.352 0.012 A 1 MET CG C 13 31.226 0.008 A 1 MET N N 15 122.654 0.021 A 2 THR H H 1 8.950 0.003 A 2 THR HA H 1 4.607 0.007 A 2 THR HB H 1 4.734 0.010 A 2 THR HG2% H 1 1.249 0.008 A 2 THR CA C 13 59.469 0.044 A 2 THR CB C 13 67.629 0.053 A 2 THR CG2 C 13 21.672 0.057 A 2 THR N N 15 116.344 0.041 A 3 PRO HA H 1 4.175 0.003 A 3 PRO HBx H 1 2.372 0.006 A 3 PRO HDx H 1 3.893 0.003 A 3 PRO HDy H 1 3.893 0.003 A 3 PRO CA C 13 65.183 0.042 A 3 PRO CB C 13 30.966 0.015 A 3 PRO CG C 13 27.570 0.000 A 4 GLU H H 1 8.943 0.002 A 4 GLU HA H 1 4.016 0.011 A 4 GLU HBy H 1 2.018 0.009 A 4 GLU HBx H 1 1.871 0.000 A 4 GLU HGy H 1 2.449 0.006 A 4 GLU HGx H 1 2.253 0.003 A 4 GLU CA C 13 59.826 0.000 A 4 GLU CB C 13 28.264 0.000 A 4 GLU CG C 13 36.738 0.073 A 4 GLU N N 15 116.437 0.025 A 5 GLN H H 1 7.708 0.002 A 5 GLN HA H 1 3.744 0.008 A 5 GLN HBx H 1 2.006 0.003 A 5 GLN HBy H 1 2.006 0.003 A 5 GLN HGx H 1 2.114 0.000 A 5 GLN HGy H 1 2.114 0.000 A 5 GLN CA C 13 59.099 0.000 A 5 GLN CB C 13 27.841 0.000 A 5 GLN CG C 13 35.181 0.000 A 5 GLN N N 15 120.183 0.050 A 6 ARG H H 1 8.391 0.001 A 6 ARG HA H 1 4.090 0.003 A 6 ARG HBx H 1 1.810 0.003 A 6 ARG HBy H 1 1.810 0.003 A 6 ARG HDx H 1 3.188 0.017 A 6 ARG HDy H 1 3.188 0.017 A 6 ARG CA C 13 58.959 0.046 A 6 ARG CB C 13 29.179 0.082 A 6 ARG CD C 13 42.701 0.032 A 6 ARG N N 15 119.108 0.044 A 7 GLU H H 1 8.000 0.005 A 7 GLU HA H 1 4.095 0.004 A 7 GLU HBx H 1 2.080 0.009 A 7 GLU HBy H 1 2.080 0.009 A 7 GLU HGx H 1 2.370 0.002 A 7 GLU HGy H 1 2.370 0.002 A 7 GLU CA C 13 57.354 0.095 A 7 GLU CB C 13 29.141 0.050 A 7 GLU CG C 13 35.611 0.000 A 7 GLU N N 15 116.726 0.025 A 8 PHE H H 1 7.706 0.002 A 8 PHE HA H 1 4.660 0.005 A 8 PHE HBy H 1 3.326 0.007 A 8 PHE HBx H 1 2.980 0.006 A 8 PHE HDx H 1 7.266 0.005 A 8 PHE HDy H 1 7.266 0.005 A 8 PHE CA C 13 58.055 0.047 A 8 PHE CB C 13 40.736 0.038 A 8 PHE N N 15 119.217 0.013 A 9 LEU H H 1 7.840 0.000 A 9 LEU HA H 1 3.992 0.011 A 9 LEU HBx H 1 1.836 0.006 A 9 LEU HBy H 1 1.836 0.006 A 9 LEU HDx% H 1 0.820 0.006 A 9 LEU HDy% H 1 0.820 0.006 A 9 LEU CA C 13 58.626 0.000 A 9 LEU CB C 13 39.294 0.024 A 9 LEU CDy C 13 24.215 0.012 A 9 LEU CDx C 13 23.789 0.042 A 9 LEU N N 15 119.532 0.024 A 10 PRO HA H 1 4.105 0.004 A 10 PRO HBx H 1 2.333 0.001 A 10 PRO HDy H 1 3.729 0.001 A 10 PRO HDx H 1 3.497 0.007 A 10 PRO CA C 13 65.682 0.084 A 10 PRO CB C 13 30.489 0.059 A 10 PRO CD C 13 49.984 0.029 A 10 PRO CG C 13 27.602 0.000 A 11 GLU H H 1 8.019 0.004 A 11 GLU HA H 1 3.979 0.002 A 11 GLU HBy H 1 2.211 0.000 A 11 GLU HBx H 1 2.017 0.000 A 11 GLU CA C 13 58.338 0.077 A 11 GLU CB C 13 28.364 0.000 A 11 GLU CG C 13 35.682 0.000 A 11 GLU N N 15 116.603 0.034 A 12 ILE H H 1 7.398 0.002 A 12 ILE HA H 1 3.322 0.009 A 12 ILE HB H 1 1.890 0.008 A 12 ILE HD1% H 1 0.819 0.003 A 12 ILE HG1x H 1 1.482 0.007 A 12 ILE HG1y H 1 1.482 0.007 A 12 ILE HG2% H 1 0.656 0.008 A 12 ILE CA C 13 64.525 0.037 A 12 ILE CB C 13 37.118 0.128 A 12 ILE CD1 C 13 13.566 0.011 A 12 ILE CG1 C 13 28.493 0.000 A 12 ILE CG2 C 13 17.315 0.058 A 12 ILE N N 15 120.060 0.031 A 13 LEU H H 1 7.492 0.001 A 13 LEU HA H 1 3.701 0.011 A 13 LEU HBy H 1 1.597 0.006 A 13 LEU HBx H 1 1.464 0.007 A 13 LEU HDx% H 1 0.802 0.003 A 13 LEU HDy% H 1 0.702 0.003 A 13 LEU CA C 13 57.359 0.026 A 13 LEU CB C 13 40.532 0.071 A 13 LEU CDy C 13 24.714 0.000 A 13 LEU CDx C 13 23.288 0.130 A 13 LEU N N 15 117.822 0.037 A 14 ALA H H 1 8.038 0.001 A 14 ALA HA H 1 3.951 0.007 A 14 ALA HB% H 1 1.382 0.007 A 14 ALA CA C 13 54.165 0.066 A 14 ALA CB C 13 17.236 0.009 A 14 ALA N N 15 118.447 0.018 A 15 GLU H H 1 7.085 0.002 A 15 GLU HA H 1 4.092 0.005 A 15 GLU HBx H 1 2.066 0.005 A 15 GLU HBy H 1 2.066 0.005 A 15 GLU CA C 13 57.492 0.012 A 15 GLU CB C 13 28.447 0.022 A 15 GLU CG C 13 34.548 0.000 A 15 GLU N N 15 117.320 0.014 A 16 ILE H H 1 7.331 0.002 A 16 ILE HA H 1 3.608 0.012 A 16 ILE HB H 1 1.837 0.006 A 16 ILE HD1% H 1 0.744 0.009 A 16 ILE HG2% H 1 0.759 0.010 A 16 ILE CA C 13 64.020 0.064 A 16 ILE CB C 13 37.722 0.139 A 16 ILE CD1 C 13 13.605 0.003 A 16 ILE CG1 C 13 28.624 0.000 A 16 ILE CG2 C 13 17.104 0.012 A 16 ILE N N 15 116.223 0.012 A 17 ILE H H 1 8.214 0.004 A 17 ILE HA H 1 3.648 0.010 A 17 ILE HB H 1 1.742 0.011 A 17 ILE HD1% H 1 0.755 0.006 A 17 ILE HG1x H 1 1.540 0.004 A 17 ILE HG1y H 1 1.540 0.004 A 17 ILE HG2% H 1 0.824 0.006 A 17 ILE CA C 13 63.279 0.063 A 17 ILE CB C 13 37.459 0.127 A 17 ILE CD1 C 13 12.700 0.031 A 17 ILE CG2 C 13 16.726 0.018 A 17 ILE N N 15 116.602 0.017 A 18 ALA H H 1 8.056 0.004 A 18 ALA HA H 1 4.180 0.008 A 18 ALA HB% H 1 1.388 0.007 A 18 ALA CA C 13 53.736 0.041 A 18 ALA CB C 13 18.574 0.001 A 18 ALA N N 15 119.329 0.036 A 19 ASN H H 1 7.295 0.001 A 19 ASN HA H 1 5.022 0.008 A 19 ASN HBx H 1 2.851 0.009 A 19 ASN HBy H 1 2.851 0.009 A 19 ASN HD2y H 1 7.749 0.001 A 19 ASN HD2x H 1 6.976 0.003 A 19 ASN CA C 13 53.590 0.054 A 19 ASN CB C 13 41.094 0.044 A 19 ASN N N 15 110.910 0.030 A 19 ASN ND2 N 15 115.870 0.008 A 20 LEU H H 1 8.134 0.002 A 20 LEU HA H 1 4.723 0.008 A 20 LEU HBy H 1 1.747 0.005 A 20 LEU HBx H 1 1.476 0.004 A 20 LEU HDx% H 1 0.880 0.004 A 20 LEU HDy% H 1 0.794 0.008 A 20 LEU CA C 13 53.487 0.078 A 20 LEU CB C 13 43.809 0.021 A 20 LEU CDy C 13 25.783 0.000 A 20 LEU CDx C 13 22.373 0.012 A 20 LEU N N 15 119.881 0.024 A 21 ASP H H 1 8.081 0.003 A 21 ASP HA H 1 5.115 0.008 A 21 ASP HBy H 1 2.917 0.005 A 21 ASP HBx H 1 2.658 0.006 A 21 ASP CA C 13 49.573 0.042 A 21 ASP CB C 13 41.252 0.019 A 21 ASP N N 15 119.289 0.040 A 22 PRO HA H 1 3.936 0.006 A 22 PRO HBx H 1 1.865 0.007 A 22 PRO HBy H 1 1.865 0.007 A 22 PRO HDx H 1 4.005 0.003 A 22 PRO HDy H 1 4.005 0.003 A 22 PRO HGx H 1 2.188 0.003 A 22 PRO HGy H 1 2.188 0.003 A 22 PRO CA C 13 64.351 0.077 A 22 PRO CB C 13 31.527 0.000 A 22 PRO CD C 13 50.321 0.000 A 22 PRO CG C 13 26.647 0.000 A 23 THR H H 1 8.130 0.002 A 23 THR HA H 1 3.770 0.005 A 23 THR HB H 1 4.162 0.010 A 23 THR HG2% H 1 1.180 0.008 A 23 THR CA C 13 65.649 0.095 A 23 THR CB C 13 67.525 0.048 A 23 THR CG2 C 13 21.362 0.091 A 23 THR N N 15 109.956 0.034 A 24 LYS H H 1 7.410 0.002 A 24 LYS HA H 1 4.164 0.003 A 24 LYS HBx H 1 2.014 0.007 A 24 LYS HBy H 1 2.014 0.007 A 24 LYS HDx H 1 1.742 0.004 A 24 LYS HDy H 1 1.742 0.004 A 24 LYS HEx H 1 3.015 0.011 A 24 LYS HEy H 1 3.015 0.011 A 24 LYS HGy H 1 1.568 0.008 A 24 LYS HGx H 1 1.450 0.004 A 24 LYS CA C 13 57.783 0.056 A 24 LYS CB C 13 31.429 0.043 A 24 LYS CD C 13 27.907 0.042 A 24 LYS CE C 13 41.496 0.000 A 24 LYS CG C 13 24.474 0.030 A 24 LYS N N 15 121.423 0.022 A 25 ILE H H 1 7.255 0.002 A 25 ILE HA H 1 3.448 0.006 A 25 ILE HB H 1 1.651 0.008 A 25 ILE HD1% H 1 0.432 0.008 A 25 ILE HG1x H 1 1.390 0.008 A 25 ILE HG1y H 1 1.390 0.008 A 25 ILE HG2% H 1 0.562 0.005 A 25 ILE CA C 13 63.939 0.041 A 25 ILE CB C 13 37.148 0.139 A 25 ILE CD1 C 13 13.155 0.069 A 25 ILE CG1 C 13 27.076 0.053 A 25 ILE CG2 C 13 16.880 0.010 A 25 ILE N N 15 118.727 0.043 A 26 LEU H H 1 7.893 0.002 A 26 LEU HA H 1 3.733 0.004 A 26 LEU HBy H 1 1.859 0.013 A 26 LEU HBx H 1 1.395 0.006 A 26 LEU HDx% H 1 0.828 0.005 A 26 LEU HDy% H 1 0.828 0.005 A 26 LEU CA C 13 57.584 0.069 A 26 LEU CB C 13 40.870 0.040 A 26 LEU CDx C 13 25.692 0.010 A 26 LEU CG C 13 25.601 0.000 A 26 LEU N N 15 117.967 0.041 A 27 GLU H H 1 7.851 0.003 A 27 GLU HA H 1 3.796 0.009 A 27 GLU HBx H 1 2.034 0.000 A 27 GLU HBy H 1 2.034 0.000 A 27 GLU CA C 13 58.982 0.018 A 27 GLU CB C 13 28.774 0.025 A 27 GLU CG C 13 35.911 0.000 A 27 GLU N N 15 117.202 0.043 A 28 GLU H H 1 7.597 0.003 A 28 GLU HA H 1 4.127 0.006 A 28 GLU HBx H 1 1.999 0.008 A 28 GLU HBy H 1 1.999 0.008 A 28 GLU CA C 13 57.217 0.000 A 28 GLU CB C 13 28.199 0.000 A 28 GLU N N 15 119.243 0.028 A 29 LEU HA H 1 3.875 0.009 A 29 LEU HBy H 1 1.942 0.004 A 29 LEU HBx H 1 1.116 0.007 A 29 LEU HDx% H 1 0.731 0.002 A 29 LEU HDy% H 1 0.731 0.002 A 29 LEU CA C 13 57.442 0.015 A 29 LEU CB C 13 40.811 0.082 A 29 LEU CDx C 13 21.779 0.000 A 29 LEU CDy C 13 21.779 0.000 A 29 LEU CG C 13 25.296 0.000 A 30 LEU H H 1 8.508 0.003 A 30 LEU HA H 1 4.115 0.007 A 30 LEU HBy H 1 1.944 0.005 A 30 LEU HBx H 1 1.452 0.000 A 30 LEU HDx% H 1 0.862 0.003 A 30 LEU HDy% H 1 0.760 0.009 A 30 LEU CA C 13 57.859 0.013 A 30 LEU CB C 13 41.266 0.081 A 30 LEU CDx C 13 23.616 0.006 A 30 LEU CDy C 13 23.616 0.006 A 30 LEU CG C 13 25.449 0.000 A 30 LEU N N 15 121.505 0.029 A 31 ARG H H 1 8.274 0.006 A 31 ARG HA H 1 4.049 0.016 A 31 ARG HBx H 1 1.946 0.004 A 31 ARG HBy H 1 1.946 0.004 A 31 ARG HDx H 1 3.186 0.006 A 31 ARG HDy H 1 3.186 0.006 A 31 ARG HGx H 1 1.681 0.011 A 31 ARG HGy H 1 1.681 0.011 A 31 ARG CA C 13 58.469 0.075 A 31 ARG CB C 13 29.373 0.002 A 31 ARG CD C 13 42.730 0.000 A 31 ARG CG C 13 26.935 0.000 A 31 ARG N N 15 120.484 0.041 A 32 ARG H H 1 7.291 0.003 A 32 ARG HA H 1 4.453 0.006 A 32 ARG HBy H 1 2.190 0.006 A 32 ARG HBx H 1 1.630 0.006 A 32 ARG HDy H 1 3.138 0.000 A 32 ARG HDx H 1 3.033 0.000 A 32 ARG HGy H 1 1.807 0.000 A 32 ARG HGx H 1 1.677 0.001 A 32 ARG CA C 13 53.662 0.009 A 32 ARG CB C 13 29.501 0.094 A 32 ARG CD C 13 41.804 0.039 A 32 ARG CG C 13 26.349 0.000 A 32 ARG N N 15 114.502 0.020 A 33 GLY H H 1 8.134 0.002 A 33 GLY HAx H 1 4.053 0.016 A 33 GLY HAy H 1 4.053 0.016 A 33 GLY CA C 13 45.591 0.017 A 33 GLY N N 15 108.310 0.021 A 34 LEU H H 1 8.121 0.001 A 34 LEU HA H 1 4.405 0.005 A 34 LEU HBx H 1 1.515 0.006 A 34 LEU HBy H 1 1.515 0.006 A 34 LEU HDx% H 1 0.811 0.000 A 34 LEU HDy% H 1 0.743 0.008 A 34 LEU CA C 13 53.328 0.047 A 34 LEU CB C 13 41.530 0.093 A 34 LEU CDx C 13 21.042 0.049 A 34 LEU CDy C 13 21.042 0.049 A 34 LEU CG C 13 26.204 0.000 A 34 LEU N N 15 117.715 0.015 A 35 LEU H H 1 7.219 0.002 A 35 LEU HA H 1 4.565 0.009 A 35 LEU HBy H 1 1.268 0.006 A 35 LEU HBx H 1 1.119 0.006 A 35 LEU HDx% H 1 0.738 0.011 A 35 LEU HDy% H 1 0.738 0.011 A 35 LEU HG H 1 1.659 0.011 A 35 LEU CA C 13 52.823 0.037 A 35 LEU CB C 13 46.726 0.030 A 35 LEU CDx C 13 25.326 0.014 A 35 LEU CDy C 13 26.249 0.045 A 35 LEU N N 15 119.920 0.018 A 36 THR H H 1 8.948 0.002 A 36 THR HA H 1 4.743 0.011 A 36 THR HB H 1 4.606 0.009 A 36 THR HG2% H 1 1.155 0.008 A 36 THR CA C 13 59.034 0.028 A 36 THR CB C 13 68.143 0.070 A 36 THR CG2 C 13 20.891 0.004 A 36 THR N N 15 115.405 0.031 A 37 PRO HA H 1 4.087 0.003 A 37 PRO HBy H 1 2.385 0.006 A 37 PRO HBx H 1 1.943 0.008 A 37 PRO HDy H 1 3.896 0.001 A 37 PRO HDx H 1 3.808 0.002 A 37 PRO HGx H 1 2.197 0.001 A 37 PRO HGy H 1 2.197 0.001 A 37 PRO CA C 13 65.107 0.029 A 37 PRO CB C 13 30.837 0.000 A 37 PRO CD C 13 49.681 0.016 A 37 PRO CG C 13 27.302 0.057 A 38 ALA H H 1 7.975 0.001 A 38 ALA HA H 1 4.100 0.004 A 38 ALA HB% H 1 1.337 0.006 A 38 ALA CA C 13 54.287 0.061 A 38 ALA CB C 13 17.689 0.069 A 38 ALA N N 15 119.090 0.032 A 39 GLU H H 1 7.592 0.002 A 39 GLU HA H 1 3.785 0.006 A 39 GLU HBy H 1 2.093 0.004 A 39 GLU HBx H 1 1.213 0.000 A 39 GLU CA C 13 58.284 0.089 A 39 GLU CB C 13 29.256 0.012 A 39 GLU N N 15 120.475 0.042 A 40 LEU H H 1 7.878 0.009 A 40 LEU HA H 1 3.827 0.010 A 40 LEU HBy H 1 1.974 0.012 A 40 LEU HBx H 1 1.368 0.008 A 40 LEU HDx% H 1 0.841 0.009 A 40 LEU HDy% H 1 0.841 0.009 A 40 LEU HG H 1 1.529 0.009 A 40 LEU CA C 13 58.019 0.020 A 40 LEU CB C 13 40.944 0.065 A 40 LEU CDx C 13 25.157 0.095 A 40 LEU CDy C 13 25.157 0.095 A 40 LEU N N 15 118.126 0.032 A 41 GLN H H 1 7.957 0.005 A 41 GLN HA H 1 3.711 0.010 A 41 GLN HBx H 1 2.084 0.009 A 41 GLN HBy H 1 2.084 0.009 A 41 GLN HE2y H 1 7.790 0.001 A 41 GLN HE2x H 1 6.812 0.001 A 41 GLN HGy H 1 2.398 0.005 A 41 GLN HGx H 1 2.341 0.005 A 41 GLN CA C 13 57.560 0.064 A 41 GLN CB C 13 27.534 0.029 A 41 GLN CG C 13 32.790 0.000 A 41 GLN N N 15 116.956 0.024 A 41 GLN NE2 N 15 115.384 0.017 A 42 GLU H H 1 7.676 0.002 A 42 GLU HA H 1 4.035 0.009 A 42 GLU HBy H 1 2.343 0.011 A 42 GLU HBx H 1 2.203 0.008 A 42 GLU HGx H 1 2.578 0.012 A 42 GLU HGy H 1 2.578 0.012 A 42 GLU CA C 13 58.865 0.036 A 42 GLU CB C 13 29.099 0.044 A 42 GLU CG C 13 36.210 0.048 A 42 GLU N N 15 117.014 0.023 A 43 VAL H H 1 7.566 0.001 A 43 VAL HA H 1 3.668 0.009 A 43 VAL HB H 1 2.213 0.007 A 43 VAL HGx% H 1 1.009 0.011 A 43 VAL HGy% H 1 0.884 0.010 A 43 VAL CA C 13 65.594 0.027 A 43 VAL CB C 13 30.619 0.123 A 43 VAL CGx C 13 22.380 0.062 A 43 VAL CGy C 13 22.380 0.062 A 43 VAL N N 15 116.546 0.029 A 44 LEU H H 1 8.199 0.006 A 44 LEU HA H 1 3.945 0.007 A 44 LEU HBy H 1 1.774 0.016 A 44 LEU HBx H 1 1.439 0.010 A 44 LEU HDx% H 1 0.797 0.007 A 44 LEU HDy% H 1 0.742 0.004 A 44 LEU CA C 13 56.364 0.039 A 44 LEU CB C 13 40.548 0.100 A 44 LEU CDx C 13 21.553 0.001 A 44 LEU CDy C 13 21.553 0.001 A 44 LEU CG C 13 24.890 0.000 A 44 LEU N N 15 118.168 0.045 A 45 ASP H H 1 7.776 0.001 A 45 ASP HA H 1 4.478 0.009 A 45 ASP HBx H 1 2.654 0.005 A 45 ASP HBy H 1 2.654 0.005 A 45 ASP CA C 13 54.734 0.055 A 45 ASP CB C 13 40.556 0.036 A 45 ASP N N 15 116.834 0.045 A 46 LEU H H 1 7.548 0.003 A 46 LEU HA H 1 4.442 0.005 A 46 LEU HBy H 1 2.069 0.011 A 46 LEU HBx H 1 1.332 0.008 A 46 LEU HDx% H 1 0.893 0.007 A 46 LEU HDy% H 1 0.847 0.008 A 46 LEU HG H 1 2.039 0.006 A 46 LEU CA C 13 54.059 0.063 A 46 LEU CB C 13 41.147 0.073 A 46 LEU CDx C 13 21.927 0.069 A 46 LEU CDy C 13 26.674 0.051 A 46 LEU CG C 13 25.654 0.037 A 46 LEU N N 15 121.360 0.034 A 47 LYS H H 1 8.586 0.001 A 47 LYS HA H 1 4.177 0.006 A 47 LYS HBx H 1 1.979 0.006 A 47 LYS HBy H 1 1.979 0.006 A 47 LYS HDx H 1 1.614 0.000 A 47 LYS HDy H 1 1.614 0.000 A 47 LYS HEx