data_nef_c18834_2m10 save_entry_information _nef_nmr_meta_data.sf_category nef_nmr_meta_data _nef_nmr_meta_data.sf_framecode entry_information _nef_nmr_meta_data.format_name nmr_exchange_format _nef_nmr_meta_data.format_version 1.1 save_ save_assembly _nef_molecular_system.sf_category nef_molecular_system _nef_molecular_system.sf_framecode assembly loop_ _nef_covalent_links.chain_code_1 _nef_covalent_links.sequence_code_1 _nef_covalent_links.residue_name_1 _nef_covalent_links.atom_name_1 _nef_covalent_links.chain_code_2 _nef_covalent_links.sequence_code_2 _nef_covalent_links.residue_name_2 _nef_covalent_links.atom_name_2 1 22 CYS SG 2 1 33B C1 1 77 CYS SG 2 1 33B C20 stop_ loop_ _nef_sequence.index _nef_sequence.chain_code _nef_sequence.sequence_code _nef_sequence.residue_name _nef_sequence.linking _nef_sequence.residue_variant _nef_sequence.cis_peptide 1 A 1 GLY start . false 2 A 2 PRO middle . false 3 A 3 LYS middle . . 4 A 4 PRO middle . false 5 A 5 GLY middle . false 6 A 6 ASP middle . . 7 A 7 ILE middle . . 8 A 8 PHE middle . . 9 A 9 GLU middle . . 10 A 10 VAL middle . . 11 A 11 GLU middle . . 12 A 12 LEU middle . . 13 A 13 ALA middle . . 14 A 14 LYS middle . . 15 A 15 ASN middle . . 16 A 16 ASP middle . . 17 A 17 ASN middle . . 18 A 18 SER middle . . 19 A 19 LEU middle . . 20 A 20 GLY middle . false 21 A 21 ILE middle . . 22 A 22 CYS middle -HG . 23 A 23 VAL middle . . 24 A 24 THR middle . . 25 A 25 GLY middle . false 26 A 26 GLY middle . false 27 A 27 VAL middle . . 28 A 28 ASN middle . . 29 A 29 THR middle . . 30 A 30 SER middle . . 31 A 31 VAL middle . . 32 A 32 ARG middle . . 33 A 33 HIS middle . . 34 A 34 GLY middle . false 35 A 35 GLY middle . false 36 A 36 ILE middle . . 37 A 37 TYR middle . . 38 A 38 VAL middle . . 39 A 39 LYS middle . . 40 A 40 ALA middle . . 41 A 41 VAL middle . . 42 A 42 ILE middle . . 43 A 43 PRO middle . false 44 A 44 GLN middle . . 45 A 45 GLY middle . false 46 A 46 ALA middle . . 47 A 47 ALA middle . . 48 A 48 GLU middle . . 49 A 49 SER middle . . 50 A 50 ASP middle . . 51 A 51 GLY middle . false 52 A 52 ARG middle . . 53 A 53 ILE middle . . 54 A 54 HIS middle . . 55 A 55 LYS middle . . 56 A 56 GLY middle . false 57 A 57 ASP middle . . 58 A 58 ARG middle . . 59 A 59 VAL middle . . 60 A 60 LEU middle . . 61 A 61 ALA middle . . 62 A 62 VAL middle . . 63 A 63 ASN middle . . 64 A 64 GLY middle . false 65 A 65 VAL middle . . 66 A 66 SER middle . . 67 A 67 LEU middle . . 68 A 68 GLU middle . . 69 A 69 GLY middle . false 70 A 70 ALA middle . . 71 A 71 THR middle . . 72 A 72 HIS middle . . 73 A 73 LYS middle . . 74 A 74 GLN middle . . 75 A 75 ALA middle . . 76 A 76 VAL middle . . 77 A 77 CYS middle -HG . 78 A 78 THR middle . . 79 A 79 LEU middle . . 80 A 80 ARG middle . . 81 A 81 ASN middle . . 82 A 82 THR middle . . 83 A 83 GLY middle . false 84 A 84 GLN middle . . 85 A 85 VAL middle . . 86 A 86 VAL middle . . 87 A 87 HIS middle . . 88 A 88 LEU middle . . 89 A 89 LEU middle . . 90 A 90 LEU middle . . 91 A 91 GLU middle . . 92 A 92 LYS middle . . 93 A 93 GLY middle . false 94 A 94 GLN middle . . 95 A 95 SER middle . . 96 A 96 PRO middle . false 97 A 97 THR end . . 98 B 1 33B . . . 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 GLY HA2 H 1 3.888 0.020 A 1 GLY HA3 H 1 3.888 0.020 A 1 GLY CA C 13 43.286 0.3 A 2 PRO HA H 1 4.474 0.020 A 2 PRO HBx H 1 1.464 0.020 A 2 PRO HBy H 1 2.076 0.020 A 2 PRO HDx H 1 3.326 0.020 A 2 PRO HDy H 1 3.368 0.020 A 2 PRO HGx H 1 1.324 0.020 A 2 PRO HGy H 1 1.366 0.020 A 2 PRO C C 13 175.857 0.3 A 2 PRO CA C 13 62.843 0.3 A 2 PRO CB C 13 32.268 0.3 A 2 PRO CD C 13 49.659 0.3 A 2 PRO CG C 13 26.654 0.3 A 3 LYS H H 1 8.952 0.020 A 3 LYS HA H 1 4.590 0.020 A 3 LYS HBy H 1 1.764 0.020 A 3 LYS HBx H 1 1.706 0.020 A 3 LYS HD2 H 1 1.693 0.020 A 3 LYS HD3 H 1 1.693 0.020 A 3 LYS HE2 H 1 3.030 0.020 A 3 LYS HE3 H 1 3.030 0.020 A 3 LYS HG2 H 1 1.496 0.020 A 3 LYS HG3 H 1 1.496 0.020 A 3 LYS CA C 13 53.618 0.3 A 3 LYS CB C 13 31.556 0.3 A 3 LYS CD C 13 28.745 0.3 A 3 LYS CE C 13 43.155 0.3 A 3 LYS CG C 13 24.358 0.3 A 3 LYS N N 15 124.698 0.3 A 4 PRO HA H 1 3.944 0.020 A 4 PRO HBx H 1 1.732 0.020 A 4 PRO HBy H 1 1.806 0.020 A 4 PRO HDx H 1 3.539 0.020 A 4 PRO HDy H 1 3.797 0.020 A 4 PRO HGx H 1 2.006 0.020 A 4 PRO HGy H 1 2.151 0.020 A 4 PRO C C 13 177.504 0.3 A 4 PRO CA C 13 64.544 0.3 A 4 PRO CB C 13 31.770 0.3 A 4 PRO CD C 13 50.170 0.3 A 4 PRO CG C 13 27.890 0.3 A 5 GLY H H 1 9.011 0.020 A 5 GLY HAx H 1 3.736 0.020 A 5 GLY HAy H 1 4.399 0.020 A 5 GLY C C 13 174.146 0.3 A 5 GLY CA C 13 45.033 0.3 A 5 GLY N N 15 113.728 0.3 A 6 ASP H H 1 8.468 0.020 A 6 ASP HA H 1 4.670 0.020 A 6 ASP HBy H 1 2.986 0.020 A 6 ASP HBx H 1 2.679 0.020 A 6 ASP C C 13 175.673 0.3 A 6 ASP CA C 13 54.918 0.3 A 6 ASP CB C 13 41.446 0.3 A 6 ASP N N 15 121.776 0.3 A 7 ILE H H 1 8.362 0.020 A 7 ILE HA H 1 5.331 0.020 A 7 ILE HB H 1 1.756 0.020 A 7 ILE HD1% H 1 0.800 0.020 A 7 ILE HG1y H 1 1.630 0.020 A 7 ILE HG1x H 1 1.166 0.020 A 7 ILE HG2% H 1 0.823 0.020 A 7 ILE C C 13 176.824 0.3 A 7 ILE CA C 13 59.601 0.3 A 7 ILE CB C 13 38.254 0.3 A 7 ILE CD1 C 13 12.433 0.3 A 7 ILE CG1 C 13 27.783 0.3 A 7 ILE CG2 C 13 17.794 0.3 A 7 ILE N N 15 121.570 0.3 A 8 PHE H H 1 9.476 0.020 A 8 PHE HA H 1 5.072 0.020 A 8 PHE HB2 H 1 3.029 0.020 A 8 PHE HB3 H 1 3.029 0.020 A 8 PHE HD1 H 1 7.011 0.020 A 8 PHE HD2 H 1 7.011 0.020 A 8 PHE HE1 H 1 6.780 0.020 A 8 PHE HE2 H 1 6.780 0.020 A 8 PHE HZ H 1 7.249 0.020 A 8 PHE C C 13 171.149 0.3 A 8 PHE CA C 13 55.529 0.3 A 8 PHE CB C 13 41.312 0.3 A 8 PHE CD1 C 13 132.314 0.3 A 8 PHE CD2 C 13 132.314 0.3 A 8 PHE CE1 C 13 131.229 0.3 A 8 PHE CE2 C 13 131.229 0.3 A 8 PHE CZ C 13 129.690 0.3 A 8 PHE N N 15 125.816 0.3 A 9 GLU H H 1 8.490 0.020 A 9 GLU HA H 1 5.213 0.020 A 9 GLU HBx H 1 1.854 0.020 A 9 GLU HBy H 1 1.896 0.020 A 9 GLU HG2 H 1 2.146 0.020 A 9 GLU HG3 H 1 2.146 0.020 A 9 GLU C C 13 175.995 0.3 A 9 GLU CA C 13 53.989 0.3 A 9 GLU CB C 13 33.428 0.3 A 9 GLU CG C 13 37.039 0.3 A 9 GLU N N 15 118.961 0.3 A 10 VAL H H 1 8.577 0.020 A 10 VAL HA H 1 4.137 0.020 A 10 VAL HB H 1 1.676 0.020 A 10 VAL HGx% H 1 0.836 0.020 A 10 VAL HGy% H 1 0.788 0.020 A 10 VAL C C 13 173.221 0.3 A 10 VAL CA C 13 61.091 0.3 A 10 VAL CB C 13 36.766 0.3 A 10 VAL CG1 C 13 21.566 0.3 A 10 VAL CG2 C 13 22.672 0.3 A 10 VAL N N 15 119.964 0.3 A 11 GLU H H 1 7.794 0.020 A 11 GLU HA H 1 4.955 0.020 A 11 GLU HBy H 1 1.840 0.020 A 11 GLU HBx H 1 1.791 0.020 A 11 GLU HG2 H 1 1.802 0.020 A 11 GLU HG3 H 1 1.802 0.020 A 11 GLU C C 13 174.538 0.3 A 11 GLU CA C 13 54.862 0.3 A 11 GLU CB C 13 30.836 0.3 A 11 GLU CG C 13 37.115 0.3 A 11 GLU N N 15 126.219 0.3 A 12 LEU H H 1 8.848 0.020 A 12 LEU HA H 1 4.646 0.020 A 12 LEU HBx H 1 1.270 0.020 A 12 LEU HBy H 1 1.338 0.020 A 12 LEU HDx% H 1 0.614 0.020 A 12 LEU HDy% H 1 0.741 0.020 A 12 LEU HG H 1 1.366 0.020 A 12 LEU C C 13 173.916 0.3 A 12 LEU CA C 13 53.137 0.3 A 12 LEU CB C 13 46.126 0.3 A 12 LEU CD1 C 13 26.160 0.3 A 12 LEU CD2 C 13 24.934 0.3 A 12 LEU CG C 13 26.374 0.3 A 12 LEU N N 15 126.212 0.3 A 13 ALA H H 1 8.494 0.020 A 13 ALA HA H 1 5.095 0.020 A 13 ALA HB% H 1 1.323 0.020 A 13 ALA C C 13 177.352 0.3 A 13 ALA CA C 13 49.920 0.3 A 13 ALA CB C 13 19.377 0.3 A 13 ALA N N 15 126.357 0.3 A 14 LYS H H 1 8.496 0.020 A 14 LYS HA H 1 3.752 0.020 A 14 LYS HB2 H 1 1.769 0.020 A 14 LYS HB3 H 1 1.769 0.020 A 14 LYS HDy H 1 1.482 0.020 A 14 LYS HDx H 1 1.258 0.020 A 14 LYS HE2 H 1 3.039 0.020 A 14 LYS HE3 H 1 3.039 0.020 A 14 LYS HG2 H 1 0.815 0.020 A 14 LYS HG3 H 1 0.815 0.020 A 14 LYS C C 13 176.313 0.3 A 14 LYS CA C 13 57.762 0.3 A 14 LYS CB C 13 34.469 0.3 A 14 LYS CD C 13 30.086 0.3 A 14 LYS CE C 13 42.009 0.3 A 14 LYS CG C 13 27.422 0.3 A 14 LYS N N 15 120.000 0.3 A 15 ASN H H 1 8.079 0.020 A 15 ASN HA H 1 4.917 0.020 A 15 ASN HBx H 1 2.788 0.020 A 15 ASN HBy H 1 2.863 0.020 A 15 ASN CA C 13 52.487 0.3 A 15 ASN CB C 13 40.684 0.3 A 15 ASN N N 15 117.473 0.3 A 16 ASP HA H 1 4.259 0.020 A 16 ASP HBy H 1 2.907 0.020 A 16 ASP HBx H 1 2.538 0.020 A 16 ASP C C 13 175.515 0.3 A 16 ASP CA C 13 55.520 0.3 A 16 ASP CB C 13 39.303 0.3 A 17 ASN H H 1 8.959 0.020 A 17 ASN HA H 1 4.232 0.020 A 17 ASN HBx H 1 2.791 0.020 A 17 ASN HBy H 1 3.127 0.020 A 17 ASN C C 13 174.550 0.3 A 17 ASN CA C 13 54.349 0.3 A 17 ASN CB C 13 38.455 0.3 A 17 ASN N N 15 110.160 0.3 A 18 SER H H 1 7.892 0.020 A 18 SER HA H 1 4.976 0.020 A 18 SER HBx H 1 3.787 0.020 A 18 SER HBy H 1 3.930 0.020 A 18 SER CA C 13 56.519 0.3 A 18 SER CB C 13 65.053 0.3 A 18 SER N N 15 112.013 0.3 A 19 LEU HA H 1 4.256 0.020 A 19 LEU HBy H 1 1.810 0.020 A 19 LEU HBx H 1 1.413 0.020 A 19 LEU HDx% H 1 0.823 0.020 A 19 LEU HDy% H 1 0.666 0.020 A 19 LEU HG H 1 1.595 0.020 A 19 LEU C C 13 176.996 0.3 A 19 LEU CA C 13 55.945 0.3 A 19 LEU CB C 13 43.178 0.3 A 19 LEU CD1 C 13 25.872 0.3 A 19 LEU CD2 C 13 23.516 0.3 A 19 LEU CG C 13 26.922 0.3 A 20 GLY H H 1 8.804 0.020 A 20 GLY HAx H 1 3.879 0.020 A 20 GLY HAy H 1 4.185 0.020 A 20 GLY C C 13 176.218 0.3 A 20 GLY CA C 13 46.868 0.3 A 20 GLY N N 15 105.651 0.3 A 21 ILE H H 1 7.775 0.020 A 21 ILE HA H 1 4.842 0.020 A 21 ILE HB H 1 1.476 0.020 A 21 ILE HD1% H 1 0.510 0.020 A 21 ILE HG12 H 1 1.420 0.020 A 21 ILE HG13 H 1 1.420 0.020 A 21 ILE HG2% H 1 0.670 0.020 A 21 ILE C C 13 175.987 0.3 A 21 ILE CA C 13 59.795 0.3 A 21 ILE CB C 13 42.334 0.3 A 21 ILE CD1 C 13 13.094 0.3 A 21 ILE CG1 C 13 25.949 0.3 A 21 ILE CG2 C 13 18.683 0.3 A 21 ILE N N 15 115.348 0.3 A 22 CYS H H 1 8.533 0.020 A 22 CYS C C 13 176.187 0.3 A 22 CYS CA C 13 53.779 0.3 A 22 CYS CB C 13 36.527 0.3 A 22 CYS N N 15 123.503 0.3 A 23 VAL H H 1 7.720 0.020 A 23 VAL HA H 1 5.448 0.020 A 23 VAL HB H 1 2.034 0.020 A 23 VAL HGx% H 1 0.479 0.020 A 23 VAL HGy% H 1 0.487 0.020 A 23 VAL C C 13 174.219 0.3 A 23 VAL CA C 13 59.422 0.3 A 23 VAL CB C 13 35.094 0.3 A 23 VAL CG1 C 13 21.166 0.3 A 23 VAL CG2 C 13 17.525 0.3 A 23 VAL N N 15 114.882 0.3 A 24 THR H H 1 9.175 0.020 A 24 THR HA H 1 4.691 0.020 A 24 THR HB H 1 3.898 0.020 A 24 THR HG2% H 1 1.099 0.020 A 24 THR C C 13 171.649 0.3 A 24 THR CA C 13 59.560 0.3 A 24 THR CB C 13 70.573 0.3 A 24 THR CG2 C 13 18.981 0.3 A 24 THR N N 15 115.462 0.3 A 25 GLY H H 1 8.323 0.020 A 25 GLY HAx H 1 4.083 0.020 A 25 GLY HAy H 1 5.291 0.020 A 25 GLY C C 13 174.216 0.3 A 25 GLY CA C 13 44.664 0.3 A 25 GLY N N 15 111.734 0.3 A 26 GLY H H 1 7.541 0.020 A 26 GLY HAx H 1 3.742 0.020 A 26 GLY HAy H 1 4.580 0.020 A 26 GLY C C 13 176.306 0.3 A 26 GLY CA C 13 43.770 0.3 A 26 GLY N N 15 107.524 0.3 A 27 VAL H H 1 8.055 0.020 A 27 VAL HA H 1 4.128 0.020 A 27 VAL HB H 1 2.073 0.020 A 27 VAL HGx% H 1 0.907 0.020 A 27 VAL HGy% H 1 0.866 0.020 A 27 VAL C C 13 175.716 0.3 A 27 VAL CA C 13 63.894 0.3 A 27 VAL CB C 13 31.963 0.3 A 27 VAL CG1 C 13 21.180 0.3 A 27 VAL CG2 C 13 19.900 0.3 A 27 VAL N N 15 116.903 0.3 A 28 ASN H H 1 8.779 0.020 A 28 ASN HA H 1 4.803 0.020 A 28 ASN HBx H 1 2.887 0.020 A 28 ASN HBy H 1 3.073 0.020 A 28 ASN C C 13 174.846 0.3 A 28 ASN CA C 13 53.480 0.3 A 28 ASN CB C 13 37.754 0.3 A 28 ASN N N 15 117.840 0.3 A 29 THR H H 1 7.857 0.020 A 29 THR HA H 1 4.690 0.020 A 29 THR HB H 1 4.429 0.020 A 29 THR HG2% H 1 1.098 0.020 A 29 THR CA C 13 61.624 0.3 A 29 THR CB C 13 70.939 0.3 A 29 THR CG2 C 13 21.391 0.3 A 29 THR N N 15 111.408 0.3 A 30 SER H H 1 8.438 0.020 A 30 SER HA H 1 4.537 0.020 A 30 SER HBx H 1 3.889 0.020 A 30 SER HBy H 1 4.014 0.020 A 30 SER C C 13 174.867 0.3 A 30 SER CA C 13 58.369 0.3 A 30 SER CB C 13 63.547 0.3 A 30 SER N N 15 113.816 0.3 A 31 VAL H H 1 7.567 0.020 A 31 VAL HA H 1 4.098 0.020 A 31 VAL HB H 1 2.134 0.020 A 31 VAL HGx% H 1 0.966 0.020 A 31 VAL HGy% H 1 1.061 0.020 A 31 VAL C C 13 176.528 0.3 A 31 VAL CA C 13 62.070 0.3 A 31 VAL CB C 13 32.507 0.3 A 31 VAL CG1 C 13 21.270 0.3 A 31 VAL CG2 C 13 20.414 0.3 A 31 VAL N N 15 118.013 0.3 A 32 ARG H H 1 8.501 0.020 A 32 ARG HA H 1 4.007 0.020 A 32 ARG HBx H 1 1.556 0.020 A 32 ARG HBy H 1 1.649 0.020 A 32 ARG HDy H 1 2.866 0.020 A 32 ARG HDx H 1 2.758 0.020 A 32 ARG HGx H 1 1.114 0.020 A 32 ARG HGy H 1 1.350 0.020 A 32 ARG CA C 13 58.009 0.3 A 32 ARG CB C 13 29.571 0.3 A 32 ARG CD C 13 42.437 0.3 A 32 ARG CG C 13 26.712 0.3 A 32 ARG N N 15 124.719 0.3 A 33 HIS HA H 1 4.577 0.020 A 33 HIS HBy H 1 3.367 0.020 A 33 HIS HBx H 1 3.244 0.020 A 33 HIS C C 13 175.064 0.3 A 33 HIS CA C 13 56.814 0.3 A 33 HIS CB C 13 29.091 0.3 A 34 GLY H H 1 8.469 0.020 A 34 GLY HAx H 1 3.766 0.020 A 34 GLY HAy H 1 3.904 0.020 A 34 GLY C C 13 174.616 