data_nef_c25546_2n14 save_entry_information _nef_nmr_meta_data.sf_category nef_nmr_meta_data _nef_nmr_meta_data.sf_framecode entry_information _nef_nmr_meta_data.format_name nmr_exchange_format _nef_nmr_meta_data.format_version 1.1 loop_ _nef_related_entries.database_name _nef_related_entries.database_accession_code BMRB 25536 PDB 2N0U PDB 2N14 stop_ save_ save_assembly _nef_molecular_system.sf_category nef_molecular_system _nef_molecular_system.sf_framecode assembly loop_ _nef_sequence.index _nef_sequence.chain_code _nef_sequence.sequence_code _nef_sequence.residue_name _nef_sequence.linking _nef_sequence.residue_variant _nef_sequence.cis_peptide 1 A 23 GLN start . . 2 A 24 ILE middle . . 3 A 25 ASN middle . . 4 A 26 GLN middle . . 5 A 27 VAL middle . . 6 A 28 ARG middle . . 7 A 29 PRO middle . false 8 A 30 LYS middle . . 9 A 31 LEU middle . . 10 A 32 PRO middle . false 11 A 33 LEU middle . . 12 A 34 LEU middle . . 13 A 35 LYS middle . . 14 A 36 ILE middle . . 15 A 37 LEU middle . . 16 A 38 HIS middle . . 17 A 39 ALA middle . . 18 A 40 ALA middle . . 19 A 41 GLY middle . false 20 A 42 ALA middle . . 21 A 43 GLN middle . . 22 A 44 GLY middle . false 23 A 45 GLU middle . . 24 A 46 MET middle . . 25 A 47 PHE middle . . 26 A 48 THR middle . . 27 A 49 VAL middle . . 28 A 50 LYS middle . . 29 A 51 GLU middle . . 30 A 52 VAL middle . . 31 A 53 MET middle . . 32 A 54 HIS middle . . 33 A 55 TYR middle . . 34 A 56 LEU middle . . 35 A 57 GLY middle . false 36 A 58 GLN middle . . 37 A 59 TYR middle . . 38 A 60 ILE middle . . 39 A 61 MET middle . . 40 A 62 VAL middle . . 41 A 63 LYS middle . . 42 A 64 GLN middle . . 43 A 65 LEU middle . . 44 A 66 TYR middle . . 45 A 67 ASP middle . . 46 A 68 GLN middle . . 47 A 69 GLN middle . . 48 A 70 GLU middle . . 49 A 71 GLN middle . . 50 A 72 HIS middle . . 51 A 73 MET middle . . 52 A 74 VAL middle . . 53 A 75 TYR middle . . 54 A 76 CYS middle . . 55 A 77 GLY middle . false 56 A 78 GLY middle . false 57 A 79 ASP middle . . 58 A 80 LEU middle . . 59 A 81 LEU middle . . 60 A 82 GLY middle . false 61 A 83 GLU middle . . 62 A 84 LEU middle . . 63 A 85 LEU middle . . 64 A 86 GLY middle . false 65 A 87 ARG middle . . 66 A 88 GLN middle . . 67 A 89 SER middle . . 68 A 90 PHE middle . . 69 A 91 SER middle . . 70 A 92 VAL middle . . 71 A 93 LYS middle . . 72 A 94 ASP middle . . 73 A 95 PRO middle . false 74 A 96 SER middle . . 75 A 97 PRO middle . false 76 A 98 LEU middle . . 77 A 99 TYR middle . . 78 A 100 ASP middle . . 79 A 101 MET middle . . 80 A 102 LEU middle . . 81 A 103 ARG middle . . 82 A 104 LYS middle . . 83 A 105 ASN middle . . 84 A 106 LEU middle . . 85 A 107 VAL middle . . 86 A 108 THR middle . . 87 A 109 LEU middle . . 88 A 110 ALA middle . . 89 A 111 THR end . . 90 B 1 49H . . . 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 23 GLN H1 H 1 8.533 0.02 A 23 GLN HA H 1 4.317 0.02 A 23 GLN HB2 H 1 1.91 0.02 A 23 GLN HB3 H 1 1.91 0.02 A 23 GLN HG2 H 1 2.291 0.02 A 23 GLN HG3 H 1 2.291 0.02 A 23 GLN C C 13 175.885 0.3 A 23 GLN CA C 13 56.053 0.3 A 23 GLN CB C 13 29.693 0.3 A 23 GLN CG C 13 34.049 0.3 A 23 GLN N N 15 121.991 0.3 A 24 ILE H H 1 8.127 0.02 A 24 ILE HA H 1 4.149 0.02 A 24 ILE HB H 1 1.807 0.02 A 24 ILE HD1% H 1 0.799 0.02 A 24 ILE HG1y H 1 1.384 0.02 A 24 ILE HG1x H 1 1.117 0.02 A 24 ILE HG2% H 1 0.859 0.02 A 24 ILE C C 13 175.65 0.3 A 24 ILE CA C 13 61.085 0.3 A 24 ILE CB C 13 38.887 0.3 A 24 ILE CD1 C 13 13.147 0.3 A 24 ILE CG1 C 13 27.224 0.3 A 24 ILE CG2 C 13 17.844 0.3 A 24 ILE N N 15 120.769 0.3 A 25 ASN H H 1 8.441 0.02 A 25 ASN HA H 1 4.717 0.02 A 25 ASN HBy H 1 2.78 0.02 A 25 ASN HBx H 1 2.74 0.02 A 25 ASN HD21 H 1 7.536 0.02 A 25 ASN HD22 H 1 6.786 0.02 A 25 ASN C C 13 174.775 0.3 A 25 ASN CA C 13 53.316 0.3 A 25 ASN CB C 13 39.252 0.3 A 25 ASN N N 15 121.926 0.3 A 25 ASN ND2 N 15 112.172 0.3 A 26 GLN H H 1 8.206 0.02 A 26 GLN HA H 1 4.569 0.02 A 26 GLN HB2 H 1 1.873 0.02 A 26 GLN HB3 H 1 1.873 0.02 A 26 GLN HE21 H 1 7.277 0.02 A 26 GLN HE22 H 1 6.633 0.02 A 26 GLN HGy H 1 2.231 0.02 A 26 GLN HGx H 1 1.999 0.02 A 26 GLN C C 13 175.291 0.3 A 26 GLN CA C 13 55.531 0.3 A 26 GLN CB C 13 31.943 0.3 A 26 GLN CG C 13 34.763 0.3 A 26 GLN N N 15 118.882 0.3 A 26 GLN NE2 N 15 110.912 0.3 A 27 VAL H H 1 9.411 0.02 A 27 VAL HA H 1 4.849 0.02 A 27 VAL HB H 1 1.854 0.02 A 27 VAL HGx% H 1 0.714 0.02 A 27 VAL HGy% H 1 0.773 0.02 A 27 VAL C C 13 173.9 0.3 A 27 VAL CA C 13 58.943 0.3 A 27 VAL CB C 13 35.761 0.3 A 27 VAL CG1 C 13 19.226 0.3 A 27 VAL CG2 C 13 22.242 0.3 A 27 VAL N N 15 114.037 0.3 A 28 ARG H H 1 8.904 0.02 A 28 ARG HA H 1 5.453 0.02 A 28 ARG HBy H 1 1.87 0.02 A 28 ARG HBx H 1 1.575 0.02 A 28 ARG HD2 H 1 3.089 0.02 A 28 ARG HD3 H 1 3.089 0.02 A 28 ARG HE H 1 7.222 0.02 A 28 ARG HGy H 1 1.665 0.02 A 28 ARG HGx H 1 1.442 0.02 A 28 ARG CA C 13 52.421 0.3 A 28 ARG CB C 13 33.438 0.3 A 28 ARG CD C 13 43.804 0.3 A 28 ARG CG C 13 27.629 0.3 A 28 ARG N N 15 121.82 0.3 A 29 PRO HA H 1 4.996 0.02 A 29 PRO HBy H 1 1.851 0.02 A 29 PRO HBx H 1 1.711 0.02 A 29 PRO HDy H 1 4.134 0.02 A 29 PRO HDx H 1 4.017 0.02 A 29 PRO HGy H 1 1.806 0.02 A 29 PRO HGx H 1 1.395 0.02 A 29 PRO CA C 13 61.767 0.3 A 29 PRO CB C 13 32.078 0.3 A 29 PRO CD C 13 51.607 0.3 A 29 PRO CG C 13 28.065 0.3 A 30 LYS H H 1 8.479 0.02 A 30 LYS HA H 1 4.202 0.02 A 30 LYS HBy H 1 2.009 0.02 A 30 LYS HBx H 1 1.875 0.02 A 30 LYS HD2 H 1 1.56 0.02 A 30 LYS HD3 H 1 1.56 0.02 A 30 LYS HE2 H 1 2.868 0.02 A 30 LYS HE3 H 1 2.868 0.02 A 30 LYS HG2 H 1 1.31 0.02 A 30 LYS HG3 H 1 1.31 0.02 A 30 LYS C C 13 177.557 0.3 A 30 LYS CA C 13 57.645 0.3 A 30 LYS CB C 13 33.858 0.3 A 30 LYS CD C 13 29.329 0.3 A 30 LYS CE C 13 42.109 0.3 A 30 LYS CG C 13 27.294 0.3 A 30 LYS N N 15 121.343 0.3 A 31 LEU H H 1 8.621 0.02 A 31 LEU HA H 1 4.066 0.02 A 31 LEU HB2 H 1 1.688 0.02 A 31 LEU HB3 H 1 1.688 0.02 A 31 LEU HD1% H 1 0.9 0.02 A 31 LEU HG H 1 1.606 0.02 A 31 LEU CA C 13 59.993 0.3 A 31 LEU CB C 13 39.677 0.3 A 31 LEU CD1 C 13 24.218 0.3 A 31 LEU CG C 13 27.078 0.3 A 31 LEU N N 15 121.732 0.3 A 32 PRO HA H 1 4.135 0.02 A 32 PRO HBy H 1 2.247 0.02 A 32 PRO HBx H 1 1.62 0.02 A 32 PRO HDy H 1 3.72 0.02 A 32 PRO HDx H 1 3.439 0.02 A 32 PRO HGy H 1 1.961 0.02 A 32 PRO HGx H 1 1.915 0.02 A 32 PRO CA C 13 66.355 0.3 A 32 PRO CB C 13 31.303 0.3 A 32 PRO CD C 13 49.842 0.3 A 32 PRO CG C 13 28.651 0.3 A 33 LEU H H 1 6.601 0.02 A 33 LEU HA H 1 3.982 0.02 A 33 LEU HBy H 1 1.811 0.02 A 33 LEU HBx H 1 1.095 0.02 A 33 LEU HDx% H 1 0.696 0.02 A 33 LEU HDy% H 1 0.672 0.02 A 33 LEU HG H 1 1.243 0.02 A 33 LEU C C 13 177.726 0.3 A 33 LEU CA C 13 55.985 0.3 A 33 LEU CB C 13 41.687 0.3 A 33 LEU CD1 C 13 27.248 0.3 A 33 LEU CD2 C 13 22.729 0.3 A 33 LEU CG C 13 27.386 0.3 A 33 LEU N N 15 113.389 0.3 A 34 LEU H H 1 8.414 0.02 A 34 LEU HA H 1 3.399 0.02 A 34 LEU HBy H 1 1.676 0.02 A 34 LEU HBx H 1 1.217 0.02 A 34 LEU HDx% H 1 0.882 0.02 A 34 LEU HDy% H 1 0.843 0.02 A 34 LEU HG H 1 1.623 0.02 A 34 LEU C C 13 177.467 0.3 A 34 LEU CA C 13 58.071 0.3 A 34 LEU CB C 13 41.726 0.3 A 34 LEU CD1 C 13 24.036 0.3 A 34 LEU CD2 C 13 25.409 0.3 A 34 LEU CG C 13 27.011 0.3 A 34 LEU N N 15 121.911 0.3 A 35 LYS H H 1 7.981 0.02 A 35 LYS HA H 1 3.807 0.02 A 35 LYS HBy H 1 1.77 0.02 A 35 LYS HBx H 1 1.707 0.02 A 35 LYS HD2 H 1 1.57 0.02 A 35 LYS HD3 H 1 1.57 0.02 A 35 LYS HE2 H 1 2.842 0.02 A 35 LYS HE3 H 1 2.842 0.02 A 35 LYS HG2 H 1 1.327 0.02 A 35 LYS HG3 H 1 1.327 0.02 A 35 LYS C C 13 180.207 0.3 A 35 LYS CA C 13 59.83 0.3 A 35 LYS CB C 13 32.193 0.3 A 35 LYS CD C 13 29.177 0.3 A 35 LYS CE C 13 41.977 0.3 A 35 LYS CG C 13 25.307 0.3 A 35 LYS N N 15 115.046 0.3 A 36 ILE H H 1 6.749 0.02 A 36 ILE HA H 1 3.315 0.02 A 36 ILE HB H 1 1.691 0.02 A 36 ILE HD1% H 1 0.349 0.02 A 36 ILE HG1y H 1 1.397 0.02 A 36 ILE HG1x H 1 0.694 0.02 A 36 ILE HG2% H 1 -0.267 0.02 A 36 ILE C C 13 176.418 0.3 A 36 ILE CA C 13 64.315 0.3 A 36 ILE CB C 13 37.373 0.3 A 36 ILE CD1 C 13 13.219 0.3 A 36 ILE CG1 C 13 28.831 0.3 A 36 ILE CG2 C 13 15.349 0.3 A 36 ILE N N 15 120.133 0.3 A 37 LEU H H 1 7.643 0.02 A 37 LEU HA H 1 3.535 0.02 A 37 LEU HBy H 1 1.351 0.02 A 37 LEU HBx H 1 0.581 0.02 A 37 LEU HDx% H 1 0.418 0.02 A 37 LEU HDy% H 1 0.118 0.02 A 37 LEU HG H 1 1.619 0.02 A 37 LEU C C 13 180.263 0.3 A 37 LEU CA C 13 58.102 0.3 A 37 LEU CB C 13 38.981 0.3 A 37 LEU CD1 C 13 23.032 0.3 A 37 LEU CD2 C 13 26.317 0.3 A 37 LEU CG C 13 26.529 0.3 A 37 LEU N N 15 116.871 0.3 A 38 HIS H H 1 8.939 0.02 A 38 HIS HA H 1 4.662 0.02 A 38 HIS HB2 H 1 3.078 0.02 A 38 HIS HB3 H 1 3.078 0.02 A 38 HIS HD2 H 1 6.481 0.02 A 38 HIS HE1 H 1 7.943 0.02 A 38 HIS C C 13 179.936 0.3 A 38 HIS CA C 13 57.124 0.3 A 38 HIS CB C 13 30.617 0.3 A 38 HIS CD2 C 13 115.54 0.3 A 38 HIS CE1 C 13 138.349 0.3 A 38 HIS N N 15 117.736 0.3 A 39 ALA H H 1 7.96 0.02 A 39 ALA HA H 1 4.254 0.02 A 39 ALA HB% H 1 1.74 0.02 A 39 ALA C C 13 178.764 0.3 A 39 ALA CA C 13 54.902 0.3 A 39 ALA CB C 13 17.989 0.3 A 39 ALA N N 15 124.182 0.3 A 40 ALA H H 1 7.652 0.02 A 40 ALA HA H 1 4.422 0.02 A 40 ALA HB% H 1 1.766 0.02 A 40 ALA C C 13 176.261 0.3 A 40 ALA CA C 13 51.956 0.3 A 40 ALA CB C 13 20.906 0.3 A 40 ALA N N 15 118.208 0.3 A 41 GLY H H 1 7.687 0.02 A 41 GLY HAy H 1 4.454 0.02 A 41 GLY HAx H 1 3.626 0.02 A 41 GLY C C 13 174.412 0.3 A 41 GLY CA C 13 44.74 0.3 A 41 GLY N N 15 104.057 0.3 A 42 ALA H H 1 7.569 0.02 A 42 ALA HA H 1 3.637 0.02 A 42 ALA HB% H 1 0.17 0.02 A 42 ALA C C 13 175.956 0.3 A 42 ALA CA C 13 52.536 0.3 A 42 ALA CB C 13 19.127 0.3 A 42 ALA N N 15 123.727 0.3 A 43 GLN H H 1 8.537 0.02 A 43 GLN HA H 1 4.379 0.02 A 43 GLN HBy H 1 1.948 0.02 A 43 GLN HBx H 1 1.808 0.02 A 43 GLN HE21 H 1 7.382 0.02 A 43 GLN HE22 H 1 6.704 0.02 A 43 GLN HGy H 1 2.232 0.02 A 43 GLN HGx H 1 2.178 0.02 A 43 GLN C C 13 175.528 0.3 A 43 GLN CA C 13 54.5 0.3 A 43 GLN CB C 13 31.835 0.3 A 43 GLN CG C 13 33.768 0.3 A 43 GLN N N 15 117.659 0.3 A 43 GLN NE2 N 15 112.028 0.3 A 44 GLY H H 1 8.545 0.02 A 44 GLY HAy H 1 4.135 0.02 A 44 GLY HAx H 1 3.748 0.02 A 44 GLY C C 13 174.073 0.3 A 44 GLY CA C 13 44.5 0.3 A 44 GLY N N 15 108.246 0.3 A 45 GLU H H 1 8.309 0.02 A 45 GLU HA H 1 4.61 0.02 A 45 GLU HBy H 1 2.087 0.02 A 45 GLU HBx H 1 1.801 0.02 A 45 GLU HGy H 1 2.16 0.02 A 45 GLU HGx H 1 2.097 0.02 A 45 GLU C C 13 174.007 0.3 A 45 GLU CA C 13 56.851 0.3 A 45 GLU CB C 13 32.797 0.3 A 45 GLU CG C 13 36.704 0.3 A 45 GLU N N 15 114.649 0.3 A 46 MET H H 1 6.881 0.02 A 46 MET HA H 1 5.06 0.02 A 46 MET HB2 H 1 1.658 0.02 A 46 MET HB3 H 1 1.658 0.02 A 46 MET HE% H 1 1.69 0.02 A 46 MET HGy H 1 2.319 0.02 A 46 MET HGx H 1 2.219 0.02 A 46 MET C C 13 174.637 0.3 A 46 MET CA C 13 54.012 0.3 A 46 MET CB C 13 35.618 0.3 A 46 MET CE C 13 15.576 0.3 A 46 MET CG C 13 31.838 0.3 A 46 MET N N 15 115.512 0.3 A 47 PHE H H 1 8.618 0.02 A 47 PHE HA H 1 5.102 0.02 A 47 PHE HBy H 1 3.634 0.02 A 47 PHE HBx H 1 2.088 0.02 A 47 PHE HD1 H 1 6.929 0.02 A 47 PHE HD2 H 1 6.929 0.02 A 47 PHE HE1 H 1 6.944 0.02 A 47 PHE HE2 H 1 6.944 0.02 A 47 PHE HZ H 1 6.605 0.02 A 47 PHE C C 13 175.742 0.3 A 47 PHE CA C 13 57.167 0.3 A 47 PHE CB C 13 46.737 0.3 A 47 PHE CE1 C 13 131.953 0.3 A 47 PHE CE2 C 13 131.953 0.3 A 47 PHE CZ C 13 130.159 0.3 A 47 PHE N N 15 119.006 0.3 A 48 THR H H 1 9.14 0.02 A 48 THR HA H 1 4.979 0.02 A 48 THR HB H 1 4.741 0.02 A 48 THR HG2% H 1 1.293 0.02 A 48 THR C C 13 176.666 0.3 A 48 THR CA C 13 60.87 0.3 A 48 THR CB C 13 70.941 0.3 A 48 THR CG2 C 13 22.323 0.3 A 48 THR N N 15 110.826 0.3 A 49 VAL H H 1 9.104 0.02 A 49 VAL HA H 1 3.386 0.02 A 49 VAL HB H 1 2.025 0.02 A 49 VAL HGx% H 1 0.976 0.02 A 49 VAL HGy% H 1 0.772 0.02 A 49 VAL C C 13 177.726 0.3 A 49 VAL CA C 13 68.091 0.3 A 49 VAL CB C 13 31.332 0.3 A 49 VAL CG1 C 13 23.75 0.3 A 49 VAL CG2 C 13 21.838 0.3 A 49 VAL N N 15 121.955 0.3 A 50 LYS H H 1 8.168 0.02 A 50 LYS HA H 1 3.952 0.02 A 50 LYS HBy H 1 1.832 0.02 A 50 LYS HBx H 1 1.735 0.02 A 50 LYS HDy H 1 1.655 0.02 A 50 LYS HDx H 1 1.577 0.02 A 50 LYS HEy H 1 2.949 0.02 A 50 LYS HEx H 1 2.862 0.02 A 50 LYS HGy H 1 1.51 0.02 A 50 LYS HGx H 1 1.365 0.02 A 50 LYS C C 13 180.06 0.3 A 50 LYS CA C 13 60.196 0.3 A 50 LYS CB C 13 32.557 0.3 A 50 LYS CD C 13 29.495 0.3 A 50 LYS CE C 13 42.156 0.3 A 50 LYS CG C 13 25.401 0.3 A 50 LYS N N 15 118.624 0.3 A 51 GLU H H 1 7.884 0.02 A 51 GLU HA H 1 4.038 0.02 A 51 GLU HBy H 1 2.872 0.02 A 51 GLU HBx H 1 2.205 0.02 A 51 GLU HGy H 1 2.496 0.02 A 51 GLU HGx H 1 2.358 0.02 A 51 GLU C C 13 178.583 0.3 A 51 GLU CA C 13 59.622 0.3 A 51 GLU CB C 13 31.206 0.3 A 51 GLU CG C 13 38.002 0.3 A 51 GLU N N 15 119.782 0.3 A 52 VAL H H 1 8.268 0.02 A 52 VAL HA H 1 3.253 0.02 A 52 VAL HB H 1 2.359 0.02 A 52 VAL HGx% H 1 0.885 0.02 A 52 VAL HGy% H 1 0.81 0.02 A 52 VAL C C 13 177.546 0.3 A 52 VAL CA C 13 67.725 0.3 A 52 VAL CB C 13 31.073 0.3 A 52 VAL CG1 C 13 21.405 0.3 A 52 VAL CG2 C 13 22.65 0.3 A 52 VAL N N 15 119.239 0.3 A 53 MET H H 1 8.221 0.02 A 53 MET HA H 1 4.191 0.02 A 53 MET HBy H 1 2.695 0.02 A 53 MET HBx H 1 2.603 0.02 A 53 MET HE% H 1 1.696 0.02 A 53 MET HGy H 1 2.201 0.02 A 53 MET HGx H 1 1.935 0.02 A 53 MET C C 13 178.64 0.3 A 53 MET CA C 13 57.503 0.3 A 53 MET CB C 13 32.543 0.3 A 53 MET CE C 13 17.003 0.3 A 53 MET CG C 13 30.638 0.3 A 53 MET N N 15 114.767 0.3 A 54 HIS H H 1 8.086 0.02 A 54 HIS HA H 1 4.14 0.02 A 54 HIS HBy H 1 3.142 0.02 A 54 HIS HBx H 1 3.01 0.02 A 54 HIS HD2 H 1 7.091 0.02 A 54 HIS HE1 H 1 7.655 0.02 A 54 HIS C C 13 178.531 0.3 A 54 HIS CA C 13 59.967 0.3 A 54 HIS CB C 13 30.18 0.3 A 54 HIS CD2 C 13 118.473 0.3 A 54 HIS CE1 C 13 139.015 0.3 A 54 HIS N N 15 118.978 0.3 A 55 TYR H H 1 8.466 0.02 A 55 TYR HA H 1 3.865 0.02 A 55 TYR HBy H 1 2.848 0.02 A 55 TYR HBx H 1 2.654 0.02 A 55 TYR HD1 H 1 7.017 0.02 A 55 TYR HD2 H 1 7.017 0.02 A 55 TYR HE1 H 1 6.744 0.02 A 55 TYR HE2 H 1 6.744 0.02 A 55 TYR C C 13 177.684 0.3 A 55 TYR CA C 13 63.483 0.3 A 55 TYR CB C 13 38.826 0.3 A 55 TYR CD1 C 13 133.401 0.3 A 55 TYR CD2 C 13 133.401 0.3 A 55 TYR CE1 C 13 118.493 0.3 A 55 TYR CE2 C 13 118.493 0.3 A 55 TYR N N 15 116.937 0.3 A 56 LEU H H 1 8.445 0.02 A 56 LEU C C 13 178.438 0.3 A 56 LEU CA C 13 58.625 0.3 A 56 LEU CB C 13 41.698 0.3 A 56 LEU N N 15 121.122 0.3 A 57 GLY H H 1 7.63 0.02 A 57 GLY HA2 H 1 3.866 0.02 A 57 GLY HA3 H 1 3.866 0.02 A 57 GLY C C 13 175.796 0.3 A 57 GLY CA C 13 46.882 0.3 A 57 GLY N N 15 105.294 0.3 A 58 GLN H H 1 7.682 0.02 A 58 GLN HA H 1 3.831 0.02 A 58 GLN HB2 H 1 1.815 0.02 A 58 GLN HB3 H 1 1.815 0.02 A 58 GLN HE21 H 1 7.445 0.02 A 58 GLN HE22 H 1 6.9 0.02 A 58 GLN HG2 H 1 2.044 0.02 A 58 GLN HG3 H 1 2.044 0.02 A 58 GLN C C 13 177.478 0.3 A 58 GLN CA C 13 58.471 0.3 A 58 GLN CB C 13 28.358 0.3 A 58 GLN CG C 13 33.846 0.3 A 58 GLN N N 15 119.08 0.3 A 58 GLN NE2 N 15 112.07 0.3 A 59 TYR H H 1 8.515 0.02 A 59 TYR HA H 1 3.809 0.02 A 59 TYR HBy H 1 3.309 0.02 A 59 TYR HBx H 1 2.999 0.02 A 59 TYR HD1 H 1 6.816 0.02 A 59 TYR HD2 H 1 6.816 0.02 A 59 TYR HE1 H 1 6.853 0.02 A 59 TYR HE2 H 1 6.853 0.02 A 59 TYR C C 13 176.215 0.3 A 59 TYR CA C 13 62.349 0.3 A 59 TYR CB C 13 38.397 0.3 A 59 TYR CD1 C 13 132.897 0.3 A 59 TYR CD2 C 13 132.897 0.3 A 59 TYR CE1 C 13 118.724 0.3 A 59 TYR CE2 C 13 118.724 0.3 A 59 TYR N N 15 121.14 0.3 A 60 ILE H H 1 7.589 0.02 A 60 ILE HA H 1 3.282 0.02 A 60 ILE HB H 1 1.866 0.02 A 60 ILE HD1% H 1 0.983 0.02 A 60 ILE HG1y H 1 1.928 0.02 A 60 ILE HG1x H 1 0.976 0.02 A 60 ILE HG2% H 1 0.865 0.02 A 60 ILE C C 13 177.952 0.3 A 60 ILE CA C 13 65.516 0.3 A 60 ILE CB C 13 38.334 0.3 A 60 ILE CD1 C 13 15.306 0.3 A 60 ILE CG1 C 13 30.566 0.3 A 60 ILE CG2 C 13 19.262 0.3 A 60 ILE N N 15 116.941 0.3 A 61 MET H H 1 7.736 0.02 A 61 MET HA H 1 4.511 0.02 A 61 MET HB2 H 1 2.489 0.02 A 61 MET HB3 H 1 2.489 0.02 A 61 MET HE% H 1 1.696 0.02 A 61 MET HG2 H 1 2.128 0.02 A 61 MET HG3 H 1 2.128 0.02 A 61 MET C C 13 180.579 0.3 A 61 MET CA C 13 57.598 0.3 A 61 MET CB C 13 31.334 0.3 A 61 MET CE C 13 16.048 0.3 A 61 MET CG C 13 30.334 0.3 A 61 MET N N 15 115.944 0.3 A 62 VAL H H 1 9.046 0.02 A 62 VAL HA H 1 3.835 0.02 A 62 VAL HB H 1 2.09 0.02 A 62 VAL HGx% H 1 1.039 0.02 A 62 VAL HGy% H 1 0.927 0.02 A 62 VAL C C 13 178.786 0.3 A 62 VAL CA C 13 65.635 0.3 A 62 VAL CB C 13 31.692 0.3 A 62 VAL CG1 C 13 22.124 0.3 A 62 VAL CG2 C 13 20.884 0.3 A 62 VAL N N 15 121.027 0.3 A 63 LYS H H 1 7.835 0.02 A 63 LYS HA H 1 4.055 0.02 A 63 LYS HBy H 1 1.574 0.02 A 63 LYS HBx H 1 1.296 0.02 A 63 LYS HDy H 1 1.254 0.02 A 63 LYS HDx H 1 1.157 0.02 A 63 LYS HE2 H 1 2.749 0.02 A 63 LYS HE3 H 1 2.749 0.02 A 63 LYS HG2 H 1 0.836 0.02 A 63 LYS HG3 H 1 0.836 0.02 A 63 LYS HZ1 H 1 6.676 0.02 A 63 LYS HZ2 H 1 6.676 0.02 A 63 LYS HZ3 H 1 6.676 0.02 A 63 LYS C C 13 174.784 0.3 A 63 LYS CA C 13 55.877 0.3 A 63 LYS CB C 13 31.179 0.3 A 63 LYS CD C 13 28.532 0.3 A 63 LYS CE C 13 42.048 0.3 A 63 LYS CG C 13 24.865 0.3 A 63 LYS N N 15 116.925 0.3 A 64 GLN H H 1 7.664 0.02 A 64 GLN HA H 1 3.652 0.02 A 64 GLN HBy H 1 2.059 0.02 A 64 GLN HBx H 1 1.994 0.02 A 64 GLN HE21 H 1 7.477 0.02 A 64 