H 1 3.007 0.000 A 47 LYS HEy H 1 3.007 0.000 A 47 LYS HGx H 1 1.491 0.000 A 47 LYS HGy H 1 1.491 0.000 A 47 LYS CA C 13 57.459 0.025 A 47 LYS CB C 13 32.785 0.028 A 47 LYS CD C 13 27.665 0.000 A 47 LYS CE C 13 41.574 0.000 A 47 LYS CG C 13 24.330 0.000 A 47 LYS N N 15 116.693 0.040 A 48 THR H H 1 7.459 0.003 A 48 THR HA H 1 5.013 0.006 A 48 THR HB H 1 4.597 0.007 A 48 THR HG2% H 1 1.246 0.011 A 48 THR CA C 13 57.421 0.053 A 48 THR CB C 13 69.457 0.043 A 48 THR CG2 C 13 21.118 0.152 A 48 THR N N 15 107.567 0.016 A 49 PRO HA H 1 4.336 0.006 A 49 PRO HBy H 1 2.383 0.003 A 49 PRO HBx H 1 1.914 0.006 A 49 PRO HDx H 1 3.920 0.006 A 49 PRO HDy H 1 3.920 0.006 A 49 PRO HGx H 1 2.151 0.000 A 49 PRO HGy H 1 2.151 0.000 A 49 PRO CA C 13 64.167 0.051 A 49 PRO CB C 13 31.248 0.101 A 49 PRO CD C 13 50.345 0.000 A 49 PRO CG C 13 26.967 0.000 A 50 GLU H H 1 9.036 0.002 A 50 GLU HA H 1 3.818 0.007 A 50 GLU HBy H 1 2.091 0.000 A 50 GLU HBx H 1 1.883 0.011 A 50 GLU HGy H 1 2.318 0.002 A 50 GLU HGx H 1 2.154 0.016 A 50 GLU CA C 13 60.106 0.034 A 50 GLU CB C 13 28.104 0.041 A 50 GLU CG C 13 36.181 0.055 A 50 GLU N N 15 117.217 0.032 A 51 GLU H H 1 7.561 0.001 A 51 GLU HA H 1 3.911 0.001 A 51 GLU HBx H 1 2.140 0.012 A 51 GLU HBy H 1 2.140 0.012 A 51 GLU HGx H 1 2.253 0.003 A 51 GLU HGy H 1 2.253 0.003 A 51 GLU CA C 13 58.607 0.000 A 51 GLU CB C 13 30.604 0.024 A 51 GLU CG C 13 36.748 0.000 A 51 GLU N N 15 117.482 0.036 A 52 GLN H H 1 8.125 0.003 A 52 GLN HA H 1 3.789 0.005 A 52 GLN HBy H 1 2.250 0.013 A 52 GLN HBx H 1 1.482 0.006 A 52 GLN HE2y H 1 6.890 0.002 A 52 GLN HE2x H 1 6.406 0.004 A 52 GLN HGy H 1 2.603 0.007 A 52 GLN HGx H 1 2.523 0.006 A 52 GLN CA C 13 58.970 0.033 A 52 GLN CB C 13 27.522 0.005 A 52 GLN CG C 13 32.929 0.000 A 52 GLN N N 15 118.967 0.032 A 52 GLN NE2 N 15 107.520 0.014 A 53 ALA H H 1 8.698 0.002 A 53 ALA HA H 1 3.747 0.012 A 53 ALA HB% H 1 1.375 0.006 A 53 ALA CA C 13 54.759 0.011 A 53 ALA CB C 13 18.354 0.071 A 53 ALA N N 15 119.946 0.011 A 54 LYS H H 1 7.647 0.004 A 54 LYS HA H 1 3.692 0.018 A 54 LYS HBx H 1 1.785 0.007 A 54 LYS HBy H 1 1.785 0.007 A 54 LYS HDy H 1 1.606 0.000 A 54 LYS HDx H 1 1.567 0.000 A 54 LYS HEx H 1 2.827 0.011 A 54 LYS HEy H 1 2.827 0.011 A 54 LYS HGy H 1 1.564 0.000 A 54 LYS HGx H 1 1.321 0.006 A 54 LYS CA C 13 59.136 0.003 A 54 LYS CB C 13 31.793 0.036 A 54 LYS CD C 13 28.699 0.116 A 54 LYS CE C 13 41.430 0.000 A 54 LYS CG C 13 25.626 0.024 A 54 LYS N N 15 115.558 0.026 A 55 LYS H H 1 7.593 0.002 A 55 LYS HA H 1 3.852 0.003 A 55 LYS HBy H 1 1.661 0.002 A 55 LYS HBx H 1 1.597 0.005 A 55 LYS HDx H 1 1.464 0.002 A 55 LYS HDy H 1 1.464 0.002 A 55 LYS HEy H 1 2.747 0.004 A 55 LYS HEx H 1 2.613 0.004 A 55 LYS HGx H 1 1.015 0.005 A 55 LYS HGy H 1 1.015 0.005 A 55 LYS CA C 13 56.369 0.113 A 55 LYS CB C 13 30.101 0.033 A 55 LYS CD C 13 26.503 0.059 A 55 LYS CE C 13 40.841 0.066 A 55 LYS N N 15 119.514 0.036 A 56 LEU H H 1 8.035 0.003 A 56 LEU HA H 1 3.835 0.004 A 56 LEU HBy H 1 1.878 0.008 A 56 LEU HBx H 1 1.497 0.012 A 56 LEU HDx% H 1 0.822 0.003 A 56 LEU HDy% H 1 0.746 0.000 A 56 LEU CA C 13 57.881 0.104 A 56 LEU CB C 13 41.062 0.125 A 56 LEU CDx C 13 23.984 0.000 A 56 LEU CDy C 13 23.984 0.000 A 56 LEU CG C 13 26.431 0.000 A 56 LEU N N 15 118.162 0.058 A 57 ILE H H 1 7.769 0.004 A 57 ILE HA H 1 3.532 0.007 A 57 ILE HB H 1 1.954 0.006 A 57 ILE HD1% H 1 0.552 0.008 A 57 ILE HG1y H 1 1.289 0.011 A 57 ILE HG1x H 1 1.230 0.002 A 57 ILE HG2% H 1 0.720 0.007 A 57 ILE CA C 13 62.607 0.061 A 57 ILE CB C 13 35.192 0.110 A 57 ILE CD1 C 13 10.780 0.015 A 57 ILE CG1 C 13 27.827 0.006 A 57 ILE CG2 C 13 17.615 0.027 A 57 ILE N N 15 116.360 0.080 A 58 ASP H H 1 7.859 0.001 A 58 ASP HA H 1 4.236 0.007 A 58 ASP HBy H 1 2.742 0.005 A 58 ASP HBx H 1 2.513 0.010 A 58 ASP CA C 13 57.080 0.041 A 58 ASP CB C 13 39.997 0.035 A 58 ASP N N 15 121.683 0.022 A 59 PHE H H 1 7.968 0.004 A 59 PHE HA H 1 4.450 0.014 A 59 PHE HBx H 1 3.248 0.023 A 59 PHE HBy H 1 3.248 0.023 A 59 PHE HDx H 1 6.998 0.006 A 59 PHE HDy H 1 6.998 0.006 A 59 PHE HEx H 1 7.301 0.006 A 59 PHE HEy H 1 7.301 0.006 A 59 PHE CA C 13 57.353 0.020 A 59 PHE CB C 13 36.750 0.000 A 59 PHE N N 15 115.587 0.029 A 60 ILE H H 1 7.787 0.003 A 60 ILE HA H 1 3.784 0.009 A 60 ILE HB H 1 1.814 0.002 A 60 ILE HD1% H 1 0.808 0.005 A 60 ILE HG2% H 1 0.807 0.001 A 60 ILE CA C 13 63.825 0.019 A 60 ILE CB C 13 37.937 0.000 A 60 ILE CD1 C 13 11.532 0.000 A 60 ILE CG1 C 13 27.837 0.000 A 60 ILE CG2 C 13 17.065 0.024 A 60 ILE N N 15 117.997 0.034 A 61 LEU HA H 1 4.133 0.008 A 61 LEU CA C 13 55.461 0.065 A 61 LEU CB C 13 39.989 0.117 A 61 LEU CDx C 13 21.031 0.031 A 61 LEU CDy C 13 24.531 0.012 A 61 LEU CG C 13 24.342 0.000 stop_ save_ save_CNS/XPLOR_distance_constraints_2 _nef_distance_restraint_list.sf_category nef_distance_restraint_list _nef_distance_restraint_list.sf_framecode CNS/XPLOR_distance_constraints_2 _nef_distance_restraint_list.restraint_origin noe _nef_distance_restraint_list.potential_type square-well-parabolic loop_ _nef_distance_restraint.index _nef_distance_restraint.restraint_id _nef_distance_restraint.chain_code_1 _nef_distance_restraint.sequence_code_1 _nef_distance_restraint.residue_name_1 _nef_distance_restraint.atom_name_1 _nef_distance_restraint.chain_code_2 _nef_distance_restraint.sequence_code_2 _nef_distance_restraint.residue_name_2 _nef_distance_restraint.atom_name_2 _nef_distance_restraint.weight _nef_distance_restraint.lower_limit _nef_distance_restraint.upper_limit 1 1 A 2 THR H A 2 THR HG2% 1.0 1.8 4.0 2 2 A 2 THR H A 2 THR HA 1.0 1.8 3.1 3 3 A 4 GLU H A 3 PRO HBy 1.0 1.8 4.3 4 4 A 4 GLU H A 4 GLU HBx 1.0 1.8 3.2 5 5 A 4 GLU H A 5 GLN H 1.0 1.8 3.8 6 6 A 4 GLU H A 6 ARG H 1.0 1.8 4.6 7 7 A 4 GLU H A 5 GLN H 1.0 1.8 3.7 8 8 A 5 GLN H A 5 GLN HA 1.0 1.8 4.0 9 9 A 4 GLU H A 6 ARG H 1.0 1.8 4.5 10 10 A 6 ARG H A 5 GLN HA 1.0 1.8 4.4 11 11 A 5 GLN H A 6 ARG H 1.0 1.8 3.5 12 12 A 6 ARG H A 6 ARG HA 1.0 1.8 3.3 13 13 A 6 ARG H A 6 ARG HDx 1.0 1.8 5.2 14 13 A 6 ARG H A 6 ARG HDy 1.0 1.8 5.2 15 14 A 6 ARG H A 7 GLU H 1.0 1.8 3.6 16 15 A 5 GLN HA A 7 GLU H 1.0 1.8 4.2 17 16 A 6 ARG HA A 7 GLU H 1.0 2.3 3.6 18 17 A 6 ARG H A 7 GLU H 1.0 1.8 3.7 19 18 A 7 GLU H A 7 GLU HBx 1.0 1.8 3.4 20 18 A 7 GLU H A 7 GLU HBy 1.0 1.8 3.4 21 19 A 7 GLU H A 7 GLU HGx 1.0 1.8 4.4 22 19 A 7 GLU H A 7 GLU HGy 1.0 1.8 4.4 23 20 A 7 GLU H A 8 PHE H 1.0 1.8 3.4 24 21 A 5 GLN HA A 8 PHE H 1.0 1.8 4.0 25 22 A 8 PHE H A 7 GLU HA 1.0 1.8 3.7 26 23 A 8 PHE H A 7 GLU HBx 1.0 1.8 4.1 27 23 A 7 GLU HBy A 8 PHE H 1.0 1.8 4.1 28 24 A 8 PHE H A 7 GLU HGx 1.0 1.8 5.0 29 24 A 7 GLU HGy A 8 PHE H 1.0 1.8 5.0 30 25 A 7 GLU H A 8 PHE H 1.0 1.8 3.4 31 26 A 8 PHE H A 8 PHE HA 1.0 1.8 3.8 32 27 A 8 PHE H A 8 PHE HBx 1.0 1.8 3.9 33 28 A 8 PHE H A 8 PHE HBy 1.0 1.8 2.9 34 29 A 8 PHE H A 8 PHE HD% 1.0 1.8 4.7 35 30 A 8 PHE H A 9 LEU HBx 1.0 2.3 4.9 36 30 A 8 PHE H A 9 LEU HBy 1.0 2.3 4.9 37 31 A 5 GLN HA A 9 LEU H 1.0 2.3 4.4 38 32 A 7 GLU H A 9 LEU H 1.0 1.8 4.2 39 33 A 8 PHE HA A 9 LEU H 1.0 1.8 4.4 40 34 A 8 PHE HBx A 9 LEU H 1.0 1.8 4.2 41 35 A 8 PHE HBy A 9 LEU H 1.0 1.8 4.2 42 36 A 9 LEU H A 9 LEU HA 1.0 1.8 3.4 43 37 A 9 LEU H A 9 LEU HBx 1.0 1.8 3.4 44 37 A 9 LEU HBy A 9 LEU H 1.0 1.8 3.4 45 38 A 9 LEU H A 9 LEU HDx% 1.0 2.3 4.8 46 38 A 9 LEU H A 9 LEU HDy% 1.0 2.3 4.8 47 39 A 9 LEU H A 10 PRO HDy 1.0 1.8 4.3 48 39 A 9 LEU H A 10 PRO HDx 1.0 1.8 4.3 49 40 A 8 PHE HA A 11 GLU H 1.0 1.8 4.8 50 41 A 11 GLU H A 10 PRO HDy 1.0 1.8 4.7 51 41 A 10 PRO HDx A 11 GLU H 1.0 1.8 4.7 52 42 A 11 GLU H A 11 GLU HBy 1.0 1.8 3.8 53 42 A 11 GLU H A 11 GLU HBx 1.0 1.8 3.8 54 43 A 11 GLU H A 12 ILE HA 1.0 2.3 5.3 55 44 A 11 GLU H A 12 ILE H 1.0 1.8 3.3 56 45 A 11 GLU H A 13 LEU HDx% 1.0 2.3 6.0 57 46 A 12 ILE H A 12 ILE HD1% 1.0 1.8 4.6 58 47 A 11 GLU H A 12 ILE H 1.0 1.8 3.3 59 48 A 12 ILE HA A 12 ILE H 1.0 1.8 4.0 60 49 A 12 ILE H A 12 ILE HG2% 1.0 2.3 4.5 61 50 A 13 LEU H A 10 PRO HA 1.0 1.8 4.3 62 51 A 13 LEU H A 11 GLU HA 1.0 1.8 5.0 63 52 A 12 ILE HA A 13 LEU H 1.0 1.8 5.0 64 53 A 13 LEU H A 12 ILE HB 1.0 2.3 4.2 65 54 A 13 LEU H A 13 LEU HA 1.0 1.8 4.0 66 55 A 13 LEU H A 13 LEU HDy% 1.0 2.3 4.6 67 55 A 13 LEU H A 13 LEU HDx% 1.0 2.3 4.6 68 56 A 13 LEU H A 13 LEU HBx 1.0 1.8 3.7 69 56 A 13 LEU H A 13 LEU HBy 1.0 1.8 3.7 70 57 A 13 LEU H A 14 ALA H 1.0 1.8 3.8 71 58 A 13 LEU H A 14 ALA H 1.0 1.8 3.4 72 59 A 14 ALA H A 14 ALA HA 1.0 1.8 3.1 73 60 A 14 ALA H A 15 GLU H 1.0 1.8 3.5 74 61 A 12 ILE HA A 15 GLU H 1.0 1.8 4.6 75 62 A 13 LEU HA A 15 GLU H 1.0 1.8 4.8 76 63 A 15 GLU H A 14 ALA HB% 1.0 1.8 3.9 77 64 A 14 ALA H A 15 GLU H 1.0 1.8 3.6 78 65 A 15 GLU H A 15 GLU HA 1.0 1.8 3.5 79 66 A 15 GLU H A 15 GLU HBx 1.0 1.8 3.5 80 66 A 15 GLU H A 15 GLU HBy 1.0 1.8 3.5 81 67 A 15 GLU H A 16 ILE HG2% 1.0 2.3 5.0 82 68 A 15 GLU H A 16 ILE H 1.0 1.8 3.5 83 69 A 15 GLU H A 17 ILE H 1.0 1.8 6.0 84 70 A 15 GLU HA A 16 ILE H 1.0 1.8 4.5 85 71 A 16 ILE H A 15 GLU HBx 1.0 1.8 4.1 86 71 A 15 GLU HBy A 16 ILE H 1.0 1.8 4.1 87 72 A 15 GLU H A 16 ILE H 1.0 1.8 3.7 88 73 A 16 ILE H A 16 ILE HA 1.0 1.8 3.9 89 74 A 16 ILE H A 16 ILE HB 1.0 1.8 3.6 90 75 A 16 ILE HG2% A 16 ILE H 1.0 1.8 3.7 91 76 A 16 ILE H A 17 ILE H 1.0 1.8 3.8 92 77 A 14 ALA HA A 17 ILE H 1.0 1.8 4.2 93 78 A 17 ILE H A 15 GLU HBx 1.0 1.8 5.7 94 78 A 15 GLU HBy A 17 ILE H 1.0 1.8 5.7 95 79 A 15 GLU H A 17 ILE H 1.0 1.8 4.9 96 80 A 16 ILE HG2% A 17 ILE H 1.0 1.8 3.6 97 81 A 16 ILE H A 17 ILE H 1.0 1.8 3.6 98 82 A 17 ILE H A 17 ILE HA 1.0 1.8 3.4 99 83 A 17 ILE H A 17 ILE HB 1.0 1.8 3.1 100 84 A 17 ILE H A 17 ILE HG1x 1.0 1.8 3.9 101 84 A 17 ILE H A 17 ILE HG1y 1.0 1.8 3.9 102 85 A 17 ILE HA A 18 ALA H 1.0 1.8 3.9 103 86 A 18 ALA H A 18 ALA HB% 1.0 1.8 3.5 104 87 A 18 ALA H A 18 ALA HA 1.0 1.8 3.4 105 88 A 18 ALA H A 19 ASN H 1.0 1.8 3.5 106 89 A 17 ILE HA A 19 ASN H 1.0 1.8 4.5 107 90 A 17 ILE HB A 19 ASN H 1.0 2.3 5.2 108 91 A 19 ASN H A 17 ILE HG2% 1.0 2.3 6.0 109 92 A 18 ALA HA A 19 ASN H 1.0 1.8 4.0 110 93 A 18 ALA HB% A 19 ASN H 1.0 1.8 4.2 111 94 A 18 ALA H A 19 ASN H 1.0 1.8 3.6 112 95 A 19 ASN H A 19 ASN HA 1.0 1.8 3.7 113 96 A 19 ASN H A 19 ASN HBx 1.0 1.8 3.8 114 96 A 19 ASN H A 19 ASN HBy 1.0 1.8 3.8 115 97 A 19 ASN H A 19 ASN HD2y 1.0 2.3 4.8 116 98 A 19 ASN H A 19 ASN HD2x 1.0 2.3 5.2 117 99 A 19 ASN H A 20 LEU HA 1.0 1.8 6.0 118 100 A 19 ASN H A 20 LEU H 1.0 1.8 3.6 119 101 A 19 ASN HA A 19 ASN HD2y 1.0 1.8 4.8 120 102 A 19 ASN HD2y A 19 ASN HBx 1.0 1.8 3.8 121 102 A 19 ASN HBy A 19 ASN HD2y 1.0 1.8 3.8 122 103 A 19 ASN H A 19 ASN HD2y 1.0 2.3 4.7 123 104 A 18 ALA HB% A 19 ASN HD2x 1.0 2.3 5.0 124 105 A 19 ASN HD2x A 19 ASN HBx 1.0 1.8 3.9 125 105 A 19 ASN HBy A 19 ASN HD2x 1.0 1.8 3.9 126 106 A 19 ASN H A 19 ASN HD2x 1.0 2.3 4.9 127 107 A 16 ILE HA A 20 LEU H 1.0 2.3 4.7 128 108 A 18 ALA HA A 20 LEU H 1.0 1.8 6.0 129 109 A 19 ASN HA A 20 LEU H 1.0 1.8 4.0 130 110 A 20 LEU H A 19 ASN HBx 1.0 1.8 4.4 131 110 A 19 ASN HBy A 20 LEU H 1.0 1.8 4.4 132 111 A 19 ASN H A 20 LEU H 1.0 2.3 3.8 133 112 A 20 LEU HA A 20 LEU H 1.0 1.8 3.9 134 113 A 20 LEU H A 20 LEU HBx 1.0 1.8 3.4 135 114 A 20 LEU H A 20 LEU HBy 1.0 1.8 3.9 136 115 A 20 LEU H A 20 LEU HDy% 1.0 2.3 5.2 137 116 A 20 LEU HA A 21 ASP H 1.0 1.8 3.3 138 117 A 20 LEU HBx A 21 ASP H 1.0 2.3 3.9 139 118 A 21 ASP H A 21 ASP HA 1.0 1.8 3.9 140 119 A 21 ASP H A 21 ASP HBx 1.0 1.8 3.9 141 120 A 21 ASP H A 21 ASP HBy 1.0 1.8 3.4 142 121 A 21 ASP H A 25 ILE HD1% 1.0 1.8 5.2 143 122 A 21 ASP HA A 23 THR H 1.0 1.8 4.7 144 123 A 23 THR H A 22 PRO HBx 1.0 1.8 4.1 145 123 A 23 THR H A 22 PRO HBy 1.0 1.8 4.1 146 124 A 23 THR H A 22 PRO HGx 1.0 2.3 5.2 147 124 A 23 THR H A 22 PRO HGy 1.0 2.3 5.2 148 125 A 23 THR H A 22 PRO HDx 1.0 2.3 4.6 149 125 A 23 THR H A 22 PRO HDy 1.0 2.3 4.6 150 126 A 23 THR H A 23 THR HA 1.0 1.8 3.6 151 127 A 23 THR H A 23 THR HB 1.0 1.8 3.6 152 128 A 23 THR H A 23 THR HG2% 1.0 1.8 4.2 153 129 A 23 THR H A 24 LYS H 1.0 1.8 3.5 154 130 A 23 THR H A 25 ILE H 1.0 1.8 4.7 155 131 A 21 ASP HBx A 24 LYS H 1.0 1.8 4.5 156 132 A 21 ASP HBy A 24 LYS H 1.0 1.8 4.8 157 133 A 21 ASP HA A 24 LYS H 1.0 1.8 6.0 158 134 A 23 THR HA A 24 LYS H 1.0 1.8 4.2 159 135 A 23 THR HB A 24 LYS H 1.0 1.8 3.5 160 136 A 23 THR HG2% A 24 LYS H 1.0 1.8 4.9 161 137 A 23 THR H A 24 LYS H 1.0 1.8 3.4 162 138 A 24 LYS H A 24 LYS HBx 1.0 1.8 3.6 163 138 A 24 LYS H A 24 LYS HBy 1.0 1.8 3.6 164 139 A 24 LYS H A 24 LYS HGx 1.0 2.3 4.4 165 140 A 24 LYS H A 24 LYS HGy 1.0 2.3 4.7 166 141 A 25 ILE HD1% A 24 LYS H 1.0 2.3 6.3 167 142 A 24 LYS H A 25 ILE HA 1.0 1.8 6.0 168 143 A 24 LYS H A 26 LEU H 1.0 1.8 4.5 169 144 A 20 LEU HDy% A 25 ILE H 1.0 2.3 5.7 170 145 A 25 ILE H A 22 PRO HA 1.0 1.8 4.5 171 146 A 23 THR HA A 25 ILE H 1.0 1.8 4.9 172 147 A 23 THR HB A 25 ILE H 1.0 2.3 5.3 173 148 A 23 THR H A 25 ILE H 1.0 1.8 6.0 174 149 A 25 ILE H A 24 LYS HBx 1.0 1.8 4.2 175 149 A 25 ILE H A 24 LYS HBy 1.0 1.8 4.2 176 150 A 24 LYS H A 25 ILE H 1.0 1.8 3.6 177 151 A 25 ILE H A 25 ILE HA 1.0 1.8 4.0 178 152 A 25 ILE H A 25 ILE HB 1.0 1.8 3.9 179 153 A 25 ILE HD1% A 25 ILE H 1.0 1.8 4.5 180 154 A 25 ILE H A 25 ILE HG1x 1.0 1.8 4.3 181 154 A 25 ILE H A 25 ILE HG1y 1.0 1.8 4.3 182 155 A 25 ILE H A 26 LEU H 1.0 1.8 3.7 183 156 A 26 LEU H A 25 ILE HB 1.0 1.8 3.9 184 157 A 25 ILE H A 26 LEU H 1.0 1.8 3.7 185 158 A 26 LEU H A 26 LEU HDy% 1.0 2.3 4.3 186 158 A 26 LEU H A 26 LEU HDx% 1.0 2.3 4.3 187 159 A 27 GLU H A 24 LYS HA 1.0 1.8 