0.3 A 34 GLY CA C 13 46.594 0.3 A 34 GLY N N 15 109.357 0.3 A 35 GLY H H 1 7.787 0.020 A 35 GLY HAx H 1 3.374 0.020 A 35 GLY HAy H 1 3.921 0.020 A 35 GLY C C 13 170.518 0.3 A 35 GLY CA C 13 44.641 0.3 A 35 GLY N N 15 104.989 0.3 A 36 ILE H H 1 8.362 0.020 A 36 ILE HA H 1 4.746 0.020 A 36 ILE HB H 1 2.076 0.020 A 36 ILE HD1% H 1 0.453 0.020 A 36 ILE HG1y H 1 1.733 0.020 A 36 ILE HG1x H 1 1.057 0.020 A 36 ILE HG2% H 1 0.510 0.020 A 36 ILE C C 13 174.616 0.3 A 36 ILE CA C 13 56.955 0.3 A 36 ILE CB C 13 35.618 0.3 A 36 ILE CD1 C 13 8.786 0.3 A 36 ILE CG1 C 13 25.766 0.3 A 36 ILE CG2 C 13 16.372 0.3 A 36 ILE N N 15 119.808 0.3 A 37 TYR H H 1 8.904 0.020 A 37 TYR HA H 1 5.268 0.020 A 37 TYR HBx H 1 2.434 0.020 A 37 TYR HBy H 1 2.630 0.020 A 37 TYR HD1 H 1 6.928 0.020 A 37 TYR HD2 H 1 6.928 0.020 A 37 TYR HE1 H 1 6.816 0.020 A 37 TYR HE2 H 1 6.816 0.020 A 37 TYR C C 13 176.069 0.3 A 37 TYR CA C 13 55.959 0.3 A 37 TYR CB C 13 42.436 0.3 A 37 TYR CD1 C 13 133.656 0.3 A 37 TYR CD2 C 13 133.656 0.3 A 37 TYR CE1 C 13 117.486 0.3 A 37 TYR CE2 C 13 117.486 0.3 A 37 TYR N N 15 123.168 0.3 A 38 VAL H H 1 9.230 0.020 A 38 VAL HA H 1 3.799 0.020 A 38 VAL HB H 1 2.266 0.020 A 38 VAL HGx% H 1 0.610 0.020 A 38 VAL HGy% H 1 0.664 0.020 A 38 VAL C C 13 175.886 0.3 A 38 VAL CA C 13 64.084 0.3 A 38 VAL CB C 13 31.444 0.3 A 38 VAL CG1 C 13 21.774 0.3 A 38 VAL CG2 C 13 20.949 0.3 A 38 VAL N N 15 120.273 0.3 A 39 LYS H H 1 9.584 0.020 A 39 LYS HA H 1 4.389 0.020 A 39 LYS HBx H 1 1.398 0.020 A 39 LYS HBy H 1 1.629 0.020 A 39 LYS HDy H 1 1.658 0.020 A 39 LYS HDx H 1 1.575 0.020 A 39 LYS HE2 H 1 2.975 0.020 A 39 LYS HE3 H 1 2.975 0.020 A 39 LYS HGy H 1 1.386 0.020 A 39 LYS HGx H 1 1.252 0.020 A 39 LYS C C 13 174.763 0.3 A 39 LYS CA C 13 56.536 0.3 A 39 LYS CB C 13 34.539 0.3 A 39 LYS CD C 13 29.689 0.3 A 39 LYS CE C 13 42.166 0.3 A 39 LYS CG C 13 24.670 0.3 A 39 LYS N N 15 133.619 0.3 A 40 ALA H H 1 7.584 0.020 A 40 ALA HA H 1 4.504 0.020 A 40 ALA HB% H 1 1.342 0.020 A 40 ALA C C 13 174.686 0.3 A 40 ALA CA C 13 51.897 0.3 A 40 ALA CB C 13 22.245 0.3 A 40 ALA N N 15 117.459 0.3 A 41 VAL H H 1 8.747 0.020 A 41 VAL HA H 1 4.379 0.020 A 41 VAL HB H 1 2.001 0.020 A 41 VAL HGx% H 1 0.746 0.020 A 41 VAL HGy% H 1 0.715 0.020 A 41 VAL C C 13 175.714 0.3 A 41 VAL CA C 13 61.149 0.3 A 41 VAL CB C 13 32.506 0.3 A 41 VAL CG1 C 13 21.791 0.3 A 41 VAL CG2 C 13 20.486 0.3 A 41 VAL N N 15 120.599 0.3 A 42 ILE H H 1 7.827 0.020 A 42 ILE HA H 1 4.127 0.020 A 42 ILE HB H 1 1.682 0.020 A 42 ILE HD1% H 1 0.827 0.020 A 42 ILE HG1y H 1 1.424 0.020 A 42 ILE HG1x H 1 1.132 0.020 A 42 ILE HG2% H 1 0.959 0.020 A 42 ILE CA C 13 58.826 0.3 A 42 ILE CB C 13 38.216 0.3 A 42 ILE CD1 C 13 11.573 0.3 A 42 ILE CG1 C 13 27.522 0.3 A 42 ILE CG2 C 13 16.186 0.3 A 42 ILE N N 15 127.775 0.3 A 43 PRO HA H 1 4.475 0.020 A 43 PRO HBx H 1 1.877 0.020 A 43 PRO HBy H 1 2.403 0.020 A 43 PRO HDy H 1 4.096 0.020 A 43 PRO HDx H 1 3.599 0.020 A 43 PRO HGx H 1 2.005 0.020 A 43 PRO HGy H 1 2.144 0.020 A 43 PRO C C 13 177.234 0.3 A 43 PRO CA C 13 64.177 0.3 A 43 PRO CB C 13 31.801 0.3 A 43 PRO CD C 13 51.861 0.3 A 43 PRO CG C 13 27.879 0.3 A 44 GLN H H 1 9.388 0.020 A 44 GLN HA H 1 3.848 0.020 A 44 GLN HBx H 1 2.299 0.020 A 44 GLN HBy H 1 2.379 0.020 A 44 GLN HGx H 1 2.252 0.020 A 44 GLN HGy H 1 2.342 0.020 A 44 GLN C C 13 175.628 0.3 A 44 GLN CA C 13 58.141 0.3 A 44 GLN CB C 13 26.441 0.3 A 44 GLN CG C 13 35.113 0.3 A 44 GLN N N 15 116.932 0.3 A 45 GLY H H 1 7.875 0.020 A 45 GLY HAy H 1 4.311 0.020 A 45 GLY HAx H 1 3.846 0.020 A 45 GLY C C 13 174.404 0.3 A 45 GLY CA C 13 44.658 0.3 A 45 GLY N N 15 106.131 0.3 A 46 ALA H H 1 9.017 0.020 A 46 ALA HA H 1 4.051 0.020 A 46 ALA HB% H 1 1.501 0.020 A 46 ALA C C 13 180.673 0.3 A 46 ALA CA C 13 55.045 0.3 A 46 ALA CB C 13 18.508 0.3 A 46 ALA N N 15 121.011 0.3 A 47 ALA H H 1 7.754 0.020 A 47 ALA HA H 1 4.068 0.020 A 47 ALA HB% H 1 1.265 0.020 A 47 ALA C C 13 180.699 0.3 A 47 ALA CA C 13 54.917 0.3 A 47 ALA CB C 13 18.630 0.3 A 47 ALA N N 15 118.848 0.3 A 48 GLU H H 1 9.317 0.020 A 48 GLU HA H 1 3.823 0.020 A 48 GLU HB2 H 1 1.908 0.020 A 48 GLU HB3 H 1 1.908 0.020 A 48 GLU HG2 H 1 2.145 0.020 A 48 GLU HG3 H 1 2.145 0.020 A 48 GLU C C 13 178.174 0.3 A 48 GLU CA C 13 59.909 0.3 A 48 GLU CB C 13 29.759 0.3 A 48 GLU CG C 13 37.451 0.3 A 48 GLU N N 15 124.400 0.3 A 49 SER H H 1 8.115 0.020 A 49 SER HA H 1 4.100 0.020 A 49 SER HB2 H 1 3.903 0.020 A 49 SER HB3 H 1 3.903 0.020 A 49 SER C C 13 175.693 0.3 A 49 SER CA C 13 61.233 0.3 A 49 SER CB C 13 62.780 0.3 A 49 SER N N 15 113.388 0.3 A 50 ASP H H 1 7.609 0.020 A 50 ASP HA H 1 4.378 0.020 A 50 ASP HBx H 1 2.578 0.020 A 50 ASP HBy H 1 2.672 0.020 A 50 ASP C C 13 177.650 0.3 A 50 ASP CA C 13 57.214 0.3 A 50 ASP CB C 13 44.241 0.3 A 50 ASP N N 15 120.047 0.3 A 51 GLY H H 1 7.372 0.020 A 51 GLY HAx H 1 3.885 0.020 A 51 GLY HAy H 1 4.093 0.020 A 51 GLY C C 13 174.977 0.3 A 51 GLY CA C 13 46.352 0.3 A 51 GLY N N 15 102.979 0.3 A 52 ARG H H 1 7.966 0.020 A 52 ARG HA H 1 4.314 0.020 A 52 ARG HB2 H 1 2.024 0.020 A 52 ARG HB3 H 1 2.024 0.020 A 52 ARG HDy H 1 3.405 0.020 A 52 ARG HDx H 1 3.127 0.020 A 52 ARG HG2 H 1 1.797 0.020 A 52 ARG HG3 H 1 1.797 0.020 A 52 ARG C C 13 175.886 0.3 A 52 ARG CA C 13 57.894 0.3 A 52 ARG CB C 13 33.246 0.3 A 52 ARG CD C 13 43.995 0.3 A 52 ARG CG C 13 27.333 0.3 A 52 ARG N N 15 117.579 0.3 A 53 ILE H H 1 8.225 0.020 A 53 ILE HA H 1 4.236 0.020 A 53 ILE HB H 1 1.379 0.020 A 53 ILE HD1% H 1 0.732 0.020 A 53 ILE HG1y H 1 1.731 0.020 A 53 ILE HG1x H 1 0.884 0.020 A 53 ILE HG2% H 1 0.732 0.020 A 53 ILE C C 13 173.773 0.3 A 53 ILE CA C 13 61.405 0.3 A 53 ILE CB C 13 39.641 0.3 A 53 ILE CD1 C 13 14.871 0.3 A 53 ILE CG1 C 13 28.273 0.3 A 53 ILE CG2 C 13 17.926 0.3 A 53 ILE N N 15 120.155 0.3 A 54 HIS H H 1 9.061 0.020 A 54 HIS HA H 1 4.790 0.020 A 54 HIS HBx H 1 2.898 0.020 A 54 HIS HBy H 1 3.283 0.020 A 54 HIS HD2 H 1 7.348 0.020 A 54 HIS HE1 H 1 8.065 0.020 A 54 HIS C C 13 173.696 0.3 A 54 HIS CA C 13 54.844 0.3 A 54 HIS CB C 13 33.566 0.3 A 54 HIS CD2 C 13 120.953 0.3 A 54 HIS CE1 C 13 137.614 0.3 A 54 HIS N N 15 123.751 0.3 A 55 LYS H H 1 8.670 0.020 A 55 LYS HA H 1 3.626 0.020 A 55 LYS HB2 H 1 1.701 0.020 A 55 LYS HB3 H 1 1.701 0.020 A 55 LYS HD2 H 1 1.749 0.020 A 55 LYS HD3 H 1 1.749 0.020 A 55 LYS HE2 H 1 3.042 0.020 A 55 LYS HE3 H 1 3.042 0.020 A 55 LYS HGy H 1 1.442 0.020 A 55 LYS HGx H 1 1.276 0.020 A 55 LYS C C 13 176.916 0.3 A 55 LYS CA C 13 58.304 0.3 A 55 LYS CB C 13 32.421 0.3 A 55 LYS CD C 13 29.749 0.3 A 55 LYS CE C 13 42.072 0.3 A 55 LYS CG C 13 24.500 0.3 A 55 LYS N N 15 120.590 0.3 A 56 GLY H H 1 9.201 0.020 A 56 GLY HAx H 1 3.627 0.020 A 56 GLY HAy H 1 4.641 0.020 A 56 GLY C C 13 174.438 0.3 A 56 GLY CA C 13 44.762 0.3 A 56 GLY N N 15 114.645 0.3 A 57 ASP H H 1 8.058 0.020 A 57 ASP HA H 1 4.887 0.020 A 57 ASP HBy H 1 2.689 0.020 A 57 ASP HBx H 1 2.589 0.020 A 57 ASP C C 13 174.623 0.3 A 57 ASP CA C 13 55.836 0.3 A 57 ASP CB C 13 41.083 0.3 A 57 ASP N N 15 121.982 0.3 A 58 ARG H H 1 9.078 0.020 A 58 ARG HA H 1 4.615 0.020 A 58 ARG HBy H 1 1.737 0.020 A 58 ARG HBx H 1 1.643 0.020 A 58 ARG HDy H 1 3.020 0.020 A 58 ARG HDx H 1 2.836 0.020 A 58 ARG HGx H 1 0.758 0.020 A 58 ARG HGy H 1 0.891 0.020 A 58 ARG C C 13 175.573 0.3 A 58 ARG CA C 13 54.521 0.3 A 58 ARG CB C 13 33.701 0.3 A 58 ARG CD C 13 44.239 0.3 A 58 ARG CG C 13 27.562 0.3 A 58 ARG N N 15 123.240 0.3 A 59 VAL H H 1 8.897 0.020 A 59 VAL HA H 1 3.863 0.020 A 59 VAL HB H 1 1.691 0.020 A 59 VAL HGx% H 1 0.541 0.020 A 59 VAL HGy% H 1 0.488 0.020 A 59 VAL C C 13 174.458 0.3 A 59 VAL CA C 13 62.203 0.3 A 59 VAL CB C 13 30.998 0.3 A 59 VAL CG1 C 13 22.481 0.3 A 59 VAL CG2 C 13 19.995 0.3 A 59 VAL N N 15 126.202 0.3 A 60 LEU H H 1 9.213 0.020 A 60 LEU HA H 1 4.296 0.020 A 60 LEU HBy H 1 1.485 0.020 A 60 LEU HBx H 1 1.340 0.020 A 60 LEU HDx% H 1 0.704 0.020 A 60 LEU HDy% H 1 0.627 0.020 A 60 LEU HG H 1 1.412 0.020 A 60 LEU C C 13 178.289 0.3 A 60 LEU CA C 13 56.054 0.3 A 60 LEU CB C 13 42.612 0.3 A 60 LEU CD1 C 13 25.915 0.3 A 60 LEU CD2 C 13 21.986 0.3 A 60 LEU CG C 13 27.130 0.3 A 60 LEU N N 15 127.163 0.3 A 61 ALA H H 1 7.741 0.020 A 61 ALA HA H 1 4.954 0.020 A 61 ALA HB% H 1 1.075 0.020 A 61 ALA C C 13 175.288 0.3 A 61 ALA CA C 13 52.279 0.3 A 61 ALA CB C 13 22.096 0.3 A 61 ALA N N 15 118.886 0.3 A 62 VAL H H 1 8.256 0.020 A 62 VAL HA H 1 4.450 0.020 A 62 VAL HB H 1 1.716 0.020 A 62 VAL HGx% H 1 0.663 0.020 A 62 VAL HGy% H 1 0.595 0.020 A 62 VAL C C 13 175.323 0.3 A 62 VAL CA C 13 60.418 0.3 A 62 VAL CB C 13 34.050 0.3 A 62 VAL CG1 C 13 20.803 0.3 A 62 VAL CG2 C 13 20.641 0.3 A 62 VAL N N 15 119.929 0.3 A 63 ASN H H 1 10.392 0.020 A 63 ASN HA H 1 4.545 0.020 A 63 ASN HBx H 1 2.986 0.020 A 63 ASN HBy H 1 3.192 0.020 A 63 ASN C C 13 175.197 0.3 A 63 ASN CA C 13 54.168 0.3 A 63 ASN CB C 13 36.896 0.3 A 63 ASN N N 15 128.933 0.3 A 64 GLY H H 1 9.085 0.020 A 64 GLY HAx H 1 3.506 0.020 A 64 GLY HAy H 1 4.042 0.020 A 64 GLY C C 13 173.872 0.3 A 64 GLY CA C 13 45.171 0.3 A 64 GLY N N 15 103.413 0.3 A 65 VAL H H 1 8.028 0.020 A 65 VAL HA H 1 3.948 0.020 A 65 VAL HB H 1 2.188 0.020 A 65 VAL HGx% H 1 0.868 0.020 A 65 VAL HGy% H 1 0.909 0.020 A 65 VAL C C 13 175.645 0.3 A 65 VAL CA C 13 62.136 0.3 A 65 VAL CB C 13 31.640 0.3 A 65 VAL CG1 C 13 20.694 0.3 A 65 VAL CG2 C 13 21.063 0.3 A 65 VAL N N 15 123.643 0.3 A 66 SER H H 1 8.647 0.020 A 66 SER HA H 1 4.334 0.020 A 66 SER HBx H 1 3.807 0.020 A 66 SER HBy H 1 4.057 0.020 A 66 SER C C 13 176.388 0.3 A 66 SER CA C 13 58.342 0.3 A 66 SER CB C 13 63.562 0.3 A 66 SER N N 15 120.923 0.3 A 67 LEU H H 1 8.292 0.020 A 67 LEU HA H 1 4.438 0.020 A 67 LEU HBy H 1 1.644 0.020 A 67 LEU HBx H 1 1.407 0.020 A 67 LEU HDx% H 1 0.593 0.020 A 67 LEU HDy% H 1 0.641 0.020 A 67 LEU HG H 1 1.455 0.020 A 67 LEU C C 13 176.462 0.3 A 67 LEU CA C 13 53.732 0.3 A 67 LEU CB C 13 40.890 0.3 A 67 LEU CD1 C 13 25.568 0.3 A 67 LEU CD2 C 13 22.424 0.3 A 67 LEU CG C 13 26.847 0.3 A 67 LEU N N 15 125.116 0.3 A 68 GLU H H 1 8.305 0.020 A 68 GLU HA H 1 4.035 0.020 A 68 GLU HB2 H 1 1.901 0.020 A 68 GLU HB3 H 1 1.901 0.020 A 68 GLU HG2 H 1 2.179 0.020 A 68 GLU HG3 H 1 2.179 0.020 A 68 GLU C C 13 177.767 0.3 A 68 GLU CA C 13 58.571 0.3 A 68 GLU CB C 13 29.052 0.3 A 68 GLU CG C 13 35.859 0.3 A 68 GLU N N 15 123.552 0.3 A 69 GLY H H 1 8.977 0.020 A 69 GLY HAx H 1 3.689 0.020 A 69 GLY HAy H 1 4.097 0.020 A 69 GLY C C 13 173.618 0.3 A 69 GLY CA C 13 45.396 0.3 A 69 GLY N N 15 115.496 0.3 A 70 ALA H H 1 7.807 0.020 A 70 ALA HA H 1 4.502 0.020 A 70 ALA HB% H 1 1.367 0.020 A 70 ALA C C 13 179.820 0.3 A 70 ALA CA C 13 52.415 0.3 A 70 ALA CB C 13 19.638 0.3 A 70 ALA N N 15 121.999 0.3 A 71 THR H H 1 8.222 0.020 A 71 THR HA H 1 4.515 0.020 A 71 THR HB H 1 4.778 0.020 A 71 THR HG2% H 1 1.302 0.020 A 71 THR C C 13 174.717 0.3 A 71 THR CA C 13 60.692 0.3 A 71 THR CB C 13 71.274 0.3 A 71 THR CG2 C 13 21.998 0.3 A 71 THR N N 15 111.294 0.3 A 72 HIS H H 1 9.217 0.020 A 72 HIS HA H 1 3.860 0.020 A 72 HIS HBy H 1 3.652 0.020 A 72 HIS HBx H 1 3.069 0.020 A 72 HIS HD2 H 1 7.139 0.020 A 72 HIS HE1 H 1 8.016 0.020 A 72 HIS C C 13 176.702 0.3 A 72 HIS CA C 13 61.983 0.3 A 72 HIS CB C 13 30.047 0.3 A 72 HIS CD2 C 13 119.213 0.3 A 72 HIS CE1 C 13 136.353 0.3 A 72 HIS N N 15 121.871 0.3 A 73 LYS H H 1 8.429 0.020 A 73 LYS HA H 1 3.824 0.020 A 73 LYS HBy H 1 1.928 0.020 A 73 LYS HBx H 1 1.827 0.020 A 73 LYS HD2 H 1 1.732 0.020 A 73 LYS HD3 H 1 1.732 0.020 A 73 LYS HE2 H 1 3.082 0.020 A 73 LYS HE3 H 1 3.082 0.020 A 73 LYS HGx H 1 1.478 0.020 A 73 LYS HGy H 1 1.642 0.020 A 73 LYS C C 13 178.288 0.3 A 73 LYS CA C 13 59.350 0.3 A 73 LYS CB C 13 32.811 0.3 A 73 LYS CD C 13 29.669 0.3 A 73 LYS CE C 13 42.231 0.3 A 73 LYS CG C 13 25.218 0.3 A 73 LYS N N 15 116.941 0.3 A 74 GLN H H 1 7.660 0.020 A 74 GLN HA H 1 3.869 0.020 A 74 GLN HBy H 1 2.224 0.020 A 74 GLN HBx H 1 1.933 0.020 A 74 GLN HGx H 1 2.219 0.020 A 74 GLN HGy H 1 2.364 0.020 A 74 GLN C C 13 179.732 0.3 A 74 GLN CA C 13 58.599 0.3 A 74 GLN CB C 13 28.351 0.3 A 74 GLN CG C 13 34.130 0.3 A 74 GLN N N 15 116.915 0.3 A 75 ALA H H 1 8.379 0.020 A 75 ALA HA H 1 3.788 0.020 A 75 ALA HB% H 1 1.253 0.020 A 75 ALA C C 13 179.078 0.3 A 75 ALA CA C 13 55.566 0.3 A 75 ALA CB C 13 18.851 0.3 A 75 ALA N N 15 122.673 0.3 A 76 VAL H H 1 8.239 0.020 A 76 VAL HA H 1 3.505 0.020 A 76 VAL HB H 1 1.328 0.020 A 76 VAL HGx% H 1 0.143 0.020 A 76 VAL HGy% H 1 0.266 0.020 A 76 VAL CA C 13 65.895 0.3 A 76 VAL CB C 13 30.691 0.3 A 76 VAL CG1 C 