GLN HE22 H 1 6.712 0.02 A 64 GLN HG2 H 1 2.161 0.02 A 64 GLN HG3 H 1 2.161 0.02 A 64 GLN C C 13 175.55 0.3 A 64 GLN CA C 13 56.698 0.3 A 64 GLN CB C 13 26.101 0.3 A 64 GLN CG C 13 34.571 0.3 A 64 GLN N N 15 115.39 0.3 A 64 GLN NE2 N 15 111.505 0.3 A 65 LEU H H 1 8.06 0.02 A 65 LEU HA H 1 4.443 0.02 A 65 LEU HBy H 1 1.812 0.02 A 65 LEU HBx H 1 1.471 0.02 A 65 LEU HDx% H 1 0.764 0.02 A 65 LEU HDy% H 1 0.762 0.02 A 65 LEU HG H 1 1.383 0.02 A 65 LEU C C 13 175.979 0.3 A 65 LEU CA C 13 54.475 0.3 A 65 LEU CB C 13 41.665 0.3 A 65 LEU CD1 C 13 26.523 0.3 A 65 LEU CD2 C 13 21.616 0.3 A 65 LEU CG C 13 26.547 0.3 A 65 LEU N N 15 115.745 0.3 A 66 TYR H H 1 6.881 0.02 A 66 TYR HA H 1 5.27 0.02 A 66 TYR HBy H 1 3.126 0.02 A 66 TYR HBx H 1 2.486 0.02 A 66 TYR HD1 H 1 6.863 0.02 A 66 TYR HD2 H 1 6.863 0.02 A 66 TYR HE1 H 1 6.856 0.02 A 66 TYR HE2 H 1 6.856 0.02 A 66 TYR C C 13 174.107 0.3 A 66 TYR CA C 13 54.569 0.3 A 66 TYR CB C 13 39.535 0.3 A 66 TYR CD1 C 13 133.927 0.3 A 66 TYR CD2 C 13 133.927 0.3 A 66 TYR CE1 C 13 118.729 0.3 A 66 TYR CE2 C 13 118.729 0.3 A 66 TYR N N 15 113.559 0.3 A 67 ASP H H 1 8.311 0.02 A 67 ASP HA H 1 4.428 0.02 A 67 ASP HBy H 1 3.234 0.02 A 67 ASP HBx H 1 2.386 0.02 A 67 ASP C C 13 176.779 0.3 A 67 ASP CA C 13 53.867 0.3 A 67 ASP CB C 13 43.117 0.3 A 67 ASP N N 15 122.377 0.3 A 68 GLN H H 1 8.564 0.02 A 68 GLN HA H 1 3.891 0.02 A 68 GLN HBy H 1 2.079 0.02 A 68 GLN HBx H 1 1.963 0.02 A 68 GLN HE21 H 1 7.477 0.02 A 68 GLN HE22 H 1 6.604 0.02 A 68 GLN HG2 H 1 2.336 0.02 A 68 GLN HG3 H 1 2.336 0.02 A 68 GLN C C 13 177.122 0.3 A 68 GLN CA C 13 58.767 0.3 A 68 GLN CB C 13 28.883 0.3 A 68 GLN CG C 13 34.153 0.3 A 68 GLN N N 15 123.286 0.3 A 68 GLN NE2 N 15 111.854 0.3 A 69 GLN H H 1 8.365 0.02 A 69 GLN HA H 1 4.338 0.02 A 69 GLN HBy H 1 2.116 0.02 A 69 GLN HBx H 1 2.033 0.02 A 69 GLN HE21 H 1 7.619 0.02 A 69 GLN HE22 H 1 6.788 0.02 A 69 GLN HG2 H 1 2.299 0.02 A 69 GLN HG3 H 1 2.299 0.02 A 69 GLN C C 13 176.272 0.3 A 69 GLN CA C 13 56.914 0.3 A 69 GLN CB C 13 29.828 0.3 A 69 GLN CG C 13 34.358 0.3 A 69 GLN N N 15 115.517 0.3 A 69 GLN NE2 N 15 112.019 0.3 A 70 GLU H H 1 8.227 0.02 A 70 GLU HA H 1 4.472 0.02 A 70 GLU HB2 H 1 1.719 0.02 A 70 GLU HB3 H 1 1.719 0.02 A 70 GLU HGy H 1 2.125 0.02 A 70 GLU HGx H 1 1.994 0.02 A 70 GLU C C 13 175.832 0.3 A 70 GLU CA C 13 54.974 0.3 A 70 GLU CB C 13 29.537 0.3 A 70 GLU CG C 13 36.242 0.3 A 70 GLU N N 15 122.421 0.3 A 71 GLN H H 1 8.209 0.02 A 71 GLN HA H 1 4.436 0.02 A 71 GLN HB2 H 1 1.921 0.02 A 71 GLN HB3 H 1 1.921 0.02 A 71 GLN HE21 H 1 7.32 0.02 A 71 GLN HE22 H 1 6.705 0.02 A 71 GLN HG2 H 1 2.435 0.02 A 71 GLN HG3 H 1 2.435 0.02 A 71 GLN C C 13 174.308 0.3 A 71 GLN CA C 13 59.391 0.3 A 71 GLN CB C 13 28.075 0.3 A 71 GLN CG C 13 34.326 0.3 A 71 GLN N N 15 119.32 0.3 A 71 GLN NE2 N 15 109.674 0.3 A 72 HIS H H 1 7.392 0.02 A 72 HIS HA H 1 4.193 0.02 A 72 HIS HBy H 1 2.984 0.02 A 72 HIS HBx H 1 2.669 0.02 A 72 HIS HD2 H 1 5.192 0.02 A 72 HIS HE1 H 1 7.757 0.02 A 72 HIS C C 13 173.866 0.3 A 72 HIS CA C 13 56.032 0.3 A 72 HIS CB C 13 31.037 0.3 A 72 HIS CD2 C 13 118.949 0.3 A 72 HIS CE1 C 13 139.868 0.3 A 72 HIS N N 15 109.93 0.3 A 73 MET H H 1 7.693 0.02 A 73 MET HA H 1 4.592 0.02 A 73 MET HB2 H 1 1.554 0.02 A 73 MET HB3 H 1 1.554 0.02 A 73 MET HE% H 1 1.704 0.02 A 73 MET HG2 H 1 2.244 0.02 A 73 MET HG3 H 1 2.244 0.02 A 73 MET C C 13 174.242 0.3 A 73 MET CA C 13 52.955 0.3 A 73 MET CB C 13 31.351 0.3 A 73 MET CE C 13 14.896 0.3 A 73 MET CG C 13 30.857 0.3 A 73 MET N N 15 119.471 0.3 A 74 VAL H H 1 8.444 0.02 A 74 VAL HA H 1 3.925 0.02 A 74 VAL HB H 1 0.864 0.02 A 74 VAL HGx% H 1 0.526 0.02 A 74 VAL HGy% H 1 0.427 0.02 A 74 VAL C C 13 174.851 0.3 A 74 VAL CA C 13 61.355 0.3 A 74 VAL CB C 13 32.479 0.3 A 74 VAL CG1 C 13 21.818 0.3 A 74 VAL CG2 C 13 21.904 0.3 A 74 VAL N N 15 122.811 0.3 A 75 TYR H H 1 8.253 0.02 A 75 TYR HA H 1 4.766 0.02 A 75 TYR HBy H 1 3.052 0.02 A 75 TYR HBx H 1 2.693 0.02 A 75 TYR HD1 H 1 7.016 0.02 A 75 TYR HD2 H 1 7.016 0.02 A 75 TYR HE1 H 1 6.881 0.02 A 75 TYR HE2 H 1 6.881 0.02 A 75 TYR C C 13 174.923 0.3 A 75 TYR CA C 13 57.567 0.3 A 75 TYR CB C 13 38.494 0.3 A 75 TYR CD1 C 13 133.672 0.3 A 75 TYR CD2 C 13 133.672 0.3 A 75 TYR CE1 C 13 118.82 0.3 A 75 TYR CE2 C 13 118.82 0.3 A 75 TYR N N 15 125.895 0.3 A 76 CYS H H 1 8.269 0.02 A 76 CYS HA H 1 4.748 0.02 A 76 CYS HBy H 1 3.254 0.02 A 76 CYS HBx H 1 2.215 0.02 A 76 CYS C C 13 174.231 0.3 A 76 CYS CA C 13 55.95 0.3 A 76 CYS CB C 13 29.488 0.3 A 76 CYS N N 15 116.829 0.3 A 77 GLY H H 1 8.506 0.02 A 77 GLY HAy H 1 3.935 0.02 A 77 GLY HAx H 1 3.855 0.02 A 77 GLY C C 13 174.662 0.3 A 77 GLY CA C 13 47.002 0.3 A 77 GLY N N 15 111.816 0.3 A 78 GLY H H 1 8.893 0.02 A 78 GLY HAy H 1 3.997 0.02 A 78 GLY HAx H 1 3.846 0.02 A 78 GLY C C 13 172.811 0.3 A 78 GLY CA C 13 45.562 0.3 A 78 GLY N N 15 113.07 0.3 A 79 ASP H H 1 7.797 0.02 A 79 ASP HA H 1 4.889 0.02 A 79 ASP HBy H 1 2.571 0.02 A 79 ASP HBx H 1 2.45 0.02 A 79 ASP C C 13 176.302 0.3 A 79 ASP CA C 13 52.93 0.3 A 79 ASP CB C 13 47.082 0.3 A 79 ASP N N 15 119.638 0.3 A 80 LEU H H 1 8.587 0.02 A 80 LEU HA H 1 4.074 0.02 A 80 LEU HBy H 1 1.608 0.02 A 80 LEU HBx H 1 1.469 0.02 A 80 LEU HD1% H 1 0.861 0.02 A 80 LEU HD2% H 1 0.861 0.02 A 80 LEU HG H 1 1.52 0.02 A 80 LEU C C 13 179.059 0.3 A 80 LEU CA C 13 58.408 0.3 A 80 LEU CB C 13 42.289 0.3 A 80 LEU CD1 C 13 24.372 0.3 A 80 LEU CG C 13 27.106 0.3 A 80 LEU N N 15 128.693 0.3 A 81 LEU H H 1 9.987 0.02 A 81 LEU HA H 1 3.871 0.02 A 81 LEU HBy H 1 1.759 0.02 A 81 LEU HBx H 1 1.491 0.02 A 81 LEU HDx% H 1 0.868 0.02 A 81 LEU HDy% H 1 0.694 0.02 A 81 LEU HG H 1 1.577 0.02 A 81 LEU C C 13 178.542 0.3 A 81 LEU CA C 13 58.456 0.3 A 81 LEU CB C 13 42.517 0.3 A 81 LEU CD1 C 13 26.545 0.3 A 81 LEU CD2 C 13 22.73 0.3 A 81 LEU CG C 13 27.529 0.3 A 81 LEU N N 15 118.808 0.3 A 82 GLY H H 1 7.572 0.02 A 82 GLY HA2 H 1 3.986 0.02 A 82 GLY HA3 H 1 3.986 0.02 A 82 GLY C C 13 176.907 0.3 A 82 GLY CA C 13 47.887 0.3 A 82 GLY N N 15 105.718 0.3 A 83 GLU H H 1 7.531 0.02 A 83 GLU HA H 1 3.988 0.02 A 83 GLU HB2 H 1 2.073 0.02 A 83 GLU HB3 H 1 2.073 0.02 A 83 GLU HGy H 1 2.223 0.02 A 83 GLU HGx H 1 2.087 0.02 A 83 GLU C C 13 179.215 0.3 A 83 GLU CA C 13 58.838 0.3 A 83 GLU CB C 13 29.385 0.3 A 83 GLU CG C 13 36.255 0.3 A 83 GLU N N 15 121.784 0.3 A 84 LEU H H 1 7.726 0.02 A 84 LEU HA H 1 4.035 0.02 A 84 LEU HBy H 1 1.608 0.02 A 84 LEU HBx H 1 1.456 0.02 A 84 LEU HDx% H 1 0.652 0.02 A 84 LEU HDy% H 1 0.63 0.02 A 84 LEU HG H 1 1.521 0.02 A 84 LEU C C 13 178.842 0.3 A 84 LEU CA C 13 57.207 0.3 A 84 LEU CB C 13 42.255 0.3 A 84 LEU CD1 C 13 24.378 0.3 A 84 LEU CD2 C 13 24.886 0.3 A 84 LEU CG C 13 27.043 0.3 A 84 LEU N N 15 118.571 0.3 A 85 LEU H H 1 8.098 0.02 A 85 LEU HA H 1 3.819 0.02 A 85 LEU HBy H 1 1.72 0.02 A 85 LEU HBx H 1 1.199 0.02 A 85 LEU HDx% H 1 0.446 0.02 A 85 LEU HDy% H 1 0.375 0.02 A 85 LEU HG H 1 1.574 0.02 A 85 LEU C C 13 177.773 0.3 A 85 LEU CA C 13 55.997 0.3 A 85 LEU CB C 13 43.697 0.3 A 85 LEU CD1 C 13 26.994 0.3 A 85 LEU CD2 C 13 24.784 0.3 A 85 LEU CG C 13 26.956 0.3 A 85 LEU N N 15 115.231 0.3 A 86 GLY H H 1 7.993 0.02 A 86 GLY HAy H 1 3.899 0.02 A 86 GLY HAx H 1 3.768 0.02 A 86 GLY C C 13 174.143 0.3 A 86 GLY CA C 13 46.221 0.3 A 86 GLY N N 15 107.7 0.3 A 87 ARG H H 1 7.42 0.02 A 87 ARG HA H 1 4.655 0.02 A 87 ARG HBy H 1 2.044 0.02 A 87 ARG HBx H 1 1.467 0.02 A 87 ARG HD2 H 1 3.155 0.02 A 87 ARG HD3 H 1 3.155 0.02 A 87 ARG HGy H 1 1.475 0.02 A 87 ARG HGx H 1 1.33 0.02 A 87 ARG C C 13 174.72 0.3 A 87 ARG CA C 13 54.04 0.3 A 87 ARG CB C 13 34.139 0.3 A 87 ARG CD C 13 43.525 0.3 A 87 ARG CG C 13 26.302 0.3 A 87 ARG N N 15 113.457 0.3 A 88 GLN H H 1 8.68 0.02 A 88 GLN HA H 1 4.074 0.02 A 88 GLN HB2 H 1 2.036 0.02 A 88 GLN HB3 H 1 2.036 0.02 A 88 GLN HE21 H 1 7.498 0.02 A 88 GLN HE22 H 1 7.14 0.02 A 88 GLN HG2 H 1 2.37 0.02 A 88 GLN HG3 H 1 2.37 0.02 A 88 GLN C C 13 175.946 0.3 A 88 GLN CA C 13 56.932 0.3 A 88 GLN CB C 13 29.695 0.3 A 88 GLN CG C 13 34.379 0.3 A 88 GLN N N 15 116.39 0.3 A 88 GLN NE2 N 15 113.537 0.3 A 89 SER H H 1 7.643 0.02 A 89 SER HA H 1 5.434 0.02 A 89 SER HBy H 1 3.824 0.02 A 89 SER HBx H 1 3.422 0.02 A 89 SER C C 13 173.062 0.3 A 89 SER CA C 13 56.819 0.3 A 89 SER CB C 13 66.322 0.3 A 89 SER N N 15 110.868 0.3 A 90 PHE H H 1 8.563 0.02 A 90 PHE HA H 1 4.696 0.02 A 90 PHE HBy H 1 3.261 0.02 A 90 PHE HBx H 1 2.931 0.02 A 90 PHE HD1 H 1 6.786 0.02 A 90 PHE HD2 H 1 6.786 0.02 A 90 PHE HE1 H 1 6.875 0.02 A 90 PHE HE2 H 1 6.875 0.02 A 90 PHE HZ H 1 7.096 0.02 A 90 PHE C C 13 170.352 0.3 A 90 PHE CA C 13 57.382 0.3 A 90 PHE CB C 13 40.007 0.3 A 90 PHE CD1 C 13 133.659 0.3 A 90 PHE CE1 C 13 130.664 0.3 A 90 PHE CE2 C 13 130.664 0.3 A 90 PHE CZ C 13 128.953 0.3 A 90 PHE N N 15 115.543 0.3 A 91 SER H H 1 8.971 0.02 A 91 SER HA H 1 5.36 0.02 A 91 SER HBy H 1 4.019 0.02 A 91 SER HBx H 1 3.562 0.02 A 91 SER CA C 13 54.621 0.3 A 91 SER CB C 13 65.235 0.3 A 91 SER N N 15 113.76 0.3 A 92 VAL HA H 1 3.897 0.02 A 92 VAL HB H 1 2.071 0.02 A 92 VAL HGx% H 1 0.831 0.02 A 92 VAL HGy% H 1 0.36 0.02 A 92 VAL CA C 13 64.112 0.3 A 92 VAL CB C 13 31.017 0.3 A 92 VAL CG1 C 13 22.354 0.3 A 92 VAL CG2 C 13 18.373 0.3 A 93 LYS H H 1 8.072 0.02 A 93 LYS HA H 1 3.965 0.02 A 93 LYS HB2 H 1 1.427 0.02 A 93 LYS HB3 H 1 1.427 0.02 A 93 LYS HD2 H 1 1.268 0.02 A 93 LYS HD3 H 1 1.268 0.02 A 93 LYS HE2 H 1 2.291 0.02 A 93 LYS HE3 H 1 2.291 0.02 A 93 LYS HGy H 1 1.076 0.02 A 93 LYS HGx H 1 0.984 0.02 A 93 LYS C C 13 177.088 0.3 A 93 LYS CA C 13 57.231 0.3 A 93 LYS CB C 13 32.007 0.3 A 93 LYS CD C 13 28.818 0.3 A 93 LYS CE C 13 41.56 0.3 A 93 LYS CG C 13 25.616 0.3 A 93 LYS N N 15 116.633 0.3 A 94 ASP H H 1 7.449 0.02 A 94 ASP HA H 1 4.975 0.02 A 94 ASP HBy H 1 2.849 0.02 A 94 ASP HBx H 1 2.492 0.02 A 94 ASP CA C 13 51.255 0.3 A 94 ASP CB C 13 41.242 0.3 A 94 ASP N N 15 115.257 0.3 A 95 PRO HA H 1 4.427 0.02 A 95 PRO HB2 H 1 1.95 0.02 A 95 PRO HB3 H 1 1.95 0.02 A 95 PRO HDy H 1 3.711 0.02 A 95 PRO HDx H 1 3.383 0.02 A 95 PRO HGy H 1 1.947 0.02 A 95 PRO HGx H 1 1.826 0.02 A 95 PRO CA C 13 63.352 0.3 A 95 PRO CB C 13 32.055 0.3 A 95 PRO CD C 13 49.862 0.3 A 95 PRO CG C 13 26.676 0.3 A 96 SER H H 1 8.06 0.02 A 96 SER HA H 1 4.222 0.02 A 96 SER HB2 H 1 3.978 0.02 A 96 SER HB3 H 1 3.978 0.02 A 96 SER CA C 13 64.292 0.3 A 96 SER CB C 13 61.726 0.3 A 96 SER N N 15 118.817 0.3 A 97 PRO HA H 1 4.351 0.02 A 97 PRO HBy H 1 2.156 0.02 A 97 PRO HBx H 1 1.17 0.02 A 97 PRO HD2 H 1 3.719 0.02 A 97 PRO HD3 H 1 3.719 0.02 A 97 PRO HGy H 1 1.932 0.02 A 97 PRO HGx H 1 1.746 0.02 A 97 PRO CA C 13 65.764 0.3 A 97 PRO CB C 13 31.316 0.3 A 97 PRO CD C 13 50.734 0.3 A 97 PRO CG C 13 28.202 0.3 A 98 LEU H H 1 7.127 0.02 A 98 LEU HA H 1 3.628 0.02 A 98 LEU HBy H 1 1.519 0.02 A 98 LEU HBx H 1 1.179 0.02 A 98 LEU HDx% H 1 0.578 0.02 A 98 LEU HDy% H 1 0.503 0.02 A 98 LEU CA C 13 57.147 0.3 A 98 LEU CB C 13 41.472 0.3 A 98 LEU CD1 C 13 24.529 0.3 A 98 LEU CD2 C 13 24.963 0.3 A 98 LEU N N 15 117.964 0.3 A 99 TYR H H 1 7.594 0.02 A 99 TYR HA H 1 4.16 0.02 A 99 TYR HBy H 1 3.075 0.02 A 99 TYR HBx H 1 2.913 0.02 A 99 TYR HD1 H 1 6.976 0.02 A 99 TYR HD2 H 1 6.976 0.02 A 99 TYR HE1 H 1 6.689 0.02 A 99 TYR HE2 H 1 6.689 0.02 A 99 TYR C C 13 178.914 0.3 A 99 TYR CA C 13 60.912 0.3 A 99 TYR CB C 13 36.928 0.3 A 99 TYR CD1 C 13 132.316 0.3 A 99 TYR CD2 C 13 132.316 0.3 A 99 TYR CE1 C 13 118.234 0.3 A 99 TYR CE2 C 13 118.234 0.3 A 99 TYR N N 15 118.182 0.3 A 100 ASP H H 1 8.262 0.02 A 100 ASP HA H 1 4.322 0.02 A 100 ASP HBy H 1 2.606 0.02 A 100 ASP HBx H 1 2.534 0.02 A 100 ASP C C 13 177.737 0.3 A 100 ASP CA C 13 57.639 0.3 A 100 ASP CB C 13 40.893 0.3 A 100 ASP N N 15 119.704 0.3 A 101 MET H H 1 7.276 0.02 A 101 MET HA H 1 3.974 0.02 A 101 MET HB2 H 1 2.095 0.02 A 101 MET HB3 H 1 2.095 0.02 A 101 MET HE% H 1 1.672 0.02 A 101 MET HGy H 1 2.235 0.02 A 101 MET HGx H 1 2.19 0.02 A 101 MET C C 13 180.08 0.3 A 101 MET CA C 13 59.109 0.3 A 101 MET CB C 13 31.566 0.3 A 101 MET CE C 13 17.01 0.3 A 101 MET CG C 13 31.329 0.3 A 101 MET N N 15 118.844 0.3 A 102 LEU H H 1 8.497 0.02 A 102 LEU HA H 1 3.702 0.02 A 102 LEU HBy H 1 1.879 0.02 A 102 LEU HBx H 1 1.391 0.02 A 102 LEU HDx% H 1 0.682 0.02 A 102 LEU HDy% H 1 0.654 0.02 A 102 LEU HG H 1 1.728 0.02 A 102 LEU C C 13 178.566 0.3 A 102 LEU CA C 13 58.646 0.3 A 102 LEU CB C 13 41.243 0.3 A 102 LEU CD1 C 13 23.005 0.3 A 102 LEU CD2 C 13 23.713 0.3 A 102 LEU CG C 13 26.667 0.3 A 102 LEU N N 15 121.869 0.3 A 103 ARG H H 1 7.902 0.02 A 103 ARG HA H 1 3.96 0.02 A 103 ARG HB2 H 1 1.917 0.02 A 103 ARG HB3 H 1 1.917 0.02 A 103 ARG HD2 H 1 3.173 0.02 A 103 ARG HD3 H 1 3.173 0.02 A 103 ARG HE H 1 6.78 0.02 A 103 ARG HGy H 1 1.752 0.02 A 103 ARG HGx H 1 1.593 0.02 A 103 ARG C C 13 178.818 0.3 A 103 ARG CA C 13 59.269 0.3 A 103 ARG CB C 13 30.031 0.3 A 103 ARG CD C 13 43.363 0.3 A 103 ARG CG C 13 28.054 0.3 A 103 ARG N N 15 117.292 0.3 A 104 LYS H H 1 7.176 0.02 A 104 LYS HA H 1 4.23 0.02 A 104 LYS HB2 H 1 1.71 0.02 A 104 LYS HB3 H 1 1.71 0.02 A 104 LYS HD2 H 1 1.734 0.02 A 104 LYS HD3 H 1 1.734 0.02 A 104 LYS HEy H 1 2.883 0.02 A 104 LYS HEx H 1 2.779 0.02 A 104 LYS HGy H 1 1.525 0.02 A 104 LYS HGx H 1 1.388 0.02 A 104 LYS C C 13 177.556 0.3 A 104 LYS CA C 13 57.648 0.3 A 104 LYS CB C 13 34.16 0.3 A 104 LYS CD C 13 29.814 0.3 A 104 LYS CE C 13 42.455 0.3 A 104 LYS CG C 13 25.462 0.3 A 104 LYS N N 15 114.385 0.3 A 105 ASN H H 1 7.669 0.02 A 105 ASN HA H 1 4.748 0.02 A 105 ASN HBy H 1 2.736 0.02 A 105 ASN HBx H 1 2.392 0.02 A 105 ASN HD21 H 1 7.54 0.02 A 105 ASN HD22 H 1 6.887 0.02 A 105 ASN C C 13 172.822 0.3 A 105 ASN CA C 13 54.721 0.3 A 105 ASN CB C 13 42.36 0.3 A 105 ASN N N 15 114.31 0.3 A 105 ASN ND2 N 15 112.264 0.3 A 106 LEU H H 1 7.464 0.02 A 106 LEU HA H 1 4.74 0.02 A 106 LEU HBy H 1 1.894 0.02 A 106 LEU HBx H 1 0.983 0.02 A 106 LEU HDx% H 1 0.797 0.02 A 106 LEU HDy% H 1 0.678 0.02 A 106 LEU HG H 1 1.857 0.02 A 106 LEU C C 13 175.658 0.3 A 106 LEU CA C 13 54.27 0.3 A 106 LEU CB C 13 43.39 0.3 A 106 LEU CD1 C 13 26.426 0.3 A 106 LEU CD2 C 13 23.454 0.3 A 106 LEU CG C 13 25.657 0.3 A 106 LEU N N 15 118.69 0.3 A 107 VAL H H 1 8.201 0.02 A 107 VAL HA H 1 4.195 0.02 A 107 VAL HB H 1 2.117 0.02 A 107 VAL HGx% H 1 0.899 0.02 A 107 VAL HGy% H 1 0.869 0.02 A 107 VAL C C 13 176.054 0.3 A 107 VAL CA C 13 62.107 0.3 A 107 VAL CB C 13 33.327 0.3 A 107 VAL CG1 C 13 21.096 0.3 A 107 VAL CG2 C 13 21.247 0.3 A 107 VAL N N 15 122.918 0.3 A 108 THR H H 1 8.532 0.02 A 108 THR HA H 1 4.333 0.02 A 108 THR HB H 1 4.114 0.02 A 108 THR HG2% H 1 1.159 0.02 A 108 THR C C 13 174.216 0.3 A 108 THR CA C 13 62.534 0.3 A 108 THR CB C 13 69.689 0.3 A 108 THR CG2 C 13 21.925 0.3 A 108 THR N N 15 121.137 0.3 A 109 LEU H H 1 8.322 0.02 A 109 LEU HA H 1 4.356 0.02 A 109 LEU HB2 H 1 1.549 0.02 A 109 LEU HB3 H 1 1.549 0.02 A 109 LEU HDx% H 1 0.809 0.02 A 109 LEU HDy% H 1 0.78 0.02 A 109 LEU HG H 1 1.567 0.02 A 109 LEU C C 13 176.523 0.3 A 109 LEU CA C 13 54.909 0.3 A 109 LEU CB C 13 42.289 0.3 A 109 LEU CD1 C 13 25.39 0.3 A 109 LEU CD2 C 13 23.716 0.3 A 109 LEU CG C 13 27.122 0.3 A 109 LEU N N 15 125.668 0.3 A 110 ALA H H 1 8.265 0.02 A 110 ALA HA H 1 4.365 0.02 A 110 ALA HB% H 1 1.333 0.02 A 110 ALA C C 13 176.847 0.3 A 110 ALA CA C 13 52.445 0.3 A 110 ALA CB C 13 19.617 0.3 A 110 ALA N N 15 125.196 0.3 A 111 THR H H 1 7.674 0.02 A 111 THR HA H 1 4.06 0.02 A 111 THR HB H 1 4.168 0.02 A 111 THR HG2% H 1 1.081 0.02 A 111 THR CA C 13 63.062 0.3 A 111 THR CB C 13 70.901 0.3 A 111 THR CG2 C 13 22.137 0.3 A 111 THR N N 15 118.353 0.3 B 200 CM5 H31 H 1 7.623 0.02 B 200 CM5 H32 H 1 7.623 0.02 B 200 CM5 H33 H 1 7.623 0.02 B 200 CM5 H34 H 1 7.623 0.02 B 200 CM5 H71 H 1 5.618 0.02 B 200 CM5 H72 H 1 5.618 0.02 B 200 CM5 H81 H 1 5.529 0.02 B 200 CM5 H82 H 1 5.529 0.02 B 200 CM5 H91 H 1 4.610 0.02 B 200 CM5 H92 H 1 4.610 0.02 B 200 CM5 HD1 H 1 6.933 0.02 B 200 CM5 HD3 H 1 7.166 0.02 B 200 CM5 HD4 H 1 7.199 0.02 B 200 CM5 HD5 H 1 7.526 0.02 B 200 CM5 HE1 H 1 6.979 0.02 B 200 CM5 HE5 H 1 6.573 0.02 B 200 CM5 HE6 H 1 6.543 0.02 B 200 CM5 HH2 H 1 2.859 0.02 B 200 CM5 HH3 H 1 3.070 0.02 B 200 CM5 HH4 H 1 3.572 0.02 B 200 CM5 HHM H 1 1.189 0.02 B 200 CM5 HM1 H 1 3.717 0.02 B 200 CM5 HZ2 H 1 7.208 0.02 stop_ save_ save_DYANA/DIANA_distance_constraints_2 _nef_distance_restraint_list.sf_category nef_distance_restraint_list _nef_distance_restraint_list.sf_framecode DYANA/DIANA_distance_constraints_2 _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 111 THR HA A 111 THR HB 1.0 . 2.96 2 2 A 106 LEU H A 108 THR HB 1.0 . 5.45 3 3 A 108 THR HB A 108 THR H 1.0 . 3.57 4 4 A 108 THR HB A 109 LEU H 1.0 . 3.53 5 5 A 49 VAL HA A 51 GLU H 1.0 . 4.92 6 6 A 49 VAL HA A 52 VAL H 1.0 . 3.63 7 7 A 52 VAL HA A 101 MET HE% 1.0 . 5.11 8 8 A 52 VAL HA A 55 TYR HD% 1.0 . 4.31 9 9 A 52 VAL HA A 55 TYR H 1.0 . 4.62 10 10 A 52 VAL HA A 37 LEU HDx% 1.0 . 4.38 11 11 A 32 PRO HA A 35 LYS H 1.0 . 3.89 12 12 A 32 PRO HA A 36 ILE HD1% 1.0 . 