4.4 188 160 A 25 ILE HA A 27 GLU H 1.0 1.8 6.0 189 161 A 27 GLU H A 25 ILE HG1x 1.0 2.3 5.3 190 161 A 25 ILE HG1y A 27 GLU H 1.0 2.3 5.3 191 162 A 25 ILE H A 27 GLU H 1.0 1.8 4.9 192 163 A 27 GLU H A 26 LEU HDy% 1.0 2.3 5.0 193 163 A 27 GLU H A 26 LEU HDx% 1.0 2.3 5.0 194 164 A 27 GLU H A 27 GLU HA 1.0 1.8 3.3 195 165 A 27 GLU H A 28 GLU H 1.0 1.8 3.5 196 166 A 25 ILE HA A 28 GLU H 1.0 1.8 4.1 197 167 A 28 GLU H A 28 GLU HBx 1.0 1.8 3.3 198 167 A 28 GLU H A 28 GLU HBy 1.0 1.8 3.3 199 168 A 27 GLU HA A 30 LEU H 1.0 1.8 4.0 200 169 A 28 GLU H A 30 LEU H 1.0 1.8 4.8 201 170 A 30 LEU H A 30 LEU HA 1.0 1.8 3.4 202 171 A 30 LEU H A 30 LEU HBx 1.0 1.8 3.4 203 171 A 30 LEU H A 30 LEU HBy 1.0 1.8 3.4 204 172 A 30 LEU H A 31 ARG H 1.0 1.8 3.4 205 173 A 30 LEU H A 35 LEU HBy 1.0 2.3 4.2 206 174 A 31 ARG H A 30 LEU HDx% 1.0 2.3 4.9 207 175 A 30 LEU H A 31 ARG H 1.0 1.8 3.5 208 176 A 31 ARG H A 31 ARG HA 1.0 1.8 3.1 209 177 A 31 ARG H A 31 ARG HBx 1.0 1.8 3.3 210 177 A 31 ARG H A 31 ARG HBy 1.0 1.8 3.3 211 178 A 31 ARG H A 31 ARG HDx 1.0 1.8 5.0 212 178 A 31 ARG H A 31 ARG HDy 1.0 1.8 5.0 213 179 A 32 ARG H A 29 LEU HA 1.0 1.8 4.5 214 180 A 32 ARG H A 29 LEU HBy 1.0 1.8 6.2 215 181 A 30 LEU H A 32 ARG H 1.0 1.8 6.0 216 182 A 31 ARG HA A 32 ARG H 1.0 1.8 3.8 217 183 A 31 ARG H A 32 ARG H 1.0 1.8 3.7 218 184 A 32 ARG H A 32 ARG HA 1.0 1.8 3.8 219 185 A 32 ARG H A 32 ARG HBx 1.0 1.8 3.9 220 186 A 32 ARG H A 32 ARG HDx 1.0 1.8 5.2 221 186 A 32 ARG H A 32 ARG HDy 1.0 1.8 5.2 222 187 A 32 ARG H A 32 ARG HGy 1.0 1.8 3.5 223 188 A 32 ARG H A 33 GLY H 1.0 1.8 3.5 224 189 A 32 ARG H A 34 LEU HDy% 1.0 1.8 6.0 225 189 A 32 ARG H A 34 LEU HDx% 1.0 1.8 6.0 226 190 A 32 ARG HA A 33 GLY H 1.0 1.8 3.8 227 191 A 32 ARG H A 33 GLY H 1.0 1.8 3.2 228 192 A 32 ARG HBx A 33 GLY H 1.0 1.8 4.6 229 193 A 33 GLY H A 30 LEU HDy% 1.0 2.3 5.6 230 194 A 30 LEU H A 34 LEU H 1.0 1.8 6.0 231 195 A 32 ARG HBx A 34 LEU H 1.0 1.8 4.6 232 196 A 34 LEU H A 32 ARG HDx 1.0 1.8 6.0 233 196 A 32 ARG HDy A 34 LEU H 1.0 1.8 6.0 234 197 A 34 LEU H A 33 GLY HAx 1.0 1.8 3.9 235 197 A 34 LEU H A 33 GLY HAy 1.0 1.8 3.9 236 198 A 34 LEU H A 34 LEU HA 1.0 1.8 3.6 237 199 A 34 LEU H A 34 LEU HBx 1.0 1.8 3.5 238 199 A 34 LEU H A 34 LEU HBy 1.0 1.8 3.5 239 200 A 34 LEU H A 34 LEU HDy% 1.0 2.3 4.8 240 200 A 34 LEU HDx% A 34 LEU H 1.0 2.3 4.8 241 201 A 34 LEU H A 35 LEU H 1.0 2.3 3.7 242 202 A 30 LEU HA A 35 LEU H 1.0 2.3 3.7 243 203 A 35 LEU H A 34 LEU HBx 1.0 1.8 4.0 244 203 A 34 LEU HBy A 35 LEU H 1.0 1.8 4.0 245 204 A 35 LEU H A 34 LEU HDy% 1.0 1.8 4.3 246 204 A 34 LEU HDx% A 35 LEU H 1.0 1.8 4.3 247 205 A 34 LEU H A 35 LEU H 1.0 2.3 3.5 248 206 A 35 LEU H A 35 LEU HA 1.0 1.8 3.5 249 207 A 35 LEU H A 36 THR H 1.0 1.8 4.6 250 208 A 36 THR H A 34 LEU HDy% 1.0 2.3 5.0 251 209 A 36 THR H A 35 LEU HG 1.0 2.3 4.4 252 210 A 35 LEU HA A 36 THR H 1.0 2.3 3.5 253 211 A 35 LEU H A 36 THR H 1.0 1.8 4.7 254 212 A 36 THR H A 36 THR HG2% 1.0 2.3 4.1 255 213 A 36 THR H A 37 PRO HDy 1.0 1.8 4.8 256 213 A 36 THR H A 37 PRO HDx 1.0 1.8 4.8 257 214 A 36 THR H A 39 GLU H 1.0 2.3 4.9 258 215 A 36 THR H A 39 GLU HBx 1.0 2.3 4.4 259 216 A 36 THR H A 40 LEU H 1.0 1.8 4.8 260 217 A 38 ALA H A 36 THR HB 1.0 2.3 4.2 261 218 A 38 ALA H A 37 PRO HBx 1.0 1.8 4.3 262 219 A 38 ALA H A 37 PRO HBy 1.0 1.8 3.8 263 220 A 38 ALA H A 37 PRO HDy 1.0 1.8 4.2 264 220 A 37 PRO HDx A 38 ALA H 1.0 1.8 4.2 265 221 A 38 ALA H A 38 ALA HA 1.0 1.8 3.2 266 222 A 38 ALA H A 38 ALA HB% 1.0 1.8 3.3 267 223 A 39 GLU H A 38 ALA H 1.0 1.8 3.4 268 224 A 39 GLU H A 36 THR HA 1.0 1.8 5.0 269 225 A 39 GLU H A 36 THR HB 1.0 1.8 4.7 270 226 A 36 THR H A 39 GLU H 1.0 2.3 4.9 271 227 A 39 GLU H A 38 ALA HA 1.0 1.8 4.0 272 228 A 39 GLU H A 38 ALA HB% 1.0 1.8 3.8 273 229 A 39 GLU H A 39 GLU HA 1.0 1.8 3.6 274 230 A 39 GLU H A 39 GLU HBx 1.0 1.8 3.6 275 231 A 36 THR H A 40 LEU H 1.0 1.8 5.0 276 232 A 40 LEU H A 37 PRO HA 1.0 1.8 3.8 277 233 A 40 LEU H A 37 PRO HBx 1.0 2.3 5.7 278 234 A 40 LEU H A 39 GLU HA 1.0 2.3 3.7 279 235 A 39 GLU H A 40 LEU H 1.0 1.8 3.4 280 236 A 40 LEU H A 40 LEU HBy 1.0 1.8 3.1 281 237 A 38 ALA HA A 41 GLN H 1.0 2.3 4.2 282 238 A 40 LEU HBy A 41 GLN H 1.0 1.8 3.7 283 239 A 41 GLN H A 41 GLN HA 1.0 1.8 3.1 284 240 A 41 GLN H A 41 GLN HBx 1.0 1.8 3.1 285 240 A 41 GLN H A 41 GLN HBy 1.0 1.8 3.1 286 241 A 41 GLN H A 41 GLN HGx 1.0 1.8 3.8 287 241 A 41 GLN H A 41 GLN HGy 1.0 1.8 3.8 288 242 A 41 GLN HE2y A 41 GLN HBx 1.0 1.8 4.7 289 242 A 41 GLN HBy A 41 GLN HE2y 1.0 1.8 4.7 290 243 A 41 GLN HE2y A 41 GLN HGx 1.0 2.3 3.6 291 244 A 41 GLN HA A 41 GLN HE2y 1.0 2.3 5.3 292 245 A 41 GLN HE2y A 44 LEU HDx% 1.0 2.3 5.7 293 246 A 41 GLN HE2y A 44 LEU HBy 1.0 2.3 5.6 294 247 A 41 GLN HE2y A 44 LEU HBx 1.0 2.3 5.4 295 248 A 41 GLN HE2y A 45 ASP HBx 1.0 2.3 6.2 296 248 A 41 GLN HE2y A 45 ASP HBy 1.0 2.3 6.2 297 249 A 41 GLN HE2y A 45 ASP HA 1.0 2.3 6.5 298 250 A 41 GLN HE2x A 41 GLN HBx 1.0 1.8 5.2 299 250 A 41 GLN HBy A 41 GLN HE2x 1.0 1.8 5.2 300 251 A 41 GLN HE2x A 41 GLN HGx 1.0 1.8 4.1 301 252 A 41 GLN HA A 41 GLN HE2x 1.0 2.3 5.0 302 253 A 41 GLN HE2x A 44 LEU HDx% 1.0 2.3 5.7 303 254 A 44 LEU HBy A 41 GLN HE2x 1.0 2.0 5.8 304 255 A 44 LEU HBx A 41 GLN HE2x 1.0 2.3 5.0 305 256 A 41 GLN HE2x A 45 ASP HBx 1.0 2.3 6.7 306 256 A 45 ASP HBy A 41 GLN HE2x 1.0 2.3 6.7 307 257 A 45 ASP HA A 41 GLN HE2x 1.0 2.3 6.5 308 258 A 39 GLU HA A 42 GLU H 1.0 1.8 4.2 309 259 A 41 GLN HA A 42 GLU H 1.0 1.8 4.2 310 260 A 42 GLU H A 40 LEU HDx% 1.0 2.3 5.6 311 260 A 42 GLU H A 40 LEU HDy% 1.0 2.3 5.6 312 261 A 40 LEU HBy A 42 GLU H 1.0 2.3 5.3 313 262 A 42 GLU H A 42 GLU HBx 1.0 2.3 3.4 314 263 A 41 GLN H A 42 GLU H 1.0 1.8 3.2 315 264 A 42 GLU H A 42 GLU HA 1.0 1.8 3.1 316 265 A 42 GLU H A 42 GLU HGx 1.0 2.3 4.4 317 265 A 42 GLU H A 42 GLU HGy 1.0 2.3 4.4 318 266 A 42 GLU H A 43 VAL HGx% 1.0 1.8 4.7 319 267 A 42 GLU H A 44 LEU H 1.0 1.8 4.6 320 268 A 42 GLU HA A 43 VAL H 1.0 1.8 4.0 321 269 A 43 VAL H A 42 GLU HGx 1.0 1.8 5.0 322 269 A 42 GLU HGy A 43 VAL H 1.0 1.8 5.0 323 270 A 43 VAL H A 43 VAL HA 1.0 1.8 3.4 324 271 A 43 VAL H A 43 VAL HB 1.0 1.8 3.0 325 272 A 43 VAL HGx% A 43 VAL H 1.0 1.8 3.5 326 273 A 43 VAL H A 43 VAL HGy% 1.0 1.8 4.3 327 274 A 44 LEU HBx A 43 VAL H 1.0 2.3 5.1 328 275 A 44 LEU HBy A 43 VAL H 1.0 2.3 5.3 329 276 A 44 LEU H A 43 VAL H 1.0 1.8 3.3 330 277 A 43 VAL H A 59 PHE HE% 1.0 2.3 4.8 331 278 A 41 GLN HA A 44 LEU H 1.0 1.8 3.9 332 279 A 44 LEU H A 43 VAL HB 1.0 1.8 4.6 333 280 A 44 LEU H A 43 VAL H 1.0 1.8 3.2 334 281 A 44 LEU H A 44 LEU HA 1.0 1.8 3.5 335 282 A 44 LEU HBx A 44 LEU H 1.0 1.8 3.0 336 283 A 44 LEU HBy A 44 LEU H 1.0 1.8 3.4 337 284 A 44 LEU H A 44 LEU HDx% 1.0 2.3 4.6 338 285 A 45 ASP HA A 44 LEU H 1.0 1.8 6.0 339 286 A 44 LEU H A 45 ASP HBx 1.0 1.8 5.0 340 286 A 45 ASP HBy A 44 LEU H 1.0 1.8 5.0 341 287 A 44 LEU H A 45 ASP H 1.0 1.8 3.4 342 288 A 45 ASP H A 41 GLN HGx 1.0 2.3 6.0 343 288 A 41 GLN HGy A 45 ASP H 1.0 2.3 6.0 344 289 A 42 GLU HA A 45 ASP H 1.0 1.8 4.2 345 290 A 44 LEU H A 45 ASP H 1.0 1.8 3.4 346 291 A 45 ASP HA A 45 ASP H 1.0 1.8 3.2 347 292 A 45 ASP H A 45 ASP HBx 1.0 1.8 3.3 348 292 A 45 ASP HBy A 45 ASP H 1.0 1.8 3.3 349 293 A 45 ASP H A 46 LEU H 1.0 1.8 3.2 350 294 A 43 VAL HA A 46 LEU H 1.0 1.8 4.4 351 295 A 44 LEU HA A 46 LEU H 1.0 1.8 4.6 352 296 A 44 LEU H A 46 LEU H 1.0 1.8 5.2 353 297 A 45 ASP HA A 46 LEU H 1.0 2.3 3.8 354 298 A 46 LEU H A 45 ASP HBx 1.0 1.8 4.2 355 298 A 45 ASP HBy A 46 LEU H 1.0 1.8 4.2 356 299 A 45 ASP H A 46 LEU H 1.0 1.8 3.5 357 300 A 46 LEU H A 46 LEU HDy% 1.0 1.8 4.6 358 300 A 46 LEU H A 46 LEU HDx% 1.0 1.8 4.6 359 301 A 46 LEU H A 46 LEU HBx 1.0 1.8 3.3 360 302 A 46 LEU H A 46 LEU HBy 1.0 1.8 3.7 361 303 A 46 LEU H A 47 LYS H 1.0 2.3 5.1 362 304 A 46 LEU H A 52 GLN HE2y 1.0 2.3 5.5 363 305 A 46 LEU H A 52 GLN HE2x 1.0 1.8 5.5 364 306 A 47 LYS H A 46 LEU HA 1.0 1.8 2.9 365 307 A 46 LEU HBy A 47 LYS H 1.0 1.8 3.8 366 308 A 46 LEU HDx% A 47 LYS H 1.0 2.3 4.9 367 309 A 47 LYS H A 47 LYS HA 1.0 1.8 3.5 368 310 A 47 LYS H A 47 LYS HBx 1.0 1.8 3.5 369 310 A 47 LYS H A 47 LYS HBy 1.0 1.8 3.5 370 311 A 47 LYS H A 48 THR H 1.0 1.8 3.4 371 312 A 47 LYS H A 52 GLN HE2y 1.0 1.8 6.2 372 313 A 46 LEU HA A 48 THR H 1.0 1.8 4.8 373 314 A 46 LEU HBx A 48 THR H 1.0 1.8 3.8 374 315 A 48 THR H A 46 LEU HDy% 1.0 2.3 5.7 375 315 A 46 LEU HDx% A 48 THR H 1.0 2.3 5.7 376 316 A 47 LYS HA A 48 THR H 1.0 1.8 3.7 377 317 A 47 LYS H A 48 THR H 1.0 1.8 3.4 378 318 A 48 THR H A 48 THR HA 1.0 1.8 3.7 379 319 A 48 THR H A 48 THR HB 1.0 1.8 4.4 380 320 A 48 THR H A 48 THR HG2% 1.0 2.3 4.3 381 321 A 48 THR H A 49 PRO HDx 1.0 2.3 5.2 382 321 A 48 THR H A 49 PRO HDy 1.0 2.3 5.2 383 322 A 48 THR H A 52 GLN H 1.0 1.8 5.2 384 323 A 48 THR H A 52 GLN HGy 1.0 1.8 4.6 385 324 A 48 THR HA A 50 GLU H 1.0 1.8 4.4 386 325 A 48 THR HB A 50 GLU H 1.0 2.3 4.1 387 326 A 48 THR HG2% A 50 GLU H 1.0 1.8 4.9 388 327 A 50 GLU H A 49 PRO HA 1.0 1.8 4.3 389 328 A 50 GLU H A 50 GLU HBy 1.0 1.8 3.1 390 329 A 50 GLU H A 51 GLU H 1.0 1.8 3.6 391 330 A 52 GLN H A 50 GLU H 1.0 1.8 4.9 392 331 A 50 GLU H A 53 ALA H 1.0 2.3 5.3 393 332 A 46 LEU HBy A 51 GLU H 1.0 2.3 5.5 394 333 A 51 GLU H A 46 LEU HDy% 1.0 2.3 5.5 395 334 A 48 THR HB A 51 GLU H 1.0 1.8 4.7 396 335 A 48 THR HA A 51 GLU H 1.0 1.8 6.0 397 336 A 49 PRO HA A 51 GLU H 1.0 1.8 6.0 398 337 A 50 GLU HBy A 51 GLU H 1.0 1.8 3.7 399 338 A 50 GLU H A 51 GLU H 1.0 1.8 3.7 400 339 A 51 GLU H A 51 GLU HA 1.0 1.8 3.4 401 340 A 51 GLU H A 51 GLU HBx 1.0 1.8 3.5 402 340 A 51 GLU H A 51 GLU HBy 1.0 1.8 3.5 403 341 A 52 GLN H A 51 GLU H 1.0 1.8 3.5 404 342 A 51 GLU H A 53 ALA H 1.0 1.8 5.0 405 343 A 52 GLN H A 46 LEU HDy% 1.0 1.8 5.3 406 343 A 46 LEU HDx% A 52 GLN H 1.0 1.8 5.3 407 344 A 52 GLN H A 49 PRO HA 1.0 1.8 4.0 408 345 A 52 GLN H A 50 GLU HBy 1.0 2.3 5.2 409 346 A 52 GLN H A 50 GLU H 1.0 1.8 6.0 410 347 A 52 GLN H A 51 GLU HGx 1.0 2.3 4.8 411 347 A 52 GLN H A 51 GLU HGy 1.0 2.3 4.8 412 348 A 52 GLN H A 51 GLU H 1.0 1.8 3.4 413 349 A 52 GLN H A 52 GLN HA 1.0 1.8 3.6 414 350 A 52 GLN H A 52 GLN HBy 1.0 1.8 3.6 415 351 A 52 GLN H A 52 GLN HGy 1.0 1.8 3.4 416 352 A 52 GLN HE2y A 52 GLN H 1.0 2.3 5.9 417 353 A 52 GLN HE2x A 52 GLN H 1.0 1.8 6.0 418 354 A 52 GLN H A 53 ALA H 1.0 1.8 3.6 419 355 A 44 LEU HA A 52 GLN HE2y 1.0 2.3 4.9 420 356 A 44 LEU HBy A 52 GLN HE2y 1.0 2.0 5.8 421 357 A 52 GLN HE2y A 46 LEU HDy% 1.0 2.3 5.7 422 358 A 46 LEU H A 52 GLN HE2y 1.0 2.3 6.0 423 359 A 52 GLN HE2y A 51 GLU HGx 1.0 2.3 6.0 424 359 A 52 GLN HE2y A 51 GLU HGy 1.0 2.3 6.0 425 360 A 52 GLN HE2y A 52 GLN HGx 1.0 1.8 3.9 426 361 A 52 GLN HE2y A 52 GLN H 1.0 2.3 6.0 427 362 A 44 LEU HA A 52 GLN HE2x 1.0 1.8 4.6 428 363 A 52 GLN HE2x A 44 LEU HDx% 1.0 2.3 5.5 429 364 A 46 LEU H A 52 GLN HE2x 1.0 1.8 6.0 430 365 A 52 GLN HE2x A 52 GLN HGx 1.0 1.8 4.2 431 366 A 20 LEU HDy% A 53 ALA H 1.0 2.3 5.1 432 367 A 49 PRO HA A 53 ALA H 1.0 1.8 4.4 433 368 A 53 ALA H A 52 GLN HBx 1.0 1.8 3.4 434 369 A 52 GLN HGy A 53 ALA H 1.0 2.3 4.8 435 370 A 52 GLN H A 53 ALA H 1.0 1.8 3.4 436 371 A 53 ALA H A 53 ALA HA 1.0 1.8 3.1 437 372 A 53 ALA H A 53 ALA HB% 1.0 1.8 3.4 438 373 A 53 ALA H A 54 LYS H 1.0 1.8 3.2 439 374 A 53 ALA H A 54 LYS H 1.0 1.8 3.5 440 375 A 54 LYS H A 54 LYS HA 1.0 1.8 3.3 441 376 A 54 LYS H A 54 LYS HBx 1.0 1.8 3.7 442 376 A 54 LYS H A 54 LYS HBy 1.0 1.8 3.7 443 377 A 54 LYS H A 54 LYS HDx 1.0 2.3 4.6 444 377 A 54 LYS H A 54 LYS HDy 1.0 2.3 4.6 445 378 A 54 LYS H A 54 LYS HGy 1.0 2.3 4.7 446 378 A 54 LYS H A 54 LYS HGx 1.0 2.3 4.7 447 379 A 54 LYS H A 56 LEU H 1.0 1.8 5.0 448 380 A 55 LYS H A 55 LYS HA 1.0 1.8 3.1 449 381 A 55 LYS H A 55 LYS HEx 1.0 2.3 5.4 450 382 A 56 LEU H A 55 LYS H 1.0 1.8 3.3 451 383 A 56 LEU H A 55 LYS H 1.0 1.8 3.2 452 384 A 56 LEU H A 56 LEU HA 1.0 1.8 3.2 453 385 A 56 LEU H A 56 LEU HBx 1.0 1.8 3.1 454 386 A 56 LEU H A 56 LEU HDx% 1.0 2.3 4.4 455 387 A 56 LEU H A 57 ILE H 1.0 1.8 3.3 456 388 A 56 LEU H A 58 ASP HBx 1.0 1.8 6.2 457 389 A 54 LYS HA A 57 ILE H 1.0 1.8 3.7 458 390 A 57 ILE H A 56 LEU HBy 1.0 1.8 3.8 459 391 A 57 ILE H A 57 ILE HA 1.0 1.8 3.7 460 392 A 57 ILE H A 57 ILE HB 1.0 1.8 3.6 461 393 A 57 ILE H A 57 ILE HG1x 1.0 1.8 3.4 462 394 A 57 ILE H A 57 ILE HG2% 1.0 1.8 4.3 463 395 A 55 LYS HA A 58 ASP H 1.0 1.8 3.8 464 396 A 57 ILE HA A 58 ASP H 1.0 1.8 4.4 465 397 A 57 ILE HB A 58 ASP H 1.0 1.8 4.2 466 398 A 58 ASP H A 57 ILE HG1x 1.0 1.8 4.4 467 399 A 57 ILE HG2% A 58 ASP H 1.0 1.8 4.3 468 400 A 58 ASP H A 58 ASP HA 1.0 1.8 3.5 469 401 A 58 ASP HBx A 58 ASP H 1.0 1.8 3.5 470 402 A 58 ASP H A 58 ASP HBy 1.0 1.8 3.5 471 403 A 58 ASP H A 59 PHE HBx 1.0 1.8 6.0 472 403 A 58 ASP H A 59 PHE HBy 1.0 1.8 6.0 473 404 A 56 LEU HA A 59 PHE H 1.0 1.8 3.7 474 405 A 56 LEU HBx A 59 PHE H 1.0 2.3 5.1 475 406 A 56 LEU HBy A 59 PHE H 1.0 2.3 5.4 476 407 A 57 ILE HA A 59 PHE H 1.0 1.8 4.8 477 408 A 58 ASP HA A 59 PHE H 1.0 1.8 4.1 478 409 A 58 ASP HBx A 59 PHE H 1.0 1.8 3.7 479 410 A 58 ASP HBy A 59 PHE H 1.0 1.8 3.7 480 411 A 59 PHE H A 59 PHE HA 1.0 1.8 3.5 481 412 A 59 PHE H A 59 PHE HBx 1.0 1.8 3.7 482 412 A 59 PHE HBy A 59 PHE H 1.0 1.8 3.7 483 413 A 59 PHE H A 59 PHE HD% 1.0 1.8 4.5 484 414 A 59 PHE HE% A 59 PHE H 1.0 1.8 5.8 485 415 A 59 PHE H A 60 ILE HD1% 1.0 2.3 5.5 486 416 A 59 PHE H A 61 LEU H 1.0 1.8 4.9 487 417 A 57 ILE HA A 60 ILE H 1.0 1.8 4.0 488 418 A 59 PHE HA A 60 ILE H 1.0 1.8 4.2 489 419 A 60 ILE H A 59 PHE HBx 1.0 1.8 4.2 490 419 A 59 