13 22.131 0.3 A 76 VAL N N 15 112.831 0.3 A 77 CYS C C 13 177.150 0.3 A 77 CYS CA C 13 60.391 0.3 A 77 CYS CB C 13 35.782 0.3 A 78 THR H H 1 8.015 0.020 A 78 THR HA H 1 3.858 0.020 A 78 THR HB H 1 4.212 0.020 A 78 THR HG2% H 1 1.017 0.020 A 78 THR C C 13 176.460 0.3 A 78 THR CA C 13 67.123 0.3 A 78 THR CB C 13 68.123 0.3 A 78 THR CG2 C 13 20.941 0.3 A 78 THR N N 15 117.507 0.3 A 79 LEU H H 1 7.984 0.020 A 79 LEU HA H 1 3.750 0.020 A 79 LEU HBy H 1 1.706 0.020 A 79 LEU HBx H 1 1.366 0.020 A 79 LEU HDx% H 1 0.573 0.020 A 79 LEU HDy% H 1 0.612 0.020 A 79 LEU HG H 1 1.504 0.020 A 79 LEU CA C 13 58.190 0.3 A 79 LEU CB C 13 42.072 0.3 A 79 LEU CD1 C 13 25.115 0.3 A 79 LEU CD2 C 13 24.033 0.3 A 79 LEU CG C 13 27.434 0.3 A 79 LEU N N 15 119.666 0.3 A 80 ARG HA H 1 4.197 0.020 A 80 ARG HB2 H 1 2.057 0.020 A 80 ARG HB3 H 1 2.057 0.020 A 80 ARG HDy H 1 3.283 0.020 A 80 ARG HDx H 1 3.224 0.020 A 80 ARG HG2 H 1 1.780 0.020 A 80 ARG HG3 H 1 1.780 0.020 A 80 ARG C C 13 177.750 0.3 A 80 ARG CA C 13 58.307 0.3 A 80 ARG CB C 13 30.092 0.3 A 80 ARG CD C 13 43.033 0.3 A 80 ARG CG C 13 27.079 0.3 A 81 ASN H H 1 7.648 0.020 A 81 ASN HA H 1 4.984 0.020 A 81 ASN HBx H 1 2.750 0.020 A 81 ASN HBy H 1 2.975 0.020 A 81 ASN C C 13 174.819 0.3 A 81 ASN CA C 13 53.113 0.3 A 81 ASN CB C 13 37.668 0.3 A 81 ASN N N 15 119.843 0.3 A 82 THR H H 1 7.668 0.020 A 82 THR HA H 1 4.447 0.020 A 82 THR HB H 1 4.268 0.020 A 82 THR HG2% H 1 1.233 0.020 A 82 THR C C 13 175.114 0.3 A 82 THR CA C 13 59.944 0.3 A 82 THR CB C 13 72.611 0.3 A 82 THR CG2 C 13 22.348 0.3 A 82 THR N N 15 109.907 0.3 A 83 GLY H H 1 8.421 0.020 A 83 GLY HAx H 1 3.772 0.020 A 83 GLY HAy H 1 4.394 0.020 A 83 GLY C C 13 173.467 0.3 A 83 GLY CA C 13 44.092 0.3 A 83 GLY N N 15 109.505 0.3 A 84 GLN H H 1 8.224 0.020 A 84 GLN HA H 1 3.963 0.020 A 84 GLN HBx H 1 2.054 0.020 A 84 GLN HBy H 1 2.124 0.020 A 84 GLN HG2 H 1 2.466 0.020 A 84 GLN HG3 H 1 2.466 0.020 A 84 GLN C C 13 175.254 0.3 A 84 GLN CA C 13 58.443 0.3 A 84 GLN CB C 13 28.973 0.3 A 84 GLN CG C 13 33.792 0.3 A 84 GLN N N 15 117.276 0.3 A 85 VAL H H 1 7.699 0.020 A 85 VAL HA H 1 4.654 0.020 A 85 VAL HB H 1 1.817 0.020 A 85 VAL HGx% H 1 0.678 0.020 A 85 VAL HGy% H 1 0.854 0.020 A 85 VAL C C 13 175.879 0.3 A 85 VAL CA C 13 61.298 0.3 A 85 VAL CB C 13 33.130 0.3 A 85 VAL CG1 C 13 21.223 0.3 A 85 VAL CG2 C 13 21.151 0.3 A 85 VAL N N 15 116.186 0.3 A 86 VAL H H 1 9.043 0.020 A 86 VAL HA H 1 4.447 0.020 A 86 VAL HB H 1 1.826 0.020 A 86 VAL HGx% H 1 0.820 0.020 A 86 VAL HGy% H 1 0.895 0.020 A 86 VAL C C 13 173.365 0.3 A 86 VAL CA C 13 60.965 0.3 A 86 VAL CB C 13 34.987 0.3 A 86 VAL CG1 C 13 22.267 0.3 A 86 VAL CG2 C 13 22.692 0.3 A 86 VAL N N 15 128.499 0.3 A 87 HIS H H 1 8.855 0.020 A 87 HIS HA H 1 4.996 0.020 A 87 HIS HB2 H 1 3.122 0.020 A 87 HIS HB3 H 1 3.122 0.020 A 87 HIS HD2 H 1 6.974 0.020 A 87 HIS C C 13 174.387 0.3 A 87 HIS CA C 13 55.802 0.3 A 87 HIS CB C 13 31.179 0.3 A 87 HIS CD2 C 13 119.707 0.3 A 87 HIS N N 15 126.357 0.3 A 88 LEU H H 1 9.016 0.020 A 88 LEU HA H 1 4.960 0.020 A 88 LEU HBx H 1 1.020 0.020 A 88 LEU HBy H 1 1.595 0.020 A 88 LEU HDx% H 1 0.606 0.020 A 88 LEU HDy% H 1 0.684 0.020 A 88 LEU HG H 1 1.452 0.020 A 88 LEU C C 13 173.365 0.3 A 88 LEU CA C 13 53.494 0.3 A 88 LEU CB C 13 45.187 0.3 A 88 LEU CD1 C 13 21.894 0.3 A 88 LEU CD2 C 13 25.193 0.3 A 88 LEU CG C 13 26.083 0.3 A 88 LEU N N 15 126.780 0.3 A 89 LEU H H 1 7.965 0.020 A 89 LEU HA H 1 4.721 0.020 A 89 LEU HBy H 1 1.740 0.020 A 89 LEU HBx H 1 1.223 0.020 A 89 LEU HDx% H 1 0.801 0.020 A 89 LEU HDy% H 1 0.740 0.020 A 89 LEU HG H 1 1.271 0.020 A 89 LEU C C 13 175.213 0.3 A 89 LEU CA C 13 53.661 0.3 A 89 LEU CB C 13 45.391 0.3 A 89 LEU CD1 C 13 23.896 0.3 A 89 LEU CD2 C 13 25.340 0.3 A 89 LEU CG C 13 27.196 0.3 A 89 LEU N N 15 124.435 0.3 A 90 LEU H H 1 8.909 0.020 A 90 LEU HA H 1 5.283 0.020 A 90 LEU HBx H 1 0.194 0.020 A 90 LEU HBy H 1 0.965 0.020 A 90 LEU HDx% H 1 0.399 0.020 A 90 LEU HDy% H 1 0.614 0.020 A 90 LEU HG H 1 1.160 0.020 A 90 LEU C C 13 173.560 0.3 A 90 LEU CA C 13 54.088 0.3 A 90 LEU CB C 13 45.956 0.3 A 90 LEU CD1 C 13 27.363 0.3 A 90 LEU CD2 C 13 27.016 0.3 A 90 LEU CG C 13 27.094 0.3 A 90 LEU N N 15 127.444 0.3 A 91 GLU H H 1 8.813 0.020 A 91 GLU HA H 1 5.062 0.020 A 91 GLU HBy H 1 1.995 0.020 A 91 GLU HBx H 1 1.793 0.020 A 91 GLU HGy H 1 2.036 0.020 A 91 GLU HGx H 1 1.921 0.020 A 91 GLU C C 13 176.652 0.3 A 91 GLU CA C 13 53.787 0.3 A 91 GLU CB C 13 33.846 0.3 A 91 GLU CG C 13 36.551 0.3 A 91 GLU N N 15 118.954 0.3 A 92 LYS H H 1 9.362 0.020 A 92 LYS HA H 1 4.387 0.020 A 92 LYS HB2 H 1 2.323 0.020 A 92 LYS HB3 H 1 2.323 0.020 A 92 LYS HD2 H 1 1.329 0.020 A 92 LYS HD3 H 1 1.329 0.020 A 92 LYS HE2 H 1 2.749 0.020 A 92 LYS HE3 H 1 2.749 0.020 A 92 LYS HGx H 1 1.203 0.020 A 92 LYS HGy H 1 1.637 0.020 A 92 LYS C C 13 178.000 0.3 A 92 LYS CA C 13 56.262 0.3 A 92 LYS CB C 13 32.071 0.3 A 92 LYS CD C 13 28.921 0.3 A 92 LYS CE C 13 41.788 0.3 A 92 LYS CG C 13 23.459 0.3 A 92 LYS N N 15 129.055 0.3 A 93 GLY H H 1 9.698 0.020 A 93 GLY HAx H 1 3.822 0.020 A 93 GLY HAy H 1 4.378 0.020 A 93 GLY C C 13 173.147 0.3 A 93 GLY CA C 13 45.173 0.3 A 93 GLY N N 15 117.893 0.3 A 94 GLN H H 1 8.252 0.020 A 94 GLN HA H 1 4.262 0.020 A 94 GLN HBx H 1 1.900 0.020 A 94 GLN HBy H 1 2.121 0.020 A 94 GLN HG2 H 1 2.374 0.020 A 94 GLN HG3 H 1 2.374 0.020 A 94 GLN C C 13 175.942 0.3 A 94 GLN CA C 13 55.514 0.3 A 94 GLN CB C 13 29.688 0.3 A 94 GLN CG C 13 33.614 0.3 A 94 GLN N N 15 116.797 0.3 A 95 SER H H 1 8.377 0.020 A 95 SER HA H 1 4.658 0.020 A 95 SER HBx H 1 3.772 0.020 A 95 SER HBy H 1 3.819 0.020 A 95 SER CA C 13 56.588 0.3 A 95 SER CB C 13 63.194 0.3 A 95 SER N N 15 118.117 0.3 A 96 PRO HA H 1 4.477 0.020 A 96 PRO HBx H 1 1.967 0.020 A 96 PRO HBy H 1 2.217 0.020 A 96 PRO HDx H 1 3.695 0.020 A 96 PRO HDy H 1 3.763 0.020 A 96 PRO HG2 H 1 1.969 0.020 A 96 PRO HG3 H 1 1.969 0.020 A 96 PRO C C 13 176.291 0.3 A 96 PRO CA C 13 63.511 0.3 A 96 PRO CB C 13 31.953 0.3 A 96 PRO CD C 13 50.756 0.3 A 96 PRO CG C 13 27.188 0.3 A 97 THR H H 1 7.735 0.020 A 97 THR HA H 1 4.072 0.020 A 97 THR HB H 1 4.160 0.020 A 97 THR HG2% H 1 1.098 0.020 A 97 THR CA C 13 63.091 0.3 A 97 THR CB C 13 70.775 0.3 A 97 THR CG2 C 13 21.998 0.3 A 97 THR N N 15 118.951 0.3 stop_ save_ save_DYANA/DIANA_distance_constraints_3 _nef_distance_restraint_list.sf_category nef_distance_restraint_list _nef_distance_restraint_list.sf_framecode DYANA/DIANA_distance_constraints_3 _nef_distance_restraint_list.restraint_origin undefined _nef_distance_restraint_list.potential_type . save_ save_DYANA/DIANA_distance_constraints_4 _nef_distance_restraint_list.sf_category nef_distance_restraint_list _nef_distance_restraint_list.sf_framecode DYANA/DIANA_distance_constraints_4 _nef_distance_restraint_list.restraint_origin noe _nef_distance_restraint_list.potential_type upper-bound-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 23 VAL HA A 39 LYS H 1.0 . 3.61 2 2 A 39 LYS H A 39 LYS HBy 1.0 . 3.94 3 3 A 39 LYS H A 38 VAL HA 1.0 . 3.25 4 4 A 39 LYS H A 55 LYS HA 1.0 . 5.50 5 5 A 8 PHE HD% A 92 LYS H 1.0 . 4.19 6 6 A 92 LYS H A 8 PHE HE% 1.0 . 3.97 7 7 A 92 LYS H A 91 GLU HA 1.0 . 3.11 8 8 A 92 LYS H A 92 LYS HB2 1.0 . 3.64 9 8 A 92 LYS H A 92 LYS HB3 1.0 . 3.64 10 9 A 92 LYS H A 6 ASP H 1.0 . 4.69 11 10 A 63 ASN H A 88 LEU HA 1.0 . 4.30 12 11 A 63 ASN H A 86 VAL HGx% 1.0 . 4.61 13 12 A 63 ASN H A 87 HIS HB2 1.0 . 4.45 14 12 A 63 ASN H A 87 HIS HB3 1.0 . 4.45 15 13 A 63 ASN H A 62 VAL HGx% 1.0 . 3.72 16 14 A 63 ASN H A 89 LEU H 1.0 . 5.10 17 15 A 85 VAL H A 86 VAL H 1.0 . 4.83 18 16 A 86 VAL H A 13 ALA HA 1.0 . 3.98 19 17 A 86 VAL H A 85 VAL HA 1.0 . 2.89 20 18 A 86 VAL H A 86 VAL HB 1.0 . 3.27 21 19 A 86 VAL H A 85 VAL HGx% 1.0 . 3.35 22 20 A 41 VAL HA A 42 ILE H 1.0 . 3.17 23 21 A 42 ILE H A 42 ILE HB 1.0 . 3.77 24 22 A 42 ILE H A 42 ILE HG1y 1.0 . 4.05 25 23 A 42 ILE H A 42 ILE HD1% 1.0 . 3.86 26 24 A 42 ILE H A 42 ILE HG1x 1.0 . 4.05 27 25 A 89 LEU HA A 90 LEU H 1.0 . 3.18 28 26 A 90 LEU H A 89 LEU HBx 1.0 . 4.07 29 27 A 90 LEU H A 90 LEU HG 1.0 . 4.69 30 28 A 90 LEU H A 7 ILE HG2% 1.0 . 4.48 31 29 A 90 LEU H A 90 LEU HDx% 1.0 . 4.17 32 30 A 59 VAL HA A 60 LEU H 1.0 . 3.12 33 31 A 60 LEU H A 90 LEU HA 1.0 . 3.67 34 32 A 90 LEU H A 89 LEU HBy 1.0 . 4.51 35 33 A 88 LEU H A 87 HIS HB2 1.0 . 4.12 36 33 A 87 HIS HB3 A 88 LEU H 1.0 . 4.12 37 34 A 88 LEU H A 88 LEU HDx% 1.0 . 4.07 38 35 A 88 LEU H A 87 HIS HA 1.0 . 2.74 39 36 A 88 LEU H A 88 LEU HBy 1.0 . 3.75 40 37 A 88 LEU H A 88 LEU HG 1.0 . 4.20 41 38 A 88 LEU H A 88 LEU HBx 1.0 . 4.10 42 39 A 88 LEU H A 10 VAL HGy% 1.0 . 4.04 43 40 A 88 LEU H A 10 VAL HA 1.0 . 5.50 44 41 A 63 ASN H A 87 HIS H 1.0 . 4.27 45 42 A 87 HIS H A 87 HIS HD2 1.0 . 5.21 46 43 A 86 VAL HGx% A 87 HIS H 1.0 . 3.47 47 44 A 12 LEU HA A 13 ALA H 1.0 . 2.70 48 45 A 13 ALA H A 12 LEU HDy% 1.0 . 4.07 49 46 A 58 ARG HA A 59 VAL H 1.0 . 3.12 50 47 A 59 VAL H A 59 VAL HGy% 1.0 . 3.21 51 48 A 59 VAL H A 37 TYR HA 1.0 . 3.75 52 49 A 59 VAL H A 36 ILE HB 1.0 . 4.59 53 50 A 59 VAL H A 59 VAL HB 1.0 . 3.30 54 51 A 11 GLU HA A 12 LEU H 1.0 . 2.82 55 52 A 12 LEU H A 11 GLU HG2 1.0 . 3.85 56 52 A 12 LEU H A 11 GLU HG3 1.0 . 3.85 57 53 A 85 VAL HGx% A 12 LEU H 1.0 . 3.70 58 54 A 87 HIS H A 86 VAL HA 1.0 . 2.87 59 55 A 87 HIS H A 87 HIS HB2 1.0 . 3.18 60 55 A 87 HIS HB3 A 87 HIS H 1.0 . 3.18 61 56 A 86 VAL HB A 87 HIS H 1.0 . 4.11 62 57 A 88 LEU HDx% A 87 HIS H 1.0 . 4.40 63 58 A 13 ALA H A 11 GLU HG2 1.0 . 5.44 64 58 A 13 ALA H A 11 GLU HG3 1.0 . 5.44 65 59 A 10 VAL HA A 11 GLU H 1.0 . 2.78 66 60 A 11 GLU H A 11 GLU HG2 1.0 . 3.55 67 60 A 11 GLU HG3 A 11 GLU H 1.0 . 3.55 68 61 A 12 LEU H A 11 GLU H 1.0 . 4.65 69 62 A 11 GLU H A 10 VAL HGx% 1.0 . 3.92 70 63 A 8 PHE HD% A 8 PHE H 1.0 . 3.31 71 64 A 8 PHE HE% A 8 PHE H 1.0 . 4.57 72 65 A 8 PHE H A 8 PHE HB2 1.0 . 4.00 73 65 A 8 PHE H A 8 PHE HB3 1.0 . 4.00 74 66 A 8 PHE H A 7 ILE HB 1.0 . 4.21 75 67 A 7 ILE HG2% A 8 PHE H 1.0 . 3.26 76 68 A 90 LEU H A 8 PHE H 1.0 . 3.88 77 69 A 61 ALA HA A 67 LEU H 1.0 . 3.65 78 70 A 67 LEU H A 66 SER HA 1.0 . 3.02 79 71 A 67 LEU H A 66 SER HBx 1.0 . 4.38 80 72 A 67 LEU H A 67 LEU HBy 1.0 . 3.25 81 73 A 67 LEU H A 61 ALA HB% 1.0 . 4.23 82 74 A 67 LEU H A 67 LEU HBx 1.0 . 4.04 83 75 A 31 VAL HA A 32 ARG H 1.0 . 3.31 84 76 A 32 ARG H A 31 VAL HB 1.0 . 4.27 85 77 A 32 ARG H A 32 ARG HGy 1.0 . 4.56 86 78 A 32 ARG H A 31 VAL H 1.0 . 4.76 87 79 A 2 PRO HA A 3 LYS H 1.0 . 2.79 88 80 A 3 LYS H A 6 ASP HBx 1.0 . 4.37 89 81 A 3 LYS H A 6 ASP HBy 1.0 . 4.37 90 82 A 3 LYS H A 2 PRO HBx 1.0 . 3.92 91 83 A 3 LYS H A 3 LYS HG2 1.0 . 3.48 92 83 A 3 LYS H A 3 LYS HG3 1.0 . 3.48 93 84 A 48 GLU H A 48 GLU HG2 1.0 . 4.18 94 84 A 48 GLU H A 48 GLU HG3 1.0 . 4.18 95 85 A 48 GLU H A 48 GLU HB2 1.0 . 3.38 96 85 A 48 GLU H A 48 GLU HB3 1.0 . 3.38 97 86 A 48 GLU H A 47 ALA HB% 1.0 . 3.65 98 87 A 48 GLU H A 47 ALA H 1.0 . 3.72 99 88 A 89 LEU H A 89 LEU HBy 1.0 . 3.62 100 89 A 88 LEU HA A 89 LEU H 1.0 . 2.90 101 90 A 89 LEU H A 62 VAL HA 1.0 . 4.33 102 91 A 89 LEU H A 88 LEU HBx 1.0 . 4.67 103 92 A 54 HIS H A 54 HIS HD2 1.0 . 4.75 104 93 A 54 HIS H A 54 HIS HBx 1.0 . 4.11 105 94 A 54 HIS H A 54 HIS HBy 1.0 . 4.11 106 95 A 54 HIS H A 53 ILE HB 1.0 . 4.40 107 96 A 22 CYS H A 21 ILE HG12 1.0 . 5.17 108 96 A 21 ILE HG13 A 22 CYS H 1.0 . 5.17 109 97 A 22 CYS H A 38 VAL HGx% 1.0 . 4.81 110 98 A 68 GLU H A 68 GLU HG2 1.0 . 3.69 111 98 A 68 GLU H A 68 GLU HG3 1.0 . 3.69 112 99 A 68 GLU H A 69 GLY H 1.0 . 4.63 113 100 A 68 GLU H A 68 GLU HB2 1.0 . 2.83 114 100 A 68 GLU H A 68 GLU HB3 1.0 . 2.83 115 101 A 67 LEU HBy A 68 GLU H 1.0 . 4.10 116 102 A 68 GLU H A 67 LEU HDy% 1.0 . 4.73 117 103 A 64 GLY H A 65 VAL H 1.0 . 3.60 118 104 A 65 VAL H A 62 VAL H 1.0 . 3.79 119 105 A 65 VAL H A 65 VAL HB 1.0 . 3.19 120 106 A 65 VAL H A 65 VAL HGx% 1.0 . 3.03 121 107 A 57 ASP H A 58 ARG H 1.0 . 4.89 122 108 A 58 ARG H A 57 ASP HA 1.0 . 3.05 123 109 A 58 ARG H A 58 ARG HBx 1.0 . 3.85 124 110 A 58 ARG H A 58 ARG HBy 1.0 . 3.85 125 111 A 41 VAL HA A 22 CYS H 1.0 . 5.50 126 112 A 24 THR H A 37 TYR H 1.0 . 3.65 127 113 A 37 TYR H A 36 ILE HA 1.0 . 3.14 128 114 A 37 TYR H A 23 VAL HB 1.0 . 4.62 129 115 A 36 ILE HB A 37 TYR H 1.0 . 4.94 130 116 A 37 TYR H A 24 THR HG2% 1.0 . 4.03 131 117 A 37 TYR H A 36 ILE HD1% 1.0 . 3.84 132 118 A 37 TYR H A 37 TYR HD% 1.0 . 3.57 133 119 A 74 GLN HBx A 75 ALA H 1.0 . 3.99 134 120 A 75 ALA H A 74 GLN H 1.0 . 3.54 135 121 A 75 ALA H A 74 GLN HGy 1.0 . 4.86 136 122 A 75 ALA H A 75 ALA HB% 1.0 . 