5.10 13 13 A 90 PHE H A 89 SER HBy 1.0 . 4.69 14 14 A 62 VAL HA A 64 GLN HE22 1.0 . 4.82 15 15 A 75 TYR HD% A 89 SER HBx 1.0 . 4.60 16 16 A 90 PHE H A 89 SER HBx 1.0 . 4.69 17 17 A 75 TYR HA A 89 SER HBx 1.0 . 4.15 18 18 A 97 PRO HA A 100 ASP H 1.0 . 4.34 19 19 A 62 VAL HA A 64 GLN HE21 1.0 . 4.82 20 20 A 62 VAL HA A 62 VAL HB 1.0 . 2.92 21 21 A 75 TYR HD% A 89 SER HBy 1.0 . 4.60 22 22 A 97 PRO HA A 101 MET H 1.0 . 5.09 23 23 A 60 ILE HA A 65 LEU H 1.0 . 4.18 24 24 A 60 ILE HA A 60 ILE HG1y 1.0 . 3.70 25 25 A 60 ILE HA A 60 ILE HG1x 1.0 . 3.70 26 26 A 60 ILE HA A 60 ILE HG2% 1.0 . 3.56 27 27 A 91 SER H A 91 SER HBy 1.0 . 3.94 28 28 A 100 ASP H A 96 SER HA 1.0 . 4.83 29 29 A 96 SER HA A 95 PRO HB2 1.0 . 4.78 30 29 A 96 SER HA A 95 PRO HB3 1.0 . 4.78 31 30 A 92 VAL HA A 94 ASP H 1.0 . 4.50 32 31 A 36 ILE HA A 39 ALA H 1.0 . 3.96 33 32 A 36 ILE HA A 39 ALA HB% 1.0 . 3.41 34 33 A 55 TYR HA A 58 GLN H 1.0 . 4.03 35 34 A 55 TYR HD% A 55 TYR HA 1.0 . 3.47 36 35 A 55 TYR HA A 58 GLN HE22 1.0 . 4.75 37 36 A 94 ASP HA A 95 PRO HA 1.0 . 4.73 38 37 A 111 THR HA A 110 ALA HB% 1.0 . 4.56 39 38 A 55 TYR HA A 58 GLN HB2 1.0 . 4.52 40 38 A 55 TYR HA A 58 GLN HB3 1.0 . 4.52 41 39 A 108 THR HB A 108 THR HA 1.0 . 2.90 42 40 A 59 TYR HA A 59 TYR HD% 1.0 . 3.93 43 41 A 59 TYR HA A 62 VAL H 1.0 . 4.23 44 42 A 108 THR H A 107 VAL HA 1.0 . 3.18 45 43 A 107 VAL HA A 108 THR HG2% 1.0 . 5.12 46 44 A 62 VAL HB A 59 TYR HA 1.0 . 3.94 47 45 A 29 PRO HA A 30 LYS H 1.0 . 3.13 48 46 A 96 SER HA A 96 SER HB2 1.0 . 2.73 49 46 A 96 SER HA A 96 SER HB3 1.0 . 2.73 50 47 A 74 VAL HA A 75 TYR H 1.0 . 3.09 51 48 A 74 VAL HA A 66 TYR H 1.0 . 4.70 52 49 A 48 THR HA A 49 VAL H 1.0 . 2.97 53 50 A 48 THR HA A 27 VAL H 1.0 . 4.44 54 51 A 101 MET H A 99 TYR HA 1.0 . 4.46 55 52 A 99 TYR HA A 99 TYR HD% 1.0 . 3.81 56 53 A 99 TYR HA A 101 MET HB2 1.0 . 4.93 57 53 A 99 TYR HA A 101 MET HB3 1.0 . 4.93 58 54 A 24 ILE HA A 25 ASN H 1.0 . 3.15 59 55 A 24 ILE HA A 24 ILE HG1x 1.0 . 3.93 60 56 A 74 VAL HA A 66 TYR HA 1.0 . 3.98 61 57 A 31 LEU HA A 34 LEU HBx 1.0 . 4.18 62 58 A 31 LEU HA A 31 LEU HB2 1.0 . 2.87 63 58 A 31 LEU HA A 31 LEU HB3 1.0 . 2.87 64 59 A 102 LEU H A 103 ARG HA 1.0 . 5.29 65 60 A 35 LYS HA A 38 HIS H 1.0 . 3.99 66 61 A 35 LYS HA A 35 LYS HD2 1.0 . 3.72 67 61 A 35 LYS HA A 35 LYS HD3 1.0 . 3.72 68 62 A 35 LYS HA A 35 LYS HG2 1.0 . 3.81 69 62 A 35 LYS HA A 35 LYS HG3 1.0 . 3.81 70 63 A 51 GLU HA A 54 HIS H 1.0 . 4.54 71 64 A 51 GLU HA A 54 HIS HBy 1.0 . 3.60 72 65 A 51 GLU HA A 54 HIS HBx 1.0 . 3.60 73 66 A 83 GLU HA A 83 GLU HB2 1.0 . 2.66 74 66 A 83 GLU HA A 83 GLU HB3 1.0 . 2.66 75 67 A 83 GLU HA A 80 LEU HD1% 1.0 . 5.29 76 67 A 83 GLU HA A 80 LEU HD2% 1.0 . 5.29 77 68 A 101 MET HA A 101 MET HGy 1.0 . 3.79 78 68 A 101 MET HA A 101 MET HGx 1.0 . 3.79 79 69 A 101 MET HA A 102 LEU HDx% 1.0 . 5.05 80 69 A 101 MET HA A 102 LEU HDy% 1.0 . 5.05 81 70 A 58 GLN HA A 58 GLN HG2 1.0 . 3.51 82 70 A 58 GLN HA A 58 GLN HG3 1.0 . 3.51 83 71 A 58 GLN HA A 61 MET HB2 1.0 . 4.21 84 71 A 58 GLN HA A 61 MET HB3 1.0 . 4.21 85 72 A 102 LEU HA A 102 LEU HG 1.0 . 3.94 86 73 A 102 LEU HA A 102 LEU HDx% 1.0 . 3.13 87 73 A 102 LEU HDy% A 102 LEU HA 1.0 . 3.13 88 74 A 102 LEU HA A 105 ASN H 1.0 . 4.04 89 75 A 100 ASP HA A 103 ARG H 1.0 . 4.52 90 76 A 80 LEU HA A 84 LEU H 1.0 . 4.41 91 77 A 80 LEU HA A 83 GLU H 1.0 . 3.78 92 78 A 80 LEU HA A 83 GLU HB2 1.0 . 3.27 93 78 A 83 GLU HB3 A 80 LEU HA 1.0 . 3.27 94 79 A 81 LEU HA A 81 LEU HG 1.0 . 3.65 95 80 A 36 ILE HD1% A 81 LEU HA 1.0 . 3.64 96 81 A 81 LEU HA A 81 LEU HDy% 1.0 . 4.23 97 82 A 84 LEU H A 81 LEU HA 1.0 . 3.82 98 83 A 36 ILE HG2% A 37 LEU HA 1.0 . 4.57 99 84 A 37 LEU HA A 37 LEU HDy% 1.0 . 4.56 100 85 A 37 LEU HA A 40 ALA HB% 1.0 . 4.08 101 86 A 34 LEU HA A 37 LEU H 1.0 . 3.99 102 87 A 34 LEU HA A 37 LEU HBy 1.0 . 4.59 103 88 A 34 LEU HA A 37 LEU HBx 1.0 . 4.59 104 89 A 75 TYR HA A 76 CYS H 1.0 . 3.12 105 90 A 75 TYR HA A 89 SER HBy 1.0 . 4.15 106 91 A 75 TYR HD% A 75 TYR HA 1.0 . 4.03 107 92 A 100 ASP HA A 103 ARG HB2 1.0 . 3.58 108 92 A 100 ASP HA A 103 ARG HB3 1.0 . 3.58 109 93 A 104 LYS HA A 104 LYS HGy 1.0 . 3.72 110 93 A 104 LYS HA A 104 LYS HGx 1.0 . 3.72 111 94 A 30 LYS HA A 30 LYS HG2 1.0 . 3.37 112 94 A 30 LYS HA A 30 LYS HG3 1.0 . 3.37 113 95 A 47 PHE HA A 47 PHE HD% 1.0 . 3.69 114 96 A 47 PHE HA A 24 ILE HD1% 1.0 . 5.20 115 97 A 47 PHE HA A 48 THR H 1.0 . 3.01 116 98 A 62 VAL HA A 61 MET HA 1.0 . 4.81 117 99 A 76 CYS H A 88 GLN HA 1.0 . 4.22 118 100 A 88 GLN HA A 89 SER HA 1.0 . 4.68 119 101 A 88 GLN HA A 88 GLN HG2 1.0 . 3.60 120 101 A 88 GLN HA A 88 GLN HG3 1.0 . 3.60 121 102 A 83 GLU H A 84 LEU HA 1.0 . 5.31 122 103 A 101 MET H A 98 LEU HA 1.0 . 4.11 123 104 A 75 TYR HA A 89 SER HA 1.0 . 3.72 124 105 A 28 ARG HA A 45 GLU HA 1.0 . 4.67 125 106 A 45 GLU HA A 47 PHE HE% 1.0 . 3.81 126 107 A 85 LEU HA A 101 MET HB2 1.0 . 4.57 127 107 A 101 MET HB3 A 85 LEU HA 1.0 . 4.57 128 108 A 64 GLN HA A 66 TYR HE% 1.0 . 3.58 129 109 A 36 ILE HD1% A 33 LEU HA 1.0 . 4.22 130 110 A 33 LEU HA A 80 LEU HD1% 1.0 . 4.89 131 110 A 80 LEU HD2% A 33 LEU HA 1.0 . 4.89 132 111 A 48 THR HA A 26 GLN HA 1.0 . 3.84 133 112 A 90 PHE HD% A 91 SER HA 1.0 . 5.07 134 113 A 109 LEU HA A 110 ALA H 1.0 . 3.16 135 114 A 109 LEU HA A 109 LEU HB2 1.0 . 2.99 136 114 A 109 LEU HA A 109 LEU HB3 1.0 . 2.99 137 115 A 91 SER HA A 93 LYS H 1.0 . 4.82 138 116 A 43 GLN HA A 44 GLY H 1.0 . 2.85 139 117 A 43 GLN HA A 38 HIS HD2 1.0 . 4.87 140 118 A 43 GLN HA A 43 GLN HGy 1.0 . 3.57 141 118 A 43 GLN HA A 43 GLN HGx 1.0 . 3.57 142 119 A 43 GLN HA A 42 ALA HB% 1.0 . 5.09 143 120 A 24 ILE HD1% A 46 MET HA 1.0 . 5.26 144 121 A 28 ARG HA A 46 MET HA 1.0 . 3.81 145 122 A 46 MET HA A 28 ARG HBy 1.0 . 4.84 146 123 A 67 ASP HA A 68 GLN H 1.0 . 2.86 147 124 A 28 ARG HA A 46 MET H 1.0 . 4.64 148 125 A 79 ASP HA A 81 LEU H 1.0 . 4.31 149 126 A 80 LEU HA A 79 ASP HA 1.0 . 4.66 150 127 A 79 ASP HA A 80 LEU H 1.0 . 3.53 151 128 A 110 ALA HA A 109 LEU HB2 1.0 . 4.17 152 128 A 109 LEU HB3 A 110 ALA HA 1.0 . 4.17 153 129 A 108 THR HG2% A 110 ALA HA 1.0 . 5.06 154 130 A 40 ALA HB% A 42 ALA HA 1.0 . 5.37 155 131 A 28 ARG HA A 28 ARG HGy 1.0 . 3.95 156 131 A 28 ARG HA A 28 ARG HGx 1.0 . 3.95 157 132 A 28 ARG HA A 46 MET HB2 1.0 . 3.57 158 132 A 28 ARG HA A 46 MET HB3 1.0 . 3.57 159 133 A 28 ARG HA A 28 ARG HD2 1.0 . 4.78 160 133 A 28 ARG HA A 28 ARG HD3 1.0 . 4.78 161 134 A 111 THR HB A 110 ALA HA 1.0 . 4.00 162 135 A 42 ALA HA A 43 GLN H 1.0 . 2.84 163 136 A 42 ALA HA A 43 GLN HGy 1.0 . 4.83 164 136 A 43 GLN HGx A 42 ALA HA 1.0 . 4.83 165 137 A 40 ALA HA A 62 VAL HGy% 1.0 . 4.62 166 138 A 40 ALA HA A 58 GLN HG2 1.0 . 4.97 167 138 A 58 GLN HG3 A 40 ALA HA 1.0 . 4.97 168 139 A 94 ASP HA A 96 SER H 1.0 . 4.39 169 140 A 94 ASP HA A 95 PRO HDy 1.0 . 3.77 170 141 A 94 ASP HA A 95 PRO HDx 1.0 . 3.77 171 142 A 31 LEU H A 32 PRO HDy 1.0 . 4.26 172 143 A 87 ARG HA A 82 GLY HA2 1.0 . 4.61 173 143 A 82 GLY HA3 A 87 ARG HA 1.0 . 4.61 174 144 A 87 ARG H A 82 GLY HA2 1.0 . 4.44 175 144 A 82 GLY HA3 A 87 ARG H 1.0 . 4.44 176 145 A 82 GLY HA3 A 76 CYS HBy 1.0 . 4.52 177 145 A 76 CYS HBy A 82 GLY HA2 1.0 . 4.52 178 146 A 82 GLY HA3 A 76 CYS HBx 1.0 . 4.52 179 146 A 76 CYS HBx A 82 GLY HA2 1.0 . 4.52 180 147 A 82 GLY H A 79 ASP HBy 1.0 . 4.62 181 148 A 88 GLN HG3 A 77 GLY HAy 1.0 . 4.78 182 148 A 77 GLY HAy A 88 GLN HG2 1.0 . 4.78 183 149 A 88 GLN HG3 A 77 GLY HAx 1.0 . 4.78 184 149 A 77 GLY HAx A 88 GLN HG2 1.0 . 4.78 185 150 A 81 LEU H A 79 ASP HBx 1.0 . 4.52 186 151 A 82 GLY H A 79 ASP HBx 1.0 . 4.62 187 152 A 48 THR H A 47 PHE HBx 1.0 . 4.12 188 153 A 28 ARG HD2 A 46 MET HB2 1.0 . 3.36 189 153 A 28 ARG HD3 A 46 MET HB2 1.0 . 3.36 190 153 A 46 MET HB3 A 28 ARG HD2 1.0 . 3.36 191 153 A 46 MET HB3 A 28 ARG HD3 1.0 . 3.36 192 154 A 103 ARG HA A 103 ARG HD2 1.0 . 4.04 193 154 A 103 ARG HA A 103 ARG HD3 1.0 . 4.04 194 155 A 103 ARG H A 103 ARG HD2 1.0 . 4.51 195 155 A 103 ARG H A 103 ARG HD3 1.0 . 4.51 196 156 A 103 ARG HD2 A 104 LYS HEy 1.0 . 4.87 197 156 A 103 ARG HD3 A 104 LYS HEy 1.0 . 4.87 198 156 A 104 LYS HEx A 103 ARG HD2 1.0 . 4.87 199 156 A 103 ARG HD3 A 104 LYS HEx 1.0 . 4.87 200 157 A 103 ARG HB2 A 103 ARG HD2 1.0 . 3.48 201 157 A 103 ARG HB3 A 103 ARG HD2 1.0 . 3.48 202 157 A 103 ARG HD3 A 103 ARG HB2 1.0 . 3.48 203 157 A 103 ARG HB3 A 103 ARG HD3 1.0 . 3.48 204 158 A 87 ARG HD3 A 97 PRO HBx 1.0 . 4.88 205 158 A 87 ARG HD2 A 97 PRO HBx 1.0 . 4.88 206 159 A 100 ASP HA A 103 ARG HD2 1.0 . 4.13 207 159 A 100 ASP HA A 103 ARG HD3 1.0 . 4.13 208 160 A 82 GLY HA3 A 85 LEU HBy 1.0 . 4.47 209 160 A 82 GLY HA2 A 85 LEU HBy 1.0 . 4.47 210 161 A 85 LEU H A 85 LEU HBx 1.0 . 3.78 211 162 A 85 LEU HBx A 82 GLY HA2 1.0 . 4.47 212 162 A 82 GLY HA3 A 85 LEU HBx 1.0 . 4.47 213 163 A 48 THR HB A 50 LYS HEy 1.0 . 3.71 214 164 A 48 THR HB A 50 LYS HEx 1.0 . 3.71 215 165 A 101 MET HGy A 104 LYS HEy 1.0 . 4.85 216 165 A 101 MET HGx A 104 LYS HEy 1.0 . 4.85 217 165 A 104 LYS HEx A 101 MET HGy 1.0 . 4.85 218 165 A 101 MET HGx A 104 LYS HEx 1.0 . 4.85 219 166 A 105 ASN H A 104 LYS HEy 1.0 . 4.62 220 166 A 105 ASN H A 104 LYS HEx 1.0 . 4.62 221 167 A 104 LYS H A 104 LYS HEy 1.0 . 5.04 222 167 A 104 LYS HEx A 104 LYS H 1.0 . 5.04 223 168 A 32 PRO HA A 35 LYS HE2 1.0 . 4.75 224 168 A 32 PRO HA A 35 LYS HE3 1.0 . 4.75 225 169 A 39 ALA HB% A 63 LYS HE2 1.0 . 3.60 226 169 A 39 ALA HB% A 63 LYS HE3 1.0 . 3.60 227 170 A 106 LEU H A 105 ASN HBy 1.0 . 3.75 228 171 A 106 LEU H A 105 ASN HBx 1.0 . 3.75 229 172 A 82 GLY H A 81 LEU HBy 1.0 . 4.64 230 173 A 63 LYS HZ% A 81 LEU HBy 1.0 . 4.89 231 174 A 80 LEU HD2% A 80 LEU HBy 1.0 . 3.63 232 174 A 80 LEU HBy A 80 LEU HD1% 1.0 . 3.63 233 175 A 82 GLY H A 81 LEU HBx 1.0 . 4.64 234 176 A 63 LYS HZ% A 81 LEU HBx 1.0 . 4.89 235 177 A 80 LEU HD2% A 80 LEU HBx 1.0 . 3.63 236 177 A 80 LEU HBx A 80 LEU HD1% 1.0 . 3.63 237 178 A 84 LEU H A 84 LEU HBx 1.0 . 3.52 238 179 A 101 MET HB3 A 104 LYS HEy 1.0 . 4.46 239 179 A 101 MET HB2 A 104 LYS HEy 1.0 . 4.46 240 179 A 104 LYS HEx A 101 MET HB2 1.0 . 4.46 241 179 A 101 MET HB3 A 104 LYS HEx 1.0 . 4.46 242 180 A 101 MET HA A 104 LYS HEy 1.0 . 4.19 243 180 A 101 MET HA A 104 LYS HEx 1.0 . 4.19 244 181 A 30 LYS HD3 A 30 LYS HE2 1.0 . 2.90 245 181 A 30 LYS HE3 A 30 LYS HD2 1.0 . 2.90 246 181 A 30 LYS HD3 A 30 LYS HE3 1.0 . 2.90 247 181 A 30 LYS HD2 A 30 LYS HE2 1.0 . 2.90 248 182 A 35 LYS HE2 A 35 LYS HG2 1.0 . 3.75 249 182 A 35 LYS HE3 A 35 LYS HG2 1.0 . 3.75 250 182 A 35 LYS HG3 A 35 LYS HE2 1.0 . 3.75 251 182 A 35 LYS HG3 A 35 LYS HE3 1.0 . 3.75 252 183 A 63 LYS HA A 63 LYS HE2 1.0 . 4.74 253 183 A 63 LYS HE3 A 63 LYS HA 1.0 . 4.74 254 184 A 105 ASN H A 105 ASN HBy 1.0 . 3.91 255 185 A 35 LYS H A 34 LEU HBy 1.0 . 4.01 256 186 A 31 LEU HA A 34 LEU HBy 1.0 . 4.18 257 187 A 93 LYS HB2 A 93 LYS HE2 1.0 . 4.97 258 187 A 93 LYS HE3 A 93 LYS HB2 1.0 . 4.97 259 187 A 93 LYS HB3 A 93 LYS HE3 1.0 . 4.97 260 187 A 93 LYS HB3 A 93 LYS HE2 1.0 . 4.97 261 188 A 103 ARG H A 102 LEU HBy 1.0 . 4.39 262 189 A 103 ARG H A 102 LEU HBx 1.0 . 4.39 263 190 A 100 ASP H A 100 ASP HBy 1.0 . 3.43 264 191 A 101 MET H A 100 ASP HBx 1.0 . 3.81 265 192 A 100 ASP H A 100 ASP HBx 1.0 . 3.43 266 193 A 66 TYR HBy A 67 ASP H 1.0 . 4.86 267 194 A 67 ASP H A 66 TYR HBx 1.0 . 4.86 268 195 A 26 GLN H A 25 ASN HBx 1.0 . 4.44 269 196 A 24 ILE HB A 25 ASN HA 1.0 . 4.49 270 197 A 24 ILE HB A 24 ILE H 1.0 . 3.69 271 198 A 37 LEU H A 37 LEU HBx 1.0 . 3.86 272 199 A 42 ALA HB% A 37 LEU HBx 1.0 . 3.84 273 200 A 60 ILE H A 59 TYR HBy 1.0 . 4.16 274 201 A 60 ILE H A 59 TYR HBx 1.0 . 4.16 275 202 A 40 ALA HB% A 59 TYR HBx 1.0 . 4.19 276 203 A 60 ILE HB A 60 ILE HD1% 1.0 . 3.90 277 204 A 48 THR HB A 51 GLU HGy 1.0 . 4.71 278 205 A 51 GLU HA A 51 GLU HGy 1.0 . 3.92 279 206 A 51 GLU HA A 51 GLU HGx 1.0 . 3.92 280 207 A 48 THR HB A 51 GLU HGx 1.0 . 4.71 281 208 A 60 ILE HB A 61 MET H 1.0 . 4.09 282 209 A 100 ASP H A 99 TYR HBy 1.0 . 4.65 283 210 A 100 ASP H A 99 TYR HBx 1.0 . 4.65 284 211 A 45 GLU H A 45 GLU HGy 1.0 . 4.48 285 212 A 45 GLU HA A 45 GLU HGy 1.0 . 3.79 286 213 A 33 LEU HA A 36 ILE HB 1.0 . 4.42 287 214 A 69 GLN H A 70 GLU HGy 1.0 . 4.76 288 215 A 70 GLU HA A 70 GLU HGy 1.0 . 3.98 289 216 A 45 GLU HA A 45 GLU HGx 1.0 . 3.79 290 217 A 69 GLN H A 70 GLU HGx 1.0 . 4.76 291 218 A 70 GLU HA A 70 GLU HGx 1.0 . 3.98 292 219 A 83 GLU HGy A 80 LEU HD1% 1.0 . 4.56 293 219 A 80 LEU HD2% A 83 GLU HGy 1.0 . 4.56 294 220 A 80 LEU HD2% A 83 GLU HGx 1.0 . 4.56 295 220 A 80 LEU HD1% A 83 GLU HGx 1.0 . 4.56 296 221 A 28 ARG H A 46 MET HB2 1.0 . 5.29 297 221 A 46 MET HB3 A 28 ARG H 1.0 . 5.29 298 222 A 47 PHE H A 46 MET HB2 1.0 . 3.89 299 222 A 46 MET HB3 A 47 PHE H 1.0 . 3.89 300 223 A 45 GLU H A 46 MET HB2 1.0 . 4.52 301 223 A 46 MET HB3 A 45 GLU H 1.0 . 4.52 302 224 A 87 ARG HA A 88 GLN HG2 1.0 . 4.21 303 224 A 88 GLN HG3 A 87 ARG HA 1.0 . 4.21 304 225 A 64 GLN HA A 64 GLN HG2 1.0 . 3.41 305 225 A 64 GLN HA A 64 GLN HG3 1.0 . 3.41 306 226 A 63 LYS HBy A 64 GLN HG2 1.0 . 4.83 307 226 A 63 LYS HBx A 64 GLN HG2 1.0 . 4.83 308 226 A 64 GLN HG3 A 63 LYS HBy 1.0 . 4.83 309 226 A 64 GLN HG3 A 63 LYS HBx 1.0 . 4.83 310 227 A 65 LEU HA A 64 GLN HG2 1.0 . 4.48 311 227 A 64 GLN HG3 A 65 LEU HA 1.0 . 4.48 312 228 A 89 SER H A 88 GLN HG2 1.0 . 4.38 313 228 A 88 GLN HG3 A 89 SER H 1.0 . 4.38 314 229 A 69 GLN HE21 A 68 GLN HG2 1.0 . 5.02 315 229 A 68 GLN HG3 A 69 GLN HE21 1.0 . 5.02 316 230 A 68 GLN H A 68 GLN HG2 1.0 . 3.42 317 230 A 68 GLN H A 68 GLN HG3 1.0 . 3.42 318 231 A 68 GLN HA A 68 GLN HG2 1.0 . 3.38 319 231 A 68 GLN HG3 A 68 GLN HA 1.0 . 3.38 320 232 A 69 GLN HE22 A 68 GLN HG2 1.0 . 5.02 321 232 A 68 GLN HG3 A 69 GLN HE22 1.0 . 5.02 322 233 A 69 GLN HA A 69 GLN HG2 1.0 . 3.38 323 233 A 69 GLN HA A 69 GLN HG3 1.0 . 3.38 324 234 A 69 GLN H A 69 GLN HG2 1.0 . 3.72 325 234 A 69 GLN H A 69 GLN HG3 1.0 . 3.72 326 235 A 101 MET HA A 104 LYS HB2 1.0 . 4.49 327 235 A 101 MET HA A 104 LYS HB3 1.0 . 4.49 328 236 A 58 GLN H A 58 GLN HG2 1.0 . 3.43 329 236 A 58 GLN H A 58 GLN HG3 1.0 . 3.43 330 237 A 55 TYR HA A 58 GLN HG2 1.0 . 3.30 331 237 A 55 TYR HA A 58 GLN HG3 1.0 . 3.30 332 238 A 59 TYR H A 58 GLN HG2 1.0 . 3.78 333 238 A 58 GLN HG3 A 59 TYR H 1.0 . 3.78 334 239 A 28 ARG H A 28 ARG HBy 1.0 . 3.90 335 240 A 46 MET HA A 28 ARG HBx 1.0 . 4.84 336 241 A 53 MET HE% A 53 MET HBy 1.0 . 5.26 337 242 A 53 MET HE% A 53 MET HBx 1.0 . 5.26 338 243 A 53 MET H A 53 MET HBx 1.0 . 3.95 339 244 A 46 MET H A 45 GLU HBy 1.0 . 4.80 340 245 A 46 MET H A 45 GLU HBx 1.0 . 4.80 341 246 A 50 LYS H A 50 LYS HBy 1.0 . 3.43 342 246 A 50 LYS H A 50 LYS HBx 1.0 . 3.43 343 247 A 36 ILE H A 35 LYS HBy 1.0 . 4.03 344 247 A 35 LYS HBx A 36 ILE H 1.0 . 4.03 345 248 A 43 GLN H A 43 GLN HBy 1.0 . 3.82 346 248 A 43 GLN H A 43 GLN HBx 1.0 . 3.82 347 249 A 48 THR HA A 26 GLN HB2 1.0 . 3.63 348 249 A 48 THR HA A 26 GLN HB3 1.0 . 3.63 349 250 A 61 MET H A 61 MET HB2 1.0 . 3.73 350 250 A 61 MET HB3 A 61 MET H 1.0 . 3.73 351 251 A 60 ILE HG2% A 61 MET HB2 1.0 . 4.59 352 251 A 60 ILE HG2% A 61 MET HB3 1.0 . 4.59 353 252 A 33 LEU H A 32 PRO HBy 1.0 . 4.31 354 253 A 67 ASP H A 73 MET HG2 1.0 . 4.74 355 253 A 67 ASP H A 73 MET HG3 1.0 . 4.74 356 254 A 52 VAL H A 51 GLU HBx 1.0 . 4.20 357 255 A 87 ARG HD3 A 97 PRO HBy 1.0 . 4.88 358 255 A 97 PRO HBy A 87 ARG HD2 1.0 . 4.88 359 256 A 62 VAL HB A 64 GLN H 1.0 . 4.78 360 257 A 108 THR HG2% A 49 VAL HB 1.0 . 4.64 361 258 A 33 LEU H A 32 PRO HBx 1.0 . 4.31 362 259 A 62 VAL H A 61 MET HG2 1.0 . 4.53 363 259 A 62 VAL H A 61 MET HG3 1.0 . 4.53 364 260 A 55 TYR H A 54 HIS HBx 1.0 . 3.92 365 261 A 54 HIS H A 54 HIS HBx 1.0 . 3.65 366 262 A 69 GLN H A 69 GLN HBy 1.0 . 3.61 367 263 A 69 GLN H A 69 GLN HBx 1.0 . 3.61 368 264 A 76 CYS HA A 88 GLN HB2 1.0 . 4.80 369 264 A 76 CYS HA A 88 GLN HB3 1.0 . 4.80 370 265 A 76 CYS H A 88 GLN HB2 1.0 . 3.97 371 265 A 76 CYS H A 88 GLN HB3 1.0 . 3.97 372 266 A 72 HIS HA A 70 GLU HB2 1.0 . 5.05 373 266 A 70 GLU HB3 A 72 HIS HA 1.0 . 5.05 374 267 A 82 GLY H A 76 CYS HBy 1.0 . 4.62 375 268 A 82 GLY H A 76 CYS HBx 1.0 . 4.62 376 269 A 23 GLN HB3 A 23 GLN HG2 1.0 . 2.96 377 269 A 23 GLN HB2 A 23 GLN HG2 1.0 . 2.96 378 269 A 23 GLN HG3 A 23 GLN HB2 1.0 . 2.96 379 269 A 23 GLN HB3 A 23 GLN HG3 1.0 . 2.96 380 270 A 73 MET H A 70 GLU HB2 1.0 . 4.71 381 270 A 70 GLU HB3 A 73 MET H 1.0 . 4.71 382 271 A 33 LEU H A 30 LYS HD2 1.0 . 4.86 383 271 A 30 LYS HD3 A 33 LEU H 1.0 . 4.86 384 272 A 35 LYS HD3 A 35 LYS HG2 1.0 . 2.88 385 272 A 35 LYS HG3 A 35 LYS HD2 1.0 . 2.88 386 272 A 35 LYS HD3 A 35 LYS HG3 1.0 . 2.88 387 272 A 35 LYS HD2 A 35 LYS HG2 1.0 . 2.88 388 273 A 32 PRO HA A 35 LYS HD2 1.0 . 4.57 389 273 A 32 PRO HA A 35 LYS HD3 1.0 . 4.57 390 274 A 72 HIS HA A 71 GLN HB2 1.0 . 4.06 391 274 A 72 HIS HA A 71 GLN HB3 1.0 . 4.06 392 275 A 98 LEU H A 97 PRO HGy 1.0 . 4.76 393 275 A 97 PRO HGx A 98 LEU H 1.0 . 4.76 394 276 A 63 LYS H A 63 LYS HDy 1.0 . 4.61 395 277 A 63 LYS HA A 63 LYS HDy 1.0 . 4.15 396 278 A 63 LYS H A 63 LYS HDx 1.0 . 