PHE HBy A 60 ILE H 1.0 1.8 4.2 491 420 A 60 ILE H A 60 ILE HA 1.0 1.8 3.5 492 421 A 61 LEU H A 60 ILE H 1.0 1.8 3.4 493 422 A 57 ILE HA A 61 LEU H 1.0 1.8 4.8 494 423 A 59 PHE H A 61 LEU H 1.0 1.8 4.8 495 424 A 61 LEU H A 60 ILE HA 1.0 1.8 4.6 496 425 A 61 LEU H A 60 ILE HB 1.0 1.8 4.0 497 426 A 60 ILE HD1% A 61 LEU H 1.0 2.3 5.3 498 427 A 61 LEU H A 60 ILE H 1.0 1.8 3.5 499 428 A 61 LEU H A 61 LEU HBy 1.0 1.8 3.2 500 429 A 61 LEU H A 61 LEU HBx 1.0 1.8 3.7 501 430 A 61 LEU H A 61 LEU HD11 1.0 2.3 5.0 502 431 A 61 LEU H A 61 LEU HD21 1.0 1.8 4.9 503 432 A 61 LEU H A 61 LEU HA 1.0 1.8 3.8 504 433 A 61 LEU H A 62 LYS H 1.0 1.8 3.7 505 434 A 60 ILE HA A 62 LYS H 1.0 1.8 6.0 506 435 A 60 ILE H A 62 LYS H 1.0 1.8 6.0 507 436 A 61 LEU HBy A 62 LYS H 1.0 1.8 3.6 508 437 A 61 LEU HD11 A 62 LYS H 1.0 1.8 5.7 509 438 A 61 LEU H A 62 LYS H 1.0 1.8 3.7 510 439 A 61 LEU HD21 A 62 LYS H 1.0 1.8 6.0 511 440 A 62 LYS H A 62 LYS HA 1.0 1.8 3.4 512 441 A 62 LYS H A 62 LYS HBx 1.0 1.8 3.6 513 441 A 62 LYS H A 62 LYS HBy 1.0 1.8 3.6 514 442 A 62 LYS H A 63 LEU HA 1.0 2.3 5.1 515 443 A 62 LYS H A 63 LEU HD11 1.0 2.3 5.7 516 443 A 62 LYS H A 63 LEU HD21 1.0 2.3 5.7 517 444 A 60 ILE HA A 63 LEU H 1.0 1.8 4.6 518 445 A 62 LYS HA A 63 LEU H 1.0 1.8 3.7 519 446 A 63 LEU H A 62 LYS HBx 1.0 1.8 3.7 520 446 A 62 LYS HBy A 63 LEU H 1.0 1.8 3.7 521 447 A 63 LEU HA A 63 LEU H 1.0 1.8 3.4 522 448 A 63 LEU H A 63 LEU HD11 1.0 2.3 4.1 523 448 A 63 LEU HD21 A 63 LEU H 1.0 2.3 4.1 524 449 A 63 LEU H A 64 SER H 1.0 2.3 4.9 525 450 A 63 LEU H A 67 ASP HBy 1.0 1.8 5.4 526 451 A 63 LEU H A 67 ASP HBx 1.0 1.8 6.0 527 452 A 63 LEU HA A 64 SER H 1.0 1.8 3.1 528 453 A 64 SER H A 63 LEU HBx 1.0 1.8 3.6 529 454 A 64 SER H A 63 LEU HD11 1.0 1.8 4.1 530 454 A 63 LEU HD21 A 64 SER H 1.0 1.8 4.1 531 455 A 63 LEU H A 64 SER H 1.0 1.8 4.8 532 456 A 64 SER H A 67 ASP HBy 1.0 1.8 4.7 533 457 A 64 SER H A 67 ASP HBx 1.0 1.8 4.9 534 458 A 66 ALA H A 64 SER HA 1.0 1.8 6.0 535 459 A 66 ALA H A 65 PRO HBy 1.0 1.8 4.4 536 460 A 66 ALA H A 65 PRO HBx 1.0 1.8 4.0 537 461 A 66 ALA H A 65 PRO HGx 1.0 1.8 5.0 538 461 A 66 ALA H A 65 PRO HGy 1.0 1.8 5.0 539 462 A 66 ALA H A 66 ALA HA 1.0 1.8 3.5 540 463 A 66 ALA H A 66 ALA HB1 1.0 1.8 3.7 541 464 A 66 ALA H A 67 ASP H 1.0 1.8 4.0 542 465 A 66 ALA H A 68 VAL H 1.0 1.8 5.0 543 466 A 66 ALA H A 67 ASP H 1.0 1.8 3.5 544 467 A 67 ASP H A 67 ASP HA 1.0 1.8 3.5 545 468 A 67 ASP HBy A 67 ASP H 1.0 1.8 3.6 546 469 A 67 ASP HBx A 67 ASP H 1.0 1.8 3.6 547 470 A 67 ASP H A 68 VAL H 1.0 1.8 3.3 548 471 A 67 ASP H A 68 VAL HG21 1.0 1.8 4.6 549 472 A 63 LEU HBx A 68 VAL H 1.0 2.3 5.3 550 473 A 68 VAL H A 65 PRO HA 1.0 1.8 4.5 551 474 A 65 PRO HBx A 68 VAL H 1.0 2.3 5.6 552 475 A 68 VAL H A 67 ASP HA 1.0 1.8 5.2 553 476 A 67 ASP HBy A 68 VAL H 1.0 1.8 4.3 554 477 A 67 ASP HBx A 68 VAL H 1.0 1.8 5.1 555 478 A 67 ASP H A 68 VAL H 1.0 1.8 3.6 556 479 A 68 VAL H A 68 VAL HA 1.0 1.8 4.0 557 480 A 68 VAL H A 68 VAL HB 1.0 1.8 3.8 558 481 A 68 VAL H A 68 VAL HG11 1.0 1.8 3.8 559 482 A 68 VAL H A 68 VAL HG21 1.0 1.8 4.2 560 483 A 68 VAL H A 69 GLN HA 1.0 1.8 6.0 561 484 A 68 VAL H A 69 GLN H 1.0 1.8 3.7 562 485 A 66 ALA HA A 69 GLN H 1.0 1.8 3.9 563 486 A 68 VAL HA A 69 GLN H 1.0 1.8 4.8 564 487 A 68 VAL HG21 A 69 GLN H 1.0 1.8 4.4 565 488 A 68 VAL H A 69 GLN H 1.0 1.8 3.9 566 489 A 69 GLN HA A 69 GLN H 1.0 1.8 3.8 567 490 A 69 GLN H A 70 ALA H 1.0 1.8 3.9 568 491 A 69 GLN H A 71 ARG H 1.0 1.8 6.0 569 492 A 69 GLN HE2y A 69 GLN HBx 1.0 1.8 4.7 570 492 A 69 GLN HE2y A 69 GLN HBy 1.0 1.8 4.7 571 493 A 69 GLN HE2y A 69 GLN HGx 1.0 1.8 3.9 572 493 A 69 GLN HE2y A 69 GLN HGy 1.0 1.8 3.9 573 494 A 69 GLN HA A 69 GLN HE2y 1.0 1.8 6.0 574 495 A 69 GLN HE2y A 72 ILE HD11 1.0 2.3 5.7 575 496 A 69 GLN HE2y A 91 LEU HD21 1.0 1.8 4.8 576 497 A 67 ASP HA A 70 ALA H 1.0 1.8 4.6 577 498 A 70 ALA H A 69 GLN HBx 1.0 1.8 3.8 578 498 A 70 ALA H A 69 GLN HBy 1.0 1.8 3.8 579 499 A 70 ALA H A 69 GLN HGx 1.0 1.8 5.1 580 499 A 70 ALA H A 69 GLN HGy 1.0 1.8 5.1 581 500 A 69 GLN H A 70 ALA H 1.0 1.8 3.6 582 501 A 70 ALA H A 70 ALA HA 1.0 1.8 3.4 583 502 A 70 ALA H A 71 ARG H 1.0 1.8 3.4 584 503 A 71 ARG H A 34 LEU HDy% 1.0 1.8 5.5 585 503 A 34 LEU HDx% A 71 ARG H 1.0 1.8 5.5 586 504 A 71 ARG H A 71 ARG HDx 1.0 2.3 5.2 587 505 A 67 ASP HA A 71 ARG H 1.0 1.8 6.0 588 506 A 68 VAL HA A 71 ARG H 1.0 1.8 4.7 589 507 A 68 VAL HG11 A 71 ARG H 1.0 1.8 5.6 590 508 A 71 ARG H A 70 ALA HA 1.0 1.8 4.5 591 509 A 70 ALA H A 71 ARG H 1.0 1.8 3.5 592 510 A 71 ARG H A 71 ARG HA 1.0 1.8 3.5 593 511 A 71 ARG H A 71 ARG HBx 1.0 1.8 3.2 594 512 A 71 ARG H A 71 ARG HDy 1.0 2.3 5.4 595 512 A 71 ARG H A 71 ARG HDx 1.0 2.3 5.4 596 513 A 71 ARG H A 71 ARG HGx 1.0 2.3 4.8 597 513 A 71 ARG H A 71 ARG HGy 1.0 2.3 4.8 598 514 A 71 ARG H A 72 ILE H 1.0 1.8 3.4 599 515 A 70 ALA H A 72 ILE H 1.0 1.8 5.0 600 516 A 71 ARG HA A 72 ILE H 1.0 1.8 3.8 601 517 A 71 ARG H A 72 ILE H 1.0 1.8 3.7 602 518 A 72 ILE H A 72 ILE HA 1.0 1.8 4.0 603 519 A 72 ILE H A 72 ILE HB 1.0 2.3 3.8 604 520 A 72 ILE HD11 A 72 ILE H 1.0 2.3 4.6 605 521 A 72 ILE H A 72 ILE HG21 1.0 1.8 4.7 606 522 A 72 ILE H A 73 ASN HBx 1.0 1.8 6.0 607 522 A 72 ILE H A 73 ASN HBy 1.0 1.8 6.0 608 523 A 72 ILE H A 73 ASN H 1.0 1.8 3.8 609 524 A 72 ILE H A 72 ILE HG1x 1.0 2.3 4.0 610 524 A 72 ILE H A 72 ILE HG1y 1.0 2.3 4.0 611 525 A 73 ASN H A 69 GLN HGx 1.0 1.8 6.0 612 525 A 69 GLN HGy A 73 ASN H 1.0 1.8 6.0 613 526 A 70 ALA H A 73 ASN H 1.0 2.3 4.9 614 527 A 71 ARG HA A 73 ASN H 1.0 2.3 4.8 615 528 A 71 ARG HBx A 73 ASN H 1.0 2.3 5.5 616 529 A 73 ASN H A 72 ILE HG1x 1.0 2.3 5.1 617 529 A 73 ASN H A 72 ILE HG1y 1.0 2.3 5.1 618 530 A 72 ILE HA A 73 ASN H 1.0 1.8 4.2 619 531 A 72 ILE HB A 73 ASN H 1.0 2.3 3.8 620 532 A 72 ILE HD11 A 73 ASN H 1.0 2.3 5.5 621 533 A 72 ILE HG21 A 73 ASN H 1.0 1.8 4.2 622 534 A 72 ILE H A 73 ASN H 1.0 1.8 3.5 623 535 A 73 ASN H A 73 ASN HA 1.0 1.8 3.4 624 536 A 73 ASN H A 73 ASN HBx 1.0 1.8 3.5 625 536 A 73 ASN HBy A 73 ASN H 1.0 1.8 3.5 626 537 A 73 ASN H A 73 ASN HD2y 1.0 1.8 4.9 627 538 A 73 ASN H A 74 VAL H 1.0 1.8 3.5 628 539 A 73 ASN HD2x A 69 GLN HBx 1.0 1.8 5.5 629 539 A 69 GLN HBy A 73 ASN HD2x 1.0 1.8 5.5 630 540 A 73 ASN HD2x A 69 GLN HGx 1.0 2.3 5.9 631 540 A 69 GLN HGy A 73 ASN HD2x 1.0 2.3 5.9 632 541 A 70 ALA HA A 73 ASN HD2x 1.0 1.8 4.5 633 542 A 73 ASN HD2x A 70 ALA HB1 1.0 2.3 5.9 634 543 A 73 ASN HD2x A 73 ASN HBx 1.0 1.8 3.7 635 543 A 73 ASN HBy A 73 ASN HD2x 1.0 1.8 3.7 636 544 A 73 ASN H A 73 ASN HD2x 1.0 1.8 4.8 637 545 A 73 ASN HD2y A 69 GLN HBx 1.0 1.8 5.4 638 545 A 69 GLN HBy A 73 ASN HD2y 1.0 1.8 5.4 639 546 A 73 ASN HD2y A 69 GLN HGx 1.0 2.3 5.8 640 546 A 69 GLN HGy A 73 ASN HD2y 1.0 2.3 5.8 641 547 A 70 ALA HA A 73 ASN HD2y 1.0 1.8 4.2 642 548 A 73 ASN HD2y A 70 ALA HB1 1.0 1.8 6.0 643 549 A 73 ASN HD2y A 73 ASN HBx 1.0 1.8 3.8 644 549 A 73 ASN HBy A 73 ASN HD2y 1.0 1.8 3.8 645 550 A 73 ASN H A 73 ASN HD2y 1.0 1.8 4.9 646 551 A 71 ARG HBx A 74 VAL H 1.0 2.3 5.7 647 552 A 72 ILE HA A 74 VAL H 1.0 1.8 6.0 648 553 A 72 ILE H A 74 VAL H 1.0 1.8 6.0 649 554 A 73 ASN HA A 74 VAL H 1.0 1.8 4.5 650 555 A 74 VAL H A 73 ASN HBx 1.0 1.8 4.5 651 555 A 73 ASN HBy A 74 VAL H 1.0 1.8 4.5 652 556 A 74 VAL H A 73 ASN HD2x 1.0 2.3 5.8 653 557 A 74 VAL H A 74 VAL HA 1.0 1.8 3.3 654 558 A 74 VAL H A 74 VAL HB 1.0 1.8 3.8 655 559 A 74 VAL H A 74 VAL HG11 1.0 1.8 3.7 656 560 A 74 VAL H A 74 VAL HG21 1.0 1.8 4.3 657 561 A 74 VAL H A 75 LEU H 1.0 1.8 3.3 658 562 A 74 VAL H A 76 ARG H 1.0 1.8 6.0 659 563 A 72 ILE HA A 75 LEU H 1.0 1.8 4.5 660 564 A 74 VAL HA A 75 LEU H 1.0 1.8 3.9 661 565 A 74 VAL H A 75 LEU H 1.0 1.8 3.3 662 566 A 75 LEU H A 74 VAL HG11 1.0 1.8 4.7 663 567 A 75 LEU H A 75 LEU HD11 1.0 1.8 4.2 664 568 A 75 LEU H A 76 ARG H 1.0 1.8 3.9 665 569 A 72 ILE HA A 76 ARG H 1.0 1.8 4.4 666 570 A 72 ILE HG21 A 76 ARG H 1.0 2.3 5.5 667 571 A 73 ASN HA A 76 ARG H 1.0 1.8 4.4 668 572 A 74 VAL HA A 76 ARG H 1.0 1.8 4.8 669 573 A 76 ARG H A 75 LEU HBy 1.0 1.8 3.8 670 574 A 76 ARG H A 75 LEU HD21 1.0 2.3 5.7 671 574 A 76 ARG H A 75 LEU HD11 1.0 2.3 5.7 672 575 A 75 LEU H A 76 ARG H 1.0 1.8 3.7 673 576 A 76 ARG H A 76 ARG HA 1.0 1.8 3.8 674 577 A 76 ARG H A 76 ARG HBx 1.0 1.8 3.7 675 577 A 76 ARG H A 76 ARG HBy 1.0 1.8 3.7 676 578 A 76 ARG H A 76 ARG HDx 1.0 1.8 5.4 677 579 A 76 ARG H A 76 ARG HGx 1.0 1.8 3.9 678 579 A 76 ARG H A 76 ARG HGy 1.0 1.8 3.9 679 580 A 76 ARG H A 77 ALA HA 1.0 2.3 5.5 680 581 A 76 ARG H A 77 ALA H 1.0 1.8 4.2 681 582 A 73 ASN HA A 77 ALA H 1.0 1.8 5.1 682 583 A 74 VAL HA A 77 ALA H 1.0 1.8 3.9 683 584 A 76 ARG HA A 77 ALA H 1.0 1.8 4.2 684 585 A 77 ALA H A 76 ARG HBx 1.0 1.8 3.8 685 585 A 76 ARG HBy A 77 ALA H 1.0 1.8 3.8 686 586 A 76 ARG H A 77 ALA H 1.0 1.8 3.5 687 587 A 77 ALA HA A 77 ALA H 1.0 1.8 3.3 688 588 A 77 ALA H A 77 ALA HB1 1.0 1.8 3.3 689 589 A 77 ALA H A 78 HIS H 1.0 1.8 3.3 690 590 A 74 VAL HA A 78 HIS H 1.0 1.8 4.7 691 591 A 78 HIS H A 74 VAL HG11 1.0 1.8 6.0 692 591 A 78 HIS H A 74 VAL HG21 1.0 1.8 6.0 693 592 A 78 HIS H A 75 LEU HBy 1.0 2.3 5.7 694 593 A 75 LEU HD11 A 78 HIS H 1.0 1.8 5.9 695 594 A 75 LEU H A 78 HIS H 1.0 1.8 6.0 696 595 A 78 HIS H A 76 ARG HBx 1.0 2.3 5.4 697 595 A 76 ARG HBy A 78 HIS H 1.0 2.3 5.4 698 596 A 76 ARG H A 78 HIS H 1.0 1.8 4.8 699 597 A 77 ALA HA A 78 HIS H 1.0 2.3 3.9 700 598 A 77 ALA HB1 A 78 HIS H 1.0 1.8 3.8 701 599 A 77 ALA H A 78 HIS H 1.0 1.8 3.0 702 600 A 78 HIS H A 78 HIS HA 1.0 1.8 3.4 703 601 A 78 HIS H A 78 HIS HBy 1.0 1.8 3.6 704 602 A 78 HIS H A 78 HIS HBx 1.0 1.8 3.2 705 603 A 78 HIS H A 79 GLY HAx 1.0 1.8 5.6 706 604 A 78 HIS H A 80 TYR HD% 1.0 2.3 4.9 707 605 A 78 HIS H A 80 TYR HE% 1.0 2.3 6.2 708 606 A 78 HIS H A 80 TYR H 1.0 2.3 4.5 709 607 A 78 HIS HA A 79 GLY H 1.0 1.8 4.0 710 608 A 78 HIS HBx A 79 GLY H 1.0 1.8 4.7 711 609 A 78 HIS H A 79 GLY H 1.0 2.3 4.2 712 610 A 79 GLY H A 79 GLY HAy 1.0 1.8 3.4 713 611 A 79 GLY HAx A 79 GLY H 1.0 1.8 3.8 714 612 A 79 GLY H A 80 TYR HA 1.0 1.8 6.0 715 613 A 80 TYR HD% A 79 GLY H 1.0 1.8 6.0 716 614 A 80 TYR H A 79 GLY H 1.0 1.8 3.4 717 615 A 79 GLY H A 80 TYR HA 1.0 1.8 6.0 718 616 A 80 TYR H A 75 LEU HA 1.0 1.8 3.9 719 617 A 75 LEU HD11 A 80 TYR H 1.0 1.8 5.0 720 618 A 80 TYR H A 75 LEU HBy 1.0 1.8 5.5 721 618 A 80 TYR H A 75 LEU HBx 1.0 1.8 5.5 722 619 A 76 ARG HA A 80 TYR H 1.0 2.3 4.6 723 620 A 78 HIS H A 80 TYR H 1.0 1.8 4.3 724 621 A 78 HIS HA A 80 TYR H 1.0 1.8 6.0 725 622 A 79 GLY HAx A 80 TYR H 1.0 1.8 4.5 726 623 A 80 TYR H A 79 GLY H 1.0 1.8 3.5 727 624 A 80 TYR H A 80 TYR HA 1.0 1.8 3.8 728 625 A 80 TYR H A 80 TYR HBy 1.0 1.8 3.9 729 626 A 80 TYR H A 80 TYR HBx 1.0 1.8 3.6 730 627 A 80 TYR HD% A 80 TYR H 1.0 1.8 4.3 731 628 A 80 TYR HE% A 80 TYR H 1.0 1.8 5.4 732 629 A 80 TYR H A 81 GLN HBx 1.0 2.3 5.8 733 629 A 80 TYR H A 81 GLN HBy 1.0 2.3 5.8 734 630 A 75 LEU HA A 81 GLN H 1.0 2.3 6.0 735 631 A 75 LEU HD11 A 81 GLN H 1.0 2.3 6.0 736 632 A 80 TYR HA A 81 GLN H 1.0 1.8 3.0 737 633 A 80 TYR HD% A 81 GLN H 1.0 1.8 5.5 738 634 A 80 TYR HBx A 81 GLN H 1.0 1.8 4.5 739 635 A 80 TYR HBy A 81 GLN H 1.0 1.8 4.6 740 636 A 81 GLN H A 81 GLN HA 1.0 1.8 3.2 741 637 A 81 GLN H A 81 GLN HBx 1.0 1.8 3.3 742 637 A 81 GLN HBy A 81 GLN H 1.0 1.8 3.3 743 638 A 81 GLN H A 81 GLN HGx 1.0 1.8 3.8 744 638 A 81 GLN H A 81 GLN HGy 1.0 1.8 3.8 745 639 A 81 GLN H A 82 ALA H 1.0 1.8 3.4 746 640 A 81 GLN H A 82 ALA HA 1.0 1.8 5.5 747 641 A 81 GLN H A 83 LEU HBx 1.0 2.3 5.0 748 642 A 80 TYR HA A 82 ALA H 1.0 1.8 4.7 749 643 A 82 ALA H A 81 GLN HBx 1.0 1.8 3.6 750 643 A 81 GLN HBy A 82 ALA H 1.0 1.8 3.6 751 644 A 82 ALA H A 81 GLN HGx 1.0 1.8 4.7 752 644 A 81 GLN HGy A 82 ALA H 1.0 1.8 4.7 753 645 A 81 GLN H A 82 ALA H 1.0 1.8 3.2 754 646 A 82 ALA H A 82 ALA HA 1.0 1.8 3.3 755 647 A 82 ALA H A 82 ALA HB1 1.0 1.8 3.2 756 648 A 80 TYR HA A 83 LEU H 1.0 1.8 6.0 757 649 A 80 TYR HBy A 83 LEU H 1.0 1.8 5.3 758 650 A 80 TYR HBx A 83 LEU H 1.0 1.8 6.2 759 651 A 82 ALA HA A 83 LEU H 1.0 1.8 5.2 760 652 A 82 ALA HB1 A 83 LEU H 1.0 1.8 4.1 761 653 A 83 LEU H A 83 LEU HA 1.0 1.8 3.9 762 654 A 83 LEU H A 83 LEU HBy 1.0 1.8 3.6 763 655 A 83 LEU H A 83 LEU HD11 1.0 1.8 4.4 764 655 A 83 LEU H A 83 LEU HD21 1.0 1.8 4.4 765 656 A 83 LEU H A 84 ALA H 1.0 1.8 3.7 766 657 A 80 TYR HBx A 84 ALA H 1.0 1.8 5.1 767 658 A 83 LEU HBy A 84 ALA H 1.0 1.8 3.9 768 659 A 84 ALA H A 83 LEU HD11 1.0 2.3 5.1 769 659 A 83 LEU HD21 A 84 ALA H 1.0 2.3 5.1 770 660 A 83 LEU H A 84 ALA H 1.0 1.8 3.2 771 661 A 84 ALA H A 84 ALA HA 1.0 1.8 3.4 772 662 A 84 ALA H A 84 ALA HB1 1.0 1.8 3.3 773 663 A 84 ALA H A 85 ASP HBy 1.0 2.3 5.3 774 664 A 85 ASP H A 83 LEU HD11 1.0 2.3 6.0 775 664 A 83 LEU HD21 A 85 ASP H 1.0 2.3 6.0 776 665 A 84 ALA HA A 85 ASP H 1.0 1.8 4.1 777 666 A 84 ALA HB1 A 85 ASP H 1.0 1.8 3.8 778 667 A 84 ALA H A 85 ASP H 1.0 1.8 3.3 779 668 A 85 ASP H A 85 ASP HA 1.0 1.8 3.3 780 669 A 85 ASP HBy A 85 ASP H 1.0 1.8 3.3 781 670 A 85 ASP H A 85 ASP HBx 1.0 1.8 3.5 782 671 A 85 ASP H A 86 LYS HBy 1.0 2.3 6.0 783 672 A 85 ASP H A 86 LYS HBx 1.0 2.3 5.9 784 673 A 85 ASP H A 86 LYS H 1.0 1.8 3.9 785 674 A 83 LEU HA A 86 LYS H 1.0 1.8 4.3 786 675 A 84 ALA HB1 A 86 LYS H 1.0 2.3 5.5 787 676 A 85 ASP HBy A 86 LYS H 1.0 1.8 3.8 788 677 A 85 ASP HBx A 86 LYS H 1.0 1.8 4.0 789 678 A 85 ASP H A 86 LYS H 1.0 1.8 3.7 790 679 A 86 LYS H A 86 LYS HA 1.0 1.8 3.6 791 680 A 86 LYS HBy A 86 LYS H 1.0 1.8 3.6 792 681 A 86 LYS HBx A 86 LYS H 1.0 1.8 3.3 