3.17 137 123 A 67 LEU HDy% A 75 ALA H 1.0 . 5.20 138 124 A 72 HIS H A 73 LYS H 1.0 . 3.83 139 125 A 72 HIS H A 27 VAL H 1.0 . 4.96 140 126 A 72 HIS H A 72 HIS HE1 1.0 . 5.50 141 127 A 72 HIS H A 72 HIS HBx 1.0 . 3.70 142 128 A 72 HIS H A 72 HIS HBy 1.0 . 3.70 143 129 A 57 ASP H A 56 GLY H 1.0 . 3.25 144 130 A 57 ASP H A 93 GLY HAy 1.0 . 5.50 145 131 A 55 LYS HA A 57 ASP H 1.0 . 3.91 146 132 A 57 ASP H A 38 VAL HB 1.0 . 4.07 147 133 A 27 VAL HGx% A 70 ALA H 1.0 . 5.26 148 134 A 69 GLY H A 70 ALA H 1.0 . 3.50 149 135 A 70 ALA H A 70 ALA HB% 1.0 . 2.99 150 136 A 6 ASP H A 5 GLY H 1.0 . 3.45 151 137 A 6 ASP H A 4 PRO HA 1.0 . 4.07 152 138 A 6 ASP H A 6 ASP HBx 1.0 . 3.54 153 139 A 6 ASP H A 6 ASP HBy 1.0 . 3.54 154 140 A 6 ASP H A 92 LYS HB2 1.0 . 3.91 155 140 A 92 LYS HB3 A 6 ASP H 1.0 . 3.91 156 141 A 6 ASP H A 2 PRO HBx 1.0 . 5.26 157 142 A 8 PHE H A 7 ILE H 1.0 . 4.77 158 143 A 7 ILE H A 6 ASP HBx 1.0 . 4.54 159 144 A 7 ILE H A 6 ASP HA 1.0 . 2.90 160 145 A 7 ILE HB A 7 ILE H 1.0 . 3.17 161 146 A 7 ILE H A 7 ILE HG1y 1.0 . 3.82 162 147 A 7 ILE H A 7 ILE HG1x 1.0 . 3.97 163 148 A 65 VAL HB A 66 SER H 1.0 . 4.85 164 149 A 46 ALA H A 45 GLY HAx 1.0 . 3.31 165 150 A 46 ALA H A 45 GLY HAy 1.0 . 3.31 166 151 A 46 ALA H A 46 ALA HB% 1.0 . 3.07 167 152 A 66 SER H A 65 VAL HA 1.0 . 2.73 168 153 A 66 SER H A 66 SER HBy 1.0 . 3.77 169 154 A 40 ALA H A 41 VAL H 1.0 . 4.66 170 155 A 41 VAL H A 40 ALA HA 1.0 . 2.92 171 156 A 41 VAL H A 41 VAL HB 1.0 . 3.66 172 157 A 41 VAL H A 41 VAL HGx% 1.0 . 3.56 173 158 A 55 LYS H A 55 LYS HE2 1.0 . 4.61 174 158 A 55 LYS H A 55 LYS HE3 1.0 . 4.61 175 159 A 55 LYS H A 55 LYS HB2 1.0 . 2.91 176 159 A 55 LYS H A 55 LYS HB3 1.0 . 2.91 177 160 A 55 LYS H A 41 VAL HGy% 1.0 . 4.21 178 161 A 57 ASP H A 38 VAL H 1.0 . 4.70 179 162 A 37 TYR HA A 38 VAL H 1.0 . 3.16 180 163 A 55 LYS HA A 38 VAL H 1.0 . 4.75 181 164 A 59 VAL HGy% A 38 VAL H 1.0 . 4.40 182 165 A 37 TYR HD% A 38 VAL H 1.0 . 4.49 183 166 A 58 ARG HA A 38 VAL H 1.0 . 4.73 184 167 A 38 VAL HB A 38 VAL H 1.0 . 3.41 185 168 A 88 LEU H A 10 VAL H 1.0 . 3.85 186 169 A 11 GLU H A 10 VAL H 1.0 . 4.73 187 170 A 10 VAL H A 9 GLU HA 1.0 . 2.86 188 171 A 11 GLU HA A 10 VAL H 1.0 . 5.16 189 172 A 87 HIS HA A 10 VAL H 1.0 . 5.50 190 173 A 10 VAL H A 9 GLU HG2 1.0 . 4.54 191 173 A 10 VAL H A 9 GLU HG3 1.0 . 4.54 192 174 A 13 ALA HA A 14 LYS H 1.0 . 2.85 193 175 A 85 VAL HA A 14 LYS H 1.0 . 4.00 194 176 A 14 LYS H A 84 GLN HG2 1.0 . 5.29 195 176 A 14 LYS H A 84 GLN HG3 1.0 . 5.29 196 177 A 14 LYS H A 14 LYS HB2 1.0 . 3.28 197 177 A 14 LYS H A 14 LYS HB3 1.0 . 3.28 198 178 A 62 VAL H A 62 VAL HB 1.0 . 3.14 199 179 A 53 ILE HB A 53 ILE H 1.0 . 3.13 200 180 A 50 ASP H A 51 GLY H 1.0 . 3.38 201 181 A 89 LEU HA A 10 VAL H 1.0 . 4.22 202 182 A 88 LEU HBx A 10 VAL H 1.0 . 5.50 203 183 A 10 VAL HGy% A 10 VAL H 1.0 . 3.52 204 184 A 90 LEU HDx% A 10 VAL H 1.0 . 4.32 205 185 A 36 ILE H A 36 ILE HG1x 1.0 . 4.08 206 186 A 36 ILE HB A 36 ILE H 1.0 . 3.55 207 187 A 36 ILE H A 36 ILE HG1y 1.0 . 4.41 208 188 A 59 VAL HGy% A 36 ILE H 1.0 . 4.52 209 189 A 64 GLY H A 62 VAL H 1.0 . 4.91 210 190 A 61 ALA HA A 62 VAL H 1.0 . 2.92 211 191 A 67 LEU HDy% A 62 VAL H 1.0 . 3.67 212 192 A 81 ASN H A 81 ASN HBx 1.0 . 3.98 213 193 A 81 ASN H A 82 THR HG2% 1.0 . 4.49 214 194 A 12 LEU HDy% A 50 ASP H 1.0 . 5.13 215 195 A 50 ASP H A 53 ILE HD1% 1.0 . 5.50 216 196 A 78 THR HB A 79 LEU H 1.0 . 3.40 217 197 A 79 LEU H A 76 VAL HA 1.0 . 3.99 218 198 A 79 LEU H A 79 LEU HG 1.0 . 3.48 219 199 A 79 LEU H A 79 LEU HDy% 1.0 . 3.58 220 200 A 59 VAL HA A 91 GLU H 1.0 . 4.84 221 201 A 90 LEU HA A 91 GLU H 1.0 . 3.11 222 202 A 8 PHE HD% A 9 GLU H 1.0 . 4.02 223 203 A 9 GLU H A 8 PHE HB2 1.0 . 3.28 224 203 A 8 PHE HB3 A 9 GLU H 1.0 . 3.28 225 204 A 9 GLU H A 9 GLU HG2 1.0 . 3.80 226 204 A 9 GLU HG3 A 9 GLU H 1.0 . 3.80 227 205 A 7 ILE HG2% A 9 GLU H 1.0 . 5.11 228 206 A 47 ALA H A 46 ALA H 1.0 . 3.80 229 207 A 47 ALA H A 46 ALA HB% 1.0 . 3.30 230 208 A 47 ALA HB% A 47 ALA H 1.0 . 3.04 231 209 A 47 ALA H A 53 ILE HD1% 1.0 . 4.85 232 210 A 97 THR H A 97 THR HB 1.0 . 3.64 233 211 A 97 THR H A 96 PRO HA 1.0 . 3.15 234 212 A 97 THR H A 96 PRO HBy 1.0 . 4.44 235 213 A 91 GLU H A 91 GLU HBx 1.0 . 3.69 236 214 A 91 GLU H A 91 GLU HBy 1.0 . 3.69 237 215 A 91 GLU H A 90 LEU HBy 1.0 . 4.56 238 216 A 9 GLU H A 8 PHE HA 1.0 . 2.95 239 217 A 59 VAL HA A 61 ALA H 1.0 . 4.37 240 218 A 61 ALA H A 60 LEU HDx% 1.0 . 4.14 241 219 A 60 LEU H A 61 ALA H 1.0 . 3.29 242 220 A 89 LEU HBy A 61 ALA H 1.0 . 3.48 243 221 A 61 ALA HB% A 61 ALA H 1.0 . 3.58 244 222 A 97 THR H A 97 THR HG2% 1.0 . 3.95 245 223 A 61 ALA H A 59 VAL HGx% 1.0 . 3.37 246 224 A 93 GLY H A 92 LYS HE2 1.0 . 4.51 247 224 A 92 LYS HE3 A 93 GLY H 1.0 . 4.51 248 225 A 93 GLY H A 92 LYS HA 1.0 . 3.02 249 226 A 28 ASN H A 29 THR HA 1.0 . 5.36 250 227 A 31 VAL HB A 31 VAL H 1.0 . 3.81 251 228 A 58 ARG H A 93 GLY H 1.0 . 5.02 252 229 A 8 PHE HE% A 93 GLY H 1.0 . 5.50 253 230 A 93 GLY H A 92 LYS HB2 1.0 . 4.62 254 230 A 92 LYS HB3 A 93 GLY H 1.0 . 4.62 255 231 A 27 VAL H A 28 ASN H 1.0 . 4.23 256 232 A 28 ASN H A 29 THR H 1.0 . 4.05 257 233 A 28 ASN H A 27 VAL HGy% 1.0 . 3.81 258 234 A 28 ASN H A 27 VAL HB 1.0 . 4.60 259 235 A 52 ARG H A 52 ARG HDx 1.0 . 5.50 260 236 A 15 ASN H A 17 ASN H 1.0 . 4.82 261 237 A 15 ASN H A 14 LYS HB2 1.0 . 4.11 262 237 A 14 LYS HB3 A 15 ASN H 1.0 . 4.11 263 238 A 78 THR HB A 78 THR H 1.0 . 3.14 264 239 A 67 LEU HDy% A 78 THR H 1.0 . 4.55 265 240 A 53 ILE H A 52 ARG H 1.0 . 3.33 266 241 A 51 GLY H A 52 ARG H 1.0 . 3.72 267 242 A 52 ARG H A 52 ARG HB2 1.0 . 3.37 268 242 A 52 ARG H A 52 ARG HB3 1.0 . 3.37 269 243 A 52 ARG H A 52 ARG HG2 1.0 . 3.25 270 243 A 52 ARG H A 52 ARG HG3 1.0 . 3.25 271 244 A 53 ILE HD1% A 52 ARG H 1.0 . 4.17 272 245 A 39 LYS H A 40 ALA H 1.0 . 3.23 273 246 A 22 CYS H A 40 ALA H 1.0 . 4.89 274 247 A 23 VAL HA A 40 ALA H 1.0 . 4.93 275 248 A 38 VAL HA A 40 ALA H 1.0 . 4.11 276 249 A 40 ALA H A 39 LYS HBx 1.0 . 4.25 277 250 A 40 ALA H A 40 ALA HB% 1.0 . 3.28 278 251 A 38 VAL HGx% A 40 ALA H 1.0 . 3.40 279 252 A 84 GLN H A 84 GLN HG2 1.0 . 3.94 280 252 A 84 GLN HG3 A 84 GLN H 1.0 . 3.94 281 253 A 84 GLN H A 83 GLY HAy 1.0 . 3.25 282 254 A 84 GLN H A 84 GLN HBy 1.0 . 3.92 283 255 A 43 PRO HA A 44 GLN H 1.0 . 2.92 284 256 A 74 GLN H A 73 LYS H 1.0 . 4.05 285 257 A 73 LYS H A 72 HIS HBx 1.0 . 4.32 286 258 A 73 LYS H A 72 HIS HBy 1.0 . 4.32 287 259 A 73 LYS H A 71 THR HG2% 1.0 . 4.94 288 260 A 94 GLN H A 94 GLN HG2 1.0 . 4.03 289 260 A 94 GLN H A 94 GLN HG3 1.0 . 4.03 290 261 A 93 GLY H A 94 GLN H 1.0 . 4.81 291 262 A 27 VAL H A 26 GLY HAy 1.0 . 3.51 292 263 A 27 VAL H A 27 VAL HB 1.0 . 3.81 293 264 A 27 VAL H A 27 VAL HGy% 1.0 . 3.15 294 265 A 74 GLN H A 71 THR HA 1.0 . 4.90 295 266 A 74 GLN H A 74 GLN HGx 1.0 . 3.75 296 267 A 74 GLN H A 74 GLN HGy 1.0 . 3.75 297 268 A 74 GLN HBx A 74 GLN H 1.0 . 4.14 298 269 A 74 GLN H A 71 THR HG2% 1.0 . 4.57 299 270 A 85 VAL H A 83 GLY HAy 1.0 . 4.22 300 271 A 85 VAL H A 84 GLN H 1.0 . 3.36 301 272 A 85 VAL H A 84 GLN HBy 1.0 . 4.07 302 273 A 85 VAL H A 85 VAL HB 1.0 . 3.08 303 274 A 85 VAL H A 85 VAL HGy% 1.0 . 3.32 304 275 A 85 VAL H A 85 VAL HGx% 1.0 . 3.97 305 276 A 69 GLY H A 68 GLU HG2 1.0 . 4.56 306 276 A 68 GLU HG3 A 69 GLY H 1.0 . 4.56 307 277 A 23 VAL HA A 24 THR H 1.0 . 3.16 308 278 A 24 THR H A 24 THR HB 1.0 . 4.12 309 279 A 24 THR H A 23 VAL HB 1.0 . 3.26 310 280 A 24 THR H A 24 THR HG2% 1.0 . 3.45 311 281 A 24 THR H A 23 VAL HGx% 1.0 . 3.67 312 282 A 24 THR H A 23 VAL HGy% 1.0 . 4.02 313 283 A 69 GLY H A 68 GLU HA 1.0 . 3.07 314 284 A 69 GLY H A 27 VAL HGx% 1.0 . 5.20 315 285 A 20 GLY H A 21 ILE H 1.0 . 3.54 316 286 A 21 ILE H A 19 LEU HDx% 1.0 . 5.14 317 287 A 21 ILE H A 21 ILE HG12 1.0 . 3.57 318 287 A 21 ILE HG13 A 21 ILE H 1.0 . 3.57 319 288 A 55 LYS HA A 56 GLY H 1.0 . 2.92 320 289 A 56 GLY H A 38 VAL HB 1.0 . 3.78 321 290 A 56 GLY H A 55 LYS HB2 1.0 . 4.01 322 290 A 56 GLY H A 55 LYS HB3 1.0 . 4.01 323 291 A 38 VAL HGx% A 56 GLY H 1.0 . 4.60 324 292 A 5 GLY H A 4 PRO HA 1.0 . 2.90 325 293 A 5 GLY H A 92 LYS HB2 1.0 . 3.73 326 293 A 92 LYS HB3 A 5 GLY H 1.0 . 3.73 327 294 A 48 GLU H A 49 SER H 1.0 . 3.57 328 295 A 49 SER H A 49 SER HB2 1.0 . 3.02 329 295 A 49 SER H A 49 SER HB3 1.0 . 3.02 330 296 A 49 SER H A 48 GLU HG2 1.0 . 3.38 331 296 A 48 GLU HG3 A 49 SER H 1.0 . 3.38 332 297 A 76 VAL H A 76 VAL HGy% 1.0 . 3.57 333 298 A 24 THR HA A 25 GLY H 1.0 . 3.37 334 299 A 24 THR HG2% A 25 GLY H 1.0 . 4.05 335 300 A 25 GLY H A 31 VAL HGy% 1.0 . 4.59 336 301 A 17 ASN H A 18 SER H 1.0 . 3.75 337 302 A 18 SER H A 17 ASN HA 1.0 . 3.55 338 303 A 18 SER H A 18 SER HBx 1.0 . 3.64 339 304 A 18 SER H A 18 SER HBy 1.0 . 3.64 340 305 A 70 ALA HA A 71 THR H 1.0 . 2.75 341 306 A 71 THR H A 74 GLN HBy 1.0 . 3.38 342 307 A 74 GLN HBx A 71 THR H 1.0 . 4.21 343 308 A 71 THR HG2% A 71 THR H 1.0 . 3.06 344 309 A 27 VAL HGy% A 71 THR H 1.0 . 5.39 345 310 A 71 THR H A 74 GLN HA 1.0 . 5.50 346 311 A 29 THR H A 29 THR HG2% 1.0 . 3.83 347 312 A 81 ASN HA A 82 THR H 1.0 . 3.32 348 313 A 82 THR HG2% A 82 THR H 1.0 . 3.89 349 314 A 34 GLY H A 35 GLY H 1.0 . 3.77 350 315 A 34 GLY H A 28 ASN HA 1.0 . 4.36 351 316 A 82 THR HA A 83 GLY H 1.0 . 3.04 352 317 A 82 THR HG2% A 83 GLY H 1.0 . 4.08 353 318 A 83 GLY H A 86 VAL HGy% 1.0 . 4.26 354 319 A 31 VAL HGy% A 26 GLY H 1.0 . 4.81 355 320 A 43 PRO HA A 45 GLY H 1.0 . 4.51 356 321 A 45 GLY H A 44 GLN HA 1.0 . 3.21 357 322 A 44 GLN H A 45 GLY H 1.0 . 3.63 358 323 A 45 GLY H A 48 GLU HG2 1.0 . 4.17 359 323 A 48 GLU HG3 A 45 GLY H 1.0 . 4.17 360 324 A 45 GLY H A 48 GLU HB2 1.0 . 4.05 361 324 A 48 GLU HB3 A 45 GLY H 1.0 . 4.05 362 325 A 46 ALA H A 45 GLY H 1.0 . 4.75 363 326 A 20 GLY H A 19 LEU HG 1.0 . 4.55 364 327 A 20 GLY H A 19 LEU HBy 1.0 . 4.33 365 328 A 20 GLY H A 19 LEU HBx 1.0 . 4.33 366 329 A 20 GLY H A 14 LYS HG2 1.0 . 5.50 367 329 A 20 GLY H A 14 LYS HG3 1.0 . 5.50 368 330 A 31 VAL HGy% A 35 GLY H 1.0 . 4.17 369 331 A 64 GLY H A 65 VAL HB 1.0 . 5.49 370 332 A 61 ALA HB% A 64 GLY H 1.0 . 4.16 371 333 A 63 ASN H A 64 GLY H 1.0 . 3.84 372 334 A 51 GLY H A 48 GLU HG2 1.0 . 5.06 373 334 A 48 GLU HG3 A 51 GLY H 1.0 . 5.06 374 335 A 51 GLY H A 53 ILE HD1% 1.0 . 4.50 375 336 A 92 LYS H A 92 LYS HD2 1.0 . 5.01 376 336 A 92 LYS H A 92 LYS HD3 1.0 . 5.01 377 337 A 63 ASN H A 62 VAL HB 1.0 . 5.19 378 338 A 86 VAL H A 12 LEU HBx 1.0 . 4.67 379 339 A 86 VAL H A 13 ALA H 1.0 . 5.50 380 340 A 86 VAL H A 14 LYS H 1.0 . 5.50 381 341 A 92 LYS H A 58 ARG H 1.0 . 5.50 382 342 A 60 LEU H A 59 VAL H 1.0 . 4.43 383 343 A 90 LEU H A 10 VAL HGy% 1.0 . 4.15 384 344 A 11 GLU H A 10 VAL HB 1.0 . 4.00 385 345 A 32 ARG H A 32 ARG HGx 1.0 . 4.56 386 346 A 6 ASP H A 3 LYS H 1.0 . 5.29 387 347 A 89 LEU H A 89 LEU HDy% 1.0 . 3.76 388 348 A 67 LEU HDy% A 65 VAL H 1.0 . 4.78 389 349 A 65 VAL H A 63 ASN HA 1.0 . 4.68 390 350 A 61 ALA HA A 65 VAL H 1.0 . 5.50 391 351 A 68 GLU H A 70 ALA H 1.0 . 4.64 392 352 A 65 VAL H A 66 SER H 1.0 . 4.62 393 353 A 67 LEU HBx A 68 GLU H 1.0 . 4.73 394 354 A 90 LEU HA A 58 ARG H 1.0 . 4.82 395 355 A 36 ILE HD1% A 75 ALA H 1.0 . 4.82 396 356 A 72 HIS H A 27 VAL HGy% 1.0 . 4.69 397 357 A 57 ASP H A 93 GLY HAx 1.0 . 5.50 398 358 A 67 LEU HBx A 70 ALA H 1.0 . 4.73 399 359 A 55 LYS H A 55 LYS HGx 1.0 . 4.57 400 360 A 55 LYS H A 55 LYS HGy 1.0 . 4.57 401 361 A 41 VAL H A 55 LYS HD2 1.0 . 4.53 402 361 A 41 VAL H A 55 LYS HD3 1.0 . 4.53 403 362 A 41 VAL H A 42 ILE HG2% 1.0 . 4.95 404 363 A 37 TYR H A 38 VAL H 1.0 . 4.64 405 364 A 53 ILE H A 52 ARG HB2 1.0 . 4.37 406 364 A 53 ILE H A 52 ARG HB3 1.0 . 4.37 407 365 A 14 LYS H A 17 ASN H 1.0 . 5.50 408 366 A 14 LYS H A 15 ASN H 1.0 . 4.57 409 367 A 8 PHE HD% A 10 VAL H 1.0 . 5.14 410 368 A 79 LEU H A 78 THR HG2% 1.0 . 4.47 411 369 A 79 LEU H A 76 VAL H 1.0 . 5.26 412 370 A 50 ASP H A 49 SER H 1.0 . 3.51 413 371 A 58 ARG H A 91 GLU H 1.0 . 4.11 414 372 A 52 ARG H A 52 ARG HDy 1.0 . 5.50 415 373 A 53 ILE HB A 52 ARG H 1.0 . 4.51 416 374 A 28 ASN H A 69 GLY HAx 1.0 . 5.45 417 375 A 28 ASN H A 29 THR HG2% 1.0 . 5.50 418 376 A 44 GLN H A 43 PRO HBx 1.0 . 4.39 419 377 A 13 ALA H A 15 ASN H 1.0 . 5.50 420 378 A 27 VAL H A 26 GLY H 1.0 . 4.83 421 379 A 73 LYS H A 71 THR HB 1.0 . 5.20 422 380 A 85 VAL H A 13 ALA HA 1.0 . 5.10 423 381 A 39 LYS H A 24 THR H 1.0 . 4.72 424 382 A 69 GLY H A 68 GLU HB2 1.0 . 4.40 425 382 A 69 GLY H A 68 GLU HB3 1.0 . 4.40 426 383 A 24 THR H A 39 LYS HBx 1.0 . 4.76 427 384 A 92 LYS H A 5 GLY H 1.0 . 