4.61 397 279 A 63 LYS HA A 63 LYS HDx 1.0 . 4.15 398 280 A 46 MET H A 29 PRO HGy 1.0 . 3.94 399 280 A 46 MET H A 29 PRO HGx 1.0 . 3.94 400 281 A 46 MET HA A 28 ARG HGy 1.0 . 4.91 401 281 A 46 MET HA A 28 ARG HGx 1.0 . 4.91 402 282 A 28 ARG HGx A 46 MET HB2 1.0 . 3.07 403 282 A 28 ARG HGy A 46 MET HB2 1.0 . 3.07 404 282 A 46 MET HB3 A 28 ARG HGy 1.0 . 3.07 405 282 A 28 ARG HGx A 46 MET HB3 1.0 . 3.07 406 283 A 28 ARG H A 28 ARG HGy 1.0 . 4.63 407 283 A 28 ARG HGx A 28 ARG H 1.0 . 4.63 408 284 A 24 ILE HA A 24 ILE HG1y 1.0 . 3.93 409 285 A 102 LEU H A 102 LEU HG 1.0 . 4.03 410 286 A 31 LEU H A 31 LEU HG 1.0 . 4.39 411 287 A 43 GLN HA A 34 LEU HG 1.0 . 4.19 412 288 A 85 LEU H A 85 LEU HG 1.0 . 4.18 413 289 A 109 LEU H A 109 LEU HG 1.0 . 4.14 414 290 A 85 LEU H A 85 LEU HDx% 1.0 . 4.56 415 291 A 90 PHE HE% A 85 LEU HDx% 1.0 . 4.46 416 292 A 98 LEU HA A 85 LEU HDx% 1.0 . 4.78 417 293 A 85 LEU HA A 85 LEU HDx% 1.0 . 4.63 418 294 A 65 LEU H A 65 LEU HG 1.0 . 5.05 419 295 A 87 ARG H A 87 ARG HGx 1.0 . 4.47 420 296 A 81 LEU HA A 81 LEU HDx% 1.0 . 4.23 421 297 A 65 LEU H A 65 LEU HDx% 1.0 . 4.91 422 298 A 37 LEU H A 37 LEU HDy% 1.0 . 4.18 423 299 A 52 VAL HA A 37 LEU HDy% 1.0 . 4.38 424 300 A 106 LEU H A 106 LEU HDx% 1.0 . 4.61 425 301 A 65 LEU HA A 65 LEU HDx% 1.0 . 4.02 426 302 A 104 LYS H A 104 LYS HGy 1.0 . 4.00 427 302 A 104 LYS HGx A 104 LYS H 1.0 . 4.00 428 303 A 104 LYS HB2 A 104 LYS HGy 1.0 . 2.85 429 303 A 104 LYS HB3 A 104 LYS HGy 1.0 . 2.85 430 303 A 104 LYS HGx A 104 LYS HB2 1.0 . 2.85 431 303 A 104 LYS HGx A 104 LYS HB3 1.0 . 2.85 432 304 A 36 ILE HA A 35 LYS HG2 1.0 . 4.64 433 304 A 36 ILE HA A 35 LYS HG3 1.0 . 4.64 434 305 A 35 LYS H A 35 LYS HG2 1.0 . 4.24 435 305 A 35 LYS H A 35 LYS HG3 1.0 . 4.24 436 306 A 99 TYR HE% A 98 LEU HDy% 1.0 . 5.00 437 307 A 87 ARG H A 85 LEU HDy% 1.0 . 5.50 438 308 A 90 PHE HE% A 85 LEU HDy% 1.0 . 4.46 439 309 A 85 LEU H A 85 LEU HDy% 1.0 . 4.56 440 310 A 85 LEU HA A 85 LEU HDy% 1.0 . 4.63 441 311 A 98 LEU HA A 85 LEU HDy% 1.0 . 4.78 442 312 A 80 LEU HA A 80 LEU HD1% 1.0 . 2.81 443 312 A 80 LEU HD2% A 80 LEU HA 1.0 . 2.81 444 313 A 80 LEU HD2% A 83 GLU HB2 1.0 . 3.55 445 313 A 83 GLU HB3 A 80 LEU HD1% 1.0 . 3.55 446 313 A 83 GLU HB3 A 80 LEU HD2% 1.0 . 3.55 447 313 A 80 LEU HD1% A 83 GLU HB2 1.0 . 3.55 448 314 A 36 ILE H A 80 LEU HD1% 1.0 . 4.53 449 314 A 80 LEU HD2% A 36 ILE H 1.0 . 4.53 450 315 A 36 ILE HG2% A 80 LEU HD1% 1.0 . 4.37 451 315 A 80 LEU HD2% A 36 ILE HG2% 1.0 . 4.37 452 316 A 99 TYR HD% A 98 LEU HDx% 1.0 . 5.21 453 317 A 49 VAL H A 49 VAL HGx% 1.0 . 3.78 454 318 A 49 VAL HA A 49 VAL HGx% 1.0 . 3.81 455 319 A 49 VAL HA A 52 VAL HGy% 1.0 . 3.70 456 320 A 33 LEU H A 33 LEU HDy% 1.0 . 5.01 457 321 A 99 TYR HA A 102 LEU HDx% 1.0 . 4.60 458 321 A 99 TYR HA A 102 LEU HDy% 1.0 . 4.60 459 322 A 37 LEU H A 37 LEU HDx% 1.0 . 4.18 460 323 A 37 LEU HA A 37 LEU HDx% 1.0 . 4.56 461 324 A 93 LYS H A 92 VAL HGx% 1.0 . 5.27 462 325 A 51 GLU H A 48 THR HG2% 1.0 . 4.48 463 326 A 48 THR HG2% A 26 GLN HE21 1.0 . 4.43 464 327 A 49 VAL H A 48 THR HG2% 1.0 . 3.24 465 328 A 50 LYS H A 48 THR HG2% 1.0 . 4.23 466 329 A 48 THR HG2% A 26 GLN HE22 1.0 . 4.43 467 330 A 48 THR HA A 48 THR HG2% 1.0 . 3.26 468 331 A 49 VAL HB A 48 THR HG2% 1.0 . 4.10 469 332 A 109 LEU H A 108 THR HG2% 1.0 . 3.93 470 333 A 108 THR HA A 108 THR HG2% 1.0 . 3.34 471 334 A 62 VAL HA A 62 VAL HGx% 1.0 . 2.96 472 335 A 62 VAL H A 62 VAL HGx% 1.0 . 4.18 473 336 A 40 ALA HA A 62 VAL HGx% 1.0 . 4.62 474 337 A 49 VAL H A 49 VAL HGy% 1.0 . 3.78 475 338 A 28 ARG H A 27 VAL HGy% 1.0 . 4.61 476 339 A 27 VAL HA A 27 VAL HGy% 1.0 . 3.99 477 340 A 27 VAL H A 27 VAL HGy% 1.0 . 4.11 478 341 A 108 THR HG2% A 103 ARG HB2 1.0 . 5.00 479 341 A 108 THR HG2% A 103 ARG HB3 1.0 . 5.00 480 342 A 108 THR H A 108 THR HG2% 1.0 . 4.41 481 343 A 53 MET H A 52 VAL HGx% 1.0 . 3.98 482 344 A 49 VAL HA A 49 VAL HGy% 1.0 . 3.81 483 345 A 65 LEU H A 65 LEU HDy% 1.0 . 4.91 484 346 A 65 LEU HA A 65 LEU HDy% 1.0 . 4.02 485 347 A 40 ALA HB% A 59 TYR H 1.0 . 3.56 486 348 A 59 TYR HA A 40 ALA HB% 1.0 . 3.34 487 349 A 40 ALA HB% A 59 TYR HBy 1.0 . 4.19 488 350 A 62 VAL HA A 62 VAL HGy% 1.0 . 2.96 489 351 A 49 VAL HA A 52 VAL HGx% 1.0 . 3.70 490 352 A 51 GLU H A 52 VAL HGx% 1.0 . 4.68 491 353 A 39 ALA H A 40 ALA HB% 1.0 . 4.88 492 354 A 110 ALA HB% A 108 THR HG2% 1.0 . 4.40 493 355 A 110 ALA HB% A 111 THR H 1.0 . 4.15 494 356 A 111 THR HB A 110 ALA HB% 1.0 . 4.47 495 357 A 60 ILE HG2% A 60 ILE H 1.0 . 4.08 496 358 A 60 ILE HG2% A 61 MET HA 1.0 . 4.69 497 359 A 27 VAL H A 27 VAL HGx% 1.0 . 4.11 498 360 A 27 VAL HA A 27 VAL HGx% 1.0 . 3.99 499 361 A 42 ALA HB% A 38 HIS HA 1.0 . 3.74 500 362 A 42 ALA HB% A 37 LEU HBy 1.0 . 3.84 501 363 A 28 ARG H A 27 VAL HGx% 1.0 . 4.61 502 364 A 42 ALA HB% A 43 GLN H 1.0 . 3.47 503 365 A 38 HIS HD2 A 42 ALA HB% 1.0 . 3.50 504 366 A 40 ALA HB% A 42 ALA HB% 1.0 . 4.87 505 367 A 42 ALA HB% A 37 LEU HG 1.0 . 5.34 506 368 A 39 ALA HB% A 40 ALA H 1.0 . 3.65 507 369 A 39 ALA HB% A 40 ALA HA 1.0 . 4.20 508 370 A 39 ALA HB% A 36 ILE HG2% 1.0 . 5.50 509 371 A 39 ALA HB% A 63 LYS HZ% 1.0 . 3.49 510 372 A 24 ILE HA A 24 ILE HG2% 1.0 . 2.99 511 373 A 24 ILE HG2% A 26 GLN HGy 1.0 . 4.18 512 374 A 24 ILE HG2% A 26 GLN HGx 1.0 . 4.18 513 375 A 101 MET HE% A 101 MET H 1.0 . 4.44 514 376 A 101 MET HE% A 102 LEU HDx% 1.0 . 2.60 515 376 A 101 MET HE% A 102 LEU HDy% 1.0 . 2.60 516 377 A 101 MET HE% A 102 LEU H 1.0 . 4.03 517 378 A 101 MET HE% A 99 TYR HA 1.0 . 4.44 518 379 A 101 MET HE% A 98 LEU HA 1.0 . 3.75 519 380 A 61 MET H A 61 MET HE% 1.0 . 4.92 520 381 A 66 TYR HE% A 61 MET HE% 1.0 . 3.81 521 382 A 61 MET HA A 61 MET HE% 1.0 . 4.51 522 383 A 61 MET HE% A 61 MET HB2 1.0 . 3.92 523 383 A 61 MET HB3 A 61 MET HE% 1.0 . 3.92 524 384 A 60 ILE HA A 60 ILE HD1% 1.0 . 4.70 525 385 A 60 ILE H A 60 ILE HD1% 1.0 . 5.00 526 386 A 60 ILE HD1% A 57 GLY HA2 1.0 . 4.87 527 386 A 60 ILE HD1% A 57 GLY HA3 1.0 . 4.87 528 387 A 60 ILE HD1% A 61 MET HB2 1.0 . 5.08 529 387 A 61 MET HB3 A 60 ILE HD1% 1.0 . 5.08 530 388 A 36 ILE HG2% A 37 LEU H 1.0 . 4.04 531 389 A 36 ILE HA A 36 ILE HG2% 1.0 . 3.51 532 390 A 24 ILE HD1% A 46 MET HB2 1.0 . 4.87 533 390 A 24 ILE HD1% A 46 MET HB3 1.0 . 4.87 534 391 A 24 ILE HA A 24 ILE HD1% 1.0 . 4.25 535 392 A 36 ILE HD1% A 81 LEU H 1.0 . 4.13 536 393 A 35 LYS H A 36 ILE HD1% 1.0 . 4.94 537 394 A 36 ILE HD1% A 80 LEU H 1.0 . 5.19 538 395 A 36 ILE HD1% A 36 ILE H 1.0 . 3.80 539 396 A 36 ILE HD1% A 36 ILE HA 1.0 . 4.04 540 397 A 36 ILE HD1% A 80 LEU HD1% 1.0 . 3.78 541 397 A 36 ILE HD1% A 80 LEU HD2% 1.0 . 3.78 542 398 A 36 ILE HD1% A 36 ILE HG2% 1.0 . 3.56 543 399 A 24 ILE HD1% A 47 PHE H 1.0 . 5.06 544 400 A 24 ILE HD1% A 24 ILE H 1.0 . 4.65 545 401 A 24 ILE HD1% A 24 ILE HB 1.0 . 3.66 546 402 A 24 ILE HD1% A 48 THR H 1.0 . 4.40 547 403 A 81 LEU H A 80 LEU H 1.0 . 4.67 548 404 A 80 LEU H A 80 LEU HD1% 1.0 . 4.82 549 404 A 80 LEU HD2% A 80 LEU H 1.0 . 4.82 550 405 A 109 LEU H A 108 THR HA 1.0 . 2.77 551 406 A 109 LEU H A 109 LEU HB2 1.0 . 2.93 552 406 A 109 LEU H A 109 LEU HB3 1.0 . 2.93 553 407 A 75 TYR HD% A 75 TYR H 1.0 . 4.34 554 408 A 75 TYR H A 66 TYR HA 1.0 . 4.15 555 409 A 111 THR HB A 110 ALA H 1.0 . 4.75 556 410 A 110 ALA H A 109 LEU HB2 1.0 . 3.83 557 410 A 110 ALA H A 109 LEU HB3 1.0 . 3.83 558 411 A 110 ALA HB% A 110 ALA H 1.0 . 3.50 559 412 A 39 ALA H A 42 ALA HB% 1.0 . 5.50 560 413 A 39 ALA H A 38 HIS H 1.0 . 3.15 561 414 A 39 ALA H A 40 ALA H 1.0 . 3.16 562 415 A 39 ALA H A 36 ILE H 1.0 . 4.89 563 416 A 39 ALA H A 35 LYS HA 1.0 . 4.39 564 417 A 39 ALA H A 39 ALA HB% 1.0 . 2.80 565 418 A 38 HIS HD2 A 42 ALA H 1.0 . 4.84 566 419 A 43 GLN H A 42 ALA H 1.0 . 4.33 567 420 A 38 HIS HA A 42 ALA H 1.0 . 3.45 568 421 A 40 ALA HB% A 42 ALA H 1.0 . 4.30 569 422 A 42 ALA HB% A 42 ALA H 1.0 . 3.11 570 423 A 38 HIS H A 42 ALA H 1.0 . 4.73 571 424 A 106 LEU HA A 107 VAL H 1.0 . 3.43 572 425 A 107 VAL H A 107 VAL HB 1.0 . 3.67 573 426 A 107 VAL H A 106 LEU HG 1.0 . 4.72 574 427 A 73 MET HA A 74 VAL H 1.0 . 3.39 575 428 A 74 VAL H A 73 MET HB2 1.0 . 4.90 576 428 A 74 VAL H A 73 MET HB3 1.0 . 4.90 577 429 A 75 TYR HD% A 67 ASP H 1.0 . 5.09 578 430 A 67 ASP H A 66 TYR HD% 1.0 . 4.26 579 431 A 66 TYR HA A 67 ASP H 1.0 . 3.40 580 432 A 74 VAL HA A 67 ASP H 1.0 . 4.41 581 433 A 67 ASP H A 67 ASP HBy 1.0 . 3.50 582 434 A 67 ASP H A 67 ASP HBx 1.0 . 3.50 583 435 A 67 ASP H A 73 MET H 1.0 . 5.42 584 436 A 70 GLU H A 67 ASP HBy 1.0 . 3.99 585 437 A 70 GLU H A 70 GLU HB2 1.0 . 3.50 586 437 A 70 GLU HB3 A 70 GLU H 1.0 . 3.50 587 438 A 49 VAL H A 48 THR HB 1.0 . 3.14 588 439 A 49 VAL H A 49 VAL HB 1.0 . 3.10 589 440 A 36 ILE H A 34 LEU H 1.0 . 4.78 590 441 A 83 GLU H A 80 LEU HD1% 1.0 . 5.31 591 441 A 80 LEU HD2% A 83 GLU H 1.0 . 5.31 592 442 A 27 VAL H A 28 ARG H 1.0 . 5.31 593 443 A 28 ARG H A 27 VAL HA 1.0 . 3.10 594 444 A 28 ARG H A 27 VAL HB 1.0 . 3.06 595 445 A 28 ARG H A 28 ARG HBx 1.0 . 3.90 596 446 A 30 LYS HA A 31 LEU H 1.0 . 3.25 597 447 A 31 LEU H A 31 LEU HB2 1.0 . 3.07 598 447 A 31 LEU HB3 A 31 LEU H 1.0 . 3.07 599 448 A 31 LEU H A 32 PRO HDx 1.0 . 4.26 600 449 A 102 LEU H A 103 ARG H 1.0 . 3.78 601 450 A 34 LEU H A 34 LEU HBy 1.0 . 3.20 602 451 A 34 LEU H A 34 LEU HBx 1.0 . 3.20 603 452 A 83 GLU H A 81 LEU H 1.0 . 4.80 604 453 A 36 ILE HD1% A 83 GLU H 1.0 . 5.50 605 454 A 83 GLU H A 85 LEU H 1.0 . 4.93 606 455 A 84 LEU H A 83 GLU H 1.0 . 3.17 607 456 A 83 GLU H A 83 GLU HB2 1.0 . 2.80 608 456 A 83 GLU HB3 A 83 GLU H 1.0 . 2.80 609 457 A 30 LYS H A 30 LYS HG2 1.0 . 4.10 610 457 A 30 LYS H A 30 LYS HG3 1.0 . 4.10 611 458 A 62 VAL H A 59 TYR H 1.0 . 5.36 612 459 A 62 VAL HB A 62 VAL H 1.0 . 3.23 613 460 A 62 VAL H A 63 LYS HBy 1.0 . 4.94 614 460 A 62 VAL H A 63 LYS HBx 1.0 . 4.94 615 461 A 62 VAL H A 62 VAL HGy% 1.0 . 4.18 616 462 A 60 ILE HA A 62 VAL H 1.0 . 5.11 617 463 A 59 TYR HD% A 59 TYR H 1.0 . 4.40 618 464 A 60 ILE H A 59 TYR H 1.0 . 3.53 619 465 A 59 TYR H A 59 TYR HBy 1.0 . 3.45 620 466 A 59 TYR H A 59 TYR HBx 1.0 . 3.45 621 467 A 62 VAL H A 61 MET HB2 1.0 . 5.03 622 467 A 62 VAL H A 61 MET HB3 1.0 . 5.03 623 468 A 24 ILE H A 23 GLN HA 1.0 . 2.86 624 469 A 24 ILE H A 24 ILE HG1x 1.0 . 4.05 625 470 A 24 ILE H A 24 ILE HG1y 1.0 . 4.05 626 471 A 24 ILE H A 24 ILE HG2% 1.0 . 4.13 627 472 A 32 PRO HA A 36 ILE H 1.0 . 5.50 628 473 A 35 LYS H A 36 ILE H 1.0 . 3.46 629 474 A 37 LEU H A 36 ILE H 1.0 . 3.32 630 475 A 33 LEU HA A 36 ILE H 1.0 . 3.95 631 476 A 36 ILE HB A 36 ILE H 1.0 . 2.83 632 477 A 38 HIS H A 36 ILE H 1.0 . 4.64 633 478 A 36 ILE HG2% A 36 ILE H 1.0 . 4.10 634 479 A 51 GLU H A 47 PHE HD% 1.0 . 4.82 635 480 A 51 GLU H A 51 GLU HBy 1.0 . 3.66 636 481 A 51 GLU H A 50 LYS HBy 1.0 . 3.80 637 481 A 51 GLU H A 50 LYS HBx 1.0 . 3.80 638 482 A 51 GLU H A 52 VAL HGy% 1.0 . 4.68 639 483 A 51 GLU H A 48 THR HB 1.0 . 3.65 640 484 A 51 GLU H A 51 GLU HGy 1.0 . 3.87 641 485 A 51 GLU H A 51 GLU HGx 1.0 . 3.87 642 486 A 51 GLU H A 51 GLU HBx 1.0 . 3.66 643 487 A 52 VAL H A 51 GLU HBy 1.0 . 4.20 644 488 A 82 GLY H A 79 ASP H 1.0 . 4.70 645 489 A 80 LEU H A 79 ASP H 1.0 . 4.94 646 490 A 79 ASP H A 79 ASP HBy 1.0 . 3.31 647 491 A 79 ASP H A 79 ASP HBx 1.0 . 3.31 648 492 A 81 LEU H A 79 ASP H 1.0 . 4.88 649 493 A 79 ASP H A 78 GLY H 1.0 . 4.06 650 494 A 73 MET H A 72 HIS H 1.0 . 4.33 651 495 A 73 MET H A 73 MET HB2 1.0 . 3.98 652 495 A 73 MET H A 73 MET HB3 1.0 . 3.98 653 496 A 52 VAL H A 48 THR H 1.0 . 5.02 654 497 A 51 GLU H A 52 VAL H 1.0 . 3.78 655 498 A 72 HIS H A 71 GLN H 1.0 . 4.06 656 499 A 70 GLU HA A 71 GLN H 1.0 . 2.72 657 500 A 71 GLN H A 71 GLN HG3 1.0 . 3.61 658 500 A 71 GLN H A 71 GLN HG2 1.0 . 3.61 659 501 A 71 GLN H A 71 GLN HB2 1.0 . 3.19 660 501 A 71 GLN HB3 A 71 GLN H 1.0 . 3.19 661 502 A 81 LEU H A 79 ASP HBy 1.0 . 4.52 662 503 A 81 LEU H A 81 LEU HBy 1.0 . 3.73 663 504 A 81 LEU H A 81 LEU HBx 1.0 . 3.73 664 505 A 81 LEU H A 82 GLY H 1.0 . 3.90 665 506 A 81 LEU H A 63 LYS HZ% 1.0 . 5.31 666 507 A 47 PHE H A 27 VAL HA 1.0 . 5.21 667 508 A 27 VAL H A 47 PHE H 1.0 . 3.61 668 509 A 46 MET HA A 47 PHE H 1.0 . 2.79 669 510 A 47 PHE H A 26 GLN HB2 1.0 . 4.40 670 510 A 47 PHE H A 26 GLN HB3 1.0 . 4.40 671 511 A 47 PHE HD% A 47 PHE H 1.0 . 3.84 672 512 A 28 ARG HA A 47 PHE H 1.0 . 4.63 673 513 A 26 GLN H A 25 ASN HBy 1.0 . 4.44 674 514 A 26 GLN H A 25 ASN HA 1.0 . 2.74 675 515 A 54 HIS H A 54 HIS HBy 1.0 . 3.65 676 516 A 96 SER H A 99 TYR HE% 1.0 . 4.94 677 517 A 96 SER H A 96 SER HB2 1.0 . 3.13 678 517 A 96 SER HB3 A 96 SER H 1.0 . 3.13 679 518 A 96 SER H A 95 PRO HB2 1.0 . 4.21 680 518 A 95 PRO HB3 A 96 SER H 1.0 . 4.21 681 519 A 58 GLN H A 59 TYR H 1.0 . 4.02 682 520 A 106 LEU H A 107 VAL HA 1.0 . 5.50 683 521 A 106 LEU H A 102 LEU HA 1.0 . 4.59 684 522 A 101 MET H A 102 LEU H 1.0 . 3.63 685 523 A 100 ASP H A 101 MET H 1.0 . 3.77 686 524 A 101 MET H A 100 ASP HBy 1.0 . 3.81 687 525 A 101 MET H A 101 MET HB2 1.0 . 3.50 688 525 A 101 MET H A 101 MET HB3 1.0 . 3.50 689 526 A 81 LEU H A 80 LEU HD1% 1.0 . 5.01 690 526 A 80 LEU HD2% A 81 LEU H 1.0 . 5.01 691 527 A 24 ILE HD1% A 26 GLN H 1.0 . 5.01 692 528 A 48 THR HA A 50 LYS H 1.0 . 4.55 693 529 A 49 VAL H A 50 LYS H 1.0 . 3.33 694 530 A 51 GLU H A 50 LYS H 1.0 . 3.46 695 531 A 48 THR HB A 50 LYS H 1.0 . 3.33 696 532 A 50 LYS H A 49 VAL HB 1.0 . 3.28 697 533 A 50 LYS H A 50 LYS HGy 1.0 . 4.20 698 534 A 50 LYS H A 50 LYS HGx 1.0 . 4.20 699 535 A 84 LEU H A 83 GLU HB2 1.0 . 3.19 700 535 A 83 GLU HB3 A 84 LEU H 1.0 . 3.19 701 536 A 84 LEU H A 84 LEU HBy 1.0 . 3.52 702 537 A 84 LEU H A 80 LEU HD1% 1.0 . 5.16 703 537 A 80 LEU HD2% A 84 LEU H 1.0 . 5.16 704 538 A 106 LEU H A 106 LEU HDy% 1.0 . 4.61 705 539 A 106 LEU H A 26 GLN HA 1.0 . 5.46 706 540 A 110 ALA H A 111 THR H 1.0 . 4.62 707 541 A 110 ALA HA A 111 THR H 1.0 . 2.92 708 542 A 38 HIS HA A 40 ALA H 1.0 . 4.21 709 543 A 59 TYR HD% A 40 ALA H 1.0 . 4.25 710 544 A 37 LEU HA A 40 ALA H 1.0 . 4.21 711 545 A 38 HIS H A 40 ALA H 1.0 . 4.41 712 546 A 40 ALA HB% A 40 ALA H 1.0 . 2.96 713 547 A 100 ASP H A 99 TYR H 1.0 . 4.43 714 548 A 98 LEU H A 99 TYR H 1.0 . 5.31 715 549 A 38 HIS H A 39 ALA HA 1.0 . 5.38 716 550 A 38 HIS H A 34 LEU HA 1.0 . 4.67 717 551 A 38 HIS H A 37 LEU H 1.0 . 3.47 718 552 A 39 ALA HB% A 38 HIS H 1.0 . 4.75 719 553 A 38 HIS H A 42 ALA HB% 1.0 . 4.51 720 554 A 47 PHE HE% A 43 GLN H 1.0 . 4.47 721 555 A 43 GLN H A 47 PHE HZ 1.0 . 5.15 722 556 A 99 TYR HA A 103 ARG H 1.0 . 4.68 723 557 A 103 ARG H A 104 LYS H 1.0 . 3.71 724 558 A 103 ARG H A 103 ARG HB2 1.0 . 3.06 725 558 A 103 ARG H A 103 ARG HB3 1.0 . 3.06 726 559 A 55 TYR H A 55 TYR HBy 1.0 . 3.81 727 560 A 55 TYR H A 54 HIS HBy 1.0 . 3.92 728 561 A 60 ILE HA A 63 LYS H 1.0 . 4.79 729 562 A 62 VAL H A 63 LYS H 1.0 . 3.38 730 563 A 64 GLN H A 63 LYS H 1.0 . 3.25 731 564 A 62 VAL HB A 63 LYS H 1.0 . 3.57 732 565 A 63 LYS H A 62 VAL HGx% 1.0 . 3.98 733 566 A 63 LYS H A 62 VAL HGy% 1.0 . 3.98 734 567 A 39 ALA H A 37 LEU H 1.0 . 4.44 735 568 A 37 LEU H A 36 ILE HB 1.0 . 3.04 736 569 A 37 LEU H A 37 LEU HBy 1.0 . 3.86 737 570 A 62 VAL H A 60 ILE H 1.0 . 5.50 738 571 A 60 ILE H A 60 ILE HB 1.0 . 3.34 739 572 A 55 TYR H A 54 HIS H 1.0 . 4.00 740 573 A 55 TYR H A 54 HIS HE1 1.0 . 5.22 741 574 A 55 TYR HD% A 55 TYR H 1.0 . 3.82 742 575 A 55 TYR H A 55 TYR HBx 1.0 . 3.81 743 576 A 93 LYS H A 92 VAL HGy% 1.0 . 5.27 744 577 A 63 LYS H A 63 LYS HBy 1.0 . 3.35 745 577 A 63 LYS HBx A 63 LYS H 1.0 . 3.35 746 578 A 61 MET HA A 63 LYS H 1.0 . 5.07 747 579 A 88 GLN H A 88 GLN HE21 1.0 . 5.50 748 580 A 93 LYS H A 93 LYS HB2 1.0 . 3.89 749 580 A 93 LYS H A 93 LYS HB3 1.0 . 3.89 750 581 A 88 GLN H A 88 GLN HE22 1.0 . 5.50 751 582 A 90 PHE H A 90 PHE HD% 1.0 . 5.30 752 583 A 65 LEU H A 64 GLN H 1.0 . 4.31 753 584 A 62 VAL H A 61 MET H 1.0 . 4.55 754 585 A 58 GLN HA A 61 MET H 1.0 . 4.59 755 586 A 61 MET H A 61 MET HG2 1.0 . 4.47 756 586 A 61 MET H A 61 MET HG3 1.0 . 4.47 757 587 A 60 ILE HG2% A 61 MET H 1.0 . 5.05 758 588 A 61 MET H A 59 TYR H 1.0 . 5.46 759 589 A 68 GLN H A 69 GLN H 1.0 . 3.60 760 590 A 69 GLN H A 70 GLU H 1.0 . 2.89 761 591 A 69 GLN H A 69 GLN HE22 1.0 . 5.50 762 592 A 65 LEU H A 66 TYR HA 1.0 . 5.48 763 593 A 62 VAL H A 64 GLN H 1.0 . 4.75 764 594 A 64 GLN H A 63 LYS HBy 1.0 . 4.44 765 594 A 63 LYS HBx A 64 GLN H 1.0 . 4.44 766 595 A 66 TYR HE% A 64 GLN H 1.0 . 4.01 767 596 A 61 MET HA A 64 GLN H 1.0 . 4.13 768 597 A 62 VAL HA A 64 GLN H 1.0 . 4.08 769 598 A 64 GLN H A 64 GLN HG2 1.0 . 3.35 770 598 A 64 GLN HG3 A 64 GLN H 1.0 . 3.35 771 599 A 94 ASP H A 93 LYS HB2 1.0 . 4.67 772 599 A 94 ASP H A 93 LYS HB3 1.0 . 4.67 773 600 A 94 ASP H A 95 PRO HA 1.0 . 5.16 774 601 A 46 MET H A 45 GLU H 1.0 . 2.93 775 602 A 46 MET H A 46 MET HB2 1.0 . 3.06 776 602 A 46 MET H A 46 MET HB3 1.0 . 3.06 777 603 A 84 LEU H A 85 LEU H 1.0 . 3.33 778 604 A 85 LEU H A 83 GLU HB2 1.0 . 5.00 779 604 A 83 GLU HB3 A 85 LEU H 1.0 . 5.00 780 605 A 85 LEU H A 85 LEU HBy 1.0 . 3.78 781 606 A 85 LEU H A 84 LEU HBy 1.0 . 