793 682 A 86 LYS H A 87 LEU HD11 1.0 2.3 5.8 794 682 A 86 LYS H A 87 LEU HD21 1.0 2.3 5.8 795 683 A 86 LYS H A 87 LEU H 1.0 1.8 3.5 796 684 A 84 ALA HB1 A 87 LEU H 1.0 2.3 5.5 797 685 A 85 ASP HBy A 87 LEU H 1.0 2.3 5.7 798 686 A 86 LYS HBy A 87 LEU H 1.0 1.8 3.5 799 687 A 86 LYS H A 87 LEU H 1.0 1.8 3.4 800 688 A 87 LEU H A 87 LEU HA 1.0 1.8 3.7 801 689 A 87 LEU H A 87 LEU HD11 1.0 2.3 4.2 802 689 A 87 LEU HD21 A 87 LEU H 1.0 2.3 4.2 803 690 A 87 LEU H A 87 LEU HG 1.0 1.8 3.4 804 691 A 87 LEU H A 87 LEU HBx 1.0 1.8 3.8 805 692 A 86 LYS HA A 87 LEU H 1.0 2.3 4.5 806 693 A 87 LEU H A 88 ASN HBx 1.0 2.3 5.2 807 694 A 84 ALA HA A 88 ASN H 1.0 1.8 4.3 808 695 A 84 ALA HB1 A 88 ASN H 1.0 1.8 5.6 809 696 A 85 ASP HA A 88 ASN H 1.0 2.3 3.9 810 697 A 87 LEU HA A 88 ASN H 1.0 1.8 4.2 811 698 A 87 LEU HBx A 88 ASN H 1.0 1.8 4.2 812 699 A 88 ASN H A 88 ASN HBy 1.0 1.8 3.2 813 700 A 88 ASN H A 88 ASN HBx 1.0 1.8 3.1 814 701 A 88 ASN H A 89 LYS H 1.0 1.8 3.4 815 702 A 91 LEU HD21 A 88 ASN H 1.0 2.3 5.3 816 703 A 86 LYS HA A 89 LYS H 1.0 1.8 4.1 817 704 A 89 LYS H A 88 ASN HBy 1.0 1.8 4.2 818 705 A 89 LYS H A 88 ASN HBx 1.0 1.8 4.4 819 706 A 88 ASN H A 89 LYS H 1.0 1.8 3.4 820 707 A 89 LYS H A 89 LYS HA 1.0 1.8 3.5 821 708 A 89 LYS H A 89 LYS HBy 1.0 1.8 3.2 822 709 A 89 LYS H A 89 LYS HBx 1.0 1.8 3.2 823 710 A 89 LYS H A 89 LYS HGx 1.0 1.8 4.7 824 710 A 89 LYS H A 89 LYS HGy 1.0 1.8 4.7 825 711 A 89 LYS H A 89 LYS HBx 1.0 1.8 6.0 826 712 A 89 LYS H A 90 TYR H 1.0 1.8 4.1 827 713 A 89 LYS H A 91 LEU H 1.0 1.8 5.0 828 714 A 86 LYS HA A 90 TYR H 1.0 1.8 4.8 829 715 A 87 LEU HA A 90 TYR H 1.0 1.8 4.1 830 716 A 89 LYS HBy A 90 TYR H 1.0 1.8 3.8 831 717 A 89 LYS H A 90 TYR H 1.0 1.8 3.9 832 718 A 90 TYR H A 90 TYR HA 1.0 1.8 3.5 833 719 A 90 TYR H A 90 TYR HBx 1.0 1.8 3.7 834 720 A 90 TYR H A 91 LEU H 1.0 1.8 4.1 835 721 A 91 LEU H A 91 LEU HA 1.0 1.8 3.7 836 722 A 91 LEU H A 91 LEU HBy 1.0 1.8 3.2 837 723 A 90 TYR HA A 92 THR H 1.0 1.8 4.9 838 724 A 90 TYR H A 92 THR H 1.0 1.8 6.0 839 725 A 91 LEU HA A 92 THR H 1.0 1.8 3.9 840 726 A 91 LEU HBy A 92 THR H 1.0 1.8 3.8 841 727 A 92 THR H A 91 LEU HD11 1.0 2.3 5.7 842 728 A 92 THR H A 92 THR HA 1.0 1.8 3.5 843 729 A 92 THR H A 92 THR HG21 1.0 1.8 4.3 844 730 A 1 MET HGx A 1 MET HA 1.0 1.8 4.0 845 731 A 1 MET HGx A 1 MET HBx 1.0 1.8 4.2 846 731 A 1 MET HGx A 1 MET HBy 1.0 1.8 4.2 847 732 A 1 MET HA A 1 MET HGy 1.0 1.8 4.0 848 733 A 1 MET HGy A 1 MET HBx 1.0 1.8 3.9 849 733 A 1 MET HBy A 1 MET HGy 1.0 1.8 3.9 850 734 A 2 THR HA A 1 MET HBx 1.0 1.8 5.0 851 734 A 2 THR HA A 1 MET HBy 1.0 1.8 5.0 852 735 A 2 THR HG2% A 2 THR HA 1.0 1.8 4.0 853 736 A 2 THR HA A 3 PRO HDx 1.0 1.8 3.8 854 736 A 2 THR HA A 3 PRO HDy 1.0 1.8 3.8 855 737 A 2 THR HG2% A 2 THR HB 1.0 1.8 4.4 856 738 A 2 THR HB A 3 PRO HDx 1.0 1.8 4.4 857 738 A 3 PRO HDy A 2 THR HB 1.0 1.8 4.4 858 739 A 4 GLU HBx A 4 GLU HGx 1.0 1.8 3.6 859 740 A 4 GLU HGx A 4 GLU HBy 1.0 1.8 3.7 860 741 A 4 GLU HGx A 4 GLU HGy 1.0 1.8 3.0 861 742 A 4 GLU HGx A 4 GLU HA 1.0 1.8 4.1 862 743 A 4 GLU HGx A 93 LEU HD11 1.0 1.8 6.5 863 744 A 4 GLU HGy A 93 LEU HD11 1.0 1.8 6.5 864 745 A 6 ARG HBy A 6 ARG HDx 1.0 1.8 4.8 865 745 A 6 ARG HBx A 6 ARG HDx 1.0 1.8 4.8 866 745 A 6 ARG HDy A 6 ARG HBx 1.0 1.8 4.8 867 745 A 6 ARG HDy A 6 ARG HBy 1.0 1.8 4.8 868 746 A 6 ARG HBy A 10 PRO HDy 1.0 2.3 5.3 869 746 A 6 ARG HBx A 10 PRO HDy 1.0 2.3 5.3 870 746 A 10 PRO HDx A 6 ARG HBx 1.0 2.3 5.3 871 746 A 10 PRO HDx A 6 ARG HBy 1.0 2.3 5.3 872 747 A 6 ARG HA A 6 ARG HDx 1.0 1.8 4.8 873 747 A 6 ARG HA A 6 ARG HDy 1.0 1.8 4.8 874 748 A 7 GLU HA A 7 GLU HBx 1.0 1.8 4.1 875 748 A 7 GLU HBy A 7 GLU HA 1.0 1.8 4.1 876 749 A 8 PHE HA A 8 PHE HBx 1.0 1.8 4.0 877 750 A 8 PHE HA A 8 PHE HBy 1.0 1.8 4.1 878 751 A 8 PHE HA A 8 PHE HD% 1.0 1.8 4.5 879 752 A 8 PHE HBx A 8 PHE HBy 1.0 1.8 4.0 880 753 A 8 PHE HBx A 8 PHE HD% 1.0 1.8 6.0 881 754 A 9 LEU HA A 9 LEU HBx 1.0 1.8 4.3 882 754 A 9 LEU HBy A 9 LEU HA 1.0 1.8 4.3 883 755 A 9 LEU HBy A 9 LEU HDx% 1.0 1.8 3.7 884 755 A 9 LEU HBx A 9 LEU HDx% 1.0 1.8 3.7 885 755 A 9 LEU HDy% A 9 LEU HBx 1.0 1.8 3.7 886 755 A 9 LEU HBy A 9 LEU HDy% 1.0 1.8 3.7 887 756 A 9 LEU HBy A 10 PRO HDx 1.0 1.8 4.4 888 756 A 10 PRO HDx A 9 LEU HBx 1.0 1.8 4.4 889 757 A 9 LEU HBy A 10 PRO HDy 1.0 1.8 4.8 890 757 A 9 LEU HBx A 10 PRO HDy 1.0 1.8 4.8 891 758 A 9 LEU HDy% A 61 LEU HD21 1.0 1.8 3.9 892 758 A 61 LEU HD21 A 9 LEU HDx% 1.0 1.8 3.9 893 759 A 9 LEU HDy% A 90 TYR HDx 1.0 2.0 6.5 894 759 A 90 TYR HDx A 9 LEU HDx% 1.0 2.0 6.5 895 760 A 9 LEU HDy% A 90 TYR HDy 1.0 2.0 6.5 896 760 A 90 TYR HDy A 9 LEU HDx% 1.0 2.0 6.5 897 761 A 10 PRO HA A 10 PRO HBy 1.0 1.8 3.7 898 762 A 10 PRO HA A 13 LEU HDx% 1.0 1.8 4.9 899 762 A 10 PRO HA A 13 LEU HDy% 1.0 1.8 4.9 900 763 A 10 PRO HBy A 10 PRO HDy 1.0 1.8 6.0 901 763 A 10 PRO HDx A 10 PRO HBy 1.0 1.8 6.0 902 764 A 9 LEU HBy A 10 PRO HDy 1.0 1.8 4.3 903 764 A 9 LEU HBx A 10 PRO HDy 1.0 1.8 4.3 904 765 A 10 PRO HA A 10 PRO HDy 1.0 1.8 6.0 905 766 A 10 PRO HBy A 10 PRO HDy 1.0 1.8 6.0 906 767 A 10 PRO HDx A 10 PRO HDy 1.0 1.8 4.1 907 768 A 12 ILE HA A 12 ILE HG2% 1.0 1.8 4.4 908 769 A 12 ILE HA A 12 ILE HB 1.0 1.8 4.2 909 770 A 12 ILE HA A 12 ILE HG1x 1.0 1.8 4.9 910 770 A 12 ILE HA A 12 ILE HG1y 1.0 1.8 4.9 911 771 A 12 ILE HA A 15 GLU HBx 1.0 1.8 4.8 912 771 A 12 ILE HA A 15 GLU HBy 1.0 1.8 4.8 913 772 A 12 ILE HG2% A 12 ILE HB 1.0 1.8 4.1 914 773 A 12 ILE HA A 12 ILE HG2% 1.0 1.8 4.3 915 774 A 12 ILE HG2% A 12 ILE HB 1.0 1.8 3.7 916 775 A 12 ILE HG2% A 12 ILE HG1x 1.0 1.8 4.2 917 775 A 12 ILE HG2% A 12 ILE HG1y 1.0 1.8 4.2 918 776 A 12 ILE HD1% A 61 LEU HD21 1.0 1.8 6.0 919 777 A 12 ILE HD1% A 12 ILE HG1x 1.0 1.8 3.8 920 777 A 12 ILE HD1% A 12 ILE HG1y 1.0 1.8 3.8 921 778 A 12 ILE HD1% A 12 ILE HB 1.0 1.8 3.8 922 779 A 12 ILE HD1% A 13 LEU HA 1.0 1.8 4.8 923 780 A 9 LEU HA A 12 ILE HD1% 1.0 1.8 4.8 924 781 A 12 ILE HD1% A 90 TYR HDx 1.0 1.8 5.8 925 781 A 12 ILE HD1% A 90 TYR HDy 1.0 1.8 5.8 926 782 A 12 ILE HD1% A 90 TYR HE% 1.0 1.8 6.0 927 783 A 13 LEU HA A 13 LEU HDy% 1.0 1.8 4.0 928 783 A 13 LEU HA A 13 LEU HDx% 1.0 1.8 4.0 929 784 A 10 PRO HA A 13 LEU HBx 1.0 1.8 4.3 930 785 A 13 LEU HA A 13 LEU HBx 1.0 1.8 4.4 931 786 A 13 LEU HDx% A 13 LEU HBx 1.0 1.8 4.1 932 786 A 13 LEU HBx A 13 LEU HDy% 1.0 1.8 4.1 933 787 A 13 LEU HA A 13 LEU HBy 1.0 1.8 4.1 934 788 A 13 LEU HA A 13 LEU HDy% 1.0 1.8 4.3 935 789 A 54 LYS HEy A 13 LEU HDy% 1.0 1.8 5.4 936 789 A 13 LEU HDy% A 54 LYS HEx 1.0 1.8 5.4 937 790 A 14 ALA HA A 14 ALA HB% 1.0 1.8 3.5 938 791 A 14 ALA HA A 17 ILE HB 1.0 1.8 4.0 939 792 A 14 ALA HA A 17 ILE HD1% 1.0 1.8 4.3 940 793 A 16 ILE HG2% A 16 ILE HA 1.0 1.8 3.9 941 794 A 16 ILE HA A 20 LEU HBy 1.0 1.8 4.5 942 795 A 16 ILE HB A 16 ILE HD1% 1.0 1.8 3.3 943 796 A 16 ILE HG2% A 16 ILE HA 1.0 1.8 4.1 944 797 A 16 ILE HG2% A 16 ILE HB 1.0 1.8 3.4 945 798 A 16 ILE HG2% A 53 ALA HB% 1.0 1.8 4.2 946 799 A 17 ILE HA A 17 ILE HB 1.0 1.8 4.0 947 800 A 17 ILE HA A 17 ILE HB 1.0 1.8 5.8 948 801 A 14 ALA HA A 17 ILE HB 1.0 1.8 4.3 949 802 A 17 ILE HD1% A 17 ILE HG1x 1.0 1.8 3.5 950 802 A 17 ILE HG1y A 17 ILE HD1% 1.0 1.8 3.5 951 803 A 17 ILE HB A 17 ILE HD1% 1.0 1.8 3.8 952 804 A 17 ILE HA A 17 ILE HD1% 1.0 2.3 4.7 953 805 A 17 ILE HD1% A 50 GLU HGy 1.0 2.3 5.3 954 806 A 17 ILE HD1% A 50 GLU HGx 1.0 1.8 5.9 955 807 A 17 ILE HD1% A 50 GLU HA 1.0 2.3 5.0 956 808 A 14 ALA HA A 17 ILE HG2% 1.0 1.8 5.8 957 809 A 17 ILE HG2% A 17 ILE HG1x 1.0 1.8 3.8 958 809 A 17 ILE HG1y A 17 ILE HG2% 1.0 1.8 3.8 959 810 A 17 ILE HB A 17 ILE HG2% 1.0 1.8 3.4 960 811 A 17 ILE HA A 17 ILE HG2% 1.0 1.8 3.9 961 812 A 17 ILE HG2% A 53 ALA HB% 1.0 1.8 4.2 962 813 A 18 ALA HB% A 18 ALA HA 1.0 1.8 3.4 963 814 A 18 ALA HB% A 19 ASN HA 1.0 1.8 6.0 964 815 A 19 ASN HA A 19 ASN HBx 1.0 1.8 3.9 965 815 A 19 ASN HA A 19 ASN HBy 1.0 1.8 3.9 966 816 A 20 LEU HA A 20 LEU HBy 1.0 1.8 4.1 967 817 A 20 LEU HA A 20 LEU HDx% 1.0 1.8 4.1 968 818 A 20 LEU HA A 20 LEU HDx% 1.0 1.8 3.9 969 819 A 20 LEU HBy A 20 LEU HDx% 1.0 1.8 3.5 970 820 A 25 ILE HD1% A 20 LEU HDx% 1.0 1.8 4.3 971 821 A 80 TYR HD% A 20 LEU HDx% 1.0 1.8 4.9 972 822 A 80 TYR HE% A 20 LEU HDx% 1.0 1.8 4.7 973 823 A 20 LEU HDy% A 25 ILE HD1% 1.0 1.8 4.5 974 824 A 20 LEU HA A 20 LEU HDy% 1.0 1.8 6.0 975 825 A 20 LEU HDy% A 80 TYR HE% 1.0 1.8 6.5 976 826 A 20 LEU HDy% A 80 TYR HD% 1.0 1.8 6.5 977 827 A 21 ASP HA A 21 ASP HBx 1.0 1.8 4.3 978 828 A 21 ASP HA A 21 ASP HBy 1.0 1.8 4.1 979 829 A 21 ASP HA A 22 PRO HDx 1.0 1.8 4.0 980 829 A 21 ASP HA A 22 PRO HDy 1.0 1.8 4.0 981 830 A 21 ASP HA A 21 ASP HBy 1.0 1.8 4.3 982 831 A 21 ASP HBy A 24 LYS HBx 1.0 1.8 5.1 983 831 A 21 ASP HBy A 24 LYS HBy 1.0 1.8 5.1 984 832 A 22 PRO HA A 22 PRO HBx 1.0 1.8 3.8 985 832 A 22 PRO HBy A 22 PRO HA 1.0 1.8 3.8 986 833 A 22 PRO HA A 22 PRO HGx 1.0 1.8 4.8 987 833 A 22 PRO HGy A 22 PRO HA 1.0 1.8 4.8 988 834 A 22 PRO HA A 22 PRO HGx 1.0 1.8 5.0 989 834 A 22 PRO HGy A 22 PRO HA 1.0 1.8 5.0 990 835 A 22 PRO HA A 25 ILE HG2% 1.0 1.8 5.2 991 836 A 25 ILE HD1% A 22 PRO HA 1.0 2.3 5.5 992 837 A 22 PRO HA A 25 ILE HB 1.0 1.8 5.5 993 838 A 23 THR HA A 23 THR HB 1.0 1.8 3.8 994 839 A 23 THR HA A 23 THR HG2% 1.0 1.8 4.3 995 840 A 23 THR HA A 26 LEU HBx 1.0 1.8 4.4 996 841 A 23 THR HA A 26 LEU HDx% 1.0 2.3 4.8 997 841 A 23 THR HA A 26 LEU HDy% 1.0 2.3 4.8 998 842 A 23 THR HA A 23 THR HB 1.0 1.8 3.5 999 843 A 23 THR HB A 23 THR HG2% 1.0 1.8 3.8 1000 844 A 23 THR HA A 23 THR HG2% 1.0 1.8 3.7 1001 845 A 23 THR HB A 23 THR HG2% 1.0 1.8 3.3 1002 846 A 21 ASP HBx A 24 LYS HBx 1.0 1.8 6.0 1003 846 A 21 ASP HBx A 24 LYS HBy 1.0 1.8 6.0 1004 847 A 23 THR HB A 24 LYS HBx 1.0 2.3 5.0 1005 847 A 23 THR HB A 24 LYS HBy 1.0 2.3 5.0 1006 848 A 24 LYS HBx A 24 LYS HDx 1.0 1.8 4.1 1007 848 A 24 LYS HBy A 24 LYS HDx 1.0 1.8 4.1 1008 848 A 24 LYS HDy A 24 LYS HBx 1.0 1.8 4.1 1009 848 A 24 LYS HBy A 24 LYS HDy 1.0 1.8 4.1 1010 849 A 24 LYS HGy A 24 LYS HBx 1.0 1.8 4.3 1011 849 A 24 LYS HBy A 24 LYS HGy 1.0 1.8 4.3 1012 850 A 24 LYS HA A 24 LYS HDx 1.0 1.8 4.5 1013 850 A 24 LYS HA A 24 LYS HDy 1.0 1.8 4.5 1014 851 A 24 LYS HBx A 24 LYS HDx 1.0 1.8 3.7 1015 851 A 24 LYS HBy A 24 LYS HDx 1.0 1.8 3.7 1016 851 A 24 LYS HDy A 24 LYS HBx 1.0 1.8 3.7 1017 851 A 24 LYS HBy A 24 LYS HDy 1.0 1.8 3.7 1018 852 A 24 LYS HDx A 24 LYS HEx 1.0 1.8 3.9 1019 852 A 24 LYS HDy A 24 LYS HEx 1.0 1.8 3.9 1020 852 A 24 LYS HEy A 24 LYS HDx 1.0 1.8 3.9 1021 852 A 24 LYS HDy A 24 LYS HEy 1.0 1.8 3.9 1022 853 A 24 LYS HGy A 24 LYS HDx 1.0 1.8 3.7 1023 853 A 24 LYS HGy A 24 LYS HDy 1.0 1.8 3.7 1024 854 A 24 LYS HGx A 24 LYS HA 1.0 1.8 3.8 1025 855 A 24 LYS HGx A 24 LYS HBx 1.0 1.8 3.8 1026 855 A 24 LYS HBy A 24 LYS HGx 1.0 1.8 3.8 1027 856 A 24 LYS HGx A 24 LYS HEx 1.0 1.8 4.5 1028 856 A 24 LYS HGx A 24 LYS HEy 1.0 1.8 4.5 1029 857 A 24 LYS HGy A 24 LYS HEx 1.0 1.8 4.6 1030 857 A 24 LYS HGy A 24 LYS HEy 1.0 1.8 4.6 1031 858 A 25 ILE HA A 25 ILE HB 1.0 1.8 4.1 1032 859 A 25 ILE HD1% A 25 ILE HA 1.0 1.8 4.9 1033 860 A 25 ILE HA A 25 ILE HG2% 1.0 1.8 4.2 1034 861 A 25 ILE HA A 25 ILE HG1x 1.0 1.8 4.9 1035 861 A 25 ILE HA A 25 ILE HG1y 1.0 1.8 4.9 1036 862 A 25 ILE HA A 28 GLU HBx 1.0 1.8 4.9 1037 862 A 25 ILE HA A 28 GLU HBy 1.0 1.8 4.9 1038 863 A 25 ILE HA A 80 TYR HE% 1.0 1.8 6.2 1039 864 A 25 ILE HA A 25 ILE HB 1.0 1.8 6.0 1040 865 A 25 ILE HD1% A 25 ILE HB 1.0 1.8 4.5 1041 866 A 25 ILE HB A 25 ILE HG2% 1.0 1.8 4.3 1042 867 A 25 ILE HD1% A 22 PRO HA 1.0 2.3 5.6 1043 868 A 25 ILE HD1% A 25 ILE HA 1.0 1.8 5.3 1044 869 A 25 ILE HD1% A 25 ILE HB 1.0 1.8 4.0 1045 870 A 25 ILE HD1% A 25 ILE HG1x 1.0 1.8 3.8 1046 870 A 25 ILE HD1% A 25 ILE HG1y 1.0 1.8 3.8 1047 871 A 25 ILE HD1% A 29 LEU HDx% 1.0 2.3 4.5 1048 871 A 25 ILE HD1% A 29 LEU HDy% 1.0 2.3 4.5 1049 872 A 25 ILE HD1% A 80 TYR HE% 1.0 1.8 6.2 1050 873 A 25 ILE HD1% A 80 TYR HD% 1.0 1.8 6.2 1051 874 A 25 ILE HD1% A 25 ILE HG1x 1.0 1.8 4.0 1052 874 A 25 ILE HD1% A 25 ILE HG1y 1.0 1.8 4.0 1053 875 A 22 PRO HA A 25 ILE HG2% 1.0 1.8 6.0 1054 876 A 25 ILE HG2% A 26 LEU HA 1.0 1.8 6.2 1055 877 A 25 ILE HA A 25 ILE HG2% 1.0 1.8 4.1 1056 878 A 25 ILE HB A 25 ILE HG2% 1.0 1.8 3.8 1057 879 A 25 ILE HG2% A 25 ILE HG1x 1.0 1.8 4.4 1058 879 A 25 ILE HG1y A 25 ILE HG2% 1.0 1.8 4.4 1059 880 A 25 ILE HG2% A 75 LEU HG 1.0 1.8 5.0 1060 881 A 27 GLU HA A 28 GLU HA 1.0 2.3 4.8 1061 882 A 29 LEU HA A 29 LEU HBy 1.0 1.8 3.9 1062 883 A 29 LEU HA A 29 LEU HDx% 1.0 1.8 3.8 1063 883 A 29 LEU HA A 29 LEU HDy% 1.0 1.8 3.8 1064 884 A 30 LEU HA A 30 LEU HDy% 1.0 1.8 3.5 1065 885 A 30 LEU HDy% A 30 LEU HBx 1.0 1.8 3.8 1066 886 A 30 LEU HDy% A 35 LEU HA 1.0 1.8 5.5 1067 887 A 30 LEU HDy% A 36 THR HA 1.0 1.8 5.5 1068 888 A 31 ARG HA A 31 ARG HDx 1.0 1.8 5.0 1069 888 A 31 ARG HA A 31 ARG HDy 1.0 1.8 5.0 1070 889 A 32 ARG HA A 32 ARG HBx 1.0 1.8 4.6 1071 890 A 32 ARG HA A 32 ARG HBy 1.0 1.8 6.0 1072 891 A 74 VAL HG21 A 32 ARG HDx 1.0 1.8 6.0 1073 891 A 32 ARG HDx A 74 VAL HG11 1.0 1.8 6.0 1074 892 A 32 ARG HDy A 74 VAL HG21 1.0 1.8 5.5 1075 892 A 32 ARG HDy A 74 VAL HG11 1.0 1.8 5.5 1076 893 A 34 LEU HA A 34 LEU HDy% 1.0 1.8 3.7 1077 894 A 34 LEU HA A 34 LEU HBx 1.0 1.8 4.0 1078 894 A 34 LEU HA A 34 LEU HBy 1.0 1.8 4.0 1079 895 A 34 LEU HA A 34 LEU HDy% 1.0 1.8 3.6 1080 896 A 34 LEU HBx A 34 LEU HDy% 1.0 1.8 3.4 1081 896 A 34 LEU HBy A 34 LEU HDy% 1.0 1.8 3.4 1082 897 A 35 LEU HA A 35 LEU HBx 1.0 1.8 3.9 1083 898 A 35 LEU HBy A 35 LEU HA 1.0 1.8 3.7 1084 899 A 35 LEU