4.52 428 385 A 51 GLY H A 49 SER H 1.0 . 4.58 429 386 A 62 VAL H A 61 ALA H 1.0 . 4.63 430 387 A 90 LEU HDx% A 91 GLU H 1.0 . 5.15 431 388 A 91 GLU H A 90 LEU HDy% 1.0 . 4.16 432 389 A 91 GLU H A 60 LEU HDx% 1.0 . 4.92 433 390 A 74 GLN H A 71 THR H 1.0 . 4.14 434 391 A 64 GLY H A 62 VAL HB 1.0 . 5.49 435 392 A 64 GLY H A 65 VAL HGx% 1.0 . 4.76 436 393 A 64 GLY H A 89 LEU HDy% 1.0 . 5.41 437 394 A 51 GLY H A 52 ARG HG2 1.0 . 5.25 438 394 A 51 GLY H A 52 ARG HG3 1.0 . 5.25 439 395 A 4 PRO HDy A 3 LYS HBx 1.0 . 4.89 440 396 A 13 ALA HA A 85 VAL HA 1.0 . 3.28 441 397 A 2 PRO HDx A 1 GLY HA2 1.0 . 3.13 442 397 A 1 GLY HA3 A 2 PRO HDx 1.0 . 3.13 443 398 A 36 ILE HD1% A 36 ILE H 1.0 . 4.34 444 399 A 36 ILE HB A 36 ILE HD1% 1.0 . 4.11 445 400 A 36 ILE HD1% A 26 GLY HAy 1.0 . 4.08 446 401 A 36 ILE HD1% A 26 GLY HAx 1.0 . 4.06 447 402 A 36 ILE HD1% A 75 ALA HB% 1.0 . 3.24 448 403 A 12 LEU HDy% A 12 LEU HBy 1.0 . 3.47 449 404 A 86 VAL HB A 12 LEU HBy 1.0 . 5.50 450 405 A 12 LEU H A 12 LEU HBx 1.0 . 4.15 451 406 A 91 GLU H A 90 LEU HBx 1.0 . 4.56 452 407 A 89 LEU HBx A 61 ALA HB% 1.0 . 4.57 453 408 A 89 LEU HBx A 61 ALA H 1.0 . 4.71 454 409 A 62 VAL HGx% A 88 LEU HBx 1.0 . 4.80 455 410 A 88 LEU HDx% A 88 LEU HBy 1.0 . 3.83 456 411 A 60 LEU HDy% A 58 ARG HDx 1.0 . 5.00 457 412 A 53 ILE HD1% A 50 ASP HBx 1.0 . 4.47 458 413 A 12 LEU HDy% A 50 ASP HBy 1.0 . 3.93 459 414 A 53 ILE HD1% A 50 ASP HBy 1.0 . 4.47 460 415 A 10 VAL HB A 52 ARG HDx 1.0 . 3.86 461 416 A 10 VAL HB A 52 ARG HDy 1.0 . 3.86 462 417 A 27 VAL HGx% A 26 GLY HAy 1.0 . 4.48 463 418 A 10 VAL HGy% A 52 ARG HDy 1.0 . 4.69 464 419 A 31 VAL HGy% A 26 GLY HAx 1.0 . 5.39 465 420 A 36 ILE HG1y A 26 GLY HAx 1.0 . 5.50 466 421 A 1 GLY HA3 A 2 PRO HDy 1.0 . 3.13 467 421 A 1 GLY HA2 A 2 PRO HDy 1.0 . 3.13 468 422 A 21 ILE HB A 21 ILE HD1% 1.0 . 3.99 469 423 A 39 LYS HE2 A 39 LYS HGx 1.0 . 3.63 470 423 A 39 LYS HE3 A 39 LYS HGx 1.0 . 3.63 471 424 A 76 VAL HA A 79 LEU HBx 1.0 . 4.86 472 425 A 22 CYS H A 21 ILE HB 1.0 . 4.51 473 426 A 79 LEU HDx% A 79 LEU HBy 1.0 . 3.76 474 427 A 55 LYS HB2 A 55 LYS HE2 1.0 . 2.64 475 427 A 55 LYS HB3 A 55 LYS HE2 1.0 . 2.64 476 427 A 55 LYS HE3 A 55 LYS HB2 1.0 . 2.64 477 427 A 55 LYS HE3 A 55 LYS HB3 1.0 . 2.64 478 428 A 24 THR HG2% A 39 LYS HE2 1.0 . 4.52 479 428 A 24 THR HG2% A 39 LYS HE3 1.0 . 4.52 480 429 A 39 LYS HE3 A 39 LYS HGy 1.0 . 3.63 481 429 A 39 LYS HGy A 39 LYS HE2 1.0 . 3.63 482 430 A 79 LEU HDx% A 79 LEU HBx 1.0 . 3.76 483 431 A 55 LYS HGy A 55 LYS HE2 1.0 . 4.15 484 431 A 55 LYS HE3 A 55 LYS HGy 1.0 . 4.15 485 432 A 76 VAL HA A 79 LEU HBy 1.0 . 4.86 486 433 A 92 LYS HE2 A 92 LYS HGy 1.0 . 3.74 487 433 A 92 LYS HE3 A 92 LYS HGy 1.0 . 3.74 488 434 A 92 LYS HB3 A 92 LYS HE2 1.0 . 4.12 489 434 A 92 LYS HB2 A 92 LYS HE2 1.0 . 4.12 490 434 A 92 LYS HE3 A 92 LYS HB2 1.0 . 4.12 491 434 A 92 LYS HB3 A 92 LYS HE3 1.0 . 4.12 492 435 A 92 LYS HE3 A 92 LYS HGx 1.0 . 3.74 493 435 A 92 LYS HGx A 92 LYS HE2 1.0 . 3.74 494 436 A 7 ILE H A 6 ASP HBy 1.0 . 4.54 495 437 A 53 ILE HG2% A 57 ASP HBx 1.0 . 4.63 496 438 A 67 LEU HBx A 67 LEU HDx% 1.0 . 3.74 497 439 A 46 ALA HB% A 15 ASN HBx 1.0 . 4.02 498 440 A 67 LEU HBy A 62 VAL H 1.0 . 4.69 499 441 A 48 GLU H A 53 ILE HB 1.0 . 5.45 500 442 A 81 ASN H A 81 ASN HBy 1.0 . 3.98 501 443 A 89 LEU HA A 9 GLU HG2 1.0 . 5.42 502 443 A 89 LEU HA A 9 GLU HG3 1.0 . 5.42 503 444 A 9 GLU HA A 9 GLU HG2 1.0 . 3.64 504 444 A 9 GLU HA A 9 GLU HG3 1.0 . 3.64 505 445 A 8 PHE HA A 9 GLU HG2 1.0 . 4.39 506 445 A 9 GLU HG3 A 8 PHE HA 1.0 . 4.39 507 446 A 11 GLU HA A 11 GLU HG2 1.0 . 3.66 508 446 A 11 GLU HA A 11 GLU HG3 1.0 . 3.66 509 447 A 10 VAL H A 10 VAL HB 1.0 . 4.00 510 448 A 90 LEU HDx% A 10 VAL HB 1.0 . 4.34 511 449 A 68 GLU HA A 68 GLU HG2 1.0 . 3.58 512 449 A 68 GLU HG3 A 68 GLU HA 1.0 . 3.58 513 450 A 67 LEU H A 68 GLU HG2 1.0 . 3.73 514 450 A 67 LEU H A 68 GLU HG3 1.0 . 3.73 515 451 A 68 GLU HB2 A 68 GLU HG2 1.0 . 2.59 516 451 A 68 GLU HB3 A 68 GLU HG2 1.0 . 2.59 517 451 A 68 GLU HG3 A 68 GLU HB2 1.0 . 2.59 518 451 A 68 GLU HG3 A 68 GLU HB3 1.0 . 2.59 519 452 A 36 ILE HB A 59 VAL HB 1.0 . 3.82 520 453 A 23 VAL HB A 24 THR HA 1.0 . 4.65 521 454 A 44 GLN HA A 44 GLN HGy 1.0 . 3.70 522 455 A 86 VAL HB A 85 VAL HGx% 1.0 . 4.24 523 456 A 39 LYS HBy A 24 THR HG2% 1.0 . 4.66 524 457 A 39 LYS HBy A 40 ALA H 1.0 . 4.25 525 458 A 67 LEU HDy% A 62 VAL HB 1.0 . 3.21 526 459 A 85 VAL H A 84 GLN HG2 1.0 . 4.36 527 459 A 85 VAL H A 84 GLN HG3 1.0 . 4.36 528 460 A 75 ALA H A 74 GLN HGx 1.0 . 4.86 529 461 A 94 GLN HG3 A 94 GLN HBy 1.0 . 2.98 530 461 A 94 GLN HBy A 94 GLN HG2 1.0 . 2.98 531 462 A 84 GLN HA A 84 GLN HG2 1.0 . 3.80 532 462 A 84 GLN HG3 A 84 GLN HA 1.0 . 3.80 533 463 A 94 GLN HA A 94 GLN HG2 1.0 . 3.61 534 463 A 94 GLN HG3 A 94 GLN HA 1.0 . 3.61 535 464 A 94 GLN HG3 A 94 GLN HBx 1.0 . 2.98 536 464 A 94 GLN HBx A 94 GLN HG2 1.0 . 2.98 537 465 A 83 GLY H A 82 THR HB 1.0 . 3.98 538 466 A 31 VAL HB A 37 TYR HE% 1.0 . 4.69 539 467 A 2 PRO HBx A 6 ASP HBx 1.0 . 4.53 540 468 A 2 PRO HBx A 6 ASP HBy 1.0 . 4.53 541 469 A 44 GLN H A 43 PRO HBy 1.0 . 4.39 542 470 A 4 PRO HDx A 3 LYS HBx 1.0 . 3.88 543 471 A 3 LYS HG3 A 3 LYS HBx 1.0 . 2.96 544 471 A 3 LYS HBx A 3 LYS HG2 1.0 . 2.96 545 472 A 4 PRO HDy A 3 LYS HBy 1.0 . 4.89 546 473 A 4 PRO HDx A 3 LYS HBy 1.0 . 3.88 547 474 A 3 LYS HG3 A 3 LYS HBy 1.0 . 2.96 548 474 A 3 LYS HBy A 3 LYS HG2 1.0 . 2.96 549 475 A 38 VAL HB A 55 LYS H 1.0 . 4.78 550 476 A 63 ASN HA A 87 HIS HB2 1.0 . 3.61 551 476 A 87 HIS HB3 A 63 ASN HA 1.0 . 3.61 552 477 A 86 VAL HA A 87 HIS HB2 1.0 . 4.33 553 477 A 87 HIS HB3 A 86 VAL HA 1.0 . 4.33 554 478 A 40 ALA HA A 55 LYS HD2 1.0 . 4.63 555 478 A 40 ALA HA A 55 LYS HD3 1.0 . 4.63 556 479 A 85 VAL H A 84 GLN HBx 1.0 . 4.07 557 480 A 84 GLN H A 84 GLN HBx 1.0 . 3.92 558 481 A 67 LEU H A 68 GLU HB2 1.0 . 4.13 559 481 A 67 LEU H A 68 GLU HB3 1.0 . 4.13 560 482 A 8 PHE HE% A 92 LYS HD2 1.0 . 4.55 561 482 A 8 PHE HE% A 92 LYS HD3 1.0 . 4.55 562 483 A 92 LYS HA A 92 LYS HD2 1.0 . 4.43 563 483 A 92 LYS HA A 92 LYS HD3 1.0 . 4.43 564 484 A 85 VAL HGy% A 84 GLN HBx 1.0 . 4.49 565 485 A 85 VAL HGy% A 84 GLN HBy 1.0 . 4.49 566 486 A 93 GLY H A 92 LYS HD2 1.0 . 4.74 567 486 A 93 GLY H A 92 LYS HD3 1.0 . 4.74 568 487 A 3 LYS HA A 3 LYS HD2 1.0 . 4.36 569 487 A 3 LYS HA A 3 LYS HD3 1.0 . 4.36 570 488 A 74 GLN H A 74 GLN HBy 1.0 . 4.04 571 489 A 75 ALA H A 74 GLN HBy 1.0 . 4.72 572 490 A 53 ILE HG2% A 53 ILE HG1x 1.0 . 3.48 573 491 A 67 LEU HDy% A 78 THR HB 1.0 . 4.17 574 492 A 44 GLN H A 43 PRO HGx 1.0 . 4.92 575 493 A 7 ILE HG1x A 7 ILE HA 1.0 . 3.83 576 494 A 91 GLU HA A 7 ILE HG1y 1.0 . 5.50 577 495 A 79 LEU HG A 79 LEU HA 1.0 . 4.27 578 496 A 7 ILE HG1x A 60 LEU HDx% 1.0 . 3.93 579 497 A 8 PHE HE% A 90 LEU HDx% 1.0 . 4.07 580 498 A 90 LEU HDx% A 59 VAL HA 1.0 . 4.68 581 499 A 60 LEU H A 60 LEU HG 1.0 . 4.08 582 500 A 90 LEU HDx% A 88 LEU H 1.0 . 4.68 583 501 A 89 LEU HA A 90 LEU HDx% 1.0 . 4.37 584 502 A 79 LEU HDy% A 78 THR HA 1.0 . 5.50 585 503 A 90 LEU HA A 90 LEU HDy% 1.0 . 3.81 586 504 A 90 LEU HDy% A 90 LEU HBx 1.0 . 4.05 587 505 A 59 VAL HA A 90 LEU HDy% 1.0 . 3.63 588 506 A 90 LEU HDy% A 90 LEU HBy 1.0 . 4.05 589 507 A 13 ALA H A 12 LEU HG 1.0 . 5.50 590 508 A 11 GLU HA A 12 LEU HDx% 1.0 . 4.59 591 509 A 60 LEU H A 60 LEU HDx% 1.0 . 4.32 592 510 A 88 LEU HBx A 12 LEU HDx% 1.0 . 3.76 593 511 A 47 ALA H A 21 ILE HG12 1.0 . 4.96 594 511 A 47 ALA H A 21 ILE HG13 1.0 . 4.96 595 512 A 19 LEU HDx% A 19 LEU HBy 1.0 . 3.52 596 513 A 60 LEU HDx% A 60 LEU HA 1.0 . 4.13 597 514 A 7 ILE HB A 60 LEU HDx% 1.0 . 4.16 598 515 A 36 ILE HG1x A 23 VAL HGx% 1.0 . 4.96 599 516 A 36 ILE HG1x A 23 VAL HGy% 1.0 . 5.38 600 517 A 19 LEU HDx% A 14 LYS HA 1.0 . 5.08 601 518 A 19 LEU HDx% A 19 LEU HBx 1.0 . 3.52 602 519 A 90 LEU HA A 60 LEU HDx% 1.0 . 4.35 603 520 A 91 GLU HA A 60 LEU HDx% 1.0 . 4.51 604 521 A 67 LEU HBy A 67 LEU HDx% 1.0 . 3.33 605 522 A 36 ILE HB A 67 LEU HDx% 1.0 . 4.97 606 523 A 36 ILE HG1y A 67 LEU HDx% 1.0 . 3.69 607 524 A 61 ALA HB% A 89 LEU HDy% 1.0 . 3.33 608 525 A 89 LEU HDy% A 9 GLU HG2 1.0 . 4.28 609 525 A 9 GLU HG3 A 89 LEU HDy% 1.0 . 4.28 610 526 A 89 LEU HBy A 89 LEU HDy% 1.0 . 3.15 611 527 A 89 LEU H A 88 LEU HDy% 1.0 . 4.49 612 528 A 62 VAL HA A 88 LEU HDy% 1.0 . 3.66 613 529 A 59 VAL HA A 88 LEU HDy% 1.0 . 5.33 614 530 A 88 LEU HA A 88 LEU HDy% 1.0 . 3.47 615 531 A 90 LEU HDx% A 88 LEU HDy% 1.0 . 4.21 616 532 A 67 LEU HDx% A 75 ALA HA 1.0 . 4.02 617 533 A 76 VAL H A 67 LEU HDx% 1.0 . 4.87 618 534 A 79 LEU H A 79 LEU HDx% 1.0 . 4.49 619 535 A 76 VAL H A 79 LEU HDx% 1.0 . 5.50 620 536 A 76 VAL HA A 79 LEU HDx% 1.0 . 3.75 621 537 A 12 LEU HDy% A 47 ALA H 1.0 . 4.17 622 538 A 61 ALA H A 89 LEU HDy% 1.0 . 4.65 623 539 A 12 LEU HA A 12 LEU HDy% 1.0 . 3.32 624 540 A 12 LEU HDy% A 47 ALA HA 1.0 . 3.24 625 541 A 12 LEU HDy% A 50 ASP HBx 1.0 . 3.93 626 542 A 4 PRO HA A 92 LYS HB2 1.0 . 4.01 627 542 A 92 LYS HB3 A 4 PRO HA 1.0 . 4.01 628 543 A 55 LYS HE2 A 55 LYS HGx 1.0 . 4.15 629 543 A 55 LYS HE3 A 55 LYS HGx 1.0 . 4.15 630 544 A 4 PRO HA A 92 LYS HGx 1.0 . 4.73 631 545 A 3 LYS HD2 A 3 LYS HG2 1.0 . 2.40 632 545 A 3 LYS HD3 A 3 LYS HG2 1.0 . 2.40 633 545 A 3 LYS HG3 A 3 LYS HD2 1.0 . 2.40 634 545 A 3 LYS HG3 A 3 LYS HD3 1.0 . 2.40 635 546 A 43 PRO HA A 48 GLU HG2 1.0 . 4.19 636 546 A 48 GLU HG3 A 43 PRO HA 1.0 . 4.19 637 547 A 79 LEU HDy% A 79 LEU HBx 1.0 . 3.73 638 548 A 43 PRO HA A 44 GLN HA 1.0 . 4.71 639 549 A 89 LEU H A 89 LEU HDx% 1.0 . 4.44 640 550 A 79 LEU HDy% A 79 LEU HA 1.0 . 3.21 641 551 A 79 LEU HDy% A 79 LEU HBy 1.0 . 3.73 642 552 A 27 VAL HGy% A 27 VAL HA 1.0 . 3.27 643 553 A 90 LEU H A 89 LEU HDx% 1.0 . 4.05 644 554 A 9 GLU HA A 89 LEU HDx% 1.0 . 3.63 645 555 A 89 LEU HA A 89 LEU HDx% 1.0 . 3.02 646 556 A 89 LEU HDx% A 9 GLU HG2 1.0 . 3.11 647 556 A 9 GLU HG3 A 89 LEU HDx% 1.0 . 3.11 648 557 A 79 LEU HDy% A 78 THR HG2% 1.0 . 3.87 649 558 A 28 ASN HA A 27 VAL HA 1.0 . 4.90 650 559 A 97 THR HB A 96 PRO HA 1.0 . 4.84 651 560 A 66 SER H A 66 SER HBx 1.0 . 3.77 652 561 A 67 LEU H A 66 SER HBy 1.0 . 4.38 653 562 A 96 PRO HA A 97 THR HA 1.0 . 4.71 654 563 A 4 PRO HA A 92 LYS HGy 1.0 . 4.73 655 564 A 97 THR HA A 96 PRO HBx 1.0 . 4.90 656 565 A 10 VAL HGy% A 11 GLU H 1.0 . 4.22 657 566 A 89 LEU HA A 10 VAL HGy% 1.0 . 4.81 658 567 A 50 ASP H A 49 SER HB2 1.0 . 4.61 659 567 A 50 ASP H A 49 SER HB3 1.0 . 4.61 660 568 A 86 VAL HA A 86 VAL HGy% 1.0 . 3.20 661 569 A 86 VAL H A 86 VAL HGy% 1.0 . 3.52 662 570 A 86 VAL HGy% A 82 THR HB 1.0 . 3.17 663 571 A 82 THR HG2% A 86 VAL HGy% 1.0 . 3.28 664 572 A 87 HIS HA A 10 VAL HGy% 1.0 . 5.26 665 573 A 88 LEU HA A 10 VAL HGy% 1.0 . 5.50 666 574 A 10 VAL HGy% A 52 ARG HB2 1.0 . 4.36 667 574 A 10 VAL HGy% A 52 ARG HB3 1.0 . 4.36 668 575 A 8 PHE HD% A 10 VAL HGy% 1.0 . 3.78 669 576 A 8 PHE HE% A 10 VAL HGy% 1.0 . 3.42 670 577 A 10 VAL HGy% A 9 GLU HA 1.0 . 4.43 671 578 A 10 VAL HGy% A 10 VAL HA 1.0 . 3.35 672 579 A 10 VAL HGy% A 52 ARG HDx 1.0 . 4.69 673 580 A 90 LEU HDx% A 10 VAL HGy% 1.0 . 3.20 674 581 A 59 VAL HGx% A 60 LEU HA 1.0 . 4.55 675 582 A 82 THR HG2% A 79 LEU HA 1.0 . 3.76 676 583 A 86 VAL HGx% A 87 HIS HB2 1.0 . 4.25 677 583 A 86 VAL HGx% A 87 HIS HB3 1.0 . 4.25 678 584 A 60 LEU H A 59 VAL HGx% 1.0 . 4.04 679 585 A 59 VAL HA A 59 VAL HGx% 1.0 . 3.28 680 586 A 82 THR HG2% A 82 THR HA 1.0 . 3.26 681 587 A 86 VAL HGx% A 86 VAL H 1.0 . 4.38 682 588 A 86 VAL HGx% A 88 LEU H 1.0 . 4.86 683 589 A 88 LEU HA A 86 VAL HGx% 1.0 . 4.70 684 590 A 86 VAL HGx% A 86 VAL HA 1.0 . 3.24 685 591 A 67 LEU HDy% A 67 LEU HA 1.0 . 3.03 686 592 A 90 LEU H A 59 VAL HGx% 1.0 . 5.02 687 593 A 59 VAL HA A 90 LEU HA 1.0 . 3.87 688 594 A 41 VAL H A 40 ALA HB% 1.0 . 3.47 689 595 A 40 ALA HB% A 55 LYS HD2 1.0 . 4.15 690 595 A 40 ALA HB% A 55 LYS HD3 1.0 . 4.15 691 596 A 61 ALA HB% A 64 GLY HAx 1.0 . 4.25 692 597 A 86 VAL HGx% A 88 LEU HG 1.0 . 3.42 693 598 A 86 VAL HGx% A 82 THR HG2% 1.0 . 3.24 694 599 A 86 VAL HGx% A 62 VAL HGx% 1.0 . 3.18 695 600 A 67 LEU HBx A 67 LEU HDy% 1.0 . 3.34 696 601 A 67 LEU HBy A 67 LEU HDy% 1.0 . 2.64 697 602 A 67 LEU HDy% A 75 ALA HB% 1.0 . 4.06 698 603 A 76 VAL H A 76 VAL HGx% 1.0 . 3.87 699 604 A 31 VAL HA A 31 VAL HGy% 1.0 . 3.95 700 605 A 31 VAL HA A 31 VAL HGx% 1.0 . 3.42 701 606 A 71 THR HG2% A 71 THR HA 1.0 . 3.20 702 607 A 27 VAL HGy% A 71 THR HG2% 1.0 . 3.43 703 608 A 61 ALA HB% A 62 VAL H 1.0 . 3.17 704 609 A 66 SER HA A 61 ALA HB% 1.0 . 3.27 705 610 A 89 LEU HBy A 61 ALA HB% 1.0 . 