3.90 782 607 A 85 LEU H A 84 LEU HBx 1.0 . 3.90 783 608 A 35 LYS H A 37 LEU H 1.0 . 4.65 784 609 A 35 LYS H A 33 LEU HA 1.0 . 4.94 785 610 A 35 LYS H A 34 LEU HBx 1.0 . 4.01 786 611 A 35 LYS H A 38 HIS H 1.0 . 5.14 787 612 A 94 ASP H A 93 LYS H 1.0 . 3.29 788 613 A 91 SER H A 94 ASP H 1.0 . 5.12 789 614 A 45 GLU H A 47 PHE HZ 1.0 . 5.50 790 615 A 53 MET H A 50 LYS HA 1.0 . 4.08 791 616 A 47 PHE HE% A 53 MET H 1.0 . 5.05 792 617 A 53 MET H A 53 MET HBy 1.0 . 3.95 793 618 A 53 MET H A 52 VAL HB 1.0 . 3.38 794 619 A 53 MET H A 52 VAL HGy% 1.0 . 3.98 795 620 A 35 LYS H A 34 LEU H 1.0 . 3.66 796 621 A 35 LYS H A 35 LYS HBy 1.0 . 2.91 797 621 A 35 LYS H A 35 LYS HBx 1.0 . 2.91 798 622 A 35 LYS H A 35 LYS HD2 1.0 . 3.51 799 622 A 35 LYS H A 35 LYS HD3 1.0 . 3.51 800 623 A 45 GLU H A 44 GLY HAy 1.0 . 3.54 801 624 A 45 GLU H A 44 GLY HAx 1.0 . 3.54 802 625 A 45 GLU H A 45 GLU HGx 1.0 . 4.48 803 626 A 45 GLU H A 29 PRO HGy 1.0 . 3.94 804 626 A 45 GLU H A 29 PRO HGx 1.0 . 3.94 805 627 A 49 VAL HA A 53 MET H 1.0 . 4.52 806 628 A 102 LEU H A 105 ASN H 1.0 . 5.17 807 629 A 106 LEU H A 105 ASN H 1.0 . 3.27 808 630 A 105 ASN H A 104 LYS H 1.0 . 3.32 809 631 A 103 ARG HA A 105 ASN H 1.0 . 4.80 810 632 A 105 ASN H A 105 ASN HBx 1.0 . 3.91 811 633 A 105 ASN H A 104 LYS HB2 1.0 . 4.11 812 633 A 105 ASN H A 104 LYS HB3 1.0 . 4.11 813 634 A 104 LYS H A 103 ARG HB2 1.0 . 3.49 814 634 A 103 ARG HB3 A 104 LYS H 1.0 . 3.49 815 635 A 104 LYS H A 104 LYS HB2 1.0 . 3.53 816 635 A 104 LYS H A 104 LYS HB3 1.0 . 3.53 817 636 A 27 VAL H A 26 GLN HGy 1.0 . 4.70 818 637 A 27 VAL H A 26 GLN HGx 1.0 . 4.70 819 638 A 27 VAL H A 26 GLN HA 1.0 . 3.05 820 639 A 27 VAL H A 26 GLN H 1.0 . 4.76 821 640 A 27 VAL H A 26 GLN HB2 1.0 . 3.41 822 640 A 27 VAL H A 26 GLN HB3 1.0 . 3.41 823 641 A 91 SER H A 90 PHE HD% 1.0 . 4.24 824 642 A 91 SER H A 90 PHE HA 1.0 . 3.33 825 643 A 91 SER H A 91 SER HBx 1.0 . 3.94 826 644 A 87 ARG H A 86 GLY H 1.0 . 3.41 827 645 A 87 ARG H A 85 LEU HBx 1.0 . 4.11 828 646 A 87 ARG H A 85 LEU HDx% 1.0 . 5.50 829 647 A 66 TYR H A 65 LEU HBx 1.0 . 5.02 830 648 A 60 ILE HG2% A 66 TYR H 1.0 . 4.84 831 649 A 66 TYR H A 64 GLN HA 1.0 . 4.71 832 650 A 87 ARG H A 85 LEU HBy 1.0 . 4.11 833 651 A 87 ARG H A 87 ARG HGy 1.0 . 4.47 834 652 A 65 LEU H A 66 TYR H 1.0 . 3.95 835 653 A 66 TYR H A 65 LEU HBy 1.0 . 5.02 836 654 A 33 LEU H A 34 LEU H 1.0 . 3.05 837 655 A 33 LEU H A 33 LEU HBy 1.0 . 3.63 838 656 A 33 LEU H A 33 LEU HG 1.0 . 4.62 839 657 A 33 LEU H A 33 LEU HBx 1.0 . 3.63 840 658 A 35 LYS H A 33 LEU H 1.0 . 4.40 841 659 A 33 LEU H A 33 LEU HDx% 1.0 . 5.01 842 660 A 69 GLN H A 69 GLN HE21 1.0 . 5.50 843 661 A 55 TYR HA A 58 GLN HE21 1.0 . 4.75 844 662 A 76 CYS H A 77 GLY H 1.0 . 5.50 845 663 A 25 ASN HA A 26 GLN HE22 1.0 . 5.18 846 664 A 47 PHE HD% A 48 THR H 1.0 . 4.50 847 665 A 51 GLU H A 48 THR H 1.0 . 4.29 848 666 A 48 THR H A 47 PHE HBy 1.0 . 4.12 849 667 A 48 THR H A 48 THR HG2% 1.0 . 3.73 850 668 A 89 SER H A 88 GLN H 1.0 . 5.43 851 669 A 89 SER H A 87 ARG HD2 1.0 . 5.37 852 669 A 87 ARG HD3 A 89 SER H 1.0 . 5.37 853 670 A 89 SER H A 87 ARG HBy 1.0 . 4.21 854 671 A 89 SER H A 87 ARG HBx 1.0 . 4.21 855 672 A 25 ASN HA A 26 GLN HE21 1.0 . 5.18 856 673 A 90 PHE H A 89 SER H 1.0 . 5.09 857 674 A 44 GLY H A 45 GLU H 1.0 . 5.17 858 675 A 44 GLY H A 38 HIS HD2 1.0 . 4.95 859 676 A 44 GLY H A 43 GLN HBy 1.0 . 3.94 860 676 A 44 GLY H A 43 GLN HBx 1.0 . 3.94 861 677 A 44 GLY H A 29 PRO HGy 1.0 . 4.44 862 677 A 44 GLY H A 29 PRO HGx 1.0 . 4.44 863 678 A 86 GLY H A 85 LEU HBy 1.0 . 4.42 864 679 A 86 GLY H A 85 LEU HBx 1.0 . 4.42 865 680 A 80 LEU H A 82 GLY H 1.0 . 5.36 866 681 A 82 GLY H A 76 CYS HA 1.0 . 5.50 867 682 A 38 HIS HA A 41 GLY H 1.0 . 4.39 868 683 A 42 ALA HB% A 41 GLY H 1.0 . 4.53 869 684 A 39 ALA H A 41 GLY H 1.0 . 4.80 870 685 A 39 ALA HA A 41 GLY H 1.0 . 4.24 871 686 A 40 ALA HB% A 41 GLY H 1.0 . 4.10 872 687 A 72 HIS HE1 A 70 GLU HB2 1.0 . 5.01 873 687 A 70 GLU HB3 A 72 HIS HE1 1.0 . 5.01 874 688 A 73 MET HA A 72 HIS HE1 1.0 . 4.46 875 689 A 54 HIS HE1 A 58 GLN HG2 1.0 . 5.03 876 689 A 58 GLN HG3 A 54 HIS HE1 1.0 . 5.03 877 690 A 65 LEU H A 66 TYR HD% 1.0 . 4.44 878 691 A 66 TYR HD% A 64 GLN HBy 1.0 . 5.18 879 692 A 64 GLN HA A 66 TYR HD% 1.0 . 5.12 880 693 A 74 VAL HA A 66 TYR HD% 1.0 . 4.76 881 694 A 75 TYR HD% A 76 CYS H 1.0 . 4.40 882 695 A 66 TYR HD% A 64 GLN HBx 1.0 . 5.18 883 696 A 90 PHE HD% A 90 PHE HA 1.0 . 4.13 884 697 A 55 TYR HD% A 52 VAL HB 1.0 . 4.83 885 698 A 59 TYR HD% A 40 ALA HA 1.0 . 4.58 886 699 A 59 TYR HD% A 63 LYS H 1.0 . 4.66 887 700 A 99 TYR HD% A 98 LEU HDy% 1.0 . 5.21 888 701 A 52 VAL H A 47 PHE HE% 1.0 . 4.69 889 702 A 100 ASP H A 99 TYR HD% 1.0 . 5.10 890 703 A 47 PHE HE% A 43 GLN HBy 1.0 . 4.66 891 703 A 47 PHE HE% A 43 GLN HBx 1.0 . 4.66 892 704 A 47 PHE HE% A 47 PHE H 1.0 . 4.54 893 705 A 47 PHE HE% A 52 VAL HB 1.0 . 5.21 894 706 A 47 PHE HE% A 46 MET HB2 1.0 . 4.58 895 706 A 47 PHE HE% A 46 MET HB3 1.0 . 4.58 896 707 A 90 PHE HE% A 74 VAL HB 1.0 . 3.69 897 708 A 90 PHE HZ A 85 LEU HDx% 1.0 . 4.88 898 709 A 90 PHE HZ A 85 LEU HDy% 1.0 . 4.88 899 710 A 67 ASP H A 75 TYR HE% 1.0 . 4.88 900 711 A 75 TYR HA A 75 TYR HE% 1.0 . 4.20 901 712 A 60 ILE HG2% A 66 TYR HE% 1.0 . 3.77 902 713 A 66 TYR HE% A 64 GLN HBy 1.0 . 5.01 903 714 A 66 TYR HE% A 61 MET H 1.0 . 5.35 904 715 A 40 ALA HB% A 59 TYR HE% 1.0 . 4.79 905 716 A 66 TYR HE% A 71 GLN HG3 1.0 . 4.96 906 716 A 66 TYR HE% A 71 GLN HG2 1.0 . 4.96 907 717 A 66 TYR HE% A 68 GLN HA 1.0 . 4.13 908 718 A 66 TYR HE% A 64 GLN HBx 1.0 . 5.01 909 719 A 52 VAL HA A 55 TYR HE% 1.0 . 4.78 910 720 A 54 HIS HE1 A 55 TYR HE% 1.0 . 4.84 911 721 A 99 TYR HA A 99 TYR HE% 1.0 . 4.96 912 722 A 90 PHE HD% A 89 SER H 1.0 . 5.20 913 723 A 90 PHE HD% A 97 PRO HD2 1.0 . 4.90 914 723 A 90 PHE HD% A 97 PRO HD3 1.0 . 4.90 915 724 A 90 PHE HA A 97 PRO HD2 1.0 . 4.68 916 724 A 90 PHE HA A 97 PRO HD3 1.0 . 4.68 917 725 A 96 SER HB3 A 97 PRO HD2 1.0 . 3.59 918 725 A 97 PRO HD3 A 96 SER HB2 1.0 . 3.59 919 725 A 96 SER HB3 A 97 PRO HD3 1.0 . 3.59 920 725 A 96 SER HB2 A 97 PRO HD2 1.0 . 3.59 921 726 A 47 PHE HD% A 43 GLN H 1.0 . 4.82 922 727 A 59 TYR HD% A 40 ALA HB% 1.0 . 3.60 923 728 A 75 TYR HD% A 89 SER HA 1.0 . 4.26 924 729 A 60 ILE HA A 59 TYR HD% 1.0 . 4.31 925 730 A 89 SER HA A 90 PHE HD% 1.0 . 4.39 926 731 A 90 PHE HD% A 74 VAL HB 1.0 . 3.96 927 732 A 99 TYR HD% A 99 TYR H 1.0 . 4.82 928 733 A 95 PRO HA A 99 TYR HD% 1.0 . 5.11 929 734 A 99 TYR HD% A 96 SER H 1.0 . 4.61 930 735 A 47 PHE HE% A 37 LEU HBy 1.0 . 5.50 931 736 A 47 PHE HE% A 42 ALA HB% 1.0 . 4.07 932 737 A 47 PHE HE% A 37 LEU HBx 1.0 . 5.50 933 738 A 90 PHE HE% A 82 GLY HA2 1.0 . 4.90 934 738 A 82 GLY HA3 A 90 PHE HE% 1.0 . 4.90 935 739 A 45 GLU HA A 47 PHE HZ 1.0 . 4.77 936 740 A 42 ALA HB% A 55 TYR HE% 1.0 . 4.15 937 741 A 55 TYR HA A 55 TYR HE% 1.0 . 4.99 938 742 A 36 ILE HA A 59 TYR HE% 1.0 . 4.12 939 743 A 72 HIS HD2 A 93 LYS HE2 1.0 . 5.35 940 743 A 93 LYS HE3 A 72 HIS HD2 1.0 . 5.35 941 744 A 99 TYR HE% A 98 LEU HDx% 1.0 . 5.00 942 745 A 39 ALA HB% A 59 TYR HE% 1.0 . 3.44 943 746 A 36 ILE HG2% A 59 TYR HE% 1.0 . 4.88 944 747 A 39 ALA H A 59 TYR HE% 1.0 . 5.04 945 748 A 82 GLY H A 59 TYR HE% 1.0 . 5.43 946 749 A 38 HIS H A 38 HIS HD2 1.0 . 4.31 947 750 A 38 HIS HD2 A 38 HIS HA 1.0 . 3.08 948 751 A 90 PHE HZ A 74 VAL HGy% 1.0 . 4.84 949 752 A 90 PHE HZ A 74 VAL HGx% 1.0 . 4.84 950 753 A 60 ILE HG2% A 90 PHE HZ 1.0 . 4.49 951 754 A 42 ALA HB% A 47 PHE HZ 1.0 . 3.88 952 755 A 60 ILE HD1% A 90 PHE HZ 1.0 . 4.68 953 756 A 95 PRO HA A 99 TYR HE% 1.0 . 5.19 954 757 A 61 MET HA A 66 TYR HE% 1.0 . 3.24 955 758 A 42 ALA HA A 55 TYR HE% 1.0 . 4.25 956 759 A 75 TYR HE% A 67 ASP HBy 1.0 . 4.58 957 760 A 70 GLU H A 67 ASP HBx 1.0 . 3.99 958 761 A 75 TYR HE% A 67 ASP HBx 1.0 . 4.58 959 762 A 59 TYR HE% A 81 LEU HBy 1.0 . 4.51 960 763 A 59 TYR HE% A 81 LEU HBx 1.0 . 4.51 961 764 A 75 TYR HE% A 73 MET HE% 1.0 . 4.30 962 765 A 52 VAL H A 55 TYR HD% 1.0 . 5.50 963 766 A 71 GLN H A 70 GLU HB2 1.0 . 4.24 964 766 A 70 GLU HB3 A 71 GLN H 1.0 . 4.24 965 767 A 66 TYR HD% A 71 GLN H 1.0 . 5.30 966 768 A 96 SER HA A 99 TYR HD% 1.0 . 3.73 967 769 A 66 TYR HD% A 71 GLN HA 1.0 . 3.97 968 770 A 75 TYR HD% A 67 ASP HA 1.0 . 4.86 969 771 A 66 TYR HD% A 71 GLN HG2 1.0 . 4.65 970 772 A 66 TYR HD% A 71 GLN HG3 1.0 . 4.65 971 773 A 59 TYR HD% A 81 LEU HDx% 1.0 . 4.63 972 774 A 59 TYR HD% A 81 LEU HDy% 1.0 . 4.63 973 775 A 60 ILE HG2% A 66 TYR HD% 1.0 . 3.48 974 776 A 39 ALA HB% A 59 TYR HD% 1.0 . 3.78 975 777 A 59 TYR HD% A 60 ILE HD1% 1.0 . 5.50 976 778 A 59 TYR HD% A 36 ILE HG2% 1.0 . 3.73 977 779 A 75 TYR HD% A 73 MET HE% 1.0 . 5.03 978 780 A 24 ILE H A 24 ILE HG1x 1.0 . 3.43 979 780 A 24 ILE H A 24 ILE HG1y 1.0 . 3.43 980 781 A 24 ILE H A 26 GLN HGx 1.0 . 4.63 981 781 A 24 ILE H A 26 GLN HGy 1.0 . 4.63 982 782 A 24 ILE HA A 24 ILE HG1x 1.0 . 3.40 983 782 A 24 ILE HA A 24 ILE HG1y 1.0 . 3.40 984 783 A 24 ILE HA A 25 ASN HD22 1.0 . 3.98 985 783 A 24 ILE HA A 25 ASN HD21 1.0 . 3.98 986 784 A 24 ILE HG2% A 25 ASN HBy 1.0 . 4.97 987 784 A 24 ILE HG2% A 25 ASN HBx 1.0 . 4.97 988 785 A 24 ILE HG2% A 25 ASN HD22 1.0 . 5.34 989 785 A 24 ILE HG2% A 25 ASN HD21 1.0 . 5.34 990 786 A 26 GLN HE21 A 24 ILE HG2% 1.0 . 5.34 991 786 A 26 GLN HE22 A 24 ILE HG2% 1.0 . 5.34 992 787 A 47 PHE HA A 24 ILE HG1x 1.0 . 4.54 993 787 A 47 PHE HA A 24 ILE HG1y 1.0 . 4.54 994 788 A 24 ILE HD1% A 26 GLN HE21 1.0 . 5.34 995 788 A 24 ILE HD1% A 26 GLN HE22 1.0 . 5.34 996 789 A 24 ILE HD1% A 47 PHE HBx 1.0 . 3.67 997 789 A 24 ILE HD1% A 47 PHE HBy 1.0 . 3.67 998 790 A 25 ASN H A 25 ASN HBy 1.0 . 3.48 999 790 A 25 ASN H A 25 ASN HBx 1.0 . 3.48 1000 791 A 25 ASN H A 25 ASN HD22 1.0 . 5.22 1001 791 A 25 ASN H A 25 ASN HD21 1.0 . 5.22 1002 792 A 25 ASN HA A 25 ASN HD22 1.0 . 2.71 1003 792 A 25 ASN HA A 25 ASN HD21 1.0 . 2.71 1004 793 A 25 ASN HA A 26 GLN HE21 1.0 . 4.45 1005 793 A 25 ASN HA A 26 GLN HE22 1.0 . 4.45 1006 794 A 25 ASN HBy A 25 ASN HD22 1.0 . 3.17 1007 794 A 25 ASN HBx A 25 ASN HD22 1.0 . 3.17 1008 794 A 25 ASN HD21 A 25 ASN HBy 1.0 . 3.17 1009 794 A 25 ASN HD21 A 25 ASN HBx 1.0 . 3.17 1010 795 A 26 GLN H A 25 ASN HBy 1.0 . 3.89 1011 795 A 26 GLN H A 25 ASN HBx 1.0 . 3.89 1012 796 A 26 GLN HE22 A 25 ASN HBx 1.0 . 4.22 1013 796 A 26 GLN HE21 A 25 ASN HBy 1.0 . 4.22 1014 796 A 26 GLN HE22 A 25 ASN HBy 1.0 . 4.22 1015 796 A 26 GLN HE21 A 25 ASN HBx 1.0 . 4.22 1016 797 A 48 THR HG2% A 25 ASN HBy 1.0 . 5.02 1017 797 A 48 THR HG2% A 25 ASN HBx 1.0 . 5.02 1018 798 A 26 GLN H A 25 ASN HD22 1.0 . 5.05 1019 798 A 26 GLN H A 25 ASN HD21 1.0 . 5.05 1020 799 A 26 GLN H A 26 GLN HGx 1.0 . 3.75 1021 799 A 26 GLN H A 26 GLN HGy 1.0 . 3.75 1022 800 A 26 GLN H A 106 LEU HDy% 1.0 . 5.12 1023 800 A 26 GLN H A 106 LEU HDx% 1.0 . 5.12 1024 801 A 26 GLN HA A 26 GLN HGx 1.0 . 3.56 1025 801 A 26 GLN HA A 26 GLN HGy 1.0 . 3.56 1026 802 A 26 GLN HA A 27 VAL HGy% 1.0 . 3.92 1027 802 A 26 GLN HA A 27 VAL HGx% 1.0 . 3.92 1028 803 A 26 GLN HA A 106 LEU HDy% 1.0 . 3.84 1029 803 A 26 GLN HA A 106 LEU HDx% 1.0 . 3.84 1030 804 A 26 GLN HE21 A 26 GLN HB2 1.0 . 4.52 1031 804 A 26 GLN HE22 A 26 GLN HB2 1.0 . 4.52 1032 804 A 26 GLN HB3 A 26 GLN HE21 1.0 . 4.52 1033 804 A 26 GLN HB3 A 26 GLN HE22 1.0 . 4.52 1034 805 A 27 VAL H A 26 GLN HGx 1.0 . 4.07 1035 805 A 27 VAL H A 26 GLN HGy 1.0 . 4.07 1036 806 A 48 THR H A 26 GLN HGx 1.0 . 4.26 1037 806 A 48 THR H A 26 GLN HGy 1.0 . 4.26 1038 807 A 48 THR HA A 26 GLN HGx 1.0 . 4.88 1039 807 A 48 THR HA A 26 GLN HGy 1.0 . 4.88 1040 808 A 48 THR HG2% A 26 GLN HGx 1.0 . 4.78 1041 808 A 48 THR HG2% A 26 GLN HGy 1.0 . 4.78 1042 809 A 48 THR H A 26 GLN HE21 1.0 . 5.06 1043 809 A 48 THR H A 26 GLN HE22 1.0 . 5.06 1044 810 A 26 GLN HE21 A 106 LEU HDx% 1.0 . 4.85 1045 810 A 26 GLN HE21 A 106 LEU HDy% 1.0 . 4.85 1046 810 A 26 GLN HE22 A 106 LEU HDx% 1.0 . 4.85 1047 810 A 26 GLN HE22 A 106 LEU HDy% 1.0 . 4.85 1048 811 A 27 VAL H A 27 VAL HGy% 1.0 . 3.05 1049 811 A 27 VAL H A 27 VAL HGx% 1.0 . 3.05 1050 812 A 27 VAL H A 106 LEU HDy% 1.0 . 4.09 1051 812 A 27 VAL H A 106 LEU HDx% 1.0 . 4.09 1052 813 A 27 VAL HA A 28 ARG HBx 1.0 . 4.21 1053 813 A 27 VAL HA A 28 ARG HBy 1.0 . 4.21 1054 814 A 28 ARG H A 27 VAL HGy% 1.0 . 3.54 1055 814 A 28 ARG H A 27 VAL HGx% 1.0 . 3.54 1056 815 A 28 ARG HA A 27 VAL HGy% 1.0 . 5.21 1057 815 A 28 ARG HA A 27 VAL HGx% 1.0 . 5.21 1058 816 A 27 VAL HGy% A 29 PRO HDy 1.0 . 4.71 1059 816 A 27 VAL HGx% A 29 PRO HDy 1.0 . 4.71 1060 816 A 29 PRO HDx A 27 VAL HGy% 1.0 . 4.71 1061 816 A 27 VAL HGx% A 29 PRO HDx 1.0 . 4.71 1062 817 A 27 VAL HGy% A 45 GLU HBx 1.0 . 3.84 1063 817 A 27 VAL HGx% A 45 GLU HBx 1.0 . 3.84 1064 817 A 45 GLU HBy A 27 VAL HGy% 1.0 . 3.84 1065 817 A 27 VAL HGx% A 45 GLU HBy 1.0 . 3.84 1066 818 A 47 PHE H A 27 VAL HGy% 1.0 . 4.28 1067 818 A 47 PHE H A 27 VAL HGx% 1.0 . 4.28 1068 819 A 47 PHE HD% A 27 VAL HGy% 1.0 . 4.39 1069 819 A 47 PHE HD% A 27 VAL HGx% 1.0 . 4.39 1070 820 A 48 THR HA A 27 VAL HGy% 1.0 . 4.67 1071 820 A 48 THR HA A 27 VAL HGx% 1.0 . 4.67 1072 821 A 102 LEU HA A 27 VAL HGy% 1.0 . 4.99 1073 821 A 102 LEU HA A 27 VAL HGx% 1.0 . 4.99 1074 822 A 27 VAL HGy% A 102 LEU HBy 1.0 . 4.12 1075 822 A 27 VAL HGx% A 102 LEU HBy 1.0 . 4.12 1076 822 A 102 LEU HBx A 27 VAL HGy% 1.0 . 4.12 1077 822 A 27 VAL HGx% A 102 LEU HBx 1.0 . 4.12 1078 823 A 105 ASN H A 27 VAL HGy% 1.0 . 4.52 1079 823 A 105 ASN H A 27 VAL HGx% 1.0 . 4.52 1080 824 A 105 ASN HA A 27 VAL HGy% 1.0 . 4.32 1081 824 A 27 VAL HGx% A 105 ASN HA 1.0 . 4.32 1082 825 A 27 VAL HGx% A 105 ASN HBy 1.0 . 3.11 1083 825 A 27 VAL HGy% A 105 ASN HBy 1.0 . 3.11 1084 825 A 105 ASN HBx A 27 VAL HGy% 1.0 . 3.11 1085 825 A 27 VAL HGx% A 105 ASN HBx 1.0 . 3.11 1086 826 A 28 ARG H A 28 ARG HBx 1.0 . 3.33 1087 826 A 28 ARG H A 28 ARG HBy 1.0 . 3.33 1088 827 A 28 ARG H A 45 GLU HBx 1.0 . 4.53 1089 827 A 28 ARG H A 45 GLU HBy 1.0 . 4.53 1090 828 A 28 ARG HA A 29 PRO HDy 1.0 . 3.19 1091 828 A 28 ARG HA A 29 PRO HDx 1.0 . 3.19 1092 829 A 28 ARG HA A 46 MET HGy 1.0 . 4.45 1093 829 A 28 ARG HA A 46 MET HGx 1.0 . 4.45 1094 830 A 28 ARG HBy A 28 ARG HD2 1.0 . 3.37 1095 830 A 28 ARG HBx A 28 ARG HD2 1.0 . 3.37 1096 830 A 28 ARG HD3 A 28 ARG HBx 1.0 . 3.37 1097 830 A 28 ARG HD3 A 28 ARG HBy 1.0 . 3.37 1098 831 A 28 ARG HBy A 46 MET HB2 1.0 . 3.45 1099 831 A 28 ARG HBx A 46 MET HB2 1.0 . 3.45 1100 831 A 46 MET HB3 A 28 ARG HBx 1.0 . 3.45 1101 831 A 46 MET HB3 A 28 ARG HBy 1.0 . 3.45 1102 832 A 28 ARG HGy A 29 PRO HDy 1.0 . 3.96 1103 832 A 28 ARG HGx A 29 PRO HDy 1.0 . 3.96 1104 832 A 29 PRO HDx A 28 ARG HGy 1.0 . 3.96 1105 832 A 28 ARG HGx A 29 PRO HDx 1.0 . 3.96 1106 833 A 28 ARG HD2 A 34 LEU HDx% 1.0 . 4.77 1107 833 A 28 ARG HD3 A 34 LEU HDx% 1.0 . 4.77 1108 833 A 34 LEU HDy% A 28 ARG HD2 1.0 . 4.77 1109 833 A 28 ARG HD3 A 34 LEU HDy% 1.0 . 4.77 1110 834 A 29 PRO HA A 33 LEU HBy 1.0 . 4.72 1111 834 A 29 PRO HA A 33 LEU HBx 1.0 . 4.72 1112 835 A 29 PRO HA A 33 LEU HDy% 1.0 . 3.31 1113 835 A 29 PRO HA A 33 LEU HDx% 1.0 . 3.31 1114 836 A 33 LEU H A 29 PRO HBy 1.0 . 4.38 1115 836 A 33 LEU H A 29 PRO HBx 1.0 . 4.38 1116 837 A 29 PRO HBx A 33 LEU HBy 1.0 . 4.14 1117 837 A 29 PRO HBy A 33 LEU HBy 1.0 . 4.14 1118 837 A 33 LEU HBx A 29 PRO HBy 1.0 . 4.14 1119 837 A 33 LEU HBx A 29 PRO HBx 1.0 . 4.14 1120 838 A 29 PRO HBx A 33 LEU HDy% 1.0 . 3.45 1121 838 A 33 LEU HDx% A 29 PRO HBy 1.0 . 3.45 1122 838 A 33 LEU HDx% A 29 PRO HBx 1.0 . 3.45 1123 838 A 29 PRO HBy A 33 LEU HDy% 1.0 . 3.45 1124 839 A 34 LEU H A 29 PRO HBy 1.0 . 4.24 1125 839 A 34 LEU H A 29 PRO HBx 1.0 . 4.24 1126 840 A 34 LEU HA A 29 PRO HBy 1.0 . 4.20 1127 840 A 34 LEU HA A 29 PRO HBx 1.0 . 4.20 1128 841 A 29 PRO HBx A 44 GLY HAx 1.0 . 4.22 1129 841 A 29 PRO HBy A 44 GLY HAx 1.0 . 4.22 1130 841 A 44 GLY HAy A 29 PRO HBy 1.0 . 4.22 1131 841 A 29 PRO HBx A 44 GLY HAy 1.0 . 4.22 1132 842 A 29 PRO HGy A 33 LEU HDy% 1.0 . 4.82 1133 842 A 29 PRO HGx A 33 LEU HDy% 1.0 . 4.82 1134 842 A 33 LEU HDx% A 29 PRO HGy 1.0 . 4.82 1135 842 A 29 PRO HGx A 33 LEU HDx% 1.0 . 4.82 1136 843 A 29 PRO HGx A 34 LEU HDx% 1.0 . 4.13 1137 843 A 29 PRO HGy A 34 LEU HDx% 1.0 . 4.13 1138 843 A 34 LEU HDy% A 29 PRO HGy 1.0 . 4.13 1139 843 A 29 PRO HGx A 34 LEU HDy% 1.0 . 4.13 1140 844 A 29 PRO HGx A 37 LEU HDy% 1.0 . 3.81 1141 844 A 29 PRO HGy A 37 LEU HDy% 1.0 . 3.81 1142 844 A 37 LEU HDx% A 29 PRO HGy 1.0 . 3.81 1143 844 A 29 PRO HGx A 37 LEU HDx% 1.0 . 3.81 1144 845 A 29 PRO HGx A 44 GLY HAx 1.0 . 3.92 1145 845 A 29 PRO HGy A 44 GLY HAx 1.0 . 3.92 1146 845 A 44 GLY HAy A 29 PRO HGy 1.0 . 3.92 1147 845 A 29 PRO HGx A 44 GLY HAy 1.0 . 3.92 1148 846 A 29 PRO HGy A 45 GLU HGx 1.0 . 3.70 1149 846 A 45 GLU HGy A 29 PRO HGy 1.0 . 3.70 1150 846 A 29 PRO HGx A 45 GLU HGy 1.0 . 3.70 1151 846 A 29 PRO HGx A 45 GLU HGx 1.0 . 3.70 1152 847 A 29 PRO HDx A 34 LEU HDx% 1.0 . 4.19 1153 847 A 29 PRO HDy A 34 LEU HDx% 1.0 . 4.19 1154 847 A 34 LEU HDy% A 29 PRO HDy 1.0 . 4.19 1155 847 A 29 PRO HDx A 34 LEU HDy% 1.0 . 4.19 1156 848 A 29 PRO HDy A 45 GLU HGx 1.0 . 