HA A 35 LEU HDy% 1.0 1.8 3.9 1085 899 A 35 LEU HA A 35 LEU HDx% 1.0 1.8 3.9 1086 900 A 35 LEU HA A 35 LEU HG 1.0 1.8 4.3 1087 901 A 35 LEU HBx A 30 LEU HBx 1.0 2.3 4.9 1088 902 A 35 LEU HBx A 35 LEU HDy% 1.0 1.8 4.1 1089 902 A 35 LEU HBx A 35 LEU HDx% 1.0 1.8 4.1 1090 903 A 30 LEU HA A 35 LEU HBy 1.0 1.8 6.0 1091 904 A 35 LEU HBy A 30 LEU HBx 1.0 2.3 5.3 1092 905 A 35 LEU HBy A 35 LEU HA 1.0 1.8 4.4 1093 906 A 35 LEU HBy A 35 LEU HG 1.0 1.8 4.3 1094 907 A 35 LEU HBy A 35 LEU HDy% 1.0 1.8 4.5 1095 907 A 35 LEU HBy A 35 LEU HDx% 1.0 1.8 4.5 1096 908 A 35 LEU HA A 35 LEU HDx% 1.0 1.8 4.2 1097 909 A 35 LEU HBy A 35 LEU HDx% 1.0 1.8 3.7 1098 910 A 59 PHE HE% A 35 LEU HDx% 1.0 1.8 6.2 1099 911 A 59 PHE HD% A 35 LEU HDx% 1.0 1.8 6.0 1100 912 A 30 LEU HG A 35 LEU HDy% 1.0 2.3 5.5 1101 913 A 35 LEU HG A 35 LEU HDy% 1.0 1.8 3.5 1102 914 A 35 LEU HA A 35 LEU HDy% 1.0 1.8 4.4 1103 915 A 35 LEU HDy% A 37 PRO HDy 1.0 2.3 5.5 1104 916 A 59 PHE HD% A 35 LEU HDy% 1.0 1.8 6.0 1105 917 A 36 THR HB A 36 THR HA 1.0 1.8 3.6 1106 918 A 36 THR HG2% A 36 THR HA 1.0 1.8 4.2 1107 919 A 36 THR HA A 37 PRO HDy 1.0 1.8 4.1 1108 919 A 37 PRO HDx A 36 THR HA 1.0 1.8 4.1 1109 920 A 36 THR HA A 40 LEU HBx 1.0 1.8 6.2 1110 921 A 36 THR HG2% A 36 THR HB 1.0 1.8 4.2 1111 922 A 36 THR HB A 37 PRO HDy 1.0 1.8 4.5 1112 922 A 37 PRO HDx A 36 THR HB 1.0 1.8 4.5 1113 923 A 36 THR HG2% A 36 THR HA 1.0 1.8 3.8 1114 924 A 36 THR HG2% A 36 THR HB 1.0 1.8 3.5 1115 925 A 36 THR HG2% A 37 PRO HGx 1.0 1.8 6.0 1116 925 A 36 THR HG2% A 37 PRO HGy 1.0 1.8 6.0 1117 926 A 37 PRO HBx A 37 PRO HA 1.0 1.8 3.6 1118 927 A 37 PRO HBy A 37 PRO HA 1.0 1.8 3.4 1119 928 A 37 PRO HA A 40 LEU HBy 1.0 1.8 4.0 1120 929 A 37 PRO HA A 40 LEU HDx% 1.0 1.8 4.9 1121 929 A 37 PRO HA A 40 LEU HDy% 1.0 1.8 4.9 1122 930 A 37 PRO HDx A 36 THR HA 1.0 1.8 3.9 1123 931 A 37 PRO HDx A 36 THR HB 1.0 2.3 4.3 1124 932 A 37 PRO HDx A 37 PRO HBx 1.0 1.8 4.7 1125 933 A 37 PRO HDx A 37 PRO HGy 1.0 1.8 4.1 1126 933 A 37 PRO HDx A 37 PRO HGx 1.0 1.8 4.1 1127 934 A 30 LEU HDy% A 37 PRO HDy 1.0 2.3 6.2 1128 935 A 36 THR HG2% A 37 PRO HDy 1.0 1.8 5.0 1129 936 A 36 THR HB A 37 PRO HGx 1.0 2.3 5.6 1130 936 A 36 THR HB A 37 PRO HGy 1.0 2.3 5.6 1131 937 A 37 PRO HDy A 37 PRO HGx 1.0 1.8 3.7 1132 937 A 37 PRO HDx A 37 PRO HGx 1.0 1.8 3.7 1133 937 A 37 PRO HGy A 37 PRO HDy 1.0 1.8 3.7 1134 937 A 37 PRO HDx A 37 PRO HGy 1.0 1.8 3.7 1135 938 A 38 ALA HA A 38 ALA HB% 1.0 1.8 3.3 1136 939 A 38 ALA HA A 41 GLN HBx 1.0 1.8 4.0 1137 939 A 38 ALA HA A 41 GLN HBy 1.0 1.8 4.0 1138 940 A 38 ALA HA A 38 ALA HB% 1.0 1.8 3.2 1139 941 A 38 ALA HB% A 39 GLU HA 1.0 2.3 4.8 1140 942 A 39 GLU HA A 59 PHE HD% 1.0 1.8 6.2 1141 943 A 39 GLU HA A 59 PHE HE% 1.0 1.8 4.6 1142 944 A 40 LEU HA A 40 LEU HDx% 1.0 1.8 3.6 1143 944 A 40 LEU HDy% A 40 LEU HA 1.0 1.8 3.6 1144 945 A 41 GLN HA A 41 GLN HBx 1.0 1.8 3.8 1145 945 A 41 GLN HA A 41 GLN HBy 1.0 1.8 3.8 1146 946 A 41 GLN HA A 41 GLN HGx 1.0 1.8 4.3 1147 946 A 41 GLN HA A 41 GLN HGy 1.0 1.8 4.3 1148 947 A 41 GLN HA A 44 LEU HBx 1.0 1.8 3.5 1149 948 A 41 GLN HA A 41 GLN HBx 1.0 1.8 3.7 1150 948 A 41 GLN HA A 41 GLN HBy 1.0 1.8 3.7 1151 949 A 42 GLU HBx A 42 GLU HA 1.0 1.8 3.4 1152 950 A 42 GLU HA A 42 GLU HBy 1.0 1.8 3.2 1153 951 A 42 GLU HA A 42 GLU HGx 1.0 1.8 4.1 1154 951 A 42 GLU HA A 42 GLU HGy 1.0 1.8 4.1 1155 952 A 42 GLU HBx A 42 GLU HA 1.0 1.8 4.0 1156 953 A 42 GLU HBx A 42 GLU HGx 1.0 1.8 4.2 1157 953 A 42 GLU HBx A 42 GLU HGy 1.0 1.8 4.2 1158 954 A 42 GLU HBx A 59 PHE HE% 1.0 1.8 4.9 1159 955 A 42 GLU HA A 42 GLU HBy 1.0 1.8 3.9 1160 956 A 42 GLU HBy A 42 GLU HGx 1.0 1.8 4.3 1161 956 A 42 GLU HGy A 42 GLU HBy 1.0 1.8 4.3 1162 957 A 59 PHE HE% A 42 GLU HBy 1.0 1.8 5.5 1163 958 A 42 GLU HA A 42 GLU HGx 1.0 1.8 4.5 1164 958 A 42 GLU HA A 42 GLU HGy 1.0 1.8 4.5 1165 959 A 42 GLU HBx A 42 GLU HGx 1.0 1.8 3.9 1166 959 A 42 GLU HBx A 42 GLU HGy 1.0 1.8 3.9 1167 960 A 59 PHE HE% A 42 GLU HGx 1.0 1.8 6.0 1168 960 A 42 GLU HGy A 59 PHE HE% 1.0 1.8 6.0 1169 961 A 43 VAL HA A 43 VAL HB 1.0 1.8 4.2 1170 962 A 43 VAL HGx% A 43 VAL HA 1.0 1.8 4.1 1171 963 A 43 VAL HA A 46 LEU HDy% 1.0 1.8 3.9 1172 964 A 43 VAL HGx% A 43 VAL HB 1.0 1.8 4.2 1173 965 A 43 VAL HB A 43 VAL HGy% 1.0 1.8 4.0 1174 966 A 43 VAL HGx% A 40 LEU HA 1.0 1.8 4.0 1175 967 A 43 VAL HGx% A 43 VAL HA 1.0 1.8 3.9 1176 968 A 43 VAL HGx% A 43 VAL HB 1.0 1.8 3.5 1177 969 A 43 VAL HGx% A 59 PHE HD% 1.0 1.8 5.1 1178 970 A 43 VAL HGx% A 59 PHE HE% 1.0 1.8 4.0 1179 971 A 43 VAL HA A 43 VAL HGy% 1.0 1.8 3.9 1180 972 A 43 VAL HB A 43 VAL HGy% 1.0 1.8 3.6 1181 973 A 43 VAL HGy% A 52 GLN HA 1.0 1.8 3.8 1182 974 A 44 LEU HBx A 44 LEU HA 1.0 1.8 3.4 1183 975 A 44 LEU HBy A 44 LEU HA 1.0 1.8 3.5 1184 976 A 44 LEU HA A 44 LEU HDy% 1.0 1.8 4.0 1185 977 A 44 LEU HBy A 44 LEU HDy% 1.0 1.8 3.8 1186 977 A 44 LEU HBy A 44 LEU HDx% 1.0 1.8 3.8 1187 978 A 45 ASP HA A 45 ASP HBx 1.0 1.8 3.6 1188 978 A 45 ASP HBy A 45 ASP HA 1.0 1.8 3.6 1189 979 A 42 GLU HA A 45 ASP HBx 1.0 1.8 4.6 1190 979 A 45 ASP HBy A 42 GLU HA 1.0 1.8 4.6 1191 980 A 45 ASP HA A 45 ASP HBx 1.0 1.8 3.8 1192 980 A 45 ASP HBy A 45 ASP HA 1.0 1.8 3.8 1193 981 A 46 LEU HDx% A 46 LEU HA 1.0 2.3 4.6 1194 982 A 46 LEU HBx A 46 LEU HA 1.0 1.8 4.1 1195 983 A 46 LEU HBy A 46 LEU HA 1.0 1.8 4.4 1196 984 A 46 LEU HA A 47 LYS HA 1.0 1.8 6.0 1197 985 A 43 VAL HA A 46 LEU HDy% 1.0 1.8 4.6 1198 986 A 46 LEU HBy A 46 LEU HDy% 1.0 1.8 4.6 1199 987 A 46 LEU HA A 46 LEU HDy% 1.0 1.8 5.1 1200 988 A 52 GLN HGx A 46 LEU HDy% 1.0 1.8 5.6 1201 989 A 52 GLN HA A 46 LEU HDy% 1.0 1.8 5.3 1202 990 A 59 PHE HE% A 46 LEU HDy% 1.0 1.8 6.2 1203 991 A 48 THR HA A 48 THR HB 1.0 1.8 3.6 1204 992 A 48 THR HA A 48 THR HG2% 1.0 1.8 4.1 1205 993 A 48 THR HA A 49 PRO HDx 1.0 1.8 3.8 1206 993 A 48 THR HA A 49 PRO HDy 1.0 1.8 3.8 1207 994 A 48 THR HA A 48 THR HB 1.0 1.8 3.8 1208 995 A 48 THR HB A 48 THR HG2% 1.0 1.8 4.0 1209 996 A 48 THR HB A 49 PRO HDx 1.0 2.3 4.7 1210 996 A 48 THR HB A 49 PRO HDy 1.0 2.3 4.7 1211 997 A 48 THR HA A 48 THR HG2% 1.0 1.8 3.9 1212 998 A 48 THR HB A 48 THR HG2% 1.0 1.8 3.6 1213 999 A 48 THR HG2% A 49 PRO HDx 1.0 1.8 4.3 1214 999 A 48 THR HG2% A 49 PRO HDy 1.0 1.8 4.3 1215 1000 A 49 PRO HA A 49 PRO HBx 1.0 1.8 3.5 1216 1001 A 49 PRO HA A 49 PRO HBy 1.0 1.8 3.8 1217 1002 A 49 PRO HA A 49 PRO HDx 1.0 1.8 6.0 1218 1002 A 49 PRO HDy A 49 PRO HA 1.0 1.8 6.0 1219 1003 A 49 PRO HA A 52 GLN HBx 1.0 1.8 4.3 1220 1004 A 49 PRO HA A 52 GLN HBy 1.0 1.8 3.8 1221 1005 A 48 THR HB A 49 PRO HBx 1.0 2.3 6.5 1222 1006 A 48 THR HB A 49 PRO HBx 1.0 2.3 6.5 1223 1007 A 49 PRO HA A 49 PRO HBx 1.0 1.8 3.9 1224 1008 A 49 PRO HBx A 49 PRO HBy 1.0 1.8 2.9 1225 1009 A 49 PRO HA A 49 PRO HBy 1.0 1.8 4.3 1226 1010 A 50 GLU HBy A 50 GLU HA 1.0 1.8 3.6 1227 1011 A 50 GLU HGx A 50 GLU HA 1.0 1.8 4.0 1228 1012 A 53 ALA HB% A 50 GLU HA 1.0 1.8 5.1 1229 1013 A 50 GLU HBy A 50 GLU HA 1.0 1.8 3.9 1230 1014 A 50 GLU HGx A 50 GLU HA 1.0 1.8 3.9 1231 1015 A 50 GLU HBy A 50 GLU HGx 1.0 1.8 3.4 1232 1016 A 17 ILE HD1% A 50 GLU HGx 1.0 1.8 5.3 1233 1017 A 50 GLU HGy A 50 GLU HA 1.0 1.8 3.4 1234 1018 A 52 GLN HA A 46 LEU HDy% 1.0 1.8 5.1 1235 1019 A 52 GLN HA A 52 GLN HGx 1.0 1.8 4.0 1236 1020 A 52 GLN HA A 52 GLN HBy 1.0 1.8 3.5 1237 1021 A 53 ALA HB% A 16 ILE HD1% 1.0 2.3 4.3 1238 1022 A 53 ALA HA A 53 ALA HB% 1.0 1.8 3.6 1239 1023 A 54 LYS HEy A 54 LYS HDx 1.0 1.8 4.0 1240 1023 A 54 LYS HDx A 54 LYS HEx 1.0 1.8 4.0 1241 1024 A 54 LYS HDy A 54 LYS HEy 1.0 1.8 4.0 1242 1024 A 54 LYS HDy A 54 LYS HEx 1.0 1.8 4.0 1243 1025 A 54 LYS HGx A 54 LYS HEy 1.0 1.8 4.7 1244 1025 A 54 LYS HGx A 54 LYS HEx 1.0 1.8 4.7 1245 1026 A 54 LYS HA A 54 LYS HGy 1.0 1.8 4.4 1246 1027 A 54 LYS HEx A 54 LYS HGy 1.0 1.8 4.9 1247 1027 A 54 LYS HEy A 54 LYS HGy 1.0 1.8 4.9 1248 1028 A 54 LYS HBx A 54 LYS HGy 1.0 1.8 4.2 1249 1028 A 54 LYS HBy A 54 LYS HGy 1.0 1.8 4.2 1250 1029 A 57 ILE HG2% A 54 LYS HGy 1.0 2.3 5.6 1251 1030 A 43 VAL HGx% A 55 LYS HA 1.0 2.3 5.7 1252 1031 A 55 LYS HA A 58 ASP HBx 1.0 1.8 3.8 1253 1032 A 55 LYS HA A 58 ASP HBy 1.0 1.8 4.7 1254 1033 A 43 VAL HGx% A 55 LYS HBx 1.0 1.8 5.3 1255 1034 A 55 LYS HBx A 46 LEU HDy% 1.0 1.8 4.7 1256 1035 A 55 LYS HA A 55 LYS HBx 1.0 1.8 6.0 1257 1036 A 43 VAL HGx% A 55 LYS HBy 1.0 1.8 5.2 1258 1037 A 55 LYS HBy A 46 LEU HDy% 1.0 1.8 4.4 1259 1038 A 55 LYS HA A 55 LYS HBy 1.0 1.8 6.0 1260 1039 A 55 LYS HDx A 55 LYS HGx 1.0 1.8 4.2 1261 1039 A 55 LYS HDy A 55 LYS HGx 1.0 1.8 4.2 1262 1039 A 55 LYS HGy A 55 LYS HDx 1.0 1.8 4.2 1263 1039 A 55 LYS HDy A 55 LYS HGy 1.0 1.8 4.2 1264 1040 A 55 LYS HEx A 55 LYS HDx 1.0 1.8 4.2 1265 1040 A 55 LYS HEx A 55 LYS HDy 1.0 1.8 4.2 1266 1041 A 55 LYS HEy A 55 LYS HDx 1.0 1.8 4.4 1267 1041 A 55 LYS HDy A 55 LYS HEy 1.0 1.8 4.4 1268 1042 A 55 LYS HA A 55 LYS HDx 1.0 1.8 4.1 1269 1042 A 55 LYS HA A 55 LYS HDy 1.0 1.8 4.1 1270 1043 A 59 PHE HD% A 55 LYS HDx 1.0 1.8 6.2 1271 1043 A 59 PHE HD% A 55 LYS HDy 1.0 1.8 6.2 1272 1044 A 55 LYS HEx A 46 LEU HDy% 1.0 1.8 5.4 1273 1044 A 46 LEU HDx% A 55 LYS HEx 1.0 1.8 5.4 1274 1045 A 55 LYS HEx A 55 LYS HGx 1.0 1.8 5.0 1275 1045 A 55 LYS HEx A 55 LYS HGy 1.0 1.8 5.0 1276 1046 A 55 LYS HEx A 55 LYS HDx 1.0 1.8 4.1 1277 1046 A 55 LYS HEx A 55 LYS HDy 1.0 1.8 4.1 1278 1047 A 55 LYS HA A 55 LYS HEx 1.0 1.8 4.4 1279 1048 A 59 PHE HE% A 55 LYS HEx 1.0 1.8 6.0 1280 1049 A 55 LYS HEy A 46 LEU HDy% 1.0 1.8 4.6 1281 1049 A 46 LEU HDx% A 55 LYS HEy 1.0 1.8 4.6 1282 1050 A 55 LYS HA A 55 LYS HEy 1.0 1.8 5.0 1283 1051 A 56 LEU HA A 56 LEU HBx 1.0 1.8 3.7 1284 1052 A 56 LEU HA A 56 LEU HBy 1.0 1.8 3.5 1285 1053 A 56 LEU HA A 56 LEU HDx% 1.0 1.8 3.8 1286 1054 A 56 LEU HA A 59 PHE HBx 1.0 1.8 6.0 1287 1054 A 56 LEU HA A 59 PHE HBy 1.0 1.8 6.0 1288 1055 A 56 LEU HA A 59 PHE HD% 1.0 1.8 4.9 1289 1056 A 57 ILE HA A 57 ILE HD1% 1.0 2.3 4.9 1290 1057 A 57 ILE HA A 57 ILE HG1x 1.0 1.8 5.0 1291 1057 A 57 ILE HA A 57 ILE HG1y 1.0 1.8 5.0 1292 1058 A 57 ILE HA A 57 ILE HG2% 1.0 1.8 4.1 1293 1059 A 54 LYS HA A 57 ILE HB 1.0 1.8 4.5 1294 1060 A 57 ILE HB A 57 ILE HD1% 1.0 1.8 5.0 1295 1061 A 57 ILE HB A 57 ILE HG2% 1.0 1.8 4.0 1296 1062 A 57 ILE HA A 57 ILE HB 1.0 1.8 6.0 1297 1063 A 13 LEU HA A 57 ILE HD1% 1.0 1.8 4.8 1298 1064 A 57 ILE HA A 57 ILE HD1% 1.0 2.3 5.1 1299 1065 A 57 ILE HD1% A 57 ILE HG1x 1.0 1.8 3.7 1300 1065 A 57 ILE HD1% A 57 ILE HG1y 1.0 1.8 3.7 1301 1066 A 57 ILE HG2% A 57 ILE HG1x 1.0 1.8 4.0 1302 1067 A 57 ILE HB A 57 ILE HG2% 1.0 1.8 3.7 1303 1068 A 57 ILE HA A 57 ILE HG2% 1.0 1.8 4.2 1304 1069 A 57 ILE HG2% A 58 ASP HA 1.0 1.8 6.0 1305 1070 A 57 ILE HG2% A 61 LEU HD21 1.0 2.3 4.5 1306 1071 A 57 ILE HG2% A 58 ASP HA 1.0 1.8 5.1 1307 1072 A 58 ASP HBx A 58 ASP HA 1.0 1.8 3.7 1308 1073 A 58 ASP HA A 58 ASP HBy 1.0 1.8 3.6 1309 1074 A 58 ASP HA A 61 LEU HD21 1.0 1.8 6.0 1310 1075 A 58 ASP HBx A 58 ASP HA 1.0 1.8 3.8 1311 1076 A 59 PHE HA A 59 PHE HBx 1.0 1.8 4.5 1312 1076 A 59 PHE HBy A 59 PHE HA 1.0 1.8 4.5 1313 1077 A 59 PHE HA A 59 PHE HD% 1.0 1.8 4.1 1314 1078 A 59 PHE HE% A 59 PHE HA 1.0 1.8 6.0 1315 1079 A 59 PHE HA A 62 LYS HBx 1.0 1.8 6.0 1316 1079 A 59 PHE HA A 62 LYS HBy 1.0 1.8 6.0 1317 1080 A 60 ILE HA A 63 LEU HD11 1.0 1.8 3.8 1318 1080 A 60 ILE HA A 63 LEU HD21 1.0 1.8 3.8 1319 1081 A 60 ILE HA A 60 ILE HG2% 1.0 1.8 4.0 1320 1082 A 60 ILE HB A 60 ILE HG2% 1.0 1.8 3.5 1321 1083 A 68 VAL HA A 60 ILE HG2% 1.0 1.8 4.5 1322 1084 A 68 VAL HG11 A 60 ILE HG2% 1.0 1.8 4.1 1323 1085 A 71 ARG HDx A 60 ILE HG2% 1.0 1.8 5.0 1324 1086 A 60 ILE HG2% A 71 ARG HDy 1.0 1.8 5.1 1325 1086 A 71 ARG HDx A 60 ILE HG2% 1.0 1.8 5.1 1326 1087 A 9 LEU HDy% A 61 LEU HA 1.0 2.0 5.8 1327 1087 A 61 LEU HA A 9 LEU HDx% 1.0 2.0 5.8 1328 1088 A 61 LEU HBy A 61 LEU HA 1.0 1.8 3.7 1329 1089 A 61 LEU HBx A 61 LEU HA 1.0 1.8 3.7 1330 1090 A 61 LEU HD11 A 61 LEU HA 1.0 1.8 4.0 1331 1091 A 61 LEU HD21 A 61 LEU HA 1.0 1.8 6.0 1332 1092 A 61 LEU HBy A 61 LEU HD11 1.0 1.8 5.1 1333 1093 A 61 LEU HBx A 61 LEU HA 1.0 1.8 4.1 1334 1094 A 61 LEU HD11 A 61 LEU HA 1.0 1.8 3.8 1335 1095 A 61 LEU HBx A 61 LEU HD11 1.0 1.8 4.3 1336 1096 A 61 LEU HD11 A 61 LEU HD21 1.0 1.8 3.7 1337 1097 A 61 LEU HD11 A 90 TYR HDx 1.0 2.0 6.5 1338 1097 A 61 LEU HD11 A 90 TYR HDy 1.0 2.0 6.5 1339 1098 A 60 ILE HD1% A 61 LEU HD11 1.0 1.8 3.9 1340 1099 A 61 LEU HD11 A 87 LEU HBx 1.0 1.8 5.0 1341 1100 A 61 LEU HD21 A 61 LEU HA 1.0 1.8 6.0 1342 1101 A 61 LEU HBy A 61 LEU HD21 1.0 1.8 4.1 1343 1102 A 61 LEU HBx A 61 LEU HD21 1.0 1.8 4.5 1344 1103 A 62 LYS HA A 62 LYS HBx 1.0 1.8 3.7 1345 1103 A 62 LYS HA A 62 LYS HBy 1.0 1.8 3.7 1346 1104 A 62 LYS HA A 62 LYS HBx 1.0 1.8 4.4 1347 1104 A 62 LYS HA A 62 LYS HBy 1.0 1.8 4.4 1348 1105 A 63 LEU HA A 63 LEU HBy 1.0 1.8 3.9 1349 1106 A 63 LEU HA A 63 LEU HBx 1.0 1.8 3.7 1350 1107 A 63 LEU HA A 63 LEU HD11 1.0 1.8 4.0 1351 1107 A 63 LEU HA A 63 LEU HD21 1.0 1.8 4.0 1352 1108 A 63 LEU HA A 68 VAL HG11 1.0 2.3 6.2 1353 1109 A 63 LEU HA A 63 LEU HD11 1.0 1.8 3.4 1354 1109 A 63 LEU HA A 63 LEU HD21 1.0 1.8 3.4 1355 1110 A 67 ASP HBy A 63 LEU HD11 1.0 1.8 4.4 1356 1110 A 63 LEU HD21 A 67 ASP HBy 1.0 1.8 4.4 1357 1111 A 67 ASP HBx A 63 LEU HD11 1.0 1.8 4.5 1358 1111 A 63 LEU HD21 A 67 ASP HBx 1.0 1.8 4.5 1359 1112 A 65 PRO HBx A 65 PRO HA 1.0 1.8 3.6 1360 1113 A 65 PRO HA A 68 VAL HG11 1.0 1.8 4.7 1361 1114 A 65 PRO HA A 91 LEU HD11 1.0 1.8 4.5 1362 1115 A 66 ALA HA A 69 GLN HBx 1.0 1.8 4.1 1363 1115 A 66 ALA HA A 69 GLN HBy 1.0 1.8 4.1 1364 1116 A 67 ASP HBx A 67 