3.34 706 611 A 86 VAL HGx% A 82 THR HB 1.0 . 4.10 707 612 A 60 LEU HDy% A 58 ARG HDy 1.0 . 5.00 708 613 A 60 LEU HDy% A 60 LEU HA 1.0 . 3.05 709 614 A 76 VAL HA A 76 VAL HGx% 1.0 . 3.64 710 615 A 41 VAL HGx% A 54 HIS HA 1.0 . 4.10 711 616 A 38 VAL HA A 38 VAL HGx% 1.0 . 3.40 712 617 A 55 LYS HA A 38 VAL HGx% 1.0 . 3.18 713 618 A 74 GLN HBx A 71 THR HG2% 1.0 . 5.50 714 619 A 8 PHE HD% A 10 VAL HGx% 1.0 . 4.14 715 620 A 48 GLU H A 41 VAL HGx% 1.0 . 3.99 716 621 A 42 ILE H A 41 VAL HGx% 1.0 . 3.98 717 622 A 41 VAL HA A 41 VAL HGx% 1.0 . 3.52 718 623 A 47 ALA HB% A 41 VAL HGx% 1.0 . 3.26 719 624 A 39 LYS H A 38 VAL HGx% 1.0 . 3.78 720 625 A 60 LEU H A 60 LEU HDy% 1.0 . 3.76 721 626 A 90 LEU H A 10 VAL HGx% 1.0 . 4.81 722 627 A 10 VAL HA A 10 VAL HGx% 1.0 . 3.25 723 628 A 8 PHE HE% A 10 VAL HGx% 1.0 . 4.37 724 629 A 23 VAL HA A 38 VAL HGx% 1.0 . 4.75 725 630 A 53 ILE HG2% A 53 ILE HA 1.0 . 3.32 726 631 A 53 ILE HA A 53 ILE HG1x 1.0 . 4.07 727 632 A 29 THR HA A 29 THR HG2% 1.0 . 3.44 728 633 A 32 ARG H A 31 VAL HGx% 1.0 . 4.33 729 634 A 37 TYR HD% A 31 VAL HGx% 1.0 . 4.00 730 635 A 37 TYR HE% A 31 VAL HGx% 1.0 . 4.19 731 636 A 10 VAL HGx% A 10 VAL H 1.0 . 4.37 732 637 A 90 LEU HDx% A 10 VAL HGx% 1.0 . 3.76 733 638 A 85 VAL HGx% A 13 ALA H 1.0 . 4.52 734 639 A 38 VAL H A 23 VAL HGx% 1.0 . 5.34 735 640 A 90 LEU HDy% A 53 ILE HA 1.0 . 4.35 736 641 A 54 HIS H A 53 ILE HA 1.0 . 3.30 737 642 A 53 ILE HA A 53 ILE HG1y 1.0 . 4.07 738 643 A 49 SER HA A 49 SER HB2 1.0 . 2.98 739 643 A 49 SER HB3 A 49 SER HA 1.0 . 2.98 740 644 A 31 VAL H A 31 VAL HGx% 1.0 . 3.99 741 645 A 27 VAL HGx% A 69 GLY HAx 1.0 . 3.88 742 646 A 86 VAL H A 85 VAL HGy% 1.0 . 4.15 743 647 A 85 VAL HGy% A 13 ALA HB% 1.0 . 2.86 744 648 A 13 ALA HA A 85 VAL HGx% 1.0 . 3.90 745 649 A 85 VAL HA A 85 VAL HGx% 1.0 . 3.33 746 650 A 85 VAL HGx% A 11 GLU HG2 1.0 . 2.79 747 650 A 85 VAL HGx% A 11 GLU HG3 1.0 . 2.79 748 651 A 49 SER HA A 50 ASP HA 1.0 . 4.89 749 652 A 27 VAL H A 27 VAL HGx% 1.0 . 2.98 750 653 A 27 VAL HGx% A 71 THR HA 1.0 . 3.75 751 654 A 65 VAL HA A 65 VAL HGy% 1.0 . 3.00 752 655 A 27 VAL HGx% A 27 VAL HA 1.0 . 3.16 753 656 A 13 ALA HA A 85 VAL HGy% 1.0 . 3.36 754 657 A 85 VAL HA A 85 VAL HGy% 1.0 . 3.16 755 658 A 85 VAL HGy% A 84 GLN HG2 1.0 . 3.55 756 658 A 84 GLN HG3 A 85 VAL HGy% 1.0 . 3.55 757 659 A 13 ALA H A 85 VAL HGy% 1.0 . 4.96 758 660 A 14 LYS H A 85 VAL HGy% 1.0 . 5.34 759 661 A 39 LYS H A 23 VAL HGx% 1.0 . 4.40 760 662 A 38 VAL HA A 23 VAL HGx% 1.0 . 3.74 761 663 A 10 VAL HA A 11 GLU HG2 1.0 . 5.02 762 663 A 10 VAL HA A 11 GLU HG3 1.0 . 5.02 763 664 A 78 THR H A 78 THR HG2% 1.0 . 3.93 764 665 A 78 THR HG2% A 78 THR HA 1.0 . 3.34 765 666 A 62 VAL HB A 78 THR HG2% 1.0 . 3.49 766 667 A 67 LEU HDy% A 78 THR HG2% 1.0 . 2.98 767 668 A 38 VAL H A 38 VAL HGy% 1.0 . 3.33 768 669 A 38 VAL HA A 38 VAL HGy% 1.0 . 3.21 769 670 A 62 VAL HGx% A 78 THR HG2% 1.0 . 3.10 770 671 A 65 VAL HGx% A 66 SER H 1.0 . 3.73 771 672 A 65 VAL HGx% A 65 VAL HA 1.0 . 3.22 772 673 A 62 VAL HGx% A 62 VAL H 1.0 . 4.20 773 674 A 88 LEU HA A 62 VAL HGx% 1.0 . 4.27 774 675 A 62 VAL HGx% A 62 VAL HA 1.0 . 3.28 775 676 A 62 VAL H A 62 VAL HGy% 1.0 . 3.81 776 677 A 61 ALA HA A 62 VAL HGy% 1.0 . 4.23 777 678 A 88 LEU HA A 62 VAL HGy% 1.0 . 4.79 778 679 A 62 VAL HA A 62 VAL HGy% 1.0 . 3.45 779 680 A 37 TYR HD% A 31 VAL HGy% 1.0 . 3.85 780 681 A 31 VAL HGy% A 37 TYR HE% 1.0 . 4.01 781 682 A 41 VAL H A 41 VAL HGy% 1.0 . 3.48 782 683 A 41 VAL HGy% A 54 HIS HA 1.0 . 3.75 783 684 A 41 VAL HA A 41 VAL HGy% 1.0 . 3.46 784 685 A 32 ARG H A 31 VAL HGy% 1.0 . 4.35 785 686 A 31 VAL H A 31 VAL HGy% 1.0 . 3.59 786 687 A 42 ILE H A 41 VAL HGy% 1.0 . 4.42 787 688 A 27 VAL HGy% A 71 THR HB 1.0 . 4.21 788 689 A 90 LEU HA A 59 VAL HGy% 1.0 . 4.95 789 690 A 59 VAL HGy% A 36 ILE HB 1.0 . 4.33 790 691 A 88 LEU HBx A 59 VAL HGy% 1.0 . 5.09 791 692 A 60 LEU H A 59 VAL HGy% 1.0 . 5.17 792 693 A 59 VAL HA A 59 VAL HGy% 1.0 . 3.34 793 694 A 48 GLU HA A 48 GLU HG2 1.0 . 3.35 794 694 A 48 GLU HG3 A 48 GLU HA 1.0 . 3.35 795 695 A 41 VAL HGx% A 48 GLU HA 1.0 . 3.76 796 696 A 70 ALA HB% A 71 THR H 1.0 . 3.50 797 697 A 70 ALA HB% A 74 GLN HBy 1.0 . 3.50 798 698 A 74 GLN HBx A 70 ALA HB% 1.0 . 3.57 799 699 A 8 PHE H A 7 ILE HA 1.0 . 3.21 800 700 A 7 ILE HG1y A 7 ILE HA 1.0 . 4.04 801 701 A 8 PHE HD% A 7 ILE HA 1.0 . 4.52 802 702 A 75 ALA H A 70 ALA HB% 1.0 . 3.76 803 703 A 67 LEU HBx A 70 ALA HB% 1.0 . 4.02 804 704 A 67 LEU HDy% A 70 ALA HB% 1.0 . 3.36 805 705 A 23 VAL HA A 38 VAL HA 1.0 . 3.80 806 706 A 23 VAL HA A 23 VAL HGx% 1.0 . 3.60 807 707 A 13 ALA H A 13 ALA HB% 1.0 . 2.73 808 708 A 85 VAL HA A 13 ALA HB% 1.0 . 3.53 809 709 A 85 VAL HGx% A 13 ALA HB% 1.0 . 3.34 810 710 A 24 THR HG2% A 37 TYR HD% 1.0 . 4.33 811 711 A 24 THR HG2% A 39 LYS HGx 1.0 . 3.49 812 712 A 75 ALA HB% A 76 VAL H 1.0 . 3.52 813 713 A 24 THR HG2% A 24 THR HA 1.0 . 4.09 814 714 A 24 THR HG2% A 39 LYS HBx 1.0 . 3.43 815 715 A 24 THR HG2% A 39 LYS HGy 1.0 . 3.49 816 716 A 22 CYS H A 21 ILE HG2% 1.0 . 4.63 817 717 A 41 VAL HA A 21 ILE HG2% 1.0 . 4.27 818 718 A 67 LEU H A 68 GLU HA 1.0 . 4.53 819 719 A 21 ILE HG2% A 21 ILE HA 1.0 . 3.67 820 720 A 21 ILE HD1% A 21 ILE HG2% 1.0 . 2.88 821 721 A 46 ALA HB% A 12 LEU HBy 1.0 . 3.79 822 722 A 46 ALA HB% A 13 ALA HB% 1.0 . 4.12 823 723 A 47 ALA HB% A 53 ILE HD1% 1.0 . 2.56 824 724 A 47 ALA H A 21 ILE HG2% 1.0 . 5.34 825 725 A 47 ALA HB% A 21 ILE HG2% 1.0 . 3.24 826 726 A 61 ALA HA A 66 SER HA 1.0 . 3.84 827 727 A 14 LYS H A 84 GLN HA 1.0 . 4.92 828 728 A 85 VAL HGy% A 84 GLN HA 1.0 . 4.58 829 729 A 46 ALA HB% A 15 ASN H 1.0 . 4.81 830 730 A 13 ALA H A 46 ALA HB% 1.0 . 4.36 831 731 A 46 ALA HB% A 49 SER HB2 1.0 . 4.34 832 731 A 46 ALA HB% A 49 SER HB3 1.0 . 4.34 833 732 A 46 ALA HB% A 15 ASN HBy 1.0 . 4.02 834 733 A 12 LEU HDy% A 46 ALA HB% 1.0 . 3.47 835 734 A 66 SER HA A 62 VAL H 1.0 . 4.16 836 735 A 55 LYS HA A 38 VAL HB 1.0 . 3.92 837 736 A 55 LYS HA A 41 VAL HGy% 1.0 . 4.92 838 737 A 66 SER HA A 67 LEU HA 1.0 . 4.46 839 738 A 44 GLN HA A 44 GLN HGx 1.0 . 3.70 840 739 A 54 HIS H A 53 ILE HG2% 1.0 . 3.53 841 740 A 53 ILE HG2% A 57 ASP HBy 1.0 . 4.63 842 741 A 47 ALA HB% A 53 ILE HG2% 1.0 . 3.54 843 742 A 7 ILE HG2% A 7 ILE H 1.0 . 4.10 844 743 A 7 ILE HG2% A 8 PHE HA 1.0 . 3.87 845 744 A 7 ILE HG2% A 7 ILE HA 1.0 . 3.20 846 745 A 7 ILE HG2% A 7 ILE HG1y 1.0 . 3.38 847 746 A 53 ILE HG2% A 54 HIS HA 1.0 . 4.17 848 747 A 53 ILE HG2% A 53 ILE HG1y 1.0 . 3.48 849 748 A 14 LYS HA A 14 LYS HG2 1.0 . 3.68 850 748 A 14 LYS HG3 A 14 LYS HA 1.0 . 3.68 851 749 A 8 PHE HD% A 7 ILE HG2% 1.0 . 4.67 852 750 A 23 VAL HA A 23 VAL HGy% 1.0 . 4.23 853 751 A 23 VAL HGy% A 76 VAL HGx% 1.0 . 3.89 854 752 A 36 ILE HA A 36 ILE HD1% 1.0 . 3.40 855 753 A 40 ALA HA A 39 LYS HA 1.0 . 4.78 856 754 A 38 VAL HA A 39 LYS HA 1.0 . 4.89 857 755 A 8 PHE HE% A 92 LYS HA 1.0 . 3.85 858 756 A 42 ILE H A 42 ILE HG2% 1.0 . 3.91 859 757 A 60 LEU HG A 60 LEU HA 1.0 . 3.41 860 758 A 42 ILE HG2% A 42 ILE HA 1.0 . 3.22 861 759 A 42 ILE HG2% A 42 ILE HG1x 1.0 . 3.62 862 760 A 40 ALA HB% A 42 ILE HG2% 1.0 . 4.43 863 761 A 42 ILE HG2% A 42 ILE HG1y 1.0 . 3.62 864 762 A 37 TYR HA A 37 TYR HD% 1.0 . 4.36 865 763 A 59 VAL HGy% A 37 TYR HA 1.0 . 4.30 866 764 A 86 VAL HGx% A 87 HIS HA 1.0 . 4.40 867 765 A 86 VAL HB A 87 HIS HA 1.0 . 4.94 868 766 A 57 ASP HA A 93 GLY HAy 1.0 . 4.05 869 767 A 57 ASP HA A 93 GLY HAx 1.0 . 4.05 870 768 A 19 LEU HA A 14 LYS HG2 1.0 . 4.34 871 768 A 14 LYS HG3 A 19 LEU HA 1.0 . 4.34 872 769 A 19 LEU HDx% A 19 LEU HA 1.0 . 4.65 873 770 A 57 ASP HA A 93 GLY H 1.0 . 3.62 874 771 A 78 THR HB A 75 ALA HA 1.0 . 4.02 875 772 A 8 PHE HD% A 8 PHE HA 1.0 . 4.26 876 773 A 58 ARG HA A 57 ASP HA 1.0 . 5.15 877 774 A 67 LEU HDy% A 75 ALA HA 1.0 . 3.53 878 775 A 55 LYS H A 54 HIS HA 1.0 . 3.33 879 776 A 53 ILE HB A 47 ALA HA 1.0 . 4.64 880 777 A 53 ILE HD1% A 47 ALA HA 1.0 . 3.76 881 778 A 46 ALA HA A 49 SER HB2 1.0 . 3.56 882 778 A 49 SER HB3 A 46 ALA HA 1.0 . 3.56 883 779 A 46 ALA HB% A 53 ILE HD1% 1.0 . 5.16 884 780 A 53 ILE HB A 53 ILE HD1% 1.0 . 3.26 885 781 A 90 LEU HDx% A 53 ILE HD1% 1.0 . 4.20 886 782 A 11 GLU HA A 10 VAL HGx% 1.0 . 5.50 887 783 A 11 GLU HA A 85 VAL HGy% 1.0 . 5.50 888 784 A 58 ARG HA A 59 VAL HGy% 1.0 . 5.50 889 785 A 58 ARG HA A 37 TYR HA 1.0 . 3.61 890 786 A 50 ASP H A 46 ALA HA 1.0 . 4.67 891 787 A 50 ASP H A 47 ALA HA 1.0 . 4.87 892 788 A 90 LEU HG A 90 LEU HA 1.0 . 4.01 893 789 A 90 LEU HDx% A 90 LEU HA 1.0 . 4.19 894 790 A 89 LEU HA A 9 GLU HA 1.0 . 3.51 895 791 A 90 LEU HDx% A 9 GLU HA 1.0 . 4.77 896 792 A 63 ASN HA A 64 GLY HAy 1.0 . 4.47 897 793 A 91 GLU HA A 7 ILE HA 1.0 . 3.59 898 794 A 91 GLU HA A 7 ILE HD1% 1.0 . 3.97 899 795 A 3 LYS HA A 3 LYS HG2 1.0 . 3.58 900 795 A 3 LYS HG3 A 3 LYS HA 1.0 . 3.58 901 796 A 70 ALA HB% A 67 LEU HA 1.0 . 3.46 902 797 A 4 PRO HDy A 3 LYS HA 1.0 . 3.13 903 798 A 4 PRO HDx A 3 LYS HA 1.0 . 3.48 904 799 A 12 LEU HA A 13 ALA HB% 1.0 . 4.03 905 800 A 47 ALA HB% A 21 ILE HD1% 1.0 . 3.73 906 801 A 12 LEU HA A 12 LEU HDx% 1.0 . 4.31 907 802 A 7 ILE H A 7 ILE HD1% 1.0 . 3.99 908 803 A 7 ILE HA A 7 ILE HD1% 1.0 . 3.52 909 804 A 70 ALA HA A 74 GLN HBy 1.0 . 4.31 910 805 A 7 ILE HB A 7 ILE HD1% 1.0 . 3.28 911 806 A 60 LEU HDy% A 7 ILE HD1% 1.0 . 3.08 912 807 A 38 VAL HGx% A 40 ALA HA 1.0 . 4.41 913 808 A 40 ALA HA A 41 VAL HGx% 1.0 . 4.70 914 809 A 42 ILE HD1% A 42 ILE HG2% 1.0 . 2.99 915 810 A 42 ILE HD1% A 21 ILE HG2% 1.0 . 4.28 916 811 A 42 ILE HD1% A 42 ILE HA 1.0 . 3.53 917 812 A 42 ILE HD1% A 21 ILE HD1% 1.0 . 5.11 918 813 A 42 ILE HB A 42 ILE HD1% 1.0 . 3.90 919 814 A 95 SER HA A 96 PRO HDy 1.0 . 3.28 920 815 A 95 SER HA A 96 PRO HDx 1.0 . 3.28 921 816 A 86 VAL HB A 12 LEU HBx 1.0 . 4.41 922 817 A 4 PRO HDx A 3 LYS HD2 1.0 . 4.60 923 817 A 4 PRO HDx A 3 LYS HD3 1.0 . 4.60 924 818 A 61 ALA HA A 67 LEU HG 1.0 . 5.01 925 819 A 8 PHE HD% A 90 LEU HDx% 1.0 . 4.37 926 820 A 59 VAL H A 90 LEU HDy% 1.0 . 4.45 927 821 A 89 LEU HBy A 89 LEU HDx% 1.0 . 3.54 928 822 A 67 LEU HDy% A 74 GLN HBx 1.0 . 4.69 929 823 A 97 THR HG2% A 97 THR HA 1.0 . 3.29 930 824 A 59 VAL HGx% A 60 LEU HG 1.0 . 4.77 931 825 A 61 ALA HB% A 59 VAL HGx% 1.0 . 4.28 932 826 A 65 VAL HB A 78 THR HG2% 1.0 . 4.44 933 827 A 36 ILE HA A 75 ALA HB% 1.0 . 5.04 934 828 A 7 ILE HG2% A 7 ILE HG1x 1.0 . 3.35 935 829 A 59 VAL HB A 36 ILE HG2% 1.0 . 3.88 936 830 A 75 ALA HB% A 36 ILE HG2% 1.0 . 3.64 937 831 A 36 ILE HG1y A 36 ILE HG2% 1.0 . 3.83 938 832 A 27 VAL H A 71 THR HA 1.0 . 4.07 939 833 A 88 LEU HA A 62 VAL HA 1.0 . 4.02 940 834 A 57 ASP HA A 92 LYS HA 1.0 . 4.83 941 835 A 27 VAL HGy% A 71 THR HA 1.0 . 3.55 942 836 A 37 TYR H A 36 ILE HG2% 1.0 . 3.86 943 837 A 24 THR H A 36 ILE HG2% 1.0 . 4.54 944 838 A 1 GLY HA3 A 2 PRO HGx 1.0 . 4.25 945 838 A 1 GLY HA2 A 2 PRO HGx 1.0 . 4.25 946 838 A 2 PRO HGy A 1 GLY HA2 1.0 . 4.25 947 838 A 1 GLY HA3 A 2 PRO HGy 1.0 . 4.25 948 839 A 1 GLY HA3 A 2 PRO HDy 1.0 . 2.62 949 839 A 1 GLY HA2 A 2 PRO HDy 1.0 . 2.62 950 839 A 2 PRO HDx A 1 GLY HA2 1.0 . 2.62 951 839 A 1 GLY HA3 A 2 PRO HDx 1.0 . 2.62 952 840 A 2 PRO HA A 3 LYS HBx 1.0 . 4.67 953 840 A 2 PRO HA A 3 LYS HBy 1.0 . 4.67 954 841 A 2 PRO HBx A 6 ASP HBx 1.0 . 3.74 955 841 A 2 PRO HBx A 6 ASP HBy 1.0 . 3.74 956 842 A 2 PRO HBy A 6 ASP HBx 1.0 . 4.88 957 842 A 6 ASP HBy A 2 PRO HBy 1.0 . 4.88 958 843 A 3 LYS H A 3 LYS HBx 1.0 . 3.09 959 843 A 3 LYS H A 3 LYS HBy 1.0 . 3.09 960 844 A 3 LYS H A 6 ASP HBx 1.0 . 3.57 961 844 A 3 LYS H A 6 ASP HBy 1.0 . 3.57 962 845 A 3 LYS HBx A 3 LYS HE2 1.0 . 4.56 963 845 A 3 LYS HBy A 3 LYS HE2 1.0 . 4.56 964 845 A 3 LYS HE3 A 3 LYS HBx 1.0 . 4.56 965 845 A 3 LYS HBy A 3 LYS HE3 1.0 . 4.56 966 846 A 4 PRO HDx A 3 LYS HBx 1.0 . 3.38 967 846 A 4 PRO HDx A 3 LYS HBy 1.0 . 3.38 968 847 A 4 PRO HDy A 3 LYS HBx 1.0 . 4.10 969 847 A 4 PRO HDy A 3 LYS HBy 1.0 . 4.10 970 848 A 4 PRO HA A 92 LYS HGy 1.0 . 4.09 971 848 A 4 PRO HA A 92 LYS HGx 1.0 . 4.09 972 849 A 5 GLY H A 4 PRO HBx 1.0 . 3.98 973 849 A 5 GLY H A 4 PRO HBy 1.0 . 3.98 974 850 A 6 ASP H A 4 PRO HBx 1.0 . 5.18 975 850 A 6 ASP H A 4 PRO HBy 1.0 . 5.18 976 851 A 5 GLY H A 92 LYS HGy 1.0 . 3.73 977 851 A 5 GLY H A 92 LYS HGx 1.0 . 3.73 978 852 A 5 GLY HAx A 92 LYS HGy 1.0 . 5.18 979 852 A 5 GLY HAy A 92 LYS HGy 1.0 . 5.18 980 852 A 92 LYS HGx A 5 GLY HAx 1.0 . 5.18 981 852 A 92 LYS HGx A 5 GLY HAy 1.0 . 5.18 982 853 A 6 ASP H A 6 ASP HBx 1.0 . 2.93 983 853 A 6 ASP H A 6 ASP HBy 1.0 . 2.93 984 854 A 6 ASP H A 92 LYS HGy 1.0 . 3.91 985 854 A 6 ASP H A 92 LYS HGx 1.0 . 