4.55 1157 848 A 29 PRO HDx A 45 GLU HGx 1.0 . 4.55 1158 848 A 45 GLU HGy A 29 PRO HDy 1.0 . 4.55 1159 848 A 29 PRO HDx A 45 GLU HGy 1.0 . 4.55 1160 849 A 30 LYS H A 34 LEU HDx% 1.0 . 5.03 1161 849 A 30 LYS H A 34 LEU HDy% 1.0 . 5.03 1162 850 A 31 LEU H A 30 LYS HBy 1.0 . 3.96 1163 850 A 31 LEU H A 30 LYS HBx 1.0 . 3.96 1164 851 A 30 LYS HBy A 32 PRO HDx 1.0 . 4.75 1165 851 A 30 LYS HBx A 32 PRO HDx 1.0 . 4.75 1166 851 A 32 PRO HDy A 30 LYS HBy 1.0 . 4.75 1167 851 A 30 LYS HBx A 32 PRO HDy 1.0 . 4.75 1168 852 A 30 LYS HE3 A 31 LEU HD1% 1.0 . 3.90 1169 852 A 30 LYS HE2 A 31 LEU HD1% 1.0 . 3.90 1170 852 A 31 LEU HD21 A 30 LYS HE2 1.0 . 3.90 1171 852 A 30 LYS HE3 A 31 LEU HD21 1.0 . 3.90 1172 853 A 30 LYS HE3 A 32 PRO HGy 1.0 . 4.48 1173 853 A 30 LYS HE2 A 32 PRO HGy 1.0 . 4.48 1174 853 A 32 PRO HGx A 30 LYS HE2 1.0 . 4.48 1175 853 A 30 LYS HE3 A 32 PRO HGx 1.0 . 4.48 1176 854 A 31 LEU H A 31 LEU HD1% 1.0 . 3.69 1177 854 A 31 LEU H A 31 LEU HD21 1.0 . 3.69 1178 855 A 31 LEU H A 32 PRO HDx 1.0 . 3.70 1179 855 A 31 LEU H A 32 PRO HDy 1.0 . 3.70 1180 856 A 31 LEU HA A 34 LEU HBy 1.0 . 3.37 1181 856 A 31 LEU HA A 34 LEU HBx 1.0 . 3.37 1182 857 A 31 LEU HB2 A 32 PRO HDx 1.0 . 2.94 1183 857 A 31 LEU HB3 A 32 PRO HDx 1.0 . 2.94 1184 857 A 32 PRO HDy A 31 LEU HB2 1.0 . 2.94 1185 857 A 31 LEU HB3 A 32 PRO HDy 1.0 . 2.94 1186 858 A 31 LEU HG A 32 PRO HDx 1.0 . 5.07 1187 858 A 31 LEU HG A 32 PRO HDy 1.0 . 5.07 1188 859 A 31 LEU HD21 A 32 PRO HDx 1.0 . 4.07 1189 859 A 31 LEU HD1% A 32 PRO HDx 1.0 . 4.07 1190 859 A 32 PRO HDy A 31 LEU HD1% 1.0 . 4.07 1191 859 A 32 PRO HDy A 31 LEU HD21 1.0 . 4.07 1192 860 A 32 PRO HA A 33 LEU HDy% 1.0 . 5.10 1193 860 A 32 PRO HA A 33 LEU HDx% 1.0 . 5.10 1194 861 A 33 LEU H A 32 PRO HBx 1.0 . 3.70 1195 861 A 33 LEU H A 32 PRO HBy 1.0 . 3.70 1196 862 A 32 PRO HBx A 33 LEU HDy% 1.0 . 3.68 1197 862 A 32 PRO HBy A 33 LEU HDy% 1.0 . 3.68 1198 862 A 33 LEU HDx% A 32 PRO HBx 1.0 . 3.68 1199 862 A 33 LEU HDx% A 32 PRO HBy 1.0 . 3.68 1200 863 A 35 LYS H A 32 PRO HBx 1.0 . 5.19 1201 863 A 35 LYS H A 32 PRO HBy 1.0 . 5.19 1202 864 A 32 PRO HBy A 80 LEU HD1% 1.0 . 4.23 1203 864 A 80 LEU HD2% A 32 PRO HBx 1.0 . 4.23 1204 864 A 80 LEU HD2% A 32 PRO HBy 1.0 . 4.23 1205 864 A 32 PRO HBx A 80 LEU HD1% 1.0 . 4.23 1206 865 A 33 LEU H A 32 PRO HGy 1.0 . 4.23 1207 865 A 33 LEU H A 32 PRO HGx 1.0 . 4.23 1208 866 A 32 PRO HGx A 33 LEU HDy% 1.0 . 4.38 1209 866 A 32 PRO HGy A 33 LEU HDy% 1.0 . 4.38 1210 866 A 33 LEU HDx% A 32 PRO HGy 1.0 . 4.38 1211 866 A 33 LEU HDx% A 32 PRO HGx 1.0 . 4.38 1212 867 A 33 LEU H A 32 PRO HDx 1.0 . 3.78 1213 867 A 33 LEU H A 32 PRO HDy 1.0 . 3.78 1214 868 A 32 PRO HDx A 33 LEU HDy% 1.0 . 4.92 1215 868 A 32 PRO HDy A 33 LEU HDy% 1.0 . 4.92 1216 868 A 33 LEU HDx% A 32 PRO HDx 1.0 . 4.92 1217 868 A 33 LEU HDx% A 32 PRO HDy 1.0 . 4.92 1218 869 A 33 LEU H A 33 LEU HBy 1.0 . 3.13 1219 869 A 33 LEU H A 33 LEU HBx 1.0 . 3.13 1220 870 A 33 LEU H A 33 LEU HDy% 1.0 . 3.76 1221 870 A 33 LEU H A 33 LEU HDx% 1.0 . 3.76 1222 871 A 33 LEU HA A 33 LEU HDy% 1.0 . 3.16 1223 871 A 33 LEU HA A 33 LEU HDx% 1.0 . 3.16 1224 872 A 33 LEU HA A 36 ILE HG1y 1.0 . 4.64 1225 872 A 33 LEU HA A 36 ILE HG1x 1.0 . 4.64 1226 873 A 34 LEU H A 33 LEU HBy 1.0 . 3.41 1227 873 A 34 LEU H A 33 LEU HBx 1.0 . 3.41 1228 874 A 34 LEU H A 33 LEU HDy% 1.0 . 4.53 1229 874 A 34 LEU H A 33 LEU HDx% 1.0 . 4.53 1230 875 A 34 LEU H A 34 LEU HDx% 1.0 . 4.01 1231 875 A 34 LEU H A 34 LEU HDy% 1.0 . 4.01 1232 876 A 34 LEU HA A 34 LEU HDx% 1.0 . 3.06 1233 876 A 34 LEU HA A 34 LEU HDy% 1.0 . 3.06 1234 877 A 34 LEU HA A 37 LEU HBy 1.0 . 3.73 1235 877 A 34 LEU HA A 37 LEU HBx 1.0 . 3.73 1236 878 A 34 LEU HA A 37 LEU HDy% 1.0 . 3.91 1237 878 A 34 LEU HA A 37 LEU HDx% 1.0 . 3.91 1238 879 A 35 LYS H A 34 LEU HBy 1.0 . 3.51 1239 879 A 35 LYS H A 34 LEU HBx 1.0 . 3.51 1240 880 A 35 LYS H A 34 LEU HDx% 1.0 . 3.95 1241 880 A 35 LYS H A 34 LEU HDy% 1.0 . 3.95 1242 881 A 35 LYS HA A 34 LEU HDx% 1.0 . 4.43 1243 881 A 35 LYS HA A 34 LEU HDy% 1.0 . 4.43 1244 882 A 34 LEU HDx% A 35 LYS HD2 1.0 . 4.17 1245 882 A 35 LYS HD3 A 34 LEU HDx% 1.0 . 4.17 1246 882 A 35 LYS HD3 A 34 LEU HDy% 1.0 . 4.17 1247 882 A 34 LEU HDy% A 35 LYS HD2 1.0 . 4.17 1248 883 A 37 LEU H A 34 LEU HDx% 1.0 . 5.44 1249 883 A 37 LEU H A 34 LEU HDy% 1.0 . 5.44 1250 884 A 34 LEU HDy% A 37 LEU HBy 1.0 . 4.31 1251 884 A 34 LEU HDx% A 37 LEU HBy 1.0 . 4.31 1252 884 A 37 LEU HBx A 34 LEU HDx% 1.0 . 4.31 1253 884 A 34 LEU HDy% A 37 LEU HBx 1.0 . 4.31 1254 885 A 38 HIS H A 34 LEU HDx% 1.0 . 4.89 1255 885 A 38 HIS H A 34 LEU HDy% 1.0 . 4.89 1256 886 A 38 HIS HD2 A 34 LEU HDx% 1.0 . 4.20 1257 886 A 38 HIS HD2 A 34 LEU HDy% 1.0 . 4.20 1258 887 A 43 GLN HA A 34 LEU HDx% 1.0 . 4.21 1259 887 A 43 GLN HA A 34 LEU HDy% 1.0 . 4.21 1260 888 A 36 ILE H A 36 ILE HG1y 1.0 . 3.35 1261 888 A 36 ILE H A 36 ILE HG1x 1.0 . 3.35 1262 889 A 36 ILE HA A 36 ILE HG1y 1.0 . 3.34 1263 889 A 36 ILE HA A 36 ILE HG1x 1.0 . 3.34 1264 890 A 36 ILE HG2% A 36 ILE HG1y 1.0 . 3.18 1265 890 A 36 ILE HG2% A 36 ILE HG1x 1.0 . 3.18 1266 891 A 36 ILE HG2% A 37 LEU HDy% 1.0 . 4.29 1267 891 A 36 ILE HG2% A 37 LEU HDx% 1.0 . 4.29 1268 892 A 36 ILE HG2% A 81 LEU HDy% 1.0 . 3.95 1269 892 A 36 ILE HG2% A 81 LEU HDx% 1.0 . 3.95 1270 893 A 36 ILE HG2% A 84 LEU HDx% 1.0 . 4.17 1271 893 A 36 ILE HG2% A 84 LEU HDy% 1.0 . 4.17 1272 894 A 37 LEU H A 36 ILE HG1y 1.0 . 4.88 1273 894 A 37 LEU H A 36 ILE HG1x 1.0 . 4.88 1274 895 A 36 ILE HD1% A 80 LEU HBy 1.0 . 3.47 1275 895 A 36 ILE HD1% A 80 LEU HBx 1.0 . 3.47 1276 896 A 36 ILE HD1% A 83 GLU HGx 1.0 . 4.98 1277 896 A 36 ILE HD1% A 83 GLU HGy 1.0 . 4.98 1278 897 A 36 ILE HD1% A 84 LEU HBy 1.0 . 3.92 1279 897 A 36 ILE HD1% A 84 LEU HBx 1.0 . 3.92 1280 898 A 36 ILE HD1% A 84 LEU HDx% 1.0 . 2.90 1281 898 A 36 ILE HD1% A 84 LEU HDy% 1.0 . 2.90 1282 899 A 37 LEU H A 37 LEU HBy 1.0 . 3.21 1283 899 A 37 LEU H A 37 LEU HBx 1.0 . 3.21 1284 900 A 37 LEU H A 37 LEU HDy% 1.0 . 3.57 1285 900 A 37 LEU H A 37 LEU HDx% 1.0 . 3.57 1286 901 A 37 LEU HA A 37 LEU HDy% 1.0 . 3.18 1287 901 A 37 LEU HA A 37 LEU HDx% 1.0 . 3.18 1288 902 A 37 LEU HA A 55 TYR HBy 1.0 . 4.58 1289 902 A 37 LEU HA A 55 TYR HBx 1.0 . 4.58 1290 903 A 38 HIS H A 37 LEU HBy 1.0 . 3.39 1291 903 A 38 HIS H A 37 LEU HBx 1.0 . 3.39 1292 904 A 38 HIS HD2 A 37 LEU HBy 1.0 . 4.58 1293 904 A 38 HIS HD2 A 37 LEU HBx 1.0 . 4.58 1294 905 A 42 ALA H A 37 LEU HBy 1.0 . 5.18 1295 905 A 42 ALA H A 37 LEU HBx 1.0 . 5.18 1296 906 A 38 HIS H A 37 LEU HDy% 1.0 . 4.96 1297 906 A 38 HIS H A 37 LEU HDx% 1.0 . 4.96 1298 907 A 40 ALA H A 37 LEU HDy% 1.0 . 5.44 1299 907 A 40 ALA H A 37 LEU HDx% 1.0 . 5.44 1300 908 A 40 ALA HB% A 37 LEU HDy% 1.0 . 5.17 1301 908 A 40 ALA HB% A 37 LEU HDx% 1.0 . 5.17 1302 909 A 52 VAL HA A 37 LEU HDy% 1.0 . 3.64 1303 909 A 52 VAL HA A 37 LEU HDx% 1.0 . 3.64 1304 910 A 37 LEU HDx% A 52 VAL HGy% 1.0 . 3.69 1305 910 A 37 LEU HDy% A 52 VAL HGy% 1.0 . 3.69 1306 910 A 52 VAL HGx% A 37 LEU HDy% 1.0 . 3.69 1307 910 A 37 LEU HDx% A 52 VAL HGx% 1.0 . 3.69 1308 911 A 55 TYR H A 37 LEU HDy% 1.0 . 4.79 1309 911 A 55 TYR H A 37 LEU HDx% 1.0 . 4.79 1310 912 A 55 TYR HA A 37 LEU HDy% 1.0 . 4.80 1311 912 A 55 TYR HA A 37 LEU HDx% 1.0 . 4.80 1312 913 A 37 LEU HDx% A 55 TYR HBy 1.0 . 3.18 1313 913 A 37 LEU HDy% A 55 TYR HBy 1.0 . 3.18 1314 913 A 55 TYR HBx A 37 LEU HDy% 1.0 . 3.18 1315 913 A 37 LEU HDx% A 55 TYR HBx 1.0 . 3.18 1316 914 A 55 TYR HD% A 37 LEU HDy% 1.0 . 4.22 1317 914 A 55 TYR HD% A 37 LEU HDx% 1.0 . 4.22 1318 915 A 56 LEU H A 37 LEU HDy% 1.0 . 3.92 1319 915 A 37 LEU HDx% A 56 LEU H 1.0 . 3.92 1320 916 A 40 ALA H A 59 TYR HBy 1.0 . 4.74 1321 916 A 40 ALA H A 59 TYR HBx 1.0 . 4.74 1322 917 A 40 ALA HA A 58 GLN HE21 1.0 . 5.16 1323 917 A 58 GLN HE22 A 40 ALA HA 1.0 . 5.16 1324 918 A 40 ALA HA A 62 VAL HGy% 1.0 . 3.77 1325 918 A 40 ALA HA A 62 VAL HGx% 1.0 . 3.77 1326 919 A 40 ALA HB% A 55 TYR HBy 1.0 . 3.59 1327 919 A 40 ALA HB% A 55 TYR HBx 1.0 . 3.59 1328 920 A 40 ALA HB% A 58 GLN HE21 1.0 . 4.27 1329 920 A 58 GLN HE22 A 40 ALA HB% 1.0 . 4.27 1330 921 A 40 ALA HB% A 59 TYR HBy 1.0 . 3.59 1331 921 A 40 ALA HB% A 59 TYR HBx 1.0 . 3.59 1332 922 A 40 ALA HB% A 62 VAL HGy% 1.0 . 4.78 1333 922 A 40 ALA HB% A 62 VAL HGx% 1.0 . 4.78 1334 923 A 58 GLN HE21 A 41 GLY HAy 1.0 . 4.62 1335 923 A 58 GLN HE21 A 41 GLY HAx 1.0 . 4.62 1336 923 A 58 GLN HE22 A 41 GLY HAy 1.0 . 4.62 1337 923 A 58 GLN HE22 A 41 GLY HAx 1.0 . 4.62 1338 924 A 42 ALA H A 58 GLN HE21 1.0 . 4.73 1339 924 A 58 GLN HE22 A 42 ALA H 1.0 . 4.73 1340 925 A 42 ALA HA A 58 GLN HE21 1.0 . 4.09 1341 925 A 58 GLN HE22 A 42 ALA HA 1.0 . 4.09 1342 926 A 43 GLN HA A 44 GLY HAx 1.0 . 4.55 1343 926 A 43 GLN HA A 44 GLY HAy 1.0 . 4.55 1344 927 A 47 PHE HE% A 43 GLN HE21 1.0 . 4.67 1345 927 A 47 PHE HE% A 43 GLN HE22 1.0 . 4.67 1346 928 A 45 GLU H A 44 GLY HAx 1.0 . 3.06 1347 928 A 45 GLU H A 44 GLY HAy 1.0 . 3.06 1348 929 A 44 GLY HAy A 45 GLU HGx 1.0 . 4.28 1349 929 A 44 GLY HAx A 45 GLU HGx 1.0 . 4.28 1350 929 A 45 GLU HGy A 44 GLY HAx 1.0 . 4.28 1351 929 A 44 GLY HAy A 45 GLU HGy 1.0 . 4.28 1352 930 A 46 MET H A 44 GLY HAx 1.0 . 4.02 1353 930 A 46 MET H A 44 GLY HAy 1.0 . 4.02 1354 931 A 45 GLU H A 45 GLU HBx 1.0 . 3.64 1355 931 A 45 GLU H A 45 GLU HBy 1.0 . 3.64 1356 932 A 45 GLU H A 45 GLU HGx 1.0 . 3.65 1357 932 A 45 GLU H A 45 GLU HGy 1.0 . 3.65 1358 933 A 45 GLU HA A 45 GLU HGx 1.0 . 3.31 1359 933 A 45 GLU HA A 45 GLU HGy 1.0 . 3.31 1360 934 A 46 MET H A 45 GLU HBx 1.0 . 4.18 1361 934 A 46 MET H A 45 GLU HBy 1.0 . 4.18 1362 935 A 47 PHE HE% A 45 GLU HBx 1.0 . 4.44 1363 935 A 47 PHE HE% A 45 GLU HBy 1.0 . 4.44 1364 936 A 46 MET HA A 46 MET HGy 1.0 . 3.57 1365 936 A 46 MET HA A 46 MET HGx 1.0 . 3.57 1366 937 A 47 PHE H A 47 PHE HBx 1.0 . 3.55 1367 937 A 47 PHE H A 47 PHE HBy 1.0 . 3.55 1368 938 A 47 PHE HA A 51 GLU HBx 1.0 . 4.46 1369 938 A 47 PHE HA A 51 GLU HBy 1.0 . 4.46 1370 939 A 48 THR H A 47 PHE HBx 1.0 . 3.41 1371 939 A 48 THR H A 47 PHE HBy 1.0 . 3.41 1372 940 A 51 GLU H A 47 PHE HBx 1.0 . 5.05 1373 940 A 51 GLU H A 47 PHE HBy 1.0 . 5.05 1374 941 A 47 PHE HBx A 51 GLU HBx 1.0 . 3.50 1375 941 A 47 PHE HBy A 51 GLU HBx 1.0 . 3.50 1376 941 A 51 GLU HBy A 47 PHE HBx 1.0 . 3.50 1377 941 A 47 PHE HBy A 51 GLU HBy 1.0 . 3.50 1378 942 A 52 VAL H A 47 PHE HBx 1.0 . 4.60 1379 942 A 52 VAL H A 47 PHE HBy 1.0 . 4.60 1380 943 A 55 TYR HE% A 47 PHE HBx 1.0 . 4.38 1381 943 A 55 TYR HE% A 47 PHE HBy 1.0 . 4.38 1382 944 A 47 PHE HD% A 51 GLU HBx 1.0 . 4.41 1383 944 A 47 PHE HD% A 51 GLU HBy 1.0 . 4.41 1384 945 A 47 PHE HE% A 51 GLU HBx 1.0 . 4.98 1385 945 A 47 PHE HE% A 51 GLU HBy 1.0 . 4.98 1386 946 A 47 PHE HE% A 52 VAL HGy% 1.0 . 3.63 1387 946 A 47 PHE HE% A 52 VAL HGx% 1.0 . 3.63 1388 947 A 48 THR H A 51 GLU HBx 1.0 . 3.45 1389 947 A 48 THR H A 51 GLU HBy 1.0 . 3.45 1390 948 A 48 THR H A 51 GLU HGx 1.0 . 4.74 1391 948 A 48 THR H A 51 GLU HGy 1.0 . 4.74 1392 949 A 48 THR HA A 49 VAL HGy% 1.0 . 4.22 1393 949 A 48 THR HA A 49 VAL HGx% 1.0 . 4.22 1394 950 A 48 THR HB A 49 VAL HGy% 1.0 . 4.54 1395 950 A 48 THR HB A 49 VAL HGx% 1.0 . 4.54 1396 951 A 48 THR HB A 50 LYS HEx 1.0 . 3.02 1397 951 A 48 THR HB A 50 LYS HEy 1.0 . 3.02 1398 952 A 48 THR HB A 51 GLU HBx 1.0 . 4.70 1399 952 A 48 THR HB A 51 GLU HBy 1.0 . 4.70 1400 953 A 48 THR HG2% A 50 LYS HEx 1.0 . 3.93 1401 953 A 48 THR HG2% A 50 LYS HEy 1.0 . 3.93 1402 954 A 49 VAL H A 49 VAL HGy% 1.0 . 2.91 1403 954 A 49 VAL H A 49 VAL HGx% 1.0 . 2.91 1404 955 A 49 VAL H A 52 VAL HGy% 1.0 . 4.19 1405 955 A 49 VAL H A 52 VAL HGx% 1.0 . 4.19 1406 956 A 49 VAL HA A 49 VAL HGy% 1.0 . 2.96 1407 956 A 49 VAL HA A 49 VAL HGx% 1.0 . 2.96 1408 957 A 49 VAL HA A 52 VAL HGy% 1.0 . 3.12 1409 957 A 49 VAL HA A 52 VAL HGx% 1.0 . 3.12 1410 958 A 50 LYS H A 49 VAL HGy% 1.0 . 4.42 1411 958 A 50 LYS H A 49 VAL HGx% 1.0 . 4.42 1412 959 A 53 MET H A 49 VAL HGy% 1.0 . 3.67 1413 959 A 53 MET H A 49 VAL HGx% 1.0 . 3.67 1414 960 A 99 TYR HD% A 49 VAL HGy% 1.0 . 4.62 1415 960 A 99 TYR HD% A 49 VAL HGx% 1.0 . 4.62 1416 961 A 99 TYR HE% A 49 VAL HGy% 1.0 . 3.94 1417 961 A 99 TYR HE% A 49 VAL HGx% 1.0 . 3.94 1418 962 A 108 THR HG2% A 49 VAL HGy% 1.0 . 3.89 1419 962 A 108 THR HG2% A 49 VAL HGx% 1.0 . 3.89 1420 963 A 50 LYS H A 50 LYS HEx 1.0 . 5.34 1421 963 A 50 LYS H A 50 LYS HEy 1.0 . 5.34 1422 964 A 50 LYS H A 52 VAL HGy% 1.0 . 4.55 1423 964 A 50 LYS H A 52 VAL HGx% 1.0 . 4.55 1424 965 A 50 LYS HA A 52 VAL HGy% 1.0 . 4.14 1425 965 A 50 LYS HA A 52 VAL HGx% 1.0 . 4.14 1426 966 A 50 LYS HA A 53 MET HBx 1.0 . 4.32 1427 966 A 50 LYS HA A 53 MET HBy 1.0 . 4.32 1428 967 A 50 LYS HEx A 50 LYS HGy 1.0 . 3.14 1429 967 A 50 LYS HEy A 50 LYS HGy 1.0 . 3.14 1430 967 A 50 LYS HGx A 50 LYS HEx 1.0 . 3.14 1431 967 A 50 LYS HEy A 50 LYS HGx 1.0 . 3.14 1432 968 A 51 GLU H A 50 LYS HGy 1.0 . 4.54 1433 968 A 51 GLU H A 50 LYS HGx 1.0 . 4.54 1434 969 A 51 GLU H A 51 GLU HBx 1.0 . 3.14 1435 969 A 51 GLU H A 51 GLU HBy 1.0 . 3.14 1436 970 A 51 GLU H A 51 GLU HGx 1.0 . 3.32 1437 970 A 51 GLU H A 51 GLU HGy 1.0 . 3.32 1438 971 A 51 GLU H A 52 VAL HGy% 1.0 . 3.83 1439 971 A 51 GLU H A 52 VAL HGx% 1.0 . 3.83 1440 972 A 51 GLU HA A 54 HIS HBx 1.0 . 3.11 1441 972 A 51 GLU HA A 54 HIS HBy 1.0 . 3.11 1442 973 A 52 VAL HA A 51 GLU HBx 1.0 . 4.63 1443 973 A 52 VAL HA A 51 GLU HBy 1.0 . 4.63 1444 974 A 54 HIS HD2 A 51 GLU HBx 1.0 . 4.84 1445 974 A 51 GLU HBy A 54 HIS HD2 1.0 . 4.84 1446 975 A 55 TYR HE% A 51 GLU HGx 1.0 . 4.90 1447 975 A 55 TYR HE% A 51 GLU HGy 1.0 . 4.90 1448 976 A 52 VAL H A 52 VAL HGy% 1.0 . 3.16 1449 976 A 52 VAL H A 52 VAL HGx% 1.0 . 3.16 1450 977 A 52 VAL HA A 52 VAL HGy% 1.0 . 2.96 1451 977 A 52 VAL HA A 52 VAL HGx% 1.0 . 2.96 1452 978 A 52 VAL HA A 55 TYR HBy 1.0 . 4.56 1453 978 A 52 VAL HA A 55 TYR HBx 1.0 . 4.56 1454 979 A 53 MET H A 52 VAL HGy% 1.0 . 3.10 1455 979 A 53 MET H A 52 VAL HGx% 1.0 . 3.10 1456 980 A 53 MET HA A 52 VAL HGy% 1.0 . 4.17 1457 980 A 52 VAL HGx% A 53 MET HA 1.0 . 4.17 1458 981 A 52 VAL HGx% A 53 MET HBx 1.0 . 3.83 1459 981 A 53 MET HBy A 52 VAL HGy% 1.0 . 3.83 1460 981 A 52 VAL HGx% A 53 MET HBy 1.0 . 3.83 1461 981 A 52 VAL HGy% A 53 MET HBx 1.0 . 3.83 1462 982 A 55 TYR H A 52 VAL HGy% 1.0 . 5.44 1463 982 A 55 TYR H A 52 VAL HGx% 1.0 . 5.44 1464 983 A 55 TYR HD% A 52 VAL HGy% 1.0 . 4.50 1465 983 A 55 TYR HD% A 52 VAL HGx% 1.0 . 4.50 1466 984 A 55 TYR HE% A 52 VAL HGy% 1.0 . 4.62 1467 984 A 55 TYR HE% A 52 VAL HGx% 1.0 . 4.62 1468 985 A 52 VAL HGx% A 102 LEU HDx% 1.0 . 3.32 1469 985 A 52 VAL HGy% A 102 LEU HDx% 1.0 . 3.32 1470 985 A 102 LEU HDy% A 52 VAL HGy% 1.0 . 3.32 1471 985 A 102 LEU HDy% A 52 VAL HGx% 1.0 . 3.32 1472 986 A 53 MET H A 53 MET HBx 1.0 . 3.23 1473 986 A 53 MET H A 53 MET HBy 1.0 . 3.23 1474 987 A 53 MET H A 53 MET HGy 1.0 . 3.39 1475 987 A 53 MET H A 53 MET HGx 1.0 . 3.39 1476 988 A 53 MET HE% A 53 MET HBx 1.0 . 4.45 1477 988 A 53 MET HE% A 53 MET HBy 1.0 . 4.45 1478 989 A 53 MET HBy A 102 LEU HDx% 1.0 . 4.68 1479 989 A 102 LEU HDy% A 53 MET HBx 1.0 . 4.68 1480 989 A 102 LEU HDy% A 53 MET HBy 1.0 . 4.68 1481 989 A 53 MET HBx A 102 LEU HDx% 1.0 . 4.68 1482 990 A 54 HIS H A 53 MET HGy 1.0 . 4.24 1483 990 A 54 HIS H A 53 MET HGx 1.0 . 4.24 1484 991 A 54 HIS HA A 53 MET HGy 1.0 . 4.60 1485 991 A 53 MET HGx A 54 HIS HA 1.0 . 4.60 1486 992 A 55 TYR H A 53 MET HGy 1.0 . 5.22 1487 992 A 55 TYR H A 53 MET HGx 1.0 . 5.22 1488 993 A 54 HIS H A 54 HIS HBx 1.0 . 3.17 1489 993 A 54 HIS H A 54 HIS HBy 1.0 . 3.17 1490 994 A 55 TYR H A 54 HIS HBx 1.0 . 3.33 1491 994 A 55 TYR H A 54 HIS HBy 1.0 . 3.33 1492 995 A 54 HIS HE1 A 58 GLN HE21 1.0 . 4.52 1493 995 A 58 GLN HE22 A 54 HIS HE1 1.0 . 4.52 1494 996 A 55 TYR H A 55 TYR HBy 1.0 . 3.28 1495 996 A 55 TYR H A 55 TYR HBx 1.0 . 3.28 1496 997 A 55 TYR H A 58 GLN HE21 1.0 . 4.92 1497 997 A 55 TYR H A 58 GLN HE22 1.0 . 4.92 1498 998 A 58 GLN HE22 A 55 TYR HBy 1.0 . 4.67 1499 998 A 58 GLN HE21 A 55 TYR HBx 1.0 . 4.67 1500 998 A 58 GLN HE21 A 55 TYR HBy 1.0 . 4.67 1501 998 A 58 GLN HE22 A 55 TYR HBx 1.0 . 4.67 1502 999 A 55 TYR HD% A 58 GLN HE21 1.0 . 3.77 1503 999 A 55 TYR HD% A 58 GLN HE22 1.0 . 3.77 1504 1000 A 90 PHE HZ A 56 LEU HD11 1.0 . 3.70 1505 1000 A 90 PHE HZ A 56 LEU HD21 1.0 . 3.70 1506 1001 A 58 GLN H A 59 TYR HBy 1.0 . 4.65 1507 1001 A 58 GLN H A 59 TYR HBx 1.0 . 4.65 1508 1002 A 58 GLN HG3 A 58 GLN HE21 1.0 . 3.39 1509 1002 A 58 GLN HE22 A 58 GLN HG2 1.0 . 3.39 1510 1002 A 58 GLN HE22 A 58 GLN HG3 1.0 . 3.39 1511 1002 A 58 GLN HE21 A 58 GLN HG2 1.0 . 3.39 1512 1003 A 58 GLN HG3 A 59 TYR HBy 1.0 . 4.86 1513 1003 A 58 GLN HG2 A 59 TYR HBy 1.0 . 4.86 1514 1003 A 59 TYR HBx A 58 GLN HG2 1.0 . 4.86 1515 1003 A 58 GLN HG3 A 59 TYR HBx 1.0 . 4.86 1516 1004 A 59 TYR HA A 62 VAL HGy% 1.0 . 4.54 1517 1004 A 59 TYR HA A 62 VAL HGx% 1.0 . 4.54 1518 1005 A 60 ILE H A 59 TYR HBy 1.0 . 3.60 1519 1005 A 60 ILE H A 59 TYR HBx 1.0 . 3.60 1520 1006 A 59 TYR HBy A 60 ILE HG1x 1.0 . 4.65 1521 1006 A 59 TYR HBx A 60 ILE HG1x 1.0 . 4.65 1522 1006 A 60 ILE HG1y A 59 TYR HBy 1.0 . 