ASP HA 1.0 1.8 3.8 1365 1117 A 67 ASP HA A 70 ALA HB1 1.0 1.8 4.4 1366 1118 A 67 ASP HBy A 67 ASP HA 1.0 1.8 4.1 1367 1119 A 68 VAL HA A 68 VAL HB 1.0 1.8 4.5 1368 1120 A 68 VAL HA A 68 VAL HG11 1.0 1.8 4.3 1369 1121 A 68 VAL HG21 A 68 VAL HA 1.0 1.8 4.1 1370 1122 A 68 VAL HA A 71 ARG HGx 1.0 1.8 5.6 1371 1122 A 68 VAL HA A 71 ARG HGy 1.0 1.8 5.6 1372 1123 A 68 VAL HA A 71 ARG HBy 1.0 1.8 6.0 1373 1124 A 68 VAL HA A 71 ARG HDy 1.0 1.8 6.0 1374 1125 A 68 VAL HA A 71 ARG HDx 1.0 1.8 6.0 1375 1126 A 68 VAL HB A 68 VAL HG11 1.0 1.8 4.4 1376 1127 A 68 VAL HG21 A 68 VAL HB 1.0 1.8 4.3 1377 1128 A 61 LEU HD11 A 68 VAL HG11 1.0 2.3 5.0 1378 1129 A 65 PRO HA A 68 VAL HG11 1.0 1.8 4.5 1379 1130 A 68 VAL HA A 68 VAL HG11 1.0 1.8 4.1 1380 1131 A 68 VAL HB A 68 VAL HG11 1.0 1.8 3.8 1381 1132 A 68 VAL HG21 A 68 VAL HG11 1.0 1.8 3.5 1382 1133 A 61 LEU HA A 68 VAL HG21 1.0 1.8 5.5 1383 1134 A 61 LEU HD11 A 68 VAL HG21 1.0 2.3 5.3 1384 1135 A 68 VAL HG21 A 68 VAL HA 1.0 1.8 4.0 1385 1136 A 68 VAL HG21 A 68 VAL HB 1.0 1.8 3.8 1386 1137 A 68 VAL HG21 A 68 VAL HG11 1.0 1.8 3.2 1387 1138 A 69 GLN HA A 69 GLN HGx 1.0 1.8 4.5 1388 1138 A 69 GLN HA A 69 GLN HGy 1.0 1.8 4.5 1389 1139 A 70 ALA HA A 70 ALA HB1 1.0 1.8 3.5 1390 1140 A 70 ALA HA A 73 ASN HBx 1.0 1.8 4.0 1391 1140 A 70 ALA HA A 73 ASN HBy 1.0 1.8 4.0 1392 1141 A 70 ALA HB1 A 34 LEU HDy% 1.0 1.8 4.5 1393 1142 A 67 ASP HA A 70 ALA HB1 1.0 1.8 4.5 1394 1143 A 67 ASP HBy A 70 ALA HB1 1.0 1.8 6.2 1395 1144 A 70 ALA HA A 70 ALA HB1 1.0 1.8 3.3 1396 1145 A 71 ARG HA A 70 ALA HB1 1.0 1.8 4.9 1397 1146 A 70 ALA HB1 A 73 ASN HBx 1.0 1.8 5.5 1398 1146 A 73 ASN HBy A 70 ALA HB1 1.0 1.8 5.5 1399 1147 A 71 ARG HA A 71 ARG HGx 1.0 1.8 4.3 1400 1147 A 71 ARG HA A 71 ARG HGy 1.0 1.8 4.3 1401 1148 A 71 ARG HA A 74 VAL HG11 1.0 1.8 5.3 1402 1148 A 71 ARG HA A 74 VAL HG21 1.0 1.8 5.3 1403 1149 A 68 VAL HA A 71 ARG HDy 1.0 1.8 6.0 1404 1150 A 68 VAL HA A 71 ARG HDx 1.0 1.8 6.0 1405 1151 A 72 ILE HA A 72 ILE HB 1.0 1.8 4.2 1406 1152 A 72 ILE HA A 72 ILE HG21 1.0 1.8 4.3 1407 1153 A 72 ILE HA A 75 LEU HD21 1.0 1.8 4.5 1408 1154 A 72 ILE HA A 84 ALA HB1 1.0 1.8 5.1 1409 1155 A 72 ILE HA A 87 LEU HG 1.0 2.3 5.7 1410 1156 A 69 GLN HA A 72 ILE HB 1.0 2.3 4.5 1411 1157 A 72 ILE HD11 A 72 ILE HB 1.0 1.8 4.6 1412 1158 A 72 ILE HB A 72 ILE HG21 1.0 1.8 4.3 1413 1159 A 69 GLN HA A 72 ILE HD11 1.0 1.8 4.0 1414 1160 A 72 ILE HD11 A 72 ILE HA 1.0 2.3 5.2 1415 1161 A 72 ILE HD11 A 72 ILE HB 1.0 1.8 3.8 1416 1162 A 72 ILE HD11 A 88 ASN HA 1.0 1.8 4.3 1417 1163 A 72 ILE HD11 A 88 ASN HBy 1.0 1.8 6.0 1418 1164 A 72 ILE HD11 A 88 ASN HBx 1.0 1.8 4.8 1419 1165 A 72 ILE HA A 72 ILE HG21 1.0 1.8 4.0 1420 1166 A 72 ILE HB A 72 ILE HG21 1.0 1.8 3.6 1421 1167 A 72 ILE HD11 A 72 ILE HG21 1.0 1.8 3.4 1422 1168 A 72 ILE HG21 A 73 ASN HA 1.0 1.8 4.7 1423 1169 A 72 ILE HG21 A 84 ALA HA 1.0 1.8 4.0 1424 1170 A 72 ILE HG21 A 84 ALA HB1 1.0 2.3 4.1 1425 1171 A 72 ILE HG21 A 87 LEU HG 1.0 2.3 5.0 1426 1172 A 72 ILE HG21 A 88 ASN HBy 1.0 1.8 6.0 1427 1173 A 72 ILE HG21 A 88 ASN HBx 1.0 1.8 4.8 1428 1174 A 72 ILE HB A 73 ASN HA 1.0 1.8 6.0 1429 1175 A 72 ILE HG21 A 73 ASN HA 1.0 1.8 4.8 1430 1176 A 73 ASN HA A 73 ASN HBx 1.0 1.8 3.7 1431 1176 A 73 ASN HBy A 73 ASN HA 1.0 1.8 3.7 1432 1177 A 73 ASN HA A 76 ARG HBx 1.0 1.8 4.4 1433 1177 A 73 ASN HA A 76 ARG HBy 1.0 1.8 4.4 1434 1178 A 73 ASN HA A 76 ARG HGx 1.0 1.8 5.1 1435 1179 A 70 ALA HA A 73 ASN HBx 1.0 1.8 4.7 1436 1179 A 70 ALA HA A 73 ASN HBy 1.0 1.8 4.7 1437 1180 A 73 ASN HA A 73 ASN HBx 1.0 1.8 4.1 1438 1180 A 73 ASN HBy A 73 ASN HA 1.0 1.8 4.1 1439 1181 A 74 VAL HA A 74 VAL HB 1.0 1.8 4.0 1440 1182 A 74 VAL HA A 74 VAL HG11 1.0 1.8 3.9 1441 1183 A 74 VAL HA A 74 VAL HG21 1.0 1.8 4.1 1442 1184 A 74 VAL HA A 77 ALA HB1 1.0 1.8 4.2 1443 1185 A 74 VAL HA A 74 VAL HB 1.0 1.8 4.0 1444 1186 A 74 VAL HB A 74 VAL HG11 1.0 1.8 4.3 1445 1186 A 74 VAL HB A 74 VAL HG21 1.0 1.8 4.3 1446 1187 A 74 VAL HB A 74 VAL HG21 1.0 1.8 4.2 1447 1188 A 80 TYR HD% A 74 VAL HG11 1.0 1.8 6.0 1448 1188 A 74 VAL HG21 A 80 TYR HD% 1.0 1.8 6.0 1449 1189 A 24 LYS HEx A 74 VAL HG11 1.0 2.3 6.0 1450 1189 A 24 LYS HEy A 74 VAL HG11 1.0 2.3 6.0 1451 1189 A 74 VAL HG21 A 24 LYS HEx 1.0 2.3 6.0 1452 1189 A 74 VAL HG21 A 24 LYS HEy 1.0 2.3 6.0 1453 1190 A 74 VAL HA A 74 VAL HG11 1.0 1.8 3.5 1454 1191 A 74 VAL HB A 74 VAL HG11 1.0 1.8 3.5 1455 1192 A 74 VAL HB A 74 VAL HG21 1.0 1.8 3.5 1456 1193 A 74 VAL HG21 A 80 TYR HD% 1.0 1.8 6.0 1457 1194 A 75 LEU HD11 A 75 LEU HA 1.0 1.8 3.5 1458 1195 A 80 TYR HD% A 75 LEU HA 1.0 1.8 4.8 1459 1196 A 75 LEU HA A 75 LEU HBy 1.0 1.8 6.0 1460 1197 A 75 LEU HBx A 75 LEU HBy 1.0 1.8 4.0 1461 1198 A 75 LEU HD11 A 75 LEU HBy 1.0 1.8 4.6 1462 1198 A 75 LEU HBy A 75 LEU HD21 1.0 1.8 4.6 1463 1199 A 75 LEU HD11 A 80 TYR HD% 1.0 1.8 4.6 1464 1200 A 75 LEU HD11 A 80 TYR HE% 1.0 1.8 6.0 1465 1201 A 75 LEU HD11 A 80 TYR HA 1.0 1.8 6.0 1466 1202 A 72 ILE HA A 75 LEU HD21 1.0 1.8 4.9 1467 1203 A 75 LEU HA A 75 LEU HD21 1.0 1.8 6.0 1468 1204 A 75 LEU HBy A 75 LEU HD21 1.0 1.8 4.1 1469 1205 A 75 LEU HG A 75 LEU HD21 1.0 1.8 3.9 1470 1206 A 80 TYR HBx A 75 LEU HD21 1.0 1.8 6.0 1471 1207 A 84 ALA HA A 75 LEU HD21 1.0 1.8 4.9 1472 1208 A 84 ALA HB1 A 75 LEU HD21 1.0 1.8 4.1 1473 1209 A 76 ARG HA A 75 LEU HBy 1.0 1.8 6.0 1474 1210 A 76 ARG HA A 76 ARG HBx 1.0 1.8 4.0 1475 1210 A 76 ARG HA A 76 ARG HBy 1.0 1.8 4.0 1476 1211 A 76 ARG HA A 76 ARG HGy 1.0 1.8 3.9 1477 1212 A 76 ARG HA A 76 ARG HGx 1.0 1.8 3.6 1478 1213 A 76 ARG HA A 81 GLN HA 1.0 2.3 4.4 1479 1214 A 76 ARG HA A 81 GLN HGx 1.0 1.8 6.0 1480 1214 A 76 ARG HA A 81 GLN HGy 1.0 1.8 6.0 1481 1215 A 76 ARG HDy A 76 ARG HBx 1.0 1.8 4.3 1482 1215 A 76 ARG HBy A 76 ARG HDy 1.0 1.8 4.3 1483 1216 A 76 ARG HDx A 76 ARG HDy 1.0 1.8 3.5 1484 1217 A 76 ARG HGy A 76 ARG HDy 1.0 1.8 3.9 1485 1218 A 76 ARG HDy A 76 ARG HGx 1.0 1.8 3.7 1486 1219 A 76 ARG HA A 76 ARG HGy 1.0 1.8 6.0 1487 1220 A 76 ARG HGy A 76 ARG HDy 1.0 1.8 4.6 1488 1221 A 76 ARG HA A 76 ARG HGx 1.0 1.8 6.0 1489 1222 A 76 ARG HDy A 76 ARG HGx 1.0 1.8 4.5 1490 1223 A 76 ARG HDx A 76 ARG HGx 1.0 1.8 5.1 1491 1224 A 81 GLN HA A 76 ARG HGx 1.0 1.8 6.0 1492 1225 A 77 ALA HA A 77 ALA HB1 1.0 1.8 3.4 1493 1226 A 78 HIS HBy A 78 HIS HBx 1.0 1.8 3.7 1494 1227 A 78 HIS HBy A 80 TYR HD% 1.0 1.8 6.0 1495 1228 A 78 HIS HBy A 78 HIS HBx 1.0 1.8 3.7 1496 1229 A 78 HIS HBx A 80 TYR HD% 1.0 1.8 6.0 1497 1230 A 79 GLY HAx A 79 GLY HAy 1.0 1.8 3.5 1498 1231 A 80 TYR HA A 80 TYR HBy 1.0 1.8 4.0 1499 1232 A 80 TYR HA A 80 TYR HBx 1.0 1.8 4.2 1500 1233 A 80 TYR HD% A 80 TYR HA 1.0 1.8 4.5 1501 1234 A 80 TYR HE% A 80 TYR HA 1.0 1.8 6.0 1502 1235 A 75 LEU HD11 A 80 TYR HBy 1.0 1.8 6.0 1503 1236 A 80 TYR HA A 80 TYR HBy 1.0 1.8 6.0 1504 1237 A 80 TYR HD% A 80 TYR HBy 1.0 1.8 6.0 1505 1238 A 80 TYR HD% A 80 TYR HBx 1.0 1.8 6.0 1506 1239 A 80 TYR HBy A 80 TYR HBx 1.0 1.8 4.3 1507 1240 A 75 LEU HD11 A 80 TYR HBx 1.0 1.8 6.0 1508 1241 A 76 ARG HA A 81 GLN HA 1.0 2.3 5.0 1509 1242 A 81 GLN HA A 81 GLN HBx 1.0 1.8 3.7 1510 1242 A 81 GLN HBy A 81 GLN HA 1.0 1.8 3.7 1511 1243 A 81 GLN HA A 81 GLN HGx 1.0 1.8 4.5 1512 1243 A 81 GLN HA A 81 GLN HGy 1.0 1.8 4.5 1513 1244 A 81 GLN HA A 84 ALA HB1 1.0 1.8 4.0 1514 1245 A 76 ARG HA A 81 GLN HGx 1.0 1.8 4.8 1515 1245 A 76 ARG HA A 81 GLN HGy 1.0 1.8 4.8 1516 1246 A 81 GLN HA A 81 GLN HGx 1.0 1.8 3.9 1517 1246 A 81 GLN HA A 81 GLN HGy 1.0 1.8 3.9 1518 1247 A 81 GLN HBx A 81 GLN HGx 1.0 1.8 3.0 1519 1247 A 81 GLN HBy A 81 GLN HGx 1.0 1.8 3.0 1520 1247 A 81 GLN HGy A 81 GLN HBx 1.0 1.8 3.0 1521 1247 A 81 GLN HBy A 81 GLN HGy 1.0 1.8 3.0 1522 1248 A 81 GLN HA A 81 GLN HGx 1.0 1.8 5.0 1523 1248 A 81 GLN HA A 81 GLN HGy 1.0 1.8 5.0 1524 1249 A 81 GLN HBx A 81 GLN HGx 1.0 1.8 3.4 1525 1249 A 81 GLN HBy A 81 GLN HGx 1.0 1.8 3.4 1526 1249 A 81 GLN HGy A 81 GLN HBx 1.0 1.8 3.4 1527 1249 A 81 GLN HBy A 81 GLN HGy 1.0 1.8 3.4 1528 1250 A 84 ALA HB1 A 81 GLN HGx 1.0 2.3 5.1 1529 1250 A 81 GLN HGy A 84 ALA HB1 1.0 2.3 5.1 1530 1251 A 82 ALA HA A 82 ALA HB1 1.0 1.8 3.5 1531 1252 A 82 ALA HA A 85 ASP HBx 1.0 1.8 4.3 1532 1253 A 82 ALA HA A 82 ALA HB1 1.0 1.8 3.4 1533 1254 A 83 LEU HBx A 83 LEU HA 1.0 1.8 3.9 1534 1255 A 72 ILE HG21 A 84 ALA HA 1.0 1.8 4.3 1535 1256 A 84 ALA HA A 75 LEU HD21 1.0 1.8 4.1 1536 1256 A 75 LEU HD11 A 84 ALA HA 1.0 1.8 4.1 1537 1257 A 84 ALA HA A 76 ARG HDy 1.0 2.3 6.5 1538 1258 A 84 ALA HA A 84 ALA HB1 1.0 1.8 3.8 1539 1259 A 84 ALA HA A 87 LEU HBx 1.0 1.8 5.5 1540 1260 A 72 ILE HG21 A 84 ALA HB1 1.0 2.3 4.1 1541 1261 A 72 ILE HA A 84 ALA HB1 1.0 1.8 4.5 1542 1262 A 72 ILE HA A 84 ALA HB1 1.0 1.8 4.5 1543 1263 A 84 ALA HB1 A 88 ASN HBy 1.0 1.8 6.0 1544 1263 A 84 ALA HB1 A 88 ASN HBx 1.0 1.8 6.0 1545 1264 A 84 ALA HB1 A 75 LEU HBy 1.0 1.8 4.0 1546 1265 A 84 ALA HB1 A 75 LEU HD21 1.0 1.8 4.0 1547 1266 A 76 ARG HA A 84 ALA HB1 1.0 1.8 4.4 1548 1267 A 76 ARG HDx A 84 ALA HB1 1.0 1.8 4.9 1549 1268 A 80 TYR HBx A 84 ALA HB1 1.0 1.8 5.6 1550 1269 A 81 GLN HA A 84 ALA HB1 1.0 1.8 4.0 1551 1270 A 84 ALA HB1 A 81 GLN HGx 1.0 1.8 6.0 1552 1270 A 81 GLN HGy A 84 ALA HB1 1.0 1.8 6.0 1553 1271 A 84 ALA HA A 84 ALA HB1 1.0 1.8 3.6 1554 1272 A 84 ALA HB1 A 85 ASP HA 1.0 1.8 5.4 1555 1273 A 85 ASP HA A 88 ASN HBy 1.0 1.8 3.7 1556 1274 A 82 ALA HA A 85 ASP HBy 1.0 1.8 4.8 1557 1275 A 85 ASP HBy A 85 ASP HA 1.0 1.8 4.0 1558 1276 A 82 ALA HA A 85 ASP HBx 1.0 1.8 4.9 1559 1277 A 85 ASP HA A 85 ASP HBx 1.0 1.8 4.5 1560 1278 A 86 LYS HBx A 86 LYS HA 1.0 1.8 3.7 1561 1279 A 86 LYS HA A 86 LYS HDx 1.0 1.8 4.6 1562 1279 A 86 LYS HA A 86 LYS HDy 1.0 1.8 4.6 1563 1280 A 87 LEU HA A 87 LEU HBx 1.0 1.8 4.1 1564 1281 A 84 ALA HA A 87 LEU HD11 1.0 1.8 5.4 1565 1281 A 84 ALA HA A 87 LEU HD21 1.0 1.8 5.4 1566 1282 A 87 LEU HA A 87 LEU HD11 1.0 1.8 6.0 1567 1282 A 87 LEU HD21 A 87 LEU HA 1.0 1.8 6.0 1568 1283 A 87 LEU HG A 87 LEU HD11 1.0 1.8 4.5 1569 1283 A 87 LEU HD21 A 87 LEU HG 1.0 1.8 4.5 1570 1284 A 87 LEU HBx A 87 LEU HD11 1.0 1.8 4.9 1571 1284 A 87 LEU HD21 A 87 LEU HBx 1.0 1.8 4.9 1572 1285 A 72 ILE HD11 A 88 ASN HA 1.0 1.8 4.2 1573 1286 A 72 ILE HG21 A 88 ASN HA 1.0 1.8 4.7 1574 1287 A 91 LEU HBy A 88 ASN HA 1.0 1.8 4.5 1575 1288 A 88 ASN HA A 91 LEU HBx 1.0 1.8 5.0 1576 1289 A 72 ILE HG21 A 88 ASN HBy 1.0 1.8 5.5 1577 1290 A 72 ILE HD11 A 88 ASN HBy 1.0 1.8 5.4 1578 1291 A 88 ASN HA A 88 ASN HBy 1.0 1.8 3.3 1579 1292 A 72 ILE HG21 A 88 ASN HBx 1.0 1.8 4.8 1580 1293 A 72 ILE HG1y A 88 ASN HBx 1.0 1.8 5.0 1581 1293 A 88 ASN HBx A 72 ILE HG1x 1.0 1.8 5.0 1582 1294 A 88 ASN HA A 88 ASN HBx 1.0 1.8 3.3 1583 1295 A 91 LEU HD21 A 89 LYS HA 1.0 2.3 5.4 1584 1296 A 89 LYS HA A 92 THR HB 1.0 1.8 4.1 1585 1297 A 93 LEU HD11 A 89 LYS HEy 1.0 2.3 5.5 1586 1298 A 89 LYS HEx A 89 LYS HGx 1.0 1.8 4.9 1587 1298 A 89 LYS HGy A 89 LYS HEx 1.0 1.8 4.9 1588 1299 A 89 LYS HEx A 89 LYS HDx 1.0 1.8 4.0 1589 1299 A 89 LYS HEx A 89 LYS HDy 1.0 1.8 4.0 1590 1300 A 90 TYR HBx A 90 TYR HBy 1.0 1.8 6.0 1591 1301 A 90 TYR HDx A 90 TYR HBy 1.0 1.8 6.0 1592 1301 A 90 TYR HDy A 90 TYR HBy 1.0 1.8 6.0 1593 1302 A 87 LEU HA A 90 TYR HBx 1.0 1.8 6.0 1594 1303 A 90 TYR HBx A 90 TYR HBy 1.0 1.8 4.4 1595 1304 A 90 TYR HBx A 90 TYR HDx 1.0 1.8 6.0 1596 1304 A 90 TYR HBx A 90 TYR HDy 1.0 1.8 6.0 1597 1305 A 90 TYR HBx A 90 TYR HE% 1.0 1.8 6.0 1598 1306 A 91 LEU HA A 90 TYR HDx 1.0 2.3 6.5 1599 1306 A 91 LEU HA A 90 TYR HDy 1.0 2.3 6.5 1600 1307 A 91 LEU HA A 91 LEU HBy 1.0 1.8 3.6 1601 1308 A 91 LEU HA A 91 LEU HBx 1.0 1.8 3.8 1602 1309 A 91 LEU HA A 91 LEU HD11 1.0 1.8 3.7 1603 1310 A 91 LEU HD21 A 88 ASN HA 1.0 1.8 4.5 1604 1311 A 91 LEU HD21 A 91 LEU HA 1.0 1.8 5.1 1605 1312 A 91 LEU HD21 A 91 LEU HBy 1.0 1.8 4.1 1606 1313 A 91 LEU HD21 A 91 LEU HBx 1.0 1.8 3.6 1607 1314 A 92 THR HA A 92 THR HG21 1.0 1.8 3.8 1608 1315 A 89 LYS HA A 92 THR HB 1.0 1.8 6.0 1609 1316 A 92 THR HG21 A 92 THR HB 1.0 1.8 4.0 1610 1317 A 92 THR HA A 92 THR HG21 1.0 1.8 3.6 1611 1318 A 92 THR HG21 A 92 THR HB 1.0 1.8 3.4 1612 1319 A 93 LEU HA A 93 LEU HBy 1.0 1.8 3.7 1613 1320 A 93 LEU HA A 93 LEU HBx 1.0 1.8 4.0 1614 1321 A 93 LEU HD11 A 93 LEU HA 1.0 1.8 3.8 1615 1322 A 93 LEU HBy A 93 LEU HD21 1.0 1.8 4.9 1616 1323 A 93 LEU HD11 A 89 LYS HEy 1.0 1.8 6.0 1617 1324 A 93 LEU HD11 A 89 LYS HEx 1.0 1.8 5.5 1618 1325 A 90 TYR HA A 93 LEU HD11 1.0 1.8 6.0 1619 1326 A 93 LEU HD11 A 93 LEU HA 1.0 1.8 3.7 1620 1327 A 93 LEU HD11 A 93 LEU HBy 1.0 1.8 3.6 1621 1328 A 93 LEU HD11 A 93 LEU HBx 1.0 1.8 4.3 1622 1329 A 8 PHE HBx A 93 LEU HD21 1.0 2.3 6.5 1623 1330 A 8 PHE HBy A 93 LEU HD21 1.0 2.3 6.5 1624 1331 A 90 TYR HA A 93 LEU HD21 1.0 1.8 5.0 1625 1332 A 93 LEU HA A 93 LEU HD21 1.0 1.8 6.0 1626 1333 A 93 LEU HBy A 93 LEU HD21 1.0 1.8 3.8 1627 1334 A 93 LEU HBx A 93 LEU HD21 1.0 1.8 4.6 1628 1335 A 92 THR HG21 A 94 GLU HA 1.0 2.3 5.0 1629 1336 A 94 GLU HA A 94 GLU HBx 1.0 1.8 3.8 1630 1336 A 94 GLU HA A 94 GLU HBy 1.0 1.8 3.8 1631 1337 A 94 GLU HA A 94 GLU HGx 1.0 1.8 4.0 1632 1337 A 94 GLU HA A 94 GLU HGy 1.0 1.8 4.0 stop_ save_ save_CNS/XPLOR_distance_constraints_3 _nef_distance_restraint_list.sf_category nef_distance_restraint_list _nef_distance_restraint_list.sf_framecode CNS/XPLOR_distance_constraints_3 _nef_distance_restraint_list.restraint_origin 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 17 ILE H A 13 LEU O 1.0 1.6 2.4 2 2 A 13 LEU O A 17 ILE N 1.0 2.6 3.4 3 3 A 30 LEU H A 26 LEU O 1.0 1.6 2.4 4 4 A 26 LEU O A 30 LEU N 1.0 2.6 3.4 5 5 A 