3.91 986 855 A 7 ILE H A 6 ASP HBx 1.0 . 3.78 987 855 A 7 ILE H A 6 ASP HBy 1.0 . 3.78 988 856 A 7 ILE HD1% A 91 GLU HBx 1.0 . 3.73 989 856 A 7 ILE HD1% A 91 GLU HBy 1.0 . 3.73 990 857 A 89 LEU HDx% A 9 GLU HBx 1.0 . 3.53 991 857 A 89 LEU HDx% A 9 GLU HBy 1.0 . 3.53 992 858 A 10 VAL HA A 11 GLU HBy 1.0 . 4.57 993 858 A 10 VAL HA A 11 GLU HBx 1.0 . 4.57 994 859 A 10 VAL HB A 52 ARG HDx 1.0 . 3.37 995 859 A 10 VAL HB A 52 ARG HDy 1.0 . 3.37 996 860 A 11 GLU H A 11 GLU HBy 1.0 . 3.22 997 860 A 11 GLU H A 11 GLU HBx 1.0 . 3.22 998 861 A 12 LEU H A 11 GLU HBy 1.0 . 4.42 999 861 A 12 LEU H A 11 GLU HBx 1.0 . 4.42 1000 862 A 12 LEU HDy% A 50 ASP HBy 1.0 . 3.27 1001 862 A 12 LEU HDy% A 50 ASP HBx 1.0 . 3.27 1002 863 A 14 LYS HA A 14 LYS HDy 1.0 . 4.20 1003 863 A 14 LYS HA A 14 LYS HDx 1.0 . 4.20 1004 864 A 14 LYS HA A 19 LEU HBy 1.0 . 4.99 1005 864 A 14 LYS HA A 19 LEU HBx 1.0 . 4.99 1006 865 A 14 LYS HB3 A 19 LEU HBy 1.0 . 3.10 1007 865 A 14 LYS HB2 A 19 LEU HBy 1.0 . 3.10 1008 865 A 19 LEU HBx A 14 LYS HB2 1.0 . 3.10 1009 865 A 14 LYS HB3 A 19 LEU HBx 1.0 . 3.10 1010 866 A 14 LYS HG2 A 19 LEU HBy 1.0 . 3.83 1011 866 A 19 LEU HBx A 14 LYS HG2 1.0 . 3.83 1012 866 A 14 LYS HG3 A 19 LEU HBx 1.0 . 3.83 1013 866 A 14 LYS HG3 A 19 LEU HBy 1.0 . 3.83 1014 867 A 46 ALA H A 15 ASN HBy 1.0 . 4.67 1015 867 A 46 ALA H A 15 ASN HBx 1.0 . 4.67 1016 868 A 46 ALA HA A 15 ASN HBy 1.0 . 5.03 1017 868 A 46 ALA HA A 15 ASN HBx 1.0 . 5.03 1018 869 A 46 ALA HB% A 15 ASN HBy 1.0 . 3.42 1019 869 A 46 ALA HB% A 15 ASN HBx 1.0 . 3.42 1020 870 A 18 SER H A 17 ASN HBx 1.0 . 4.21 1021 870 A 18 SER H A 17 ASN HBy 1.0 . 4.21 1022 871 A 18 SER H A 18 SER HBx 1.0 . 3.06 1023 871 A 18 SER H A 18 SER HBy 1.0 . 3.06 1024 872 A 19 LEU HDy% A 19 LEU HBy 1.0 . 3.18 1025 872 A 19 LEU HBx A 19 LEU HDy% 1.0 . 3.18 1026 873 A 20 GLY H A 19 LEU HBy 1.0 . 3.79 1027 873 A 20 GLY H A 19 LEU HBx 1.0 . 3.79 1028 874 A 19 LEU HBx A 20 GLY HAx 1.0 . 4.33 1029 874 A 19 LEU HBy A 20 GLY HAx 1.0 . 4.33 1030 874 A 20 GLY HAy A 19 LEU HBy 1.0 . 4.33 1031 874 A 19 LEU HBx A 20 GLY HAy 1.0 . 4.33 1032 875 A 21 ILE H A 19 LEU HBy 1.0 . 4.33 1033 875 A 21 ILE H A 19 LEU HBx 1.0 . 4.33 1034 876 A 21 ILE HD1% A 19 LEU HBy 1.0 . 5.34 1035 876 A 21 ILE HD1% A 19 LEU HBx 1.0 . 5.34 1036 877 A 20 GLY HAy A 21 ILE HG12 1.0 . 4.58 1037 877 A 20 GLY HAx A 21 ILE HG12 1.0 . 4.58 1038 877 A 21 ILE HG13 A 20 GLY HAx 1.0 . 4.58 1039 877 A 21 ILE HG13 A 20 GLY HAy 1.0 . 4.58 1040 878 A 24 THR HB A 39 LYS HGx 1.0 . 4.11 1041 878 A 24 THR HB A 39 LYS HGy 1.0 . 4.11 1042 879 A 24 THR HB A 39 LYS HDy 1.0 . 3.68 1043 879 A 24 THR HB A 39 LYS HDx 1.0 . 3.68 1044 880 A 24 THR HG2% A 25 GLY HAx 1.0 . 4.32 1045 880 A 24 THR HG2% A 25 GLY HAy 1.0 . 4.32 1046 881 A 24 THR HG2% A 37 TYR HBx 1.0 . 3.45 1047 881 A 24 THR HG2% A 37 TYR HBy 1.0 . 3.45 1048 882 A 24 THR HG2% A 39 LYS HGx 1.0 . 3.04 1049 882 A 24 THR HG2% A 39 LYS HGy 1.0 . 3.04 1050 883 A 24 THR HG2% A 39 LYS HDy 1.0 . 3.92 1051 883 A 24 THR HG2% A 39 LYS HDx 1.0 . 3.92 1052 884 A 31 VAL HGx% A 25 GLY HAx 1.0 . 3.38 1053 884 A 31 VAL HGx% A 25 GLY HAy 1.0 . 3.38 1054 885 A 31 VAL HGy% A 25 GLY HAx 1.0 . 3.39 1055 885 A 31 VAL HGy% A 25 GLY HAy 1.0 . 3.39 1056 886 A 27 VAL HGy% A 28 ASN HBx 1.0 . 4.72 1057 886 A 27 VAL HGy% A 28 ASN HBy 1.0 . 4.72 1058 887 A 28 ASN H A 28 ASN HBx 1.0 . 3.65 1059 887 A 28 ASN H A 28 ASN HBy 1.0 . 3.65 1060 888 A 28 ASN H A 34 GLY HAx 1.0 . 5.07 1061 888 A 28 ASN H A 34 GLY HAy 1.0 . 5.07 1062 889 A 31 VAL HGx% A 30 SER HBx 1.0 . 5.27 1063 889 A 31 VAL HGx% A 30 SER HBy 1.0 . 5.27 1064 890 A 31 VAL HA A 32 ARG HBx 1.0 . 4.55 1065 890 A 31 VAL HA A 32 ARG HBy 1.0 . 4.55 1066 891 A 31 VAL HGx% A 34 GLY HAx 1.0 . 5.29 1067 891 A 31 VAL HGx% A 34 GLY HAy 1.0 . 5.29 1068 892 A 31 VAL HGy% A 34 GLY HAx 1.0 . 4.48 1069 892 A 31 VAL HGy% A 34 GLY HAy 1.0 . 4.48 1070 893 A 32 ARG H A 32 ARG HGx 1.0 . 3.86 1071 893 A 32 ARG H A 32 ARG HGy 1.0 . 3.86 1072 894 A 32 ARG HA A 32 ARG HGx 1.0 . 3.65 1073 894 A 32 ARG HGy A 32 ARG HA 1.0 . 3.65 1074 895 A 36 ILE H A 35 GLY HAx 1.0 . 3.12 1075 895 A 36 ILE H A 35 GLY HAy 1.0 . 3.12 1076 896 A 37 TYR H A 37 TYR HBx 1.0 . 3.37 1077 896 A 37 TYR H A 37 TYR HBy 1.0 . 3.37 1078 897 A 37 TYR HA A 58 ARG HBy 1.0 . 5.34 1079 897 A 37 TYR HA A 58 ARG HBx 1.0 . 5.34 1080 898 A 38 VAL H A 37 TYR HBx 1.0 . 4.34 1081 898 A 38 VAL H A 37 TYR HBy 1.0 . 4.34 1082 899 A 37 TYR HE% A 58 ARG HBy 1.0 . 4.11 1083 899 A 37 TYR HE% A 58 ARG HBx 1.0 . 4.11 1084 900 A 37 TYR HE% A 58 ARG HDx 1.0 . 4.56 1085 900 A 37 TYR HE% A 58 ARG HDy 1.0 . 4.56 1086 901 A 39 LYS H A 39 LYS HGx 1.0 . 4.39 1087 901 A 39 LYS H A 39 LYS HGy 1.0 . 4.39 1088 902 A 39 LYS HBx A 39 LYS HGx 1.0 . 2.52 1089 902 A 39 LYS HBx A 39 LYS HGy 1.0 . 2.52 1090 903 A 39 LYS HDy A 39 LYS HGx 1.0 . 2.37 1091 903 A 39 LYS HDx A 39 LYS HGx 1.0 . 2.37 1092 903 A 39 LYS HGy A 39 LYS HDy 1.0 . 2.37 1093 903 A 39 LYS HGy A 39 LYS HDx 1.0 . 2.37 1094 904 A 39 LYS HE2 A 39 LYS HGx 1.0 . 3.13 1095 904 A 39 LYS HE3 A 39 LYS HGx 1.0 . 3.13 1096 904 A 39 LYS HGy A 39 LYS HE2 1.0 . 3.13 1097 904 A 39 LYS HE3 A 39 LYS HGy 1.0 . 3.13 1098 905 A 42 ILE H A 42 ILE HG1x 1.0 . 3.46 1099 905 A 42 ILE H A 42 ILE HG1y 1.0 . 3.46 1100 906 A 42 ILE HA A 43 PRO HDy 1.0 . 3.36 1101 906 A 42 ILE HA A 43 PRO HDx 1.0 . 3.36 1102 907 A 42 ILE HG2% A 42 ILE HG1x 1.0 . 2.93 1103 907 A 42 ILE HG2% A 42 ILE HG1y 1.0 . 2.93 1104 908 A 42 ILE HG2% A 43 PRO HDy 1.0 . 3.56 1105 908 A 42 ILE HG2% A 43 PRO HDx 1.0 . 3.56 1106 909 A 42 ILE HD1% A 43 PRO HDy 1.0 . 4.64 1107 909 A 42 ILE HD1% A 43 PRO HDx 1.0 . 4.64 1108 910 A 44 GLN H A 43 PRO HBx 1.0 . 3.84 1109 910 A 44 GLN H A 43 PRO HBy 1.0 . 3.84 1110 911 A 43 PRO HGx A 44 GLN HBx 1.0 . 3.89 1111 911 A 43 PRO HGx A 44 GLN HBy 1.0 . 3.89 1112 912 A 44 GLN H A 44 GLN HGy 1.0 . 3.95 1113 912 A 44 GLN H A 44 GLN HGx 1.0 . 3.95 1114 913 A 44 GLN HA A 44 GLN HGy 1.0 . 3.00 1115 913 A 44 GLN HA A 44 GLN HGx 1.0 . 3.00 1116 914 A 45 GLY H A 44 GLN HBx 1.0 . 4.37 1117 914 A 45 GLY H A 44 GLN HBy 1.0 . 4.37 1118 915 A 46 ALA H A 45 GLY HAx 1.0 . 2.88 1119 915 A 46 ALA H A 45 GLY HAy 1.0 . 2.88 1120 916 A 47 ALA HA A 50 ASP HBy 1.0 . 4.00 1121 916 A 47 ALA HA A 50 ASP HBx 1.0 . 4.00 1122 917 A 50 ASP H A 50 ASP HBy 1.0 . 2.84 1123 917 A 50 ASP H A 50 ASP HBx 1.0 . 2.84 1124 918 A 51 GLY H A 50 ASP HBy 1.0 . 3.44 1125 918 A 51 GLY H A 50 ASP HBx 1.0 . 3.44 1126 919 A 52 ARG H A 52 ARG HDx 1.0 . 4.63 1127 919 A 52 ARG H A 52 ARG HDy 1.0 . 4.63 1128 920 A 52 ARG H A 53 ILE HG1x 1.0 . 4.93 1129 920 A 52 ARG H A 53 ILE HG1y 1.0 . 4.93 1130 921 A 53 ILE H A 53 ILE HG1x 1.0 . 4.70 1131 921 A 53 ILE H A 53 ILE HG1y 1.0 . 4.70 1132 922 A 53 ILE HA A 53 ILE HG1x 1.0 . 3.49 1133 922 A 53 ILE HA A 53 ILE HG1y 1.0 . 3.49 1134 923 A 53 ILE HG2% A 53 ILE HG1x 1.0 . 2.81 1135 923 A 53 ILE HG2% A 53 ILE HG1y 1.0 . 2.81 1136 924 A 54 HIS H A 53 ILE HG1x 1.0 . 4.55 1137 924 A 54 HIS H A 53 ILE HG1y 1.0 . 4.55 1138 925 A 90 LEU HDx% A 53 ILE HG1x 1.0 . 4.03 1139 925 A 90 LEU HDx% A 53 ILE HG1y 1.0 . 4.03 1140 926 A 90 LEU HDy% A 53 ILE HG1x 1.0 . 4.00 1141 926 A 90 LEU HDy% A 53 ILE HG1y 1.0 . 4.00 1142 927 A 54 HIS H A 54 HIS HBy 1.0 . 3.40 1143 927 A 54 HIS H A 54 HIS HBx 1.0 . 3.40 1144 928 A 54 HIS H A 57 ASP HBx 1.0 . 4.39 1145 928 A 54 HIS H A 57 ASP HBy 1.0 . 4.39 1146 929 A 55 LYS H A 54 HIS HBy 1.0 . 3.16 1147 929 A 55 LYS H A 54 HIS HBx 1.0 . 3.16 1148 930 A 55 LYS HA A 55 LYS HGx 1.0 . 3.65 1149 930 A 55 LYS HA A 55 LYS HGy 1.0 . 3.65 1150 931 A 55 LYS HE2 A 55 LYS HGx 1.0 . 3.65 1151 931 A 55 LYS HE3 A 55 LYS HGx 1.0 . 3.65 1152 931 A 55 LYS HGy A 55 LYS HE2 1.0 . 3.65 1153 931 A 55 LYS HE3 A 55 LYS HGy 1.0 . 3.65 1154 932 A 56 GLY H A 55 LYS HGx 1.0 . 4.71 1155 932 A 56 GLY H A 55 LYS HGy 1.0 . 4.71 1156 933 A 57 ASP HA A 56 GLY HAx 1.0 . 4.51 1157 933 A 57 ASP HA A 56 GLY HAy 1.0 . 4.51 1158 934 A 56 GLY HAy A 93 GLY HAy 1.0 . 4.73 1159 934 A 56 GLY HAx A 93 GLY HAy 1.0 . 4.73 1160 934 A 93 GLY HAx A 56 GLY HAx 1.0 . 4.73 1161 934 A 56 GLY HAy A 93 GLY HAx 1.0 . 4.73 1162 935 A 57 ASP H A 57 ASP HBx 1.0 . 2.95 1163 935 A 57 ASP H A 57 ASP HBy 1.0 . 2.95 1164 936 A 57 ASP H A 93 GLY HAy 1.0 . 4.78 1165 936 A 57 ASP H A 93 GLY HAx 1.0 . 4.78 1166 937 A 57 ASP HBy A 90 LEU HBx 1.0 . 4.46 1167 937 A 90 LEU HBy A 57 ASP HBx 1.0 . 4.46 1168 937 A 57 ASP HBy A 90 LEU HBy 1.0 . 4.46 1169 937 A 57 ASP HBx A 90 LEU HBx 1.0 . 4.46 1170 938 A 90 LEU HDy% A 57 ASP HBx 1.0 . 3.73 1171 938 A 90 LEU HDy% A 57 ASP HBy 1.0 . 3.73 1172 939 A 58 ARG H A 58 ARG HBy 1.0 . 3.27 1173 939 A 58 ARG H A 58 ARG HBx 1.0 . 3.27 1174 940 A 58 ARG H A 91 GLU HBx 1.0 . 4.06 1175 940 A 58 ARG H A 91 GLU HBy 1.0 . 4.06 1176 941 A 58 ARG HA A 58 ARG HGx 1.0 . 3.59 1177 941 A 58 ARG HA A 58 ARG HGy 1.0 . 3.59 1178 942 A 91 GLU H A 58 ARG HBy 1.0 . 5.34 1179 942 A 91 GLU H A 58 ARG HBx 1.0 . 5.34 1180 943 A 60 LEU HDy% A 58 ARG HGx 1.0 . 3.41 1181 943 A 60 LEU HDy% A 58 ARG HGy 1.0 . 3.41 1182 944 A 60 LEU HDy% A 58 ARG HDx 1.0 . 4.17 1183 944 A 60 LEU HDy% A 58 ARG HDy 1.0 . 4.17 1184 945 A 61 ALA HB% A 66 SER HBx 1.0 . 4.81 1185 945 A 61 ALA HB% A 66 SER HBy 1.0 . 4.81 1186 946 A 65 VAL H A 63 ASN HBx 1.0 . 4.84 1187 946 A 65 VAL H A 63 ASN HBy 1.0 . 4.84 1188 947 A 65 VAL HGy% A 63 ASN HBx 1.0 . 4.90 1189 947 A 65 VAL HGy% A 63 ASN HBy 1.0 . 4.90 1190 948 A 88 LEU HDx% A 63 ASN HBx 1.0 . 5.34 1191 948 A 88 LEU HDx% A 63 ASN HBy 1.0 . 5.34 1192 949 A 66 SER H A 66 SER HBx 1.0 . 2.96 1193 949 A 66 SER H A 66 SER HBy 1.0 . 2.96 1194 950 A 67 LEU H A 66 SER HBx 1.0 . 3.85 1195 950 A 67 LEU H A 66 SER HBy 1.0 . 3.85 1196 951 A 68 GLU H A 66 SER HBx 1.0 . 5.09 1197 951 A 68 GLU H A 66 SER HBy 1.0 . 5.09 1198 952 A 70 ALA HA A 74 GLN HGy 1.0 . 4.48 1199 952 A 70 ALA HA A 74 GLN HGx 1.0 . 4.48 1200 953 A 70 ALA HB% A 74 GLN HGy 1.0 . 3.96 1201 953 A 70 ALA HB% A 74 GLN HGx 1.0 . 3.96 1202 954 A 72 HIS H A 72 HIS HBx 1.0 . 3.08 1203 954 A 72 HIS H A 72 HIS HBy 1.0 . 3.08 1204 955 A 72 HIS HE1 A 72 HIS HBx 1.0 . 4.62 1205 955 A 72 HIS HE1 A 72 HIS HBy 1.0 . 4.62 1206 956 A 73 LYS H A 72 HIS HBx 1.0 . 3.46 1207 956 A 73 LYS H A 72 HIS HBy 1.0 . 3.46 1208 957 A 73 LYS HA A 72 HIS HBx 1.0 . 4.53 1209 957 A 72 HIS HBy A 73 LYS HA 1.0 . 4.53 1210 958 A 73 LYS HBx A 73 LYS HD2 1.0 . 2.87 1211 958 A 73 LYS HBy A 73 LYS HD2 1.0 . 2.87 1212 958 A 73 LYS HD3 A 73 LYS HBy 1.0 . 2.87 1213 958 A 73 LYS HBx A 73 LYS HD3 1.0 . 2.87 1214 959 A 74 GLN H A 73 LYS HBy 1.0 . 3.77 1215 959 A 74 GLN H A 73 LYS HBx 1.0 . 3.77 1216 960 A 73 LYS HE2 A 73 LYS HGx 1.0 . 3.58 1217 960 A 73 LYS HE3 A 73 LYS HGx 1.0 . 3.58 1218 960 A 73 LYS HGy A 73 LYS HE2 1.0 . 3.58 1219 960 A 73 LYS HGy A 73 LYS HE3 1.0 . 3.58 1220 961 A 74 GLN H A 73 LYS HGx 1.0 . 4.33 1221 961 A 74 GLN H A 73 LYS HGy 1.0 . 4.33 1222 962 A 74 GLN H A 74 GLN HGy 1.0 . 3.12 1223 962 A 74 GLN H A 74 GLN HGx 1.0 . 3.12 1224 963 A 74 GLN HA A 74 GLN HGy 1.0 . 3.58 1225 963 A 74 GLN HA A 74 GLN HGx 1.0 . 3.58 1226 964 A 75 ALA H A 74 GLN HGy 1.0 . 4.22 1227 964 A 75 ALA H A 74 GLN HGx 1.0 . 4.22 1228 965 A 76 VAL HA A 79 LEU HBy 1.0 . 3.98 1229 965 A 76 VAL HA A 79 LEU HBx 1.0 . 3.98 1230 966 A 76 VAL HGx% A 79 LEU HBy 1.0 . 4.40 1231 966 A 76 VAL HGx% A 79 LEU HBx 1.0 . 4.40 1232 967 A 79 LEU H A 79 LEU HBy 1.0 . 3.16 1233 967 A 79 LEU H A 79 LEU HBx 1.0 . 3.16 1234 968 A 79 LEU HDy% A 79 LEU HBy 1.0 . 3.17 1235 968 A 79 LEU HDy% A 79 LEU HBx 1.0 . 3.17 1236 969 A 81 ASN H A 81 ASN HBy 1.0 . 3.48 1237 969 A 81 ASN H A 81 ASN HBx 1.0 . 3.48 1238 970 A 82 THR HG2% A 81 ASN HBy 1.0 . 4.41 1239 970 A 82 THR HG2% A 81 ASN HBx 1.0 . 4.41 1240 971 A 84 GLN H A 84 GLN HBy 1.0 . 3.12 1241 971 A 84 GLN H A 84 GLN HBx 1.0 . 3.12 1242 972 A 85 VAL H A 84 GLN HBy 1.0 . 3.37 1243 972 A 85 VAL H A 84 GLN HBx 1.0 . 3.37 1244 973 A 90 LEU H A 90 LEU HBx 1.0 . 3.64 1245 973 A 90 LEU H A 90 LEU HBy 1.0 . 3.64 1246 974 A 90 LEU HDx% A 90 LEU HBx 1.0 . 3.31 1247 974 A 90 LEU HDx% A 90 LEU HBy 1.0 . 3.31 1248 975 A 90 LEU HDy% A 90 LEU HBx 1.0 . 3.20 1249 975 A 90 LEU HDy% A 90 LEU HBy 1.0 . 3.20 1250 976 A 91 GLU H A 90 LEU HBx 1.0 . 3.87 1251 976 A 91 GLU H A 90 LEU HBy 1.0 . 3.87 1252 977 A 91 GLU HA A 91 GLU HGy 1.0 . 3.52 1253 977 A 91 GLU HA A 91 GLU HGx 1.0 . 3.52 1254 978 A 91 GLU HA A 92 LYS HGy 1.0 . 4.40 1255 978 A 91 GLU HA A 92 LYS HGx 1.0 . 4.40 1256 979 A 92 LYS H A 91 GLU HBx 1.0 . 4.10 1257 979 A 92 LYS H A 91 GLU HBy 1.0 . 4.10 1258 980 A 92 LYS H A 92 LYS HGy 1.0 . 