4.65 1523 1006 A 59 TYR HBx A 60 ILE HG1y 1.0 . 4.65 1524 1007 A 59 TYR HD% A 60 ILE HG1x 1.0 . 4.57 1525 1007 A 59 TYR HD% A 60 ILE HG1y 1.0 . 4.57 1526 1008 A 59 TYR HD% A 63 LYS HDx 1.0 . 4.47 1527 1008 A 59 TYR HD% A 63 LYS HDy 1.0 . 4.47 1528 1009 A 59 TYR HD% A 81 LEU HDy% 1.0 . 4.05 1529 1009 A 59 TYR HD% A 81 LEU HDx% 1.0 . 4.05 1530 1010 A 59 TYR HE% A 63 LYS HDx 1.0 . 4.75 1531 1010 A 59 TYR HE% A 63 LYS HDy 1.0 . 4.75 1532 1011 A 59 TYR HE% A 81 LEU HBy 1.0 . 3.87 1533 1011 A 59 TYR HE% A 81 LEU HBx 1.0 . 3.87 1534 1012 A 59 TYR HE% A 81 LEU HDy% 1.0 . 4.03 1535 1012 A 59 TYR HE% A 81 LEU HDx% 1.0 . 4.03 1536 1013 A 60 ILE H A 60 ILE HG1x 1.0 . 3.84 1537 1013 A 60 ILE H A 60 ILE HG1y 1.0 . 3.84 1538 1014 A 60 ILE HA A 60 ILE HG1x 1.0 . 3.24 1539 1014 A 60 ILE HA A 60 ILE HG1y 1.0 . 3.24 1540 1015 A 60 ILE HA A 65 LEU HBy 1.0 . 4.01 1541 1015 A 60 ILE HA A 65 LEU HBx 1.0 . 4.01 1542 1016 A 60 ILE HG2% A 65 LEU HBy 1.0 . 4.36 1543 1016 A 60 ILE HG2% A 65 LEU HBx 1.0 . 4.36 1544 1017 A 90 PHE HZ A 60 ILE HG1x 1.0 . 4.22 1545 1017 A 90 PHE HZ A 60 ILE HG1y 1.0 . 4.22 1546 1018 A 66 TYR HE% A 61 MET HB2 1.0 . 4.71 1547 1018 A 61 MET HB3 A 66 TYR HE% 1.0 . 4.71 1548 1019 A 61 MET HB3 A 62 VAL HGy% 1.0 . 5.24 1549 1019 A 61 MET HB2 A 62 VAL HGy% 1.0 . 5.24 1550 1019 A 62 VAL HGx% A 61 MET HB2 1.0 . 5.24 1551 1019 A 61 MET HB3 A 62 VAL HGx% 1.0 . 5.24 1552 1020 A 62 VAL H A 62 VAL HGy% 1.0 . 3.08 1553 1020 A 62 VAL H A 62 VAL HGx% 1.0 . 3.08 1554 1021 A 62 VAL H A 63 LYS HDx 1.0 . 5.14 1555 1021 A 62 VAL H A 63 LYS HDy 1.0 . 5.14 1556 1022 A 62 VAL HA A 62 VAL HGy% 1.0 . 2.58 1557 1022 A 62 VAL HA A 62 VAL HGx% 1.0 . 2.58 1558 1023 A 62 VAL HB A 63 LYS HDx 1.0 . 4.61 1559 1023 A 62 VAL HB A 63 LYS HDy 1.0 . 4.61 1560 1024 A 63 LYS H A 62 VAL HGy% 1.0 . 3.32 1561 1024 A 63 LYS H A 62 VAL HGx% 1.0 . 3.32 1562 1025 A 63 LYS HA A 62 VAL HGy% 1.0 . 3.48 1563 1025 A 63 LYS HA A 62 VAL HGx% 1.0 . 3.48 1564 1026 A 62 VAL HGy% A 63 LYS HDx 1.0 . 3.35 1565 1026 A 62 VAL HGx% A 63 LYS HDx 1.0 . 3.35 1566 1026 A 63 LYS HDy A 62 VAL HGy% 1.0 . 3.35 1567 1026 A 62 VAL HGx% A 63 LYS HDy 1.0 . 3.35 1568 1027 A 62 VAL HGy% A 63 LYS HE2 1.0 . 5.19 1569 1027 A 62 VAL HGx% A 63 LYS HE2 1.0 . 5.19 1570 1027 A 63 LYS HE3 A 62 VAL HGy% 1.0 . 5.19 1571 1027 A 63 LYS HE3 A 62 VAL HGx% 1.0 . 5.19 1572 1028 A 64 GLN H A 62 VAL HGy% 1.0 . 4.29 1573 1028 A 64 GLN H A 62 VAL HGx% 1.0 . 4.29 1574 1029 A 63 LYS H A 63 LYS HDx 1.0 . 4.03 1575 1029 A 63 LYS H A 63 LYS HDy 1.0 . 4.03 1576 1030 A 63 LYS HA A 63 LYS HDx 1.0 . 3.63 1577 1030 A 63 LYS HA A 63 LYS HDy 1.0 . 3.63 1578 1031 A 64 GLN HE21 A 63 LYS HA 1.0 . 4.80 1579 1031 A 64 GLN HE22 A 63 LYS HA 1.0 . 4.80 1580 1032 A 63 LYS HZ% A 81 LEU HBy 1.0 . 4.25 1581 1032 A 63 LYS HZ% A 81 LEU HBx 1.0 . 4.25 1582 1033 A 63 LYS HZ% A 81 LEU HDy% 1.0 . 4.68 1583 1033 A 63 LYS HZ% A 81 LEU HDx% 1.0 . 4.68 1584 1034 A 64 GLN H A 64 GLN HBx 1.0 . 3.42 1585 1034 A 64 GLN H A 64 GLN HBy 1.0 . 3.42 1586 1035 A 64 GLN HE21 A 64 GLN H 1.0 . 4.56 1587 1035 A 64 GLN HE22 A 64 GLN H 1.0 . 4.56 1588 1036 A 64 GLN H A 65 LEU HDy% 1.0 . 5.44 1589 1036 A 64 GLN H A 65 LEU HDx% 1.0 . 5.44 1590 1037 A 64 GLN HE21 A 64 GLN HA 1.0 . 4.82 1591 1037 A 64 GLN HE22 A 64 GLN HA 1.0 . 4.82 1592 1038 A 66 TYR H A 64 GLN HBx 1.0 . 5.08 1593 1038 A 66 TYR H A 64 GLN HBy 1.0 . 5.08 1594 1039 A 66 TYR HE% A 64 GLN HBx 1.0 . 4.36 1595 1039 A 66 TYR HE% A 64 GLN HBy 1.0 . 4.36 1596 1040 A 65 LEU H A 65 LEU HDy% 1.0 . 4.02 1597 1040 A 65 LEU H A 65 LEU HDx% 1.0 . 4.02 1598 1041 A 65 LEU HA A 65 LEU HDy% 1.0 . 2.92 1599 1041 A 65 LEU HA A 65 LEU HDx% 1.0 . 2.92 1600 1042 A 75 TYR H A 65 LEU HBy 1.0 . 4.94 1601 1042 A 75 TYR H A 65 LEU HBx 1.0 . 4.94 1602 1043 A 65 LEU HBx A 75 TYR HBy 1.0 . 4.23 1603 1043 A 65 LEU HBy A 75 TYR HBy 1.0 . 4.23 1604 1043 A 75 TYR HBx A 65 LEU HBy 1.0 . 4.23 1605 1043 A 65 LEU HBx A 75 TYR HBx 1.0 . 4.23 1606 1044 A 75 TYR H A 65 LEU HDy% 1.0 . 4.85 1607 1044 A 75 TYR H A 65 LEU HDx% 1.0 . 4.85 1608 1045 A 76 CYS HA A 65 LEU HDy% 1.0 . 3.98 1609 1045 A 76 CYS HA A 65 LEU HDx% 1.0 . 3.98 1610 1046 A 65 LEU HDx% A 76 CYS HBx 1.0 . 3.71 1611 1046 A 65 LEU HDy% A 76 CYS HBx 1.0 . 3.71 1612 1046 A 76 CYS HBy A 65 LEU HDy% 1.0 . 3.71 1613 1046 A 65 LEU HDx% A 76 CYS HBy 1.0 . 3.71 1614 1047 A 66 TYR HD% A 71 GLN HG3 1.0 . 4.09 1615 1047 A 66 TYR HD% A 71 GLN HG2 1.0 . 4.09 1616 1048 A 66 TYR HE% A 71 GLN HE21 1.0 . 4.56 1617 1048 A 66 TYR HE% A 71 GLN HE22 1.0 . 4.56 1618 1049 A 68 GLN H A 67 ASP HBx 1.0 . 4.09 1619 1049 A 68 GLN H A 67 ASP HBy 1.0 . 4.09 1620 1050 A 69 GLN H A 67 ASP HBx 1.0 . 4.94 1621 1050 A 69 GLN H A 67 ASP HBy 1.0 . 4.94 1622 1051 A 70 GLU H A 67 ASP HBx 1.0 . 3.47 1623 1051 A 70 GLU H A 67 ASP HBy 1.0 . 3.47 1624 1052 A 67 ASP HBy A 70 GLU HB2 1.0 . 4.29 1625 1052 A 67 ASP HBx A 70 GLU HB2 1.0 . 4.29 1626 1052 A 70 GLU HB3 A 67 ASP HBx 1.0 . 4.29 1627 1052 A 70 GLU HB3 A 67 ASP HBy 1.0 . 4.29 1628 1053 A 73 MET H A 67 ASP HBx 1.0 . 5.17 1629 1053 A 73 MET H A 67 ASP HBy 1.0 . 5.17 1630 1054 A 67 ASP HBy A 73 MET HB2 1.0 . 4.28 1631 1054 A 67 ASP HBx A 73 MET HB2 1.0 . 4.28 1632 1054 A 73 MET HB3 A 67 ASP HBx 1.0 . 4.28 1633 1054 A 73 MET HB3 A 67 ASP HBy 1.0 . 4.28 1634 1055 A 67 ASP HBy A 73 MET HG2 1.0 . 4.84 1635 1055 A 67 ASP HBx A 73 MET HG2 1.0 . 4.84 1636 1055 A 73 MET HG3 A 67 ASP HBx 1.0 . 4.84 1637 1055 A 73 MET HG3 A 67 ASP HBy 1.0 . 4.84 1638 1056 A 75 TYR HD% A 67 ASP HBx 1.0 . 4.72 1639 1056 A 75 TYR HD% A 67 ASP HBy 1.0 . 4.72 1640 1057 A 75 TYR HE% A 67 ASP HBx 1.0 . 3.75 1641 1057 A 75 TYR HE% A 67 ASP HBy 1.0 . 3.75 1642 1058 A 68 GLN H A 68 GLN HBy 1.0 . 3.34 1643 1058 A 68 GLN H A 68 GLN HBx 1.0 . 3.34 1644 1059 A 69 GLN H A 68 GLN HBy 1.0 . 2.95 1645 1059 A 69 GLN H A 68 GLN HBx 1.0 . 2.95 1646 1060 A 69 GLN HA A 68 GLN HBy 1.0 . 4.27 1647 1060 A 69 GLN HA A 68 GLN HBx 1.0 . 4.27 1648 1061 A 69 GLN HE21 A 68 GLN HBy 1.0 . 4.07 1649 1061 A 69 GLN HE22 A 68 GLN HBx 1.0 . 4.07 1650 1061 A 69 GLN HE21 A 68 GLN HBx 1.0 . 4.07 1651 1061 A 69 GLN HE22 A 68 GLN HBy 1.0 . 4.07 1652 1062 A 70 GLU H A 68 GLN HBy 1.0 . 4.71 1653 1062 A 70 GLU H A 68 GLN HBx 1.0 . 4.71 1654 1063 A 69 GLN HE21 A 68 GLN HG2 1.0 . 4.25 1655 1063 A 68 GLN HG3 A 69 GLN HE22 1.0 . 4.25 1656 1063 A 68 GLN HG3 A 69 GLN HE21 1.0 . 4.25 1657 1063 A 69 GLN HE22 A 68 GLN HG2 1.0 . 4.25 1658 1064 A 69 GLN H A 68 GLN HE21 1.0 . 4.51 1659 1064 A 69 GLN H A 68 GLN HE22 1.0 . 4.51 1660 1065 A 69 GLN HA A 68 GLN HE21 1.0 . 5.27 1661 1065 A 69 GLN HA A 68 GLN HE22 1.0 . 5.27 1662 1066 A 68 GLN HE21 A 69 GLN HG2 1.0 . 4.83 1663 1066 A 68 GLN HE22 A 69 GLN HG2 1.0 . 4.83 1664 1066 A 69 GLN HG3 A 68 GLN HE21 1.0 . 4.83 1665 1066 A 69 GLN HG3 A 68 GLN HE22 1.0 . 4.83 1666 1067 A 69 GLN HE22 A 68 GLN HE22 1.0 . 4.56 1667 1067 A 69 GLN HE21 A 68 GLN HE21 1.0 . 4.56 1668 1067 A 69 GLN HE21 A 68 GLN HE22 1.0 . 4.56 1669 1067 A 69 GLN HE22 A 68 GLN HE21 1.0 . 4.56 1670 1068 A 70 GLU H A 68 GLN HE21 1.0 . 4.45 1671 1068 A 70 GLU H A 68 GLN HE22 1.0 . 4.45 1672 1069 A 69 GLN H A 69 GLN HBx 1.0 . 3.15 1673 1069 A 69 GLN H A 69 GLN HBy 1.0 . 3.15 1674 1070 A 69 GLN H A 70 GLU HGx 1.0 . 4.14 1675 1070 A 69 GLN H A 70 GLU HGy 1.0 . 4.14 1676 1071 A 69 GLN HE21 A 69 GLN HA 1.0 . 5.14 1677 1071 A 69 GLN HE22 A 69 GLN HA 1.0 . 5.14 1678 1072 A 69 GLN HA A 70 GLU HGx 1.0 . 4.52 1679 1072 A 69 GLN HA A 70 GLU HGy 1.0 . 4.52 1680 1073 A 69 GLN HA A 71 GLN HE21 1.0 . 5.34 1681 1073 A 69 GLN HA A 71 GLN HE22 1.0 . 5.34 1682 1074 A 69 GLN HBx A 69 GLN HG2 1.0 . 2.31 1683 1074 A 69 GLN HBy A 69 GLN HG2 1.0 . 2.31 1684 1074 A 69 GLN HG3 A 69 GLN HBx 1.0 . 2.31 1685 1074 A 69 GLN HG3 A 69 GLN HBy 1.0 . 2.31 1686 1075 A 70 GLU H A 69 GLN HBx 1.0 . 3.92 1687 1075 A 70 GLU H A 69 GLN HBy 1.0 . 3.92 1688 1076 A 70 GLU HA A 69 GLN HBx 1.0 . 4.62 1689 1076 A 70 GLU HA A 69 GLN HBy 1.0 . 4.62 1690 1077 A 70 GLU H A 70 GLU HGx 1.0 . 3.48 1691 1077 A 70 GLU H A 70 GLU HGy 1.0 . 3.48 1692 1078 A 73 MET H A 70 GLU HGx 1.0 . 4.36 1693 1078 A 73 MET H A 70 GLU HGy 1.0 . 4.36 1694 1079 A 72 HIS HA A 74 VAL HGy% 1.0 . 5.23 1695 1079 A 72 HIS HA A 74 VAL HGx% 1.0 . 5.23 1696 1080 A 72 HIS HD2 A 91 SER HBx 1.0 . 4.40 1697 1080 A 72 HIS HD2 A 91 SER HBy 1.0 . 4.40 1698 1081 A 72 HIS HD2 A 92 VAL HGy% 1.0 . 4.79 1699 1081 A 72 HIS HD2 A 92 VAL HGx% 1.0 . 4.79 1700 1082 A 73 MET H A 74 VAL HGy% 1.0 . 5.44 1701 1082 A 73 MET H A 74 VAL HGx% 1.0 . 5.44 1702 1083 A 74 VAL H A 74 VAL HGy% 1.0 . 4.37 1703 1083 A 74 VAL H A 74 VAL HGx% 1.0 . 4.37 1704 1084 A 74 VAL HA A 75 TYR HBy 1.0 . 4.65 1705 1084 A 74 VAL HA A 75 TYR HBx 1.0 . 4.65 1706 1085 A 75 TYR H A 74 VAL HGy% 1.0 . 3.99 1707 1085 A 75 TYR H A 74 VAL HGx% 1.0 . 3.99 1708 1086 A 75 TYR HA A 74 VAL HGy% 1.0 . 5.10 1709 1086 A 75 TYR HA A 74 VAL HGx% 1.0 . 5.10 1710 1087 A 90 PHE HD% A 74 VAL HGy% 1.0 . 3.55 1711 1087 A 90 PHE HD% A 74 VAL HGx% 1.0 . 3.55 1712 1088 A 90 PHE HE% A 74 VAL HGy% 1.0 . 3.77 1713 1088 A 90 PHE HE% A 74 VAL HGx% 1.0 . 3.77 1714 1089 A 90 PHE HZ A 74 VAL HGy% 1.0 . 4.14 1715 1089 A 90 PHE HZ A 74 VAL HGx% 1.0 . 4.14 1716 1090 A 75 TYR H A 75 TYR HBy 1.0 . 3.43 1717 1090 A 75 TYR H A 75 TYR HBx 1.0 . 3.43 1718 1091 A 75 TYR H A 89 SER HBx 1.0 . 5.05 1719 1091 A 75 TYR H A 89 SER HBy 1.0 . 5.05 1720 1092 A 75 TYR HA A 76 CYS HBx 1.0 . 4.11 1721 1092 A 75 TYR HA A 76 CYS HBy 1.0 . 4.11 1722 1093 A 75 TYR HA A 89 SER HBx 1.0 . 3.63 1723 1093 A 75 TYR HA A 89 SER HBy 1.0 . 3.63 1724 1094 A 76 CYS H A 75 TYR HBy 1.0 . 3.65 1725 1094 A 76 CYS H A 75 TYR HBx 1.0 . 3.65 1726 1095 A 77 GLY H A 75 TYR HBy 1.0 . 5.34 1727 1095 A 77 GLY H A 75 TYR HBx 1.0 . 5.34 1728 1096 A 75 TYR HD% A 89 SER HBx 1.0 . 3.78 1729 1096 A 75 TYR HD% A 89 SER HBy 1.0 . 3.78 1730 1097 A 75 TYR HE% A 89 SER HBx 1.0 . 4.55 1731 1097 A 75 TYR HE% A 89 SER HBy 1.0 . 4.55 1732 1098 A 76 CYS H A 77 GLY HAx 1.0 . 5.21 1733 1098 A 76 CYS H A 77 GLY HAy 1.0 . 5.21 1734 1099 A 76 CYS HA A 77 GLY HAx 1.0 . 4.58 1735 1099 A 76 CYS HA A 77 GLY HAy 1.0 . 4.58 1736 1100 A 76 CYS HA A 79 ASP HBx 1.0 . 4.41 1737 1100 A 76 CYS HA A 79 ASP HBy 1.0 . 4.41 1738 1101 A 76 CYS HBx A 77 GLY HAx 1.0 . 4.08 1739 1101 A 76 CYS HBy A 77 GLY HAx 1.0 . 4.08 1740 1101 A 77 GLY HAy A 76 CYS HBx 1.0 . 4.08 1741 1101 A 76 CYS HBy A 77 GLY HAy 1.0 . 4.08 1742 1102 A 79 ASP H A 76 CYS HBx 1.0 . 5.21 1743 1102 A 79 ASP H A 76 CYS HBy 1.0 . 5.21 1744 1103 A 76 CYS HBx A 79 ASP HBx 1.0 . 3.96 1745 1103 A 76 CYS HBy A 79 ASP HBx 1.0 . 3.96 1746 1103 A 79 ASP HBy A 76 CYS HBx 1.0 . 3.96 1747 1103 A 76 CYS HBy A 79 ASP HBy 1.0 . 3.96 1748 1104 A 76 CYS HBx A 81 LEU HBy 1.0 . 3.98 1749 1104 A 76 CYS HBy A 81 LEU HBy 1.0 . 3.98 1750 1104 A 81 LEU HBx A 76 CYS HBx 1.0 . 3.98 1751 1104 A 81 LEU HBx A 76 CYS HBy 1.0 . 3.98 1752 1105 A 81 LEU HG A 76 CYS HBx 1.0 . 4.65 1753 1105 A 81 LEU HG A 76 CYS HBy 1.0 . 4.65 1754 1106 A 76 CYS HBx A 81 LEU HDy% 1.0 . 3.65 1755 1106 A 76 CYS HBy A 81 LEU HDy% 1.0 . 3.65 1756 1106 A 81 LEU HDx% A 76 CYS HBx 1.0 . 3.65 1757 1106 A 81 LEU HDx% A 76 CYS HBy 1.0 . 3.65 1758 1107 A 82 GLY H A 76 CYS HBx 1.0 . 4.02 1759 1107 A 82 GLY H A 76 CYS HBy 1.0 . 4.02 1760 1108 A 76 CYS HBx A 82 GLY HA2 1.0 . 3.89 1761 1108 A 76 CYS HBy A 82 GLY HA2 1.0 . 3.89 1762 1108 A 82 GLY HA3 A 76 CYS HBx 1.0 . 3.89 1763 1108 A 82 GLY HA3 A 76 CYS HBy 1.0 . 3.89 1764 1109 A 88 GLN HA A 76 CYS HBx 1.0 . 3.28 1765 1109 A 88 GLN HA A 76 CYS HBy 1.0 . 3.28 1766 1110 A 76 CYS HBx A 88 GLN HG2 1.0 . 3.12 1767 1110 A 76 CYS HBy A 88 GLN HG2 1.0 . 3.12 1768 1110 A 88 GLN HG3 A 76 CYS HBx 1.0 . 3.12 1769 1110 A 88 GLN HG3 A 76 CYS HBy 1.0 . 3.12 1770 1111 A 77 GLY HAx A 88 GLN HG2 1.0 . 4.13 1771 1111 A 77 GLY HAy A 88 GLN HG2 1.0 . 4.13 1772 1111 A 88 GLN HG3 A 77 GLY HAx 1.0 . 4.13 1773 1111 A 88 GLN HG3 A 77 GLY HAy 1.0 . 4.13 1774 1112 A 88 GLN HE21 A 77 GLY HAx 1.0 . 5.18 1775 1112 A 88 GLN HE21 A 77 GLY HAy 1.0 . 5.18 1776 1112 A 88 GLN HE22 A 77 GLY HAy 1.0 . 5.18 1777 1112 A 88 GLN HE22 A 77 GLY HAx 1.0 . 5.18 1778 1113 A 78 GLY H A 79 ASP HBx 1.0 . 5.34 1779 1113 A 78 GLY H A 79 ASP HBy 1.0 . 5.34 1780 1114 A 79 ASP H A 81 LEU HBy 1.0 . 5.22 1781 1114 A 79 ASP H A 81 LEU HBx 1.0 . 5.22 1782 1115 A 79 ASP HBy A 80 LEU HBy 1.0 . 5.18 1783 1115 A 79 ASP HBx A 80 LEU HBy 1.0 . 5.18 1784 1115 A 80 LEU HBx A 79 ASP HBx 1.0 . 5.18 1785 1115 A 80 LEU HBx A 79 ASP HBy 1.0 . 5.18 1786 1116 A 81 LEU H A 79 ASP HBx 1.0 . 3.84 1787 1116 A 81 LEU H A 79 ASP HBy 1.0 . 3.84 1788 1117 A 79 ASP HBy A 81 LEU HBy 1.0 . 4.68 1789 1117 A 79 ASP HBx A 81 LEU HBy 1.0 . 4.68 1790 1117 A 81 LEU HBx A 79 ASP HBx 1.0 . 4.68 1791 1117 A 81 LEU HBx A 79 ASP HBy 1.0 . 4.68 1792 1118 A 82 GLY H A 79 ASP HBx 1.0 . 3.97 1793 1118 A 82 GLY H A 79 ASP HBy 1.0 . 3.97 1794 1119 A 80 LEU H A 80 LEU HBy 1.0 . 3.49 1795 1119 A 80 LEU H A 80 LEU HBx 1.0 . 3.49 1796 1120 A 81 LEU H A 80 LEU HBy 1.0 . 3.91 1797 1120 A 81 LEU H A 80 LEU HBx 1.0 . 3.91 1798 1121 A 80 LEU HD2% A 83 GLU HGx 1.0 . 3.87 1799 1121 A 80 LEU HD1% A 83 GLU HGx 1.0 . 3.87 1800 1121 A 83 GLU HGy A 80 LEU HD1% 1.0 . 3.87 1801 1121 A 80 LEU HD2% A 83 GLU HGy 1.0 . 3.87 1802 1122 A 81 LEU H A 81 LEU HBy 1.0 . 3.25 1803 1122 A 81 LEU H A 81 LEU HBx 1.0 . 3.25 1804 1123 A 81 LEU HA A 81 LEU HDy% 1.0 . 3.21 1805 1123 A 81 LEU HA A 81 LEU HDx% 1.0 . 3.21 1806 1124 A 81 LEU HA A 84 LEU HBy 1.0 . 3.76 1807 1124 A 81 LEU HA A 84 LEU HBx 1.0 . 3.76 1808 1125 A 82 GLY H A 81 LEU HBy 1.0 . 4.00 1809 1125 A 82 GLY H A 81 LEU HBx 1.0 . 4.00 1810 1126 A 82 GLY H A 81 LEU HDy% 1.0 . 4.81 1811 1126 A 82 GLY H A 81 LEU HDx% 1.0 . 4.81 1812 1127 A 81 LEU HDy% A 85 LEU HDy% 1.0 . 3.83 1813 1127 A 81 LEU HDx% A 85 LEU HDy% 1.0 . 3.83 1814 1127 A 85 LEU HDx% A 81 LEU HDy% 1.0 . 3.83 1815 1127 A 81 LEU HDx% A 85 LEU HDx% 1.0 . 3.83 1816 1128 A 82 GLY H A 85 LEU HDy% 1.0 . 5.44 1817 1128 A 82 GLY H A 85 LEU HDx% 1.0 . 5.44 1818 1129 A 82 GLY HA3 A 85 LEU HBy 1.0 . 3.71 1819 1129 A 85 LEU HBx A 82 GLY HA2 1.0 . 3.71 1820 1129 A 82 GLY HA3 A 85 LEU HBx 1.0 . 3.71 1821 1129 A 82 GLY HA2 A 85 LEU HBy 1.0 . 3.71 1822 1130 A 82 GLY HA3 A 85 LEU HDy% 1.0 . 4.96 1823 1130 A 82 GLY HA2 A 85 LEU HDy% 1.0 . 4.96 1824 1130 A 85 LEU HDx% A 82 GLY HA2 1.0 . 4.96 1825 1130 A 82 GLY HA3 A 85 LEU HDx% 1.0 . 4.96 1826 1131 A 83 GLU H A 83 GLU HGx 1.0 . 3.61 1827 1131 A 83 GLU H A 83 GLU HGy 1.0 . 3.61 1828 1132 A 83 GLU H A 84 LEU HBy 1.0 . 4.76 1829 1132 A 83 GLU H A 84 LEU HBx 1.0 . 4.76 1830 1133 A 84 LEU H A 83 GLU HGx 1.0 . 4.39 1831 1133 A 84 LEU H A 83 GLU HGy 1.0 . 4.39 1832 1134 A 84 LEU HA A 83 GLU HGx 1.0 . 3.60 1833 1134 A 84 LEU HA A 83 GLU HGy 1.0 . 3.60 1834 1135 A 83 GLU HGx A 84 LEU HBy 1.0 . 4.48 1835 1135 A 84 LEU HBx A 83 GLU HGx 1.0 . 4.48 1836 1135 A 83 GLU HGy A 84 LEU HBx 1.0 . 4.48 1837 1135 A 83 GLU HGy A 84 LEU HBy 1.0 . 4.48 1838 1136 A 83 GLU HGx A 84 LEU HDx% 1.0 . 4.10 1839 1136 A 83 GLU HGy A 84 LEU HDx% 1.0 . 4.10 1840 1136 A 84 LEU HDy% A 83 GLU HGx 1.0 . 4.10 1841 1136 A 84 LEU HDy% A 83 GLU HGy 1.0 . 4.10 1842 1137 A 84 LEU H A 84 LEU HBy 1.0 . 2.89 1843 1137 A 84 LEU H A 84 LEU HBx 1.0 . 2.89 1844 1138 A 84 LEU H A 84 LEU HDx% 1.0 . 4.05 1845 1138 A 84 LEU H A 84 LEU HDy% 1.0 . 4.05 1846 1139 A 85 LEU H A 84 LEU HBy 1.0 . 3.32 1847 1139 A 85 LEU H A 84 LEU HBx 1.0 . 3.32 1848 1140 A 85 LEU H A 84 LEU HDx% 1.0 . 4.85 1849 1140 A 85 LEU H A 84 LEU HDy% 1.0 . 4.85 1850 1141 A 85 LEU H A 85 LEU HBy 1.0 . 3.05 1851 1141 A 85 LEU H A 85 LEU HBx 1.0 . 3.05 1852 1142 A 85 LEU H A 85 LEU HDy% 1.0 . 4.00 1853 1142 A 85 LEU H A 85 LEU HDx% 1.0 . 4.00 1854 1143 A 85 LEU HA A 85 LEU HDy% 1.0 . 3.33 1855 1143 A 85 LEU HA A 85 LEU HDx% 1.0 . 3.33 1856 1144 A 85 LEU HBy A 85 LEU HDy% 1.0 . 2.86 1857 1144 A 85 LEU HBx A 85 LEU HDy% 1.0 . 2.86 1858 1144 A 85 LEU HDx% A 85 LEU HBy 1.0 . 2.86 1859 1144 A 85 LEU HDx% A 85 LEU HBx 1.0 . 2.86 1860 1145 A 86 GLY H A 85 LEU HBy 1.0 . 3.77 1861 1145 A 86 GLY H A 85 LEU HBx 1.0 . 3.77 1862 1146 A 85 LEU HBy A 87 ARG HD2 1.0 . 4.56 1863 1146 A 85 LEU HBx A 87 ARG HD2 1.0 . 4.56 1864 1146 A 87 ARG HD3 A 85 LEU HBy 1.0 . 4.56 1865 1146 A 87 ARG HD3 A 85 LEU HBx 1.0 . 4.56 1866 1147 A 90 PHE HE% A 85 LEU HBy 1.0 . 4.64 1867 1147 A 90 PHE HE% A 85 LEU HBx 1.0 . 4.64 1868 1148 A 87 ARG H A 85 LEU HDy% 1.0 . 4.63 1869 1148 A 87 ARG H A 85 LEU HDx% 1.0 . 4.63 1870 1149 A 85 LEU HDy% A 87 ARG HD2 1.0 . 5.33 1871 1149 A 85 LEU HDx% A 87 ARG HD2 1.0 . 5.33 1872 1149 A 87 ARG HD3 A 85 LEU HDy% 1.0 . 5.33 1873 1149 A 87 ARG HD3 A 85 LEU HDx% 1.0 . 5.33 1874 1150 A 90 PHE HD% A 85 LEU HDy% 1.0 . 5.25 1875 1150 A 90 PHE HD% A 85 LEU HDx% 1.0 . 5.25 1876 1151 A 90 PHE HE% A 85 LEU HDy% 1.0 . 3.66 1877 1151 A 90 PHE HE% A 85 LEU HDx% 1.0 . 3.66 1878 1152 A 90 PHE HZ A 85 LEU HDy% 1.0 . 4.29 1879 1152 A 90 PHE HZ A 85 LEU HDx% 1.0 . 4.29 1880 1153 A 85 LEU HDx% A 97 PRO HBx 1.0 . 4.59 1881 1153 A 85 LEU HDy% A 97 PRO HBx 1.0 . 