40 LEU H A 36 THR O 1.0 1.6 2.4 6 6 A 36 THR O A 40 LEU N 1.0 2.6 3.4 7 7 A 41 GLN H A 37 PRO O 1.0 1.6 2.4 8 8 A 37 PRO O A 41 GLN N 1.0 2.6 3.4 9 9 A 43 VAL H A 39 GLU O 1.0 1.6 2.4 10 10 A 39 GLU O A 43 VAL N 1.0 2.6 3.4 11 11 A 44 LEU H A 40 LEU O 1.0 1.6 2.4 12 12 A 40 LEU O A 44 LEU N 1.0 2.6 3.4 13 13 A 46 LEU H A 42 GLU O 1.0 1.6 2.4 14 14 A 42 GLU O A 46 LEU N 1.0 2.6 3.4 15 15 A 52 GLN H A 48 THR O 1.0 1.6 2.4 16 16 A 48 THR O A 52 GLN N 1.0 2.6 3.4 17 17 A 53 ALA H A 49 PRO O 1.0 1.6 2.4 18 18 A 49 PRO O A 53 ALA N 1.0 2.6 3.4 19 19 A 54 LYS H A 50 GLU O 1.0 1.6 2.4 20 20 A 50 GLU O A 54 LYS N 1.0 2.6 3.4 21 21 A 55 LYS H A 51 GLU O 1.0 1.6 2.4 22 22 A 51 GLU O A 55 LYS N 1.0 2.6 3.4 23 23 A 56 LEU H A 52 GLN O 1.0 1.6 2.4 24 24 A 52 GLN O A 56 LEU N 1.0 2.6 3.4 25 25 A 57 ILE H A 53 ALA O 1.0 1.6 2.4 26 26 A 53 ALA O A 57 ILE N 1.0 2.6 3.4 27 27 A 58 ASP H A 54 LYS O 1.0 1.6 2.4 28 28 A 54 LYS O A 58 ASP N 1.0 2.6 3.4 29 29 A 59 PHE H A 55 LYS O 1.0 1.6 2.4 30 30 A 55 LYS O A 59 PHE N 1.0 2.6 3.4 31 31 A 60 ILE H A 56 LEU O 1.0 1.6 2.4 32 32 A 56 LEU O A 60 ILE N 1.0 2.6 3.4 33 33 A 61 LEU H A 57 ILE O 1.0 1.6 2.4 34 34 A 57 ILE O A 61 LEU N 1.0 2.6 3.4 35 35 A 72 ILE H A 68 VAL O 1.0 1.6 2.4 36 36 A 68 VAL O A 72 ILE N 1.0 2.6 3.4 37 37 A 87 LEU H A 83 LEU O 1.0 1.6 2.4 38 38 A 83 LEU O A 87 LEU N 1.0 2.6 3.4 stop_ save_ save_CNS/XPLOR_dihedral_4 _nef_dihedral_restraint_list.sf_category nef_dihedral_restraint_list _nef_dihedral_restraint_list.sf_framecode CNS/XPLOR_dihedral_4 _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 1 MET C A 2 THR N A 2 THR CA A 2 THR C 1.0 -155.4 -40.8 PHI 2 2 A 2 THR C A 3 PRO N A 3 PRO CA A 3 PRO C 1.0 -62.5 -39.1 PHI 3 3 A 3 PRO C A 4 GLU N A 4 GLU CA A 4 GLU C 1.0 -75.8 -55.8 PHI 4 4 A 4 GLU C A 5 GLN N A 5 GLN CA A 5 GLN C 1.0 -75.0 -52.8 PHI 5 5 A 5 GLN C A 6 ARG N A 6 ARG CA A 6 ARG C 1.0 -74.6 -50.0 PHI 6 6 A 6 ARG C A 7 GLU N A 7 GLU CA A 7 GLU C 1.0 -94.7 -54.3 PHI 7 7 A 7 GLU C A 8 PHE N A 8 PHE CA A 8 PHE C 1.0 -121.7 -51.5 PHI 8 8 A 11 GLU C A 12 ILE N A 12 ILE CA A 12 ILE C 1.0 -77.3 -54.7 PHI 9 9 A 12 ILE C A 13 LEU N A 13 LEU CA A 13 LEU C 1.0 -82.5 -43.1 PHI 10 10 A 13 LEU C A 14 ALA N A 14 ALA CA A 14 ALA C 1.0 -79.0 -47.6 PHI 11 11 A 14 ALA C A 15 GLU N A 15 GLU CA A 15 GLU C 1.0 -74.4 -54.4 PHI 12 12 A 15 GLU C A 16 ILE N A 16 ILE CA A 16 ILE C 1.0 -95.5 -45.3 PHI 13 13 A 16 ILE C A 17 ILE N A 17 ILE CA A 17 ILE C 1.0 -85.8 -43.2 PHI 14 14 A 17 ILE C A 18 ALA N A 18 ALA CA A 18 ALA C 1.0 -92.5 -45.5 PHI 15 15 A 18 ALA C A 19 ASN N A 19 ASN CA A 19 ASN C 1.0 -119.4 -73.2 PHI 16 16 A 20 LEU C A 21 ASP N A 21 ASP CA A 21 ASP C 1.0 -149.4 -29.6 PHI 17 17 A 21 ASP C A 22 PRO N A 22 PRO CA A 22 PRO C 1.0 -68.8 -39.6 PHI 18 18 A 22 PRO C A 23 THR N A 23 THR CA A 23 THR C 1.0 -75.9 -55.9 PHI 19 19 A 23 THR C A 24 LYS N A 24 LYS CA A 24 LYS C 1.0 -72.5 -52.5 PHI 20 20 A 24 LYS C A 25 ILE N A 25 ILE CA A 25 ILE C 1.0 -88.4 -46.2 PHI 21 21 A 25 ILE C A 26 LEU N A 26 LEU CA A 26 LEU C 1.0 -80.7 -40.7 PHI 22 22 A 26 LEU C A 27 GLU N A 27 GLU CA A 27 GLU C 1.0 -79.4 -52.4 PHI 23 23 A 27 GLU C A 28 GLU N A 28 GLU CA A 28 GLU C 1.0 -75.5 -55.5 PHI 24 24 A 28 GLU C A 29 LEU N A 29 LEU CA A 29 LEU C 1.0 -79.7 -54.9 PHI 25 25 A 29 LEU C A 30 LEU N A 30 LEU CA A 30 LEU C 1.0 -73.8 -53.8 PHI 26 26 A 30 LEU C A 31 ARG N A 31 ARG CA A 31 ARG C 1.0 -76.6 -56.6 PHI 27 27 A 31 ARG C A 32 ARG N A 32 ARG CA A 32 ARG C 1.0 -107.4 -62.2 PHI 28 28 A 32 ARG C A 33 GLY N A 33 GLY CA A 33 GLY C 1.0 54.5 120.9 PHI 29 29 A 34 LEU C A 35 LEU N A 35 LEU CA A 35 LEU C 1.0 -154.6 -111.4 PHI 30 30 A 35 LEU C A 36 THR N A 36 THR CA A 36 THR C 1.0 -138.9 -42.7 PHI 31 31 A 36 THR C A 37 PRO N A 37 PRO CA A 37 PRO C 1.0 -69.7 -39.5 PHI 32 32 A 37 PRO C A 38 ALA N A 38 ALA CA A 38 ALA C 1.0 -92.5 -47.7 PHI 33 33 A 38 ALA C A 39 GLU N A 39 GLU CA A 39 GLU C 1.0 -76.8 -56.8 PHI 34 34 A 39 GLU C A 40 LEU N A 40 LEU CA A 40 LEU C 1.0 -99.1 -31.9 PHI 35 35 A 40 LEU C A 41 GLN N A 41 GLN CA A 41 GLN C 1.0 -71.1 -50.5 PHI 36 36 A 41 GLN C A 42 GLU N A 42 GLU CA A 42 GLU C 1.0 -74.8 -54.8 PHI 37 37 A 42 GLU C A 43 VAL N A 43 VAL CA A 43 VAL C 1.0 -85.6 -49.2 PHI 38 38 A 43 VAL C A 44 LEU N A 44 LEU CA A 44 LEU C 1.0 -80.0 -50.4 PHI 39 39 A 44 LEU C A 45 ASP N A 45 ASP CA A 45 ASP C 1.0 -125.7 -40.5 PHI 40 40 A 46 LEU C A 47 LYS N A 47 LYS CA A 47 LYS C 1.0 -111.7 -47.3 PHI 41 41 A 48 THR C A 49 PRO N A 49 PRO CA A 49 PRO C 1.0 -66.5 -43.1 PHI 42 42 A 49 PRO C A 50 GLU N A 50 GLU CA A 50 GLU C 1.0 -76.8 -54.0 PHI 43 43 A 50 GLU C A 51 GLU N A 51 GLU CA A 51 GLU C 1.0 -73.6 -53.6 PHI 44 44 A 51 GLU C A 52 GLN N A 52 GLN CA A 52 GLN C 1.0 -102.2 -39.2 PHI 45 45 A 52 GLN C A 53 ALA N A 53 ALA CA A 53 ALA C 1.0 -71.2 -49.2 PHI 46 46 A 53 ALA C A 54 LYS N A 54 LYS CA A 54 LYS C 1.0 -75.7 -52.7 PHI 47 47 A 54 LYS C A 55 LYS N A 55 LYS CA A 55 LYS C 1.0 -87.9 -45.9 PHI 48 48 A 55 LYS C A 56 LEU N A 56 LEU CA A 56 LEU C 1.0 -73.9 -49.3 PHI 49 49 A 56 LEU C A 57 ILE N A 57 ILE CA A 57 ILE C 1.0 -79.9 -54.5 PHI 50 50 A 57 ILE C A 58 ASP N A 58 ASP CA A 58 ASP C 1.0 -80.0 -54.2 PHI 51 51 A 58 ASP C A 59 PHE N A 59 PHE CA A 59 PHE C 1.0 -102.3 -42.7 PHI 52 52 A 59 PHE C A 60 ILE N A 60 ILE CA A 60 ILE C 1.0 -99.2 -38.6 PHI 53 53 A 60 ILE C A 61 LEU N A 61 LEU CA A 61 LEU C 1.0 -93.9 -42.7 PHI 54 54 A 63 LEU C A 64 SER N A 64 SER CA A 64 SER C 1.0 -88.2 -56.2 PHI 55 55 A 64 SER C A 65 PRO N A 65 PRO CA A 65 PRO C 1.0 -58.9 -38.9 PHI 56 56 A 65 PRO C A 66 ALA N A 66 ALA CA A 66 ALA C 1.0 -92.4 -46.4 PHI 57 57 A 66 ALA C A 67 ASP N A 67 ASP CA A 67 ASP C 1.0 -75.3 -55.3 PHI 58 58 A 67 ASP C A 68 VAL N A 68 VAL CA A 68 VAL C 1.0 -75.1 -55.1 PHI 59 59 A 68 VAL C A 69 GLN N A 69 GLN CA A 69 GLN C 1.0 -70.5 -50.5 PHI 60 60 A 69 GLN C A 70 ALA N A 70 ALA CA A 70 ALA C 1.0 -71.9 -51.9 PHI 61 61 A 70 ALA C A 71 ARG N A 71 ARG CA A 71 ARG C 1.0 -73.5 -52.1 PHI 62 62 A 71 ARG C A 72 ILE N A 72 ILE CA A 72 ILE C 1.0 -89.5 -43.5 PHI 63 63 A 72 ILE C A 73 ASN N A 73 ASN CA A 73 ASN C 1.0 -72.6 -52.6 PHI 64 64 A 73 ASN C A 74 VAL N A 74 VAL CA A 74 VAL C 1.0 -73.8 -53.8 PHI 65 65 A 74 VAL C A 75 LEU N A 75 LEU CA A 75 LEU C 1.0 -77.6 -55.2 PHI 66 66 A 75 LEU C A 76 ARG N A 76 ARG CA A 76 ARG C 1.0 -69.9 -49.9 PHI 67 67 A 76 ARG C A 77 ALA N A 77 ALA CA A 77 ALA C 1.0 -86.4 -48.0 PHI 68 68 A 77 ALA C A 78 HIS N A 78 HIS CA A 78 HIS C 1.0 -110.7 -71.3 PHI 69 69 A 78 HIS C A 79 GLY N A 79 GLY CA A 79 GLY C 1.0 54.9 111.1 PHI 70 70 A 80 TYR C A 81 GLN N A 81 GLN CA A 81 GLN C 1.0 -74.6 -39.6 PHI 71 71 A 81 GLN C A 82 ALA N A 82 ALA CA A 82 ALA C 1.0 -73.6 -53.6 PHI 72 72 A 82 ALA C A 83 LEU N A 83 LEU CA A 83 LEU C 1.0 -73.5 -53.5 PHI 73 73 A 83 LEU C A 84 ALA N A 84 ALA CA A 84 ALA C 1.0 -70.3 -50.3 PHI 74 74 A 84 ALA C A 85 ASP N A 85 ASP CA A 85 ASP C 1.0 -94.0 -42.6 PHI 75 75 A 85 ASP C A 86 LYS N A 86 LYS CA A 86 LYS C 1.0 -77.9 -57.9 PHI 76 76 A 86 LYS C A 87 LEU N A 87 LEU CA A 87 LEU C 1.0 -73.4 -53.4 PHI 77 77 A 87 LEU C A 88 ASN N A 88 ASN CA A 88 ASN C 1.0 -70.4 -50.4 PHI 78 78 A 88 ASN C A 89 LYS N A 89 LYS CA A 89 LYS C 1.0 -77.3 -55.5 PHI 79 79 A 89 LYS C A 90 TYR N A 90 TYR CA A 90 TYR C 1.0 -71.6 -49.2 PHI 80 80 A 90 TYR C A 91 LEU N A 91 LEU CA A 91 LEU C 1.0 -78.7 -50.7 PHI 81 81 A 91 LEU C A 92 THR N A 92 THR CA A 92 THR C 1.0 -102.9 -40.1 PHI 82 82 A 92 THR C A 93 LEU N A 93 LEU CA A 93 LEU C 1.0 -134.7 -43.3 PHI 83 83 A 2 THR N A 2 THR CA A 2 THR C A 3 PRO N 1.0 84.0 208.0 PSI 84 84 A 3 PRO N A 3 PRO CA A 3 PRO C A 4 GLU N 1.0 -52.4 -22.0 PSI 85 85 A 4 GLU N A 4 GLU CA A 4 GLU C A 5 GLN N 1.0 -53.0 -23.0 PSI 86 86 A 5 GLN N A 5 GLN CA A 5 GLN C A 6 ARG N 1.0 -55.9 -35.9 PSI 87 87 A 6 ARG N A 6 ARG CA A 6 ARG C A 7 GLU N 1.0 -51.2 -8.8 PSI 88 88 A 7 GLU N A 7 GLU CA A 7 GLU C A 8 PHE N 1.0 -57.6 33.2 PSI 89 89 A 8 PHE N A 8 PHE CA A 8 PHE C A 9 LEU N 1.0 -58.9 21.3 PSI 90 90 A 12 ILE N A 12 ILE CA A 12 ILE C A 13 LEU N 1.0 -57.9 -31.3 PSI 91 91 A 13 LEU N A 13 LEU CA A 13 LEU C A 14 ALA N 1.0 -55.3 -29.5 PSI 92 92 A 14 ALA N A 14 ALA CA A 14 ALA C A 15 GLU N 1.0 -57.5 -11.1 PSI 93 93 A 15 GLU N A 15 GLU CA A 15 GLU C A 16 ILE N 1.0 -59.2 -8.0 PSI 94 94 A 16 ILE N A 16 ILE CA A 16 ILE C A 17 ILE N 1.0 -59.8 -25.6 PSI 95 95 A 17 ILE N A 17 ILE CA A 17 ILE C A 18 ALA N 1.0 -58.4 -25.0 PSI 96 96 A 18 ALA N A 18 ALA CA A 18 ALA C A 19 ASN N 1.0 -53.3 -9.5 PSI 97 97 A 19 ASN N A 19 ASN CA A 19 ASN C A 20 LEU N 1.0 -46.7 22.7 PSI 98 98 A 21 ASP N A 21 ASP CA A 21 ASP C A 22 PRO N 1.0 73.4 186.2 PSI 99 99 A 22 PRO N A 22 PRO CA A 22 PRO C A 23 THR N 1.0 -47.0 -19.4 PSI 100 100 A 23 THR N A 23 THR CA A 23 THR C A 24 LYS N 1.0 -50.6 -13.0 PSI 101 101 A 24 LYS N A 24 LYS CA A 24 LYS C A 25 ILE N 1.0 -53.7 -23.9 PSI 102 102 A 25 ILE N A 25 ILE CA A 25 ILE C A 26 LEU N 1.0 -57.7 -32.9 PSI 103 103 A 26 LEU N A 26 LEU CA A 26 LEU C A 27 GLU N 1.0 -51.5 -27.3 PSI 104 104 A 27 GLU N A 27 GLU CA A 27 GLU C A 28 GLU N 1.0 -59.0 -7.8 PSI 105 105 A 28 GLU N A 28 GLU CA A 28 GLU C A 29 LEU N 1.0 -57.9 -21.5 PSI 106 106 A 29 LEU N A 29 LEU CA A 29 LEU C A 30 LEU N 1.0 -46.7 -26.7 PSI 107 107 A 30 LEU N A 30 LEU CA A 30 LEU C A 31 ARG N 1.0 -51.1 -31.1 PSI 108 108 A 31 ARG N A 31 ARG CA A 31 ARG C A 32 ARG N 1.0 -39.5 -14.7 PSI 109 109 A 32 ARG N A 32 ARG CA A 32 ARG C A 33 GLY N 1.0 -12.6 19.4 PSI 110 110 A 33 GLY N A 33 GLY CA A 33 GLY C A 34 LEU N 1.0 -24.8 43.0 PSI 111 111 A 35 LEU N A 35 LEU CA A 35 LEU C A 36 THR N 1.0 135.0 176.2 PSI 112 112 A 36 THR N A 36 THR CA A 36 THR C A 37 PRO N 1.0 121.2 183.6 PSI 113 113 A 37 PRO N A 37 PRO CA A 37 PRO C A 38 ALA N 1.0 -48.1 -17.9 PSI 114 114 A 38 ALA N A 38 ALA CA A 38 ALA C A 39 GLU N 1.0 -55.5 -12.1 PSI 115 115 A 39 GLU N A 39 GLU CA A 39 GLU C A 40 LEU N 1.0 -53.6 -33.6 PSI 116 116 A 40 LEU N A 40 LEU CA A 40 LEU C A 41 GLN N 1.0 -73.3 -1.7 PSI 117 117 A 41 GLN N A 41 GLN CA A 41 GLN C A 42 GLU N 1.0 -62.2 -12.4 PSI 118 118 A 42 GLU N A 42 GLU CA A 42 GLU C A 43 VAL N 1.0 -55.5 -15.9 PSI 119 119 A 43 VAL N A 43 VAL CA A 43 VAL C A 44 LEU N 1.0 -58.5 -19.5 PSI 120 120 A 44 LEU N A 44 LEU CA A 44 LEU C A 45 ASP N 1.0 -55.8 -16.8 PSI 121 121 A 45 ASP N A 45 ASP CA A 45 ASP C A 46 LEU N 1.0 -52.1 25.1 PSI 122 122 A 47 LYS N A 47 LYS CA A 47 LYS C A 48 THR N 1.0 -49.2 11.2 PSI 123 123 A 49 PRO N A 49 PRO CA A 49 PRO C A 50 GLU N 1.0 -49.3 -20.1 PSI 124 124 A 50 GLU N A 50 GLU CA A 50 GLU C A 51 GLU N 1.0 -62.9 -6.5 PSI 125 125 A 51 GLU N A 51 GLU CA A 51 GLU C A 52 GLN N 1.0 -55.0 -32.2 PSI 126 126 A 52 GLN N A 52 GLN CA A 52 GLN C A 53 ALA N 1.0 -72.2 -0.8 PSI 127 127 A 53 ALA N A 53 ALA CA A 53 ALA C A 54 LYS N 1.0 -60.4 -10.4 PSI 128 128 A 54 LYS N A 54 LYS CA A 54 LYS C A 55 LYS N 1.0 -68.9 -19.7 PSI 129 129 A 55 LYS N A 55 LYS CA A 55 LYS C A 56 LEU N 1.0 -57.5 -5.1 PSI 130 130 A 56 LEU N A 56 LEU CA A 56 LEU C A 57 ILE N 1.0 -57.3 -31.3 PSI 131 131 A 57 ILE N A 57 ILE CA A 57 ILE C A 58 ASP N 1.0 -51.3 -20.3 PSI 132 132 A 58 ASP N A 58 ASP CA A 58 ASP C A 59 PHE N 1.0 -62.1 -4.3 PSI 133 133 A 59 PHE N A 59 PHE CA A 59 PHE C A 60 ILE N 1.0 -57.4 -3.6 PSI 134 134 A 60 ILE N A 60 ILE CA A 60 ILE C A 61 LEU N 1.0 -50.2 -22.8 PSI 135 135 A 61 LEU N A 61 LEU CA A 61 LEU C A 62 LYS N 1.0 -41.3 -9.5 PSI 136 136 A 64 SER N A 64 SER CA A 64 SER C A 65 PRO N 1.0 130.1 169.1 PSI 137 137 A 65 PRO N A 65 PRO CA A 65 PRO C A 66 ALA N 1.0 -49.3 -28.1 PSI 138 138 A 66 ALA N A 66 ALA CA A 66 ALA C A 67 ASP N 1.0 -54.3 -12.1 PSI 139 139 A 67 ASP N A 67 ASP CA A 67 ASP C A 68 VAL N 1.0 -52.2 -30.4 PSI 140 140 A 68 VAL N A 68 VAL CA A 68 VAL C A 69 GLN N 1.0 -52.3 -32.3 PSI 141 141 A 69 GLN N A 69 GLN CA A 69 GLN C A 70 ALA N 1.0 -55.1 -34.5 PSI 142 142 A 70 ALA N A 70 ALA CA A 70 ALA C A 71 ARG N 1.0 -51.3 -29.7 PSI 143 143 A 71 ARG N A 71 ARG CA A 71 ARG C A 72 ILE N 1.0 -52.8 -29.0 PSI 144 144 A 72 ILE N A 72 ILE CA A 72 ILE C A 73 ASN N 1.0 -62.3 -20.7 PSI 145 145 A 73 ASN N A 73 ASN CA A 73 ASN C A 74 VAL N 1.0 -55.3 -26.7 PSI 146 146 A 74 VAL N A 74 VAL CA A 74 VAL C A 75 LEU N 1.0 -56.5 -36.5 PSI 147 147 A 75 LEU N A 75 LEU CA A 75 LEU C A 76 ARG N 1.0 -49.9 -29.9 PSI 148 148 A 76 ARG N A 76 ARG CA A 76 ARG C A 77 ALA N 1.0 -56.5 -36.5 PSI 149 149 A 77 ALA N A 77 ALA CA A 77 ALA C A 78 HIS N 1.0 -48.9 5.9 PSI 150 150 A 78 HIS N A 78 HIS CA A 78 HIS C A 79 GLY N 1.0 -15.6 28.8 PSI 151 151 A 79 GLY N A 79 GLY CA A 79 GLY C A 80 TYR N 1.0 -2.7 36.3 PSI 152 152 A 81 GLN N A 81 GLN CA A 81 GLN C A 82 ALA N 1.0 -69.4 -8.4 PSI 153 153 A 82 ALA N A 82 ALA CA A 82 ALA C A 83 LEU N 1.0 -51.8 -31.8 PSI 154 154 A 83 LEU N A 83 LEU CA A 83 LEU C A 84 ALA N 1.0 -53.4 -31.0 PSI 155 155 A 84 ALA N A 84 ALA CA A 84 ALA C A 85 ASP N 1.0 -58.5 -17.5 PSI 156 156 A 85 ASP N A 85 ASP CA A 85 ASP C A 86 LYS N 1.0 -56.6 -18.6 PSI 157 157 A 86 LYS N A 86 LYS CA A 86 LYS C A 87 LEU N 1.0 -52.1 -31.9 PSI 158 158 A 87 LEU N A 87 LEU CA A 87 LEU C A 88 ASN N 1.0 -50.2 -26.0 PSI 159 159 A 88 ASN N A 88 ASN CA A 88 ASN C A 89 LYS N 1.0 -55.0 -35.0 PSI 160 160 A 89 LYS N A 89 LYS CA A 89 LYS C A 90 TYR N 1.0 -54.8 -27.0 PSI 161 161 A 90 TYR N A 90 TYR CA A 90 TYR C A 91 LEU N 1.0 -60.1 -27.1 PSI 162 162 A 91 LEU N A 91 LEU CA A 91 LEU C A 92 THR N 1.0 -54.6 -10.6 PSI 163 163 A 92 THR N A 92 THR CA A 92 THR C A 93 LEU N 1.0 -62.9 13.1 PSI 164 164 A 93 LEU N A 93 LEU CA A 93 LEU C A 94 GLU N 1.0 -57.2 29.4 PSI stop_ save_