3.29 1259 980 A 92 LYS H A 92 LYS HGx 1.0 . 3.29 1260 981 A 92 LYS HA A 92 LYS HGy 1.0 . 3.62 1261 981 A 92 LYS HA A 92 LYS HGx 1.0 . 3.62 1262 982 A 92 LYS HA A 93 GLY HAy 1.0 . 5.09 1263 982 A 92 LYS HA A 93 GLY HAx 1.0 . 5.09 1264 983 A 92 LYS HE3 A 92 LYS HGy 1.0 . 3.18 1265 983 A 92 LYS HE2 A 92 LYS HGy 1.0 . 3.18 1266 983 A 92 LYS HGx A 92 LYS HE2 1.0 . 3.18 1267 983 A 92 LYS HE3 A 92 LYS HGx 1.0 . 3.18 1268 984 A 93 GLY H A 92 LYS HGy 1.0 . 5.21 1269 984 A 93 GLY H A 92 LYS HGx 1.0 . 5.21 1270 985 A 94 GLN H A 93 GLY HAy 1.0 . 3.08 1271 985 A 94 GLN H A 93 GLY HAx 1.0 . 3.08 1272 986 A 93 GLY HAy A 94 GLN HBy 1.0 . 4.59 1273 986 A 93 GLY HAx A 94 GLN HBy 1.0 . 4.59 1274 986 A 94 GLN HBx A 93 GLY HAy 1.0 . 4.59 1275 986 A 93 GLY HAx A 94 GLN HBx 1.0 . 4.59 1276 987 A 94 GLN H A 94 GLN HBy 1.0 . 3.09 1277 987 A 94 GLN H A 94 GLN HBx 1.0 . 3.09 1278 988 A 94 GLN HBy A 94 GLN HG2 1.0 . 2.42 1279 988 A 94 GLN HBx A 94 GLN HG2 1.0 . 2.42 1280 988 A 94 GLN HG3 A 94 GLN HBy 1.0 . 2.42 1281 988 A 94 GLN HG3 A 94 GLN HBx 1.0 . 2.42 1282 989 A 95 SER H A 94 GLN HBy 1.0 . 4.21 1283 989 A 94 GLN HBx A 95 SER H 1.0 . 4.21 stop_ save_ save_DYANA/DIANA_dihedral_2 _nef_dihedral_restraint_list.sf_category nef_dihedral_restraint_list _nef_dihedral_restraint_list.sf_framecode DYANA/DIANA_dihedral_2 _nef_dihedral_restraint_list.potential_type square-well-parabolic _nef_dihedral_restraint_list.restraint_origin . loop_ _nef_dihedral_restraint.index _nef_dihedral_restraint.restraint_id _nef_dihedral_restraint.chain_code_1 _nef_dihedral_restraint.sequence_code_1 _nef_dihedral_restraint.residue_name_1 _nef_dihedral_restraint.atom_name_1 _nef_dihedral_restraint.chain_code_2 _nef_dihedral_restraint.sequence_code_2 _nef_dihedral_restraint.residue_name_2 _nef_dihedral_restraint.atom_name_2 _nef_dihedral_restraint.chain_code_3 _nef_dihedral_restraint.sequence_code_3 _nef_dihedral_restraint.residue_name_3 _nef_dihedral_restraint.atom_name_3 _nef_dihedral_restraint.chain_code_4 _nef_dihedral_restraint.sequence_code_4 _nef_dihedral_restraint.residue_name_4 _nef_dihedral_restraint.atom_name_4 _nef_dihedral_restraint.weight _nef_dihedral_restraint.lower_limit _nef_dihedral_restraint.upper_limit _nef_dihedral_restraint.name 1 1 A 2 PRO C A 3 LYS N A 3 LYS CA A 3 LYS C 1.0 -120.4 -47.1 PHI 2 2 A 3 LYS N A 3 LYS CA A 3 LYS C A 4 PRO N 1.0 97.0 185.5 PSI 3 3 A 4 PRO C A 5 GLY N A 5 GLY CA A 5 GLY C 1.0 65.8 119.1 PHI 4 4 A 5 GLY N A 5 GLY CA A 5 GLY C A 6 ASP N 1.0 -36.8 11.8 PSI 5 5 A 6 ASP C A 7 ILE N A 7 ILE CA A 7 ILE C 1.0 -147.5 -63.7 PHI 6 6 A 7 ILE N A 7 ILE CA A 7 ILE C A 8 PHE N 1.0 108.2 174.5 PSI 7 7 A 7 ILE C A 8 PHE N A 8 PHE CA A 8 PHE C 1.0 -170.7 -113.6 PHI 8 8 A 8 PHE N A 8 PHE CA A 8 PHE C A 9 GLU N 1.0 134.3 180.1 PSI 9 9 A 8 PHE C A 9 GLU N A 9 GLU CA A 9 GLU C 1.0 -144.2 -104.1 PHI 10 10 A 9 GLU N A 9 GLU CA A 9 GLU C A 10 VAL N 1.0 126.1 162.9 PSI 11 11 A 9 GLU C A 10 VAL N A 10 VAL CA A 10 VAL C 1.0 -159.3 -115.5 PHI 12 12 A 10 VAL N A 10 VAL CA A 10 VAL C A 11 GLU N 1.0 117.0 166.6 PSI 13 13 A 10 VAL C A 11 GLU N A 11 GLU CA A 11 GLU C 1.0 -155.5 -76.2 PHI 14 14 A 11 GLU N A 11 GLU CA A 11 GLU C A 12 LEU N 1.0 106.6 150.5 PSI 15 15 A 11 GLU C A 12 LEU N A 12 LEU CA A 12 LEU C 1.0 -160.5 -103.7 PHI 16 16 A 12 LEU N A 12 LEU CA A 12 LEU C A 13 ALA N 1.0 119.0 168.0 PSI 17 17 A 12 LEU C A 13 ALA N A 13 ALA CA A 13 ALA C 1.0 -137.8 -59.1 PHI 18 18 A 13 ALA N A 13 ALA CA A 13 ALA C A 14 LYS N 1.0 105.4 185.0 PSI 19 19 A 13 ALA C A 14 LYS N A 14 LYS CA A 14 LYS C 1.0 -120.9 -62.0 PHI 20 20 A 14 LYS N A 14 LYS CA A 14 LYS C A 15 ASN N 1.0 -68.5 14.6 PSI 21 21 A 15 ASN C A 16 ASP N A 16 ASP CA A 16 ASP C 1.0 42.0 62.0 PHI 22 22 A 16 ASP N A 16 ASP CA A 16 ASP C A 17 ASN N 1.0 32.8 52.8 PSI 23 23 A 16 ASP C A 17 ASN N A 17 ASN CA A 17 ASN C 1.0 43.8 84.5 PHI 24 24 A 17 ASN N A 17 ASN CA A 17 ASN C A 18 SER N 1.0 -8.9 47.9 PSI 25 25 A 17 ASN C A 18 SER N A 18 SER CA A 18 SER C 1.0 -151.8 -74.6 PHI 26 26 A 18 SER N A 18 SER CA A 18 SER C A 19 LEU N 1.0 115.4 179.7 PSI 27 27 A 20 GLY C A 21 ILE N A 21 ILE CA A 21 ILE C 1.0 -152.6 -88.0 PHI 28 28 A 21 ILE N A 21 ILE CA A 21 ILE C A 22 CYS N 1.0 118.1 175.7 PSI 29 29 A 22 CYS C A 23 VAL N A 23 VAL CA A 23 VAL C 1.0 -165.1 -95.2 PHI 30 30 A 23 VAL N A 23 VAL CA A 23 VAL C A 24 THR N 1.0 121.6 176.9 PSI 31 31 A 23 VAL C A 24 THR N A 24 THR CA A 24 THR C 1.0 -174.0 -100.8 PHI 32 32 A 24 THR N A 24 THR CA A 24 THR C A 25 GLY N 1.0 132.0 170.3 PSI 33 33 A 26 GLY C A 27 VAL N A 27 VAL CA A 27 VAL C 1.0 -91.6 -48.7 PHI 34 34 A 27 VAL N A 27 VAL CA A 27 VAL C A 28 ASN N 1.0 -41.4 14.4 PSI 35 35 A 27 VAL C A 28 ASN N A 28 ASN CA A 28 ASN C 1.0 39.9 85.1 PHI 36 36 A 28 ASN N A 28 ASN CA A 28 ASN C A 29 THR N 1.0 7.5 64.0 PSI 37 37 A 28 ASN C A 29 THR N A 29 THR CA A 29 THR C 1.0 -171.2 -37.8 PHI 38 38 A 29 THR N A 29 THR CA A 29 THR C A 30 SER N 1.0 137.1 188.6 PSI 39 39 A 29 THR C A 30 SER N A 30 SER CA A 30 SER C 1.0 -130.6 -29.1 PHI 40 40 A 30 SER N A 30 SER CA A 30 SER C A 31 VAL N 1.0 -43.5 14.5 PSI 41 41 A 31 VAL C A 32 ARG N A 32 ARG CA A 32 ARG C 1.0 -97.1 -36.4 PHI 42 42 A 32 ARG N A 32 ARG CA A 32 ARG C A 33 HIS N 1.0 -71.2 21.8 PSI 43 43 A 32 ARG C A 33 HIS N A 33 HIS CA A 33 HIS C 1.0 -114.5 -62.2 PHI 44 44 A 33 HIS N A 33 HIS CA A 33 HIS C A 34 GLY N 1.0 -19.5 15.2 PSI 45 45 A 33 HIS C A 34 GLY N A 34 GLY CA A 34 GLY C 1.0 42.3 107.9 PHI 46 46 A 34 GLY N A 34 GLY CA A 34 GLY C A 35 GLY N 1.0 -14.0 67.0 PSI 47 47 A 34 GLY C A 35 GLY N A 35 GLY CA A 35 GLY C 1.0 -168.5 -58.8 PHI 48 48 A 35 GLY N A 35 GLY CA A 35 GLY C A 36 ILE N 1.0 118.6 177.3 PSI 49 49 A 36 ILE C A 37 TYR N A 37 TYR CA A 37 TYR C 1.0 -173.7 -85.7 PHI 50 50 A 37 TYR N A 37 TYR CA A 37 TYR C A 38 VAL N 1.0 133.7 174.7 PSI 51 51 A 37 TYR C A 38 VAL N A 38 VAL CA A 38 VAL C 1.0 -101.8 -48.5 PHI 52 52 A 38 VAL N A 38 VAL CA A 38 VAL C A 39 LYS N 1.0 104.2 149.0 PSI 53 53 A 38 VAL C A 39 LYS N A 39 LYS CA A 39 LYS C 1.0 -114.9 -73.4 PHI 54 54 A 39 LYS N A 39 LYS CA A 39 LYS C A 40 ALA N 1.0 -55.1 -18.4 PSI 55 55 A 39 LYS C A 40 ALA N A 40 ALA CA A 40 ALA C 1.0 -188.2 -117.0 PHI 56 56 A 40 ALA N A 40 ALA CA A 40 ALA C A 41 VAL N 1.0 119.9 174.7 PSI 57 57 A 40 ALA C A 41 VAL N A 41 VAL CA A 41 VAL C 1.0 -151.2 -83.7 PHI 58 58 A 41 VAL N A 41 VAL CA A 41 VAL C A 42 ILE N 1.0 102.9 142.6 PSI 59 59 A 41 VAL C A 42 ILE N A 42 ILE CA A 42 ILE C 1.0 -109.3 -47.9 PHI 60 60 A 42 ILE N A 42 ILE CA A 42 ILE C A 43 PRO N 1.0 100.3 170.9 PSI 61 61 A 43 PRO C A 44 GLN N A 44 GLN CA A 44 GLN C 1.0 44.0 75.1 PHI 62 62 A 44 GLN N A 44 GLN CA A 44 GLN C A 45 GLY N 1.0 -11.6 69.6 PSI 63 63 A 45 GLY C A 46 ALA N A 46 ALA CA A 46 ALA C 1.0 -70.5 -50.5 PHI 64 64 A 46 ALA N A 46 ALA CA A 46 ALA C A 47 ALA N 1.0 -52.7 -19.0 PSI 65 65 A 46 ALA C A 47 ALA N A 47 ALA CA A 47 ALA C 1.0 -81.1 -55.1 PHI 66 66 A 47 ALA N A 47 ALA CA A 47 ALA C A 48 GLU N 1.0 -49.0 -22.4 PSI 67 67 A 47 ALA C A 48 GLU N A 48 GLU CA A 48 GLU C 1.0 -72.3 -52.3 PHI 68 68 A 48 GLU N A 48 GLU CA A 48 GLU C A 49 SER N 1.0 -55.3 -35.3 PSI 69 69 A 48 GLU C A 49 SER N A 49 SER CA A 49 SER C 1.0 -79.6 -50.1 PHI 70 70 A 49 SER N A 49 SER CA A 49 SER C A 50 ASP N 1.0 -55.5 -18.2 PSI 71 71 A 51 GLY C A 52 ARG N A 52 ARG CA A 52 ARG C 1.0 -117.7 -61.0 PHI 72 72 A 52 ARG N A 52 ARG CA A 52 ARG C A 53 ILE N 1.0 -44.2 5.3 PSI 73 73 A 53 ILE C A 54 HIS N A 54 HIS CA A 54 HIS C 1.0 -157.6 -100.0 PHI 74 74 A 54 HIS N A 54 HIS CA A 54 HIS C A 55 LYS N 1.0 132.9 185.0 PSI 75 75 A 54 HIS C A 55 LYS N A 55 LYS CA A 55 LYS C 1.0 -65.7 -42.7 PHI 76 76 A 55 LYS N A 55 LYS CA A 55 LYS C A 56 GLY N 1.0 124.3 145.1 PSI 77 77 A 55 LYS C A 56 GLY N A 56 GLY CA A 56 GLY C 1.0 85.3 110.4 PHI 78 78 A 56 GLY N A 56 GLY CA A 56 GLY C A 57 ASP N 1.0 -31.6 -4.0 PSI 79 79 A 56 GLY C A 57 ASP N A 57 ASP CA A 57 ASP C 1.0 -95.3 -59.0 PHI 80 80 A 57 ASP N A 57 ASP CA A 57 ASP C A 58 ARG N 1.0 109.8 170.9 PSI 81 81 A 57 ASP C A 58 ARG N A 58 ARG CA A 58 ARG C 1.0 -153.8 -80.8 PHI 82 82 A 58 ARG N A 58 ARG CA A 58 ARG C A 59 VAL N 1.0 118.9 157.8 PSI 83 83 A 58 ARG C A 59 VAL N A 59 VAL CA A 59 VAL C 1.0 -104.6 -59.9 PHI 84 84 A 59 VAL N A 59 VAL CA A 59 VAL C A 60 LEU N 1.0 93.4 149.7 PSI 85 85 A 59 VAL C A 60 LEU N A 60 LEU CA A 60 LEU C 1.0 -121.9 -67.6 PHI 86 86 A 60 LEU N A 60 LEU CA A 60 LEU C A 61 ALA N 1.0 -57.7 -6.2 PSI 87 87 A 60 LEU C A 61 ALA N A 61 ALA CA A 61 ALA C 1.0 -185.6 -132.1 PHI 88 88 A 61 ALA N A 61 ALA CA A 61 ALA C A 62 VAL N 1.0 140.8 166.8 PSI 89 89 A 61 ALA C A 62 VAL N A 62 VAL CA A 62 VAL C 1.0 -148.2 -112.3 PHI 90 90 A 62 VAL N A 62 VAL CA A 62 VAL C A 63 ASN N 1.0 97.7 166.1 PSI 91 91 A 62 VAL C A 63 ASN N A 63 ASN CA A 63 ASN C 1.0 40.0 65.5 PHI 92 92 A 63 ASN N A 63 ASN CA A 63 ASN C A 64 GLY N 1.0 30.7 55.4 PSI 93 93 A 63 ASN C A 64 GLY N A 64 GLY CA A 64 GLY C 1.0 59.0 106.7 PHI 94 94 A 64 GLY N A 64 GLY CA A 64 GLY C A 65 VAL N 1.0 -37.3 25.5 PSI 95 95 A 64 GLY C A 65 VAL N A 65 VAL CA A 65 VAL C 1.0 -120.8 -50.7 PHI 96 96 A 65 VAL N A 65 VAL CA A 65 VAL C A 66 SER N 1.0 115.8 157.8 PSI 97 97 A 67 LEU C A 68 GLU N A 68 GLU CA A 68 GLU C 1.0 -75.1 -40.0 PHI 98 98 A 68 GLU N A 68 GLU CA A 68 GLU C A 69 GLY N 1.0 116.3 142.9 PSI 99 99 A 68 GLU C A 69 GLY N A 69 GLY CA A 69 GLY C 1.0 60.0 112.4 PHI 100 100 A 69 GLY N A 69 GLY CA A 69 GLY C A 70 ALA N 1.0 -33.9 26.8 PSI 101 101 A 69 GLY C A 70 ALA N A 70 ALA CA A 70 ALA C 1.0 -97.1 -58.7 PHI 102 102 A 70 ALA N A 70 ALA CA A 70 ALA C A 71 THR N 1.0 69.4 196.7 PSI 103 103 A 70 ALA C A 71 THR N A 71 THR CA A 71 THR C 1.0 -119.6 -47.8 PHI 104 104 A 71 THR N A 71 THR CA A 71 THR C A 72 HIS N 1.0 149.6 178.4 PSI 105 105 A 71 THR C A 72 HIS N A 72 HIS CA A 72 HIS C 1.0 -70.0 -50.0 PHI 106 106 A 72 HIS N A 72 HIS CA A 72 HIS C A 73 LYS N 1.0 -50.8 -30.8 PSI 107 107 A 72 HIS C A 73 LYS N A 73 LYS CA A 73 LYS C 1.0 -71.7 -49.7 PHI 108 108 A 73 LYS N A 73 LYS CA A 73 LYS C A 74 GLN N 1.0 -55.2 -33.7 PSI 109 109 A 73 LYS C A 74 GLN N A 74 GLN CA A 74 GLN C 1.0 -74.0 -54.0 PHI 110 110 A 74 GLN N A 74 GLN CA A 74 GLN C A 75 ALA N 1.0 -48.9 -28.5 PSI 111 111 A 74 GLN C A 75 ALA N A 75 ALA CA A 75 ALA C 1.0 -74.5 -51.3 PHI 112 112 A 75 ALA N A 75 ALA CA A 75 ALA C A 76 VAL N 1.0 -56.3 -31.7 PSI 113 113 A 75 ALA C A 76 VAL N A 76 VAL CA A 76 VAL C 1.0 -73.2 -53.2 PHI 114 114 A 76 VAL N A 76 VAL CA A 76 VAL C A 77 CYS N 1.0 -50.7 -21.6 PSI 115 115 A 77 CYS C A 78 THR N A 78 THR CA A 78 THR C 1.0 -73.5 -53.5 PHI 116 116 A 78 THR N A 78 THR CA A 78 THR C A 79 LEU N 1.0 -54.9 -34.9 PSI 117 117 A 78 THR C A 79 LEU N A 79 LEU CA A 79 LEU C 1.0 -71.3 -51.3 PHI 118 118 A 79 LEU N A 79 LEU CA A 79 LEU C A 80 ARG N 1.0 -50.6 -30.6 PSI 119 119 A 79 LEU C A 80 ARG N A 80 ARG CA A 80 ARG C 1.0 -85.1 -50.4 PHI 120 120 A 80 ARG N A 80 ARG CA A 80 ARG C A 81 ASN N 1.0 -59.9 -5.2 PSI 121 121 A 81 ASN C A 82 THR N A 82 THR CA A 82 THR C 1.0 -184.2 -75.2 PHI 122 122 A 82 THR N A 82 THR CA A 82 THR C A 83 GLY N 1.0 122.5 183.1 PSI 123 123 A 83 GLY C A 84 GLN N A 84 GLN CA A 84 GLN C 1.0 -118.3 -42.6 PHI 124 124 A 84 GLN N A 84 GLN CA A 84 GLN C A 85 VAL N 1.0 -52.9 -2.7 PSI 125 125 A 84 GLN C A 85 VAL N A 85 VAL CA A 85 VAL C 1.0 -175.0 -66.9 PHI 126 126 A 85 VAL N A 85 VAL CA A 85 VAL C A 86 VAL N 1.0 104.5 167.9 PSI 127 127 A 85 VAL C A 86 VAL N A 86 VAL CA A 86 VAL C 1.0 -139.3 -91.4 PHI 128 128 A 86 VAL N A 86 VAL CA A 86 VAL C A 87 HIS N 1.0 102.6 152.6 PSI 129 129 A 86 VAL C A 87 HIS N A 87 HIS CA A 87 HIS C 1.0 -141.5 -68.3 PHI 130 130 A 87 HIS N A 87 HIS CA A 87 HIS C A 88 LEU N 1.0 109.3 145.1 PSI 131 131 A 87 HIS C A 88 LEU N A 88 LEU CA A 88 LEU C 1.0 -164.3 -82.9 PHI 132 132 A 88 LEU N A 88 LEU CA A 88 LEU C A 89 LEU N 1.0 116.6 159.9 PSI 133 133 A 88 LEU C A 89 LEU N A 89 LEU CA A 89 LEU C 1.0 -151.3 -81.1 PHI 134 134 A 89 LEU N A 89 LEU CA A 89 LEU C A 90 LEU N 1.0 103.5 144.9 PSI 135 135 A 89 LEU C A 90 LEU N A 90 LEU CA A 90 LEU C 1.0 -156.8 -107.5 PHI 136 136 A 90 LEU N A 90 LEU CA A 90 LEU C A 91 GLU N 1.0 117.8 174.0 PSI 137 137 A 90 LEU C A 91 GLU N A 91 GLU CA A 91 GLU C 1.0 -169.0 -81.7 PHI 138 138 A 91 GLU N A 91 GLU CA A 91 GLU C A 92 LYS N 1.0 103.1 162.8 PSI 139 139 A 94 GLN C A 95 SER N A 95 SER CA A 95 SER C 1.0 -114.5 -45.4 PHI 140 140 A 95 SER N A 95 SER CA A 95 SER C A 96 PRO N 1.0 98.1 190.3 PSI stop_ save_ save_CNS/XPLOR_dipolar_coupling_6 _nef_rdc_restraint_list.sf_category nef_rdc_restraint_list _nef_rdc_restraint_list.sf_framecode CNS/XPLOR_dipolar_coupling_6 save_