4.59 1882 1153 A 97 PRO HBy A 85 LEU HDy% 1.0 . 4.59 1883 1153 A 85 LEU HDx% A 97 PRO HBy 1.0 . 4.59 1884 1154 A 98 LEU HA A 85 LEU HDy% 1.0 . 3.39 1885 1154 A 98 LEU HA A 85 LEU HDx% 1.0 . 3.39 1886 1155 A 101 MET H A 85 LEU HDy% 1.0 . 4.53 1887 1155 A 101 MET H A 85 LEU HDx% 1.0 . 4.53 1888 1156 A 85 LEU HDy% A 101 MET HGy 1.0 . 4.85 1889 1156 A 85 LEU HDx% A 101 MET HGy 1.0 . 4.85 1890 1156 A 101 MET HGx A 85 LEU HDy% 1.0 . 4.85 1891 1156 A 101 MET HGx A 85 LEU HDx% 1.0 . 4.85 1892 1157 A 101 MET HE% A 85 LEU HDy% 1.0 . 3.47 1893 1157 A 101 MET HE% A 85 LEU HDx% 1.0 . 3.47 1894 1158 A 87 ARG HA A 86 GLY HAy 1.0 . 4.55 1895 1158 A 87 ARG HA A 86 GLY HAx 1.0 . 4.55 1896 1159 A 86 GLY HAy A 87 ARG HGx 1.0 . 4.82 1897 1159 A 86 GLY HAx A 87 ARG HGx 1.0 . 4.82 1898 1159 A 87 ARG HGy A 86 GLY HAy 1.0 . 4.82 1899 1159 A 86 GLY HAx A 87 ARG HGy 1.0 . 4.82 1900 1160 A 87 ARG H A 87 ARG HGx 1.0 . 3.64 1901 1160 A 87 ARG H A 87 ARG HGy 1.0 . 3.64 1902 1161 A 88 GLN H A 87 ARG HBx 1.0 . 4.12 1903 1161 A 88 GLN H A 87 ARG HBy 1.0 . 4.12 1904 1162 A 89 SER H A 87 ARG HBx 1.0 . 3.43 1905 1162 A 89 SER H A 87 ARG HBy 1.0 . 3.43 1906 1163 A 90 PHE HD% A 87 ARG HBx 1.0 . 5.34 1907 1163 A 90 PHE HD% A 87 ARG HBy 1.0 . 5.34 1908 1164 A 89 SER H A 87 ARG HGx 1.0 . 4.53 1909 1164 A 89 SER H A 87 ARG HGy 1.0 . 4.53 1910 1165 A 87 ARG HGy A 97 PRO HBx 1.0 . 3.87 1911 1165 A 87 ARG HGx A 97 PRO HBx 1.0 . 3.87 1912 1165 A 97 PRO HBy A 87 ARG HGx 1.0 . 3.87 1913 1165 A 97 PRO HBy A 87 ARG HGy 1.0 . 3.87 1914 1166 A 87 ARG HD3 A 97 PRO HBx 1.0 . 4.11 1915 1166 A 87 ARG HD2 A 97 PRO HBx 1.0 . 4.11 1916 1166 A 97 PRO HBy A 87 ARG HD2 1.0 . 4.11 1917 1166 A 87 ARG HD3 A 97 PRO HBy 1.0 . 4.11 1918 1167 A 90 PHE H A 89 SER HBx 1.0 . 4.02 1919 1167 A 90 PHE H A 89 SER HBy 1.0 . 4.02 1920 1168 A 90 PHE HA A 91 SER HBx 1.0 . 4.36 1921 1168 A 90 PHE HA A 91 SER HBy 1.0 . 4.36 1922 1169 A 91 SER H A 90 PHE HBy 1.0 . 3.67 1923 1169 A 91 SER H A 90 PHE HBx 1.0 . 3.67 1924 1170 A 90 PHE HD% A 97 PRO HGy 1.0 . 4.58 1925 1170 A 90 PHE HD% A 97 PRO HGx 1.0 . 4.58 1926 1171 A 91 SER H A 91 SER HBx 1.0 . 3.45 1927 1171 A 91 SER H A 91 SER HBy 1.0 . 3.45 1928 1172 A 91 SER H A 92 VAL HGy% 1.0 . 5.44 1929 1172 A 91 SER H A 92 VAL HGx% 1.0 . 5.44 1930 1173 A 93 LYS H A 91 SER HBx 1.0 . 4.91 1931 1173 A 93 LYS H A 91 SER HBy 1.0 . 4.91 1932 1174 A 94 ASP H A 91 SER HBx 1.0 . 4.39 1933 1174 A 94 ASP H A 91 SER HBy 1.0 . 4.39 1934 1175 A 93 LYS H A 92 VAL HGy% 1.0 . 4.35 1935 1175 A 93 LYS H A 92 VAL HGx% 1.0 . 4.35 1936 1176 A 93 LYS H A 93 LYS HGy 1.0 . 4.14 1937 1176 A 93 LYS H A 93 LYS HGx 1.0 . 4.14 1938 1177 A 93 LYS H A 95 PRO HDx 1.0 . 5.07 1939 1177 A 93 LYS H A 95 PRO HDy 1.0 . 5.07 1940 1178 A 93 LYS HA A 93 LYS HGy 1.0 . 3.63 1941 1178 A 93 LYS HGx A 93 LYS HA 1.0 . 3.63 1942 1179 A 94 ASP H A 94 ASP HBy 1.0 . 3.62 1943 1179 A 94 ASP H A 94 ASP HBx 1.0 . 3.62 1944 1180 A 94 ASP H A 95 PRO HDx 1.0 . 4.67 1945 1180 A 94 ASP H A 95 PRO HDy 1.0 . 4.67 1946 1181 A 94 ASP HA A 95 PRO HGy 1.0 . 4.56 1947 1181 A 94 ASP HA A 95 PRO HGx 1.0 . 4.56 1948 1182 A 94 ASP HA A 95 PRO HDx 1.0 . 3.21 1949 1182 A 94 ASP HA A 95 PRO HDy 1.0 . 3.21 1950 1183 A 96 SER H A 95 PRO HGy 1.0 . 4.38 1951 1183 A 96 SER H A 95 PRO HGx 1.0 . 4.38 1952 1184 A 99 TYR HD% A 95 PRO HGy 1.0 . 4.81 1953 1184 A 99 TYR HD% A 95 PRO HGx 1.0 . 4.81 1954 1185 A 99 TYR HE% A 95 PRO HGy 1.0 . 3.69 1955 1185 A 99 TYR HE% A 95 PRO HGx 1.0 . 3.69 1956 1186 A 96 SER H A 95 PRO HDx 1.0 . 3.24 1957 1186 A 96 SER H A 95 PRO HDy 1.0 . 3.24 1958 1187 A 96 SER HA A 99 TYR HBy 1.0 . 3.91 1959 1187 A 96 SER HA A 99 TYR HBx 1.0 . 3.91 1960 1188 A 97 PRO HA A 100 ASP HBx 1.0 . 3.03 1961 1188 A 97 PRO HA A 100 ASP HBy 1.0 . 3.03 1962 1189 A 98 LEU HA A 98 LEU HDy% 1.0 . 3.90 1963 1189 A 98 LEU HA A 98 LEU HDx% 1.0 . 3.90 1964 1190 A 99 TYR HE% A 98 LEU HBy 1.0 . 4.87 1965 1190 A 99 TYR HE% A 98 LEU HBx 1.0 . 4.87 1966 1191 A 99 TYR HD% A 98 LEU HDy% 1.0 . 4.57 1967 1191 A 99 TYR HD% A 98 LEU HDx% 1.0 . 4.57 1968 1192 A 99 TYR HE% A 98 LEU HDy% 1.0 . 4.14 1969 1192 A 99 TYR HE% A 98 LEU HDx% 1.0 . 4.14 1970 1193 A 101 MET HE% A 98 LEU HDy% 1.0 . 4.35 1971 1193 A 101 MET HE% A 98 LEU HDx% 1.0 . 4.35 1972 1194 A 99 TYR H A 99 TYR HBy 1.0 . 3.62 1973 1194 A 99 TYR H A 99 TYR HBx 1.0 . 3.62 1974 1195 A 100 ASP H A 99 TYR HBy 1.0 . 3.97 1975 1195 A 100 ASP H A 99 TYR HBx 1.0 . 3.97 1976 1196 A 99 TYR HD% A 102 LEU HDx% 1.0 . 3.79 1977 1196 A 99 TYR HD% A 102 LEU HDy% 1.0 . 3.79 1978 1197 A 100 ASP HA A 103 ARG HGy 1.0 . 4.89 1979 1197 A 100 ASP HA A 103 ARG HGx 1.0 . 4.89 1980 1198 A 100 ASP HBx A 103 ARG HGy 1.0 . 4.21 1981 1198 A 100 ASP HBy A 103 ARG HGy 1.0 . 4.21 1982 1198 A 103 ARG HGx A 100 ASP HBx 1.0 . 4.21 1983 1198 A 100 ASP HBy A 103 ARG HGx 1.0 . 4.21 1984 1199 A 101 MET H A 101 MET HGy 1.0 . 3.56 1985 1199 A 101 MET H A 101 MET HGx 1.0 . 3.56 1986 1200 A 102 LEU H A 101 MET HGy 1.0 . 4.69 1987 1200 A 102 LEU H A 101 MET HGx 1.0 . 4.69 1988 1201 A 102 LEU H A 102 LEU HBy 1.0 . 3.56 1989 1201 A 102 LEU H A 102 LEU HBx 1.0 . 3.56 1990 1202 A 102 LEU H A 102 LEU HDx% 1.0 . 4.13 1991 1202 A 102 LEU H A 102 LEU HDy% 1.0 . 4.13 1992 1203 A 102 LEU HA A 105 ASN HBy 1.0 . 3.97 1993 1203 A 102 LEU HA A 105 ASN HBx 1.0 . 3.97 1994 1204 A 102 LEU HA A 106 LEU HDy% 1.0 . 4.08 1995 1204 A 102 LEU HA A 106 LEU HDx% 1.0 . 4.08 1996 1205 A 103 ARG H A 102 LEU HBy 1.0 . 3.85 1997 1205 A 103 ARG H A 102 LEU HBx 1.0 . 3.85 1998 1206 A 103 ARG HA A 102 LEU HBy 1.0 . 4.40 1999 1206 A 103 ARG HA A 102 LEU HBx 1.0 . 4.40 2000 1207 A 105 ASN H A 102 LEU HBy 1.0 . 5.26 2001 1207 A 105 ASN H A 102 LEU HBx 1.0 . 5.26 2002 1208 A 108 THR HG2% A 102 LEU HBy 1.0 . 4.50 2003 1208 A 108 THR HG2% A 102 LEU HBx 1.0 . 4.50 2004 1209 A 103 ARG H A 102 LEU HDx% 1.0 . 5.44 2005 1209 A 102 LEU HDy% A 103 ARG H 1.0 . 5.44 2006 1210 A 103 ARG H A 103 ARG HGy 1.0 . 3.76 2007 1210 A 103 ARG H A 103 ARG HGx 1.0 . 3.76 2008 1211 A 103 ARG HA A 103 ARG HGy 1.0 . 3.65 2009 1211 A 103 ARG HA A 103 ARG HGx 1.0 . 3.65 2010 1212 A 104 LYS H A 103 ARG HGy 1.0 . 3.65 2011 1212 A 104 LYS H A 103 ARG HGx 1.0 . 3.65 2012 1213 A 104 LYS HB2 A 105 ASN HBy 1.0 . 4.79 2013 1213 A 105 ASN HBx A 104 LYS HB2 1.0 . 4.79 2014 1213 A 104 LYS HB3 A 105 ASN HBx 1.0 . 4.79 2015 1213 A 104 LYS HB3 A 105 ASN HBy 1.0 . 4.79 2016 1214 A 104 LYS HGy A 105 ASN HBy 1.0 . 4.72 2017 1214 A 104 LYS HGx A 105 ASN HBy 1.0 . 4.72 2018 1214 A 105 ASN HBx A 104 LYS HGy 1.0 . 4.72 2019 1214 A 104 LYS HGx A 105 ASN HBx 1.0 . 4.72 2020 1215 A 105 ASN H A 105 ASN HBy 1.0 . 3.27 2021 1215 A 105 ASN H A 105 ASN HBx 1.0 . 3.27 2022 1216 A 105 ASN H A 106 LEU HDy% 1.0 . 4.66 2023 1216 A 105 ASN H A 106 LEU HDx% 1.0 . 4.66 2024 1217 A 106 LEU H A 106 LEU HBy 1.0 . 3.11 2025 1217 A 106 LEU H A 106 LEU HBx 1.0 . 3.11 2026 1218 A 106 LEU H A 106 LEU HDy% 1.0 . 3.97 2027 1218 A 106 LEU H A 106 LEU HDx% 1.0 . 3.97 2028 1219 A 106 LEU HA A 107 VAL HGx% 1.0 . 4.65 2029 1219 A 106 LEU HA A 107 VAL HGy% 1.0 . 4.65 2030 1220 A 107 VAL H A 106 LEU HDy% 1.0 . 4.44 2031 1220 A 107 VAL H A 106 LEU HDx% 1.0 . 4.44 2032 1221 A 108 THR H A 106 LEU HDy% 1.0 . 4.12 2033 1221 A 108 THR H A 106 LEU HDx% 1.0 . 4.12 2034 1222 A 108 THR HB A 106 LEU HDy% 1.0 . 4.32 2035 1222 A 108 THR HB A 106 LEU HDx% 1.0 . 4.32 2036 1223 A 107 VAL H A 107 VAL HGx% 1.0 . 4.05 2037 1223 A 107 VAL H A 107 VAL HGy% 1.0 . 4.05 2038 1224 A 107 VAL HA A 107 VAL HGx% 1.0 . 3.07 2039 1224 A 107 VAL HA A 107 VAL HGy% 1.0 . 3.07 2040 1225 A 108 THR HA A 107 VAL HGx% 1.0 . 4.41 2041 1225 A 108 THR HA A 107 VAL HGy% 1.0 . 4.41 2042 1226 A 109 LEU H A 109 LEU HDx% 1.0 . 5.44 2043 1226 A 109 LEU H A 109 LEU HDy% 1.0 . 5.44 2044 1227 A 109 LEU HA A 109 LEU HDx% 1.0 . 3.16 2045 1227 A 109 LEU HA A 109 LEU HDy% 1.0 . 3.16 2046 1228 A 110 ALA H A 109 LEU HDx% 1.0 . 4.50 2047 1228 A 110 ALA H A 109 LEU HDy% 1.0 . 4.50 stop_ 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 hbond _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 38 HIS H A 34 LEU O 1.0 . 2.0 2 2 A 34 LEU O A 38 HIS N 1.0 . 3.0 3 3 A 39 ALA H A 35 LYS O 1.0 . 2.0 4 4 A 35 LYS O A 39 ALA N 1.0 . 3.0 5 5 A 41 GLY H A 38 HIS O 1.0 . 2.0 6 6 A 38 HIS O A 41 GLY N 1.0 . 3.0 7 7 A 52 VAL H A 48 THR O 1.0 . 2.0 8 8 A 48 THR O A 52 VAL N 1.0 . 3.0 9 9 A 53 MET H A 49 VAL O 1.0 . 2.0 10 10 A 49 VAL O A 53 MET N 1.0 . 3.0 11 11 A 59 TYR H A 55 TYR O 1.0 . 2.0 12 12 A 55 TYR O A 59 TYR N 1.0 . 3.0 13 13 A 60 ILE H A 56 LEU O 1.0 . 2.0 14 14 A 56 LEU O A 60 ILE N 1.0 . 3.0 15 15 A 61 MET H A 57 GLY O 1.0 . 2.0 16 16 A 57 GLY O A 61 MET N 1.0 . 3.0 17 17 A 62 VAL H A 58 GLN O 1.0 . 2.0 18 18 A 58 GLN O A 62 VAL N 1.0 . 3.0 19 19 A 64 GLN H A 60 ILE O 1.0 . 2.0 20 20 A 60 ILE O A 64 GLN N 1.0 . 3.0 21 21 A 63 LYS H A 59 TYR O 1.0 . 2.0 22 22 A 59 TYR O A 63 LYS N 1.0 . 3.0 23 23 A 73 MET H A 70 GLU O 1.0 . 2.0 24 24 A 70 GLU O A 73 MET N 1.0 . 3.0 25 25 A 79 ASP H A 76 CYS O 1.0 . 2.0 26 26 A 76 CYS O A 79 ASP N 1.0 . 3.0 27 27 A 83 GLU H A 79 ASP O 1.0 . 2.0 28 28 A 79 ASP O A 83 GLU N 1.0 . 3.0 29 29 A 84 LEU H A 80 LEU O 1.0 . 2.0 30 30 A 80 LEU O A 84 LEU N 1.0 . 3.0 31 31 A 85 LEU H A 81 LEU O 1.0 . 2.0 32 32 A 81 LEU O A 85 LEU N 1.0 . 3.0 33 33 A 86 GLY H A 82 GLY O 1.0 . 2.0 34 34 A 82 GLY O A 86 GLY N 1.0 . 3.0 35 35 A 102 LEU H A 98 LEU O 1.0 . 2.0 36 36 A 98 LEU O A 102 LEU N 1.0 . 3.0 37 37 A 103 ARG H A 99 TYR O 1.0 . 2.0 38 38 A 99 TYR O A 103 ARG N 1.0 . 3.0 39 39 A 105 ASN H A 102 LEU O 1.0 . 2.0 40 40 A 102 LEU O A 105 ASN N 1.0 . 3.0 stop_ save_ save_DYANA/DIANA_dihedral_3 _nef_dihedral_restraint_list.sf_category nef_dihedral_restraint_list _nef_dihedral_restraint_list.sf_framecode DYANA/DIANA_dihedral_3 _nef_dihedral_restraint_list.potential_type square-well-parabolic _nef_dihedral_restraint_list.restraint_origin . loop_ _nef_dihedral_restraint.index _nef_dihedral_restraint.restraint_id _nef_dihedral_restraint.chain_code_1 _nef_dihedral_restraint.sequence_code_1 _nef_dihedral_restraint.residue_name_1 _nef_dihedral_restraint.atom_name_1 _nef_dihedral_restraint.chain_code_2 _nef_dihedral_restraint.sequence_code_2 _nef_dihedral_restraint.residue_name_2 _nef_dihedral_restraint.atom_name_2 _nef_dihedral_restraint.chain_code_3 _nef_dihedral_restraint.sequence_code_3 _nef_dihedral_restraint.residue_name_3 _nef_dihedral_restraint.atom_name_3 _nef_dihedral_restraint.chain_code_4 _nef_dihedral_restraint.sequence_code_4 _nef_dihedral_restraint.residue_name_4 _nef_dihedral_restraint.atom_name_4 _nef_dihedral_restraint.weight _nef_dihedral_restraint.lower_limit _nef_dihedral_restraint.upper_limit _nef_dihedral_restraint.name 1 1 A 25 ASN C A 26 GLN N A 26 GLN CA A 26 GLN C 1.0 -163.0 -68.4 PHI 2 2 A 26 GLN N A 26 GLN CA A 26 GLN C A 27 VAL N 1.0 135.5 180.3 PSI 3 3 A 26 GLN C A 27 VAL N A 27 VAL CA A 27 VAL C 1.0 -163.2 -104.2 PHI 4 4 A 27 VAL N A 27 VAL CA A 27 VAL C A 28 ARG N 1.0 138.9 172.0 PSI 5 5 A 27 VAL C A 28 ARG N A 28 ARG CA A 28 ARG C 1.0 -164.6 -87.1 PHI 6 6 A 28 ARG N A 28 ARG CA A 28 ARG C A 29 PRO N 1.0 101.8 175.0 PSI 7 7 A 30 LYS C A 31 LEU N A 31 LEU CA A 31 LEU C 1.0 -83.1 -32.5 PHI 8 8 A 31 LEU N A 31 LEU CA A 31 LEU C A 32 PRO N 1.0 -64.9 -14.4 PSI 9 9 A 33 LEU C A 34 LEU N A 34 LEU CA A 34 LEU C 1.0 -76.9 -47.1 PHI 10 10 A 34 LEU N A 34 LEU CA A 34 LEU C A 35 LYS N 1.0 -58.7 -31.2 PSI 11 11 A 34 LEU C A 35 LYS N A 35 LYS CA A 35 LYS C 1.0 -72.4 -51.7 PHI 12 12 A 35 LYS N A 35 LYS CA A 35 LYS C A 36 ILE N 1.0 -52.8 -12.9 PSI 13 13 A 35 LYS C A 36 ILE N A 36 ILE CA A 36 ILE C 1.0 -77.4 -55.4 PHI 14 14 A 36 ILE N A 36 ILE CA A 36 ILE C A 37 LEU N 1.0 -54.3 -34.3 PSI 15 15 A 36 ILE C A 37 LEU N A 37 LEU CA A 37 LEU C 1.0 -70.6 -50.6 PHI 16 16 A 37 LEU N A 37 LEU CA A 37 LEU C A 38 HIS N 1.0 -56.9 -30.8 PSI 17 17 A 37 LEU C A 38 HIS N A 38 HIS CA A 38 HIS C 1.0 -76.2 -52.0 PHI 18 18 A 38 HIS N A 38 HIS CA A 38 HIS C A 39 ALA N 1.0 -49.5 -28.4 PSI 19 19 A 38 HIS C A 39 ALA N A 39 ALA CA A 39 ALA C 1.0 -80.3 -53.6 PHI 20 20 A 39 ALA N A 39 ALA CA A 39 ALA C A 40 ALA N 1.0 -43.0 -4.1 PSI 21 21 A 39 ALA C A 40 ALA N A 40 ALA CA A 40 ALA C 1.0 -118.2 -64.6 PHI 22 22 A 40 ALA N A 40 ALA CA A 40 ALA C A 41 GLY N 1.0 -25.7 29.4 PSI 23 23 A 47 PHE N A 47 PHE CA A 47 PHE C A 48 THR N 1.0 122.2 178.4 PSI 24 24 A 47 PHE C A 48 THR N A 48 THR CA A 48 THR C 1.0 -96.3 -60.0 PHI 25 25 A 48 THR N A 48 THR CA A 48 THR C A 49 VAL N 1.0 150.6 184.4 PSI 26 26 A 48 THR C A 49 VAL N A 49 VAL CA A 49 VAL C 1.0 -69.6 -47.9 PHI 27 27 A 49 VAL N A 49 VAL CA A 49 VAL C A 50 LYS N 1.0 -53.1 -26.2 PSI 28 28 A 49 VAL C A 50 LYS N A 50 LYS CA A 50 LYS C 1.0 -72.6 -48.2 PHI 29 29 A 50 LYS N A 50 LYS CA A 50 LYS C A 51 GLU N 1.0 -50.3 -30.3 PSI 30 30 A 50 LYS C A 51 GLU N A 51 GLU CA A 51 GLU C 1.0 -80.4 -52.3 PHI 31 31 A 51 GLU N A 51 GLU CA A 51 GLU C A 52 VAL N 1.0 -58.3 -28.7 PSI 32 32 A 51 GLU C A 52 VAL N A 52 VAL CA A 52 VAL C 1.0 -75.2 -52.7 PHI 33 33 A 52 VAL N A 52 VAL CA A 52 VAL C A 53 MET N 1.0 -59.8 -29.7 PSI 34 34 A 52 VAL C A 53 MET N A 53 MET CA A 53 MET C 1.0 -73.0 -47.4 PHI 35 35 A 53 MET N A 53 MET CA A 53 MET C A 54 HIS N 1.0 -51.8 -24.0 PSI 36 36 A 53 MET C A 54 HIS N A 54 HIS CA A 54 HIS C 1.0 -74.4 -51.7 PHI 37 37 A 54 HIS N A 54 HIS CA A 54 HIS C A 55 TYR N 1.0 -59.7 -27.7 PSI 38 38 A 54 HIS C A 55 TYR N A 55 TYR CA A 55 TYR C 1.0 -74.3 -54.3 PHI 39 39 A 55 TYR N A 55 TYR CA A 55 TYR C A 56 LEU N 1.0 -53.7 -26.7 PSI 40 40 A 55 TYR C A 56 LEU N A 56 LEU CA A 56 LEU C 1.0 -86.9 -50.7 PHI 41 41 A 56 LEU N A 56 LEU CA A 56 LEU C A 57 GLY N 1.0 -58.4 -24.8 PSI 42 42 A 56 LEU C A 57 GLY N A 57 GLY CA A 57 GLY C 1.0 -74.3 -54.3 PHI 43 43 A 57 GLY N A 57 GLY CA A 57 GLY C A 58 GLN N 1.0 -47.3 -27.3 PSI 44 44 A 57 GLY C A 58 GLN N A 58 GLN CA A 58 GLN C 1.0 -75.0 -55.0 PHI 45 45 A 58 GLN N A 58 GLN CA A 58 GLN C A 59 TYR N 1.0 -52.7 -31.8 PSI 46 46 A 58 GLN C A 59 TYR N A 59 TYR CA A 59 TYR C 1.0 -74.5 -54.5 PHI 47 47 A 59 TYR N A 59 TYR CA A 59 TYR C A 60 ILE N 1.0 -54.4 -34.4 PSI 48 48 A 59 TYR C A 60 ILE N A 60 ILE CA A 60 ILE C 1.0 -72.5 -52.5 PHI 49 49 A 60 ILE N A 60 ILE CA A 60 ILE C A 61 MET N 1.0 -55.7 -27.6 PSI 50 50 A 60 ILE C A 61 MET N A 61 MET CA A 61 MET C 1.0 -73.2 -53.1 PHI 51 51 A 61 MET N A 61 MET CA A 61 MET C A 62 VAL N 1.0 -52.8 -25.8 PSI 52 52 A 61 MET C A 62 VAL N A 62 VAL CA A 62 VAL C 1.0 -78.1 -45.8 PHI 53 53 A 62 VAL N A 62 VAL CA A 62 VAL C A 63 LYS N 1.0 -55.4 -18.7 PSI 54 54 A 62 VAL C A 63 LYS N A 63 LYS CA A 63 LYS C 1.0 -115.9 -65.0 PHI 55 55 A 63 LYS N A 63 LYS CA A 63 LYS C A 64 GLN N 1.0 -15.7 29.8 PSI 56 56 A 66 TYR C A 67 ASP N A 67 ASP CA A 67 ASP C 1.0 -120.3 -55.7 PHI 57 57 A 67 ASP N A 67 ASP CA A 67 ASP C A 68 GLN N 1.0 79.3 198.8 PSI 58 58 A 67 ASP C A 68 GLN N A 68 GLN CA A 68 GLN C 1.0 -69.7 -46.2 PHI 59 59 A 68 GLN N A 68 GLN CA A 68 GLN C A 69 GLN N 1.0 -55.3 -10.5 PSI 60 60 A 68 GLN C A 69 GLN N A 69 GLN CA A 69 GLN C 1.0 -114.5 -51.5 PHI 61 61 A 69 GLN N A 69 GLN CA A 69 GLN C A 70 GLU N 1.0 -36.5 13.6 PSI 62 62 A 79 ASP C A 80 LEU N A 80 LEU CA A 80 LEU C 1.0 -68.0 -46.7 PHI 63 63 A 80 LEU N A 80 LEU CA A 80 LEU C A 81 LEU N 1.0 -55.7 -28.2 PSI 64 64 A 82 GLY C A 83 GLU N A 83 GLU CA A 83 GLU C 1.0 -82.6 -48.2 PHI 65 65 A 83 GLU N A 83 GLU CA A 83 GLU C A 84 LEU N 1.0 -65.2 -15.2 PSI 66 66 A 88 GLN C A 89 SER N A 89 SER CA A 89 SER C 1.0 -157.1 -85.2 PHI 67 67 A 89 SER N A 89 SER CA A 89 SER C A 90 PHE N 1.0 124.9 185.8 PSI 68 68 A 89 SER C A 90 PHE N A 90 PHE CA A 90 PHE C 1.0 -193.0 -97.6 PHI 69 69 A 90 PHE N A 90 PHE CA A 90 PHE C A 91 SER N 1.0 121.2 182.6 PSI 70 70 A 90 PHE C A 91 SER N A 91 SER CA A 91 SER C 1.0 -154.6 -63.5 PHI 71 71 A 91 SER N A 91 SER CA A 91 SER C A 92 VAL N 1.0 136.6 179.6 PSI 72 72 A 91 SER C A 92 VAL N A 92 VAL CA A 92 VAL C 1.0 -77.5 -46.1 PHI 73 73 A 92 VAL N A 92 VAL CA A 92 VAL C A 93 LYS N 1.0 -51.1 2.9 PSI 74 74 A 92 VAL C A 93 LYS N A 93 LYS CA A 93 LYS C 1.0 -95.0 -48.0 PHI 75 75 A 93 LYS N A 93 LYS CA A 93 LYS C A 94 ASP N 1.0 -53.6 -0.6 PSI 76 76 A 97 PRO C A 98 LEU N A 98 LEU CA A 98 LEU C 1.0 -73.9 -50.7 PHI 77 77 A 98 LEU N A 98 LEU CA A 98 LEU C A 99 TYR N 1.0 -57.6 -22.9 PSI 78 78 A 98 LEU C A 99 TYR N A 99 TYR CA A 99 TYR C 1.0 -79.4 -46.9 PHI 79 79 A 99 TYR N A 99 TYR CA A 99 TYR C A 100 ASP N 1.0 -52.1 -29.3 PSI 80 80 A 99 TYR C A 100 ASP N A 100 ASP CA A 100 ASP C 1.0 -72.3 -52.3 PHI 81 81 A 100 ASP N A 100 ASP CA A 100 ASP C A 101 MET N 1.0 -51.5 -31.6 PSI 82 82 A 100 ASP C A 101 MET N A 101 MET CA A 101 MET C 1.0 -79.5 -53.7 PHI 83 83 A 101 MET N A 101 MET CA A 101 MET C A 102 LEU N 1.0 -49.6 -29.6 PSI 84 84 A 103 ARG C A 104 LYS N A 104 LYS CA A 104 LYS C 1.0 -105.2 -53.0 PHI 85 85 A 104 LYS N A 104 LYS CA A 104 LYS C A 105 ASN N 1.0 -44.2 -2.7 PSI 86 86 A 105 ASN C A 106 LEU N A 106 LEU CA A 106 LEU C 1.0 -155.8 -61.1 PHI 87 87 A 106 LEU N A 106 LEU CA A 106 LEU C A 107 VAL N 1.0 96.0 169.8 PSI stop_ save_