data_nef_c17456_2lau save_entry_information _nef_nmr_meta_data.sf_category nef_nmr_meta_data _nef_nmr_meta_data.sf_framecode entry_information _nef_nmr_meta_data.format_name nmr_exchange_format _nef_nmr_meta_data.format_version 1.1 save_ save_assembly _nef_molecular_system.sf_category nef_molecular_system _nef_molecular_system.sf_framecode assembly loop_ _nef_covalent_links.chain_code_1 _nef_covalent_links.sequence_code_1 _nef_covalent_links.residue_name_1 _nef_covalent_links.atom_name_1 _nef_covalent_links.chain_code_2 _nef_covalent_links.sequence_code_2 _nef_covalent_links.residue_name_2 _nef_covalent_links.atom_name_2 1 65 HIS NE2 2 1 ZN ZN 1 62 CYS SG 2 1 ZN ZN 1 7 CYS SG 2 1 ZN ZN 1 12 CYS SG 2 1 ZN ZN stop_ loop_ _nef_sequence.index _nef_sequence.chain_code _nef_sequence.sequence_code _nef_sequence.residue_name _nef_sequence.linking _nef_sequence.residue_variant _nef_sequence.cis_peptide 1 A 1 GLY start . false 2 A 2 SER middle . . 3 A 3 PRO middle . false 4 A 4 GLY middle . false 5 A 5 PHE middle . . 6 A 6 THR middle . . 7 A 7 CYS middle -HG . 8 A 8 CYS middle . . 9 A 9 VAL middle . . 10 A 10 PRO middle . false 11 A 11 GLY middle . false 12 A 12 CYS middle -HG . 13 A 13 TYR middle . . 14 A 14 ASN middle . . 15 A 15 ASN middle . . 16 A 16 SER middle . . 17 A 17 HIS middle . . 18 A 18 ARG middle . . 19 A 19 ASP middle . . 20 A 20 LYS middle . . 21 A 21 ALA middle . . 22 A 22 LEU middle . . 23 A 23 HIS middle . . 24 A 24 PHE middle . . 25 A 25 TYR middle . . 26 A 26 THR middle . . 27 A 27 PHE middle . . 28 A 28 PRO middle . false 29 A 29 LYS middle . . 30 A 30 ASP middle . . 31 A 31 ALA middle . . 32 A 32 GLU middle . . 33 A 33 LEU middle . . 34 A 34 ARG middle . . 35 A 35 ARG middle . . 36 A 36 LEU middle . . 37 A 37 TRP middle . . 38 A 38 LEU middle . . 39 A 39 LYS middle . . 40 A 40 ASN middle . . 41 A 41 VAL middle . . 42 A 42 SER middle . . 43 A 43 ARG middle . . 44 A 44 ALA middle . . 45 A 45 GLY middle . false 46 A 46 VAL middle . . 47 A 47 SER middle . . 48 A 48 GLY middle . false 49 A 49 CYS middle . . 50 A 50 PHE middle . . 51 A 51 SER middle . . 52 A 52 THR middle . . 53 A 53 PHE middle . . 54 A 54 GLN middle . . 55 A 55 PRO middle . false 56 A 56 THR middle . . 57 A 57 THR middle . . 58 A 58 GLY middle . false 59 A 59 HIS middle . . 60 A 60 ARG middle . . 61 A 61 LEU middle . . 62 A 62 CYS middle -HG . 63 A 63 SER middle . . 64 A 64 VAL middle . . 65 A 65 HIS middle -HE2 . 66 A 66 PHE middle . . 67 A 67 GLN middle . . 68 A 68 GLY middle . false 69 A 69 GLY middle . false 70 A 70 ARG middle . . 71 A 71 LYS middle . . 72 A 72 THR middle . . 73 A 73 TYR middle . . 74 A 74 THR middle . . 75 A 75 VAL middle . . 76 A 76 ARG middle . . 77 A 77 VAL middle . . 78 A 78 PRO middle . false 79 A 79 THR middle . . 80 A 80 ILE middle . . 81 A 81 PHE end . . 82 B 1 ZN . . . 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 3 PRO HA H 1 4.296 0.020 A 3 PRO HBy H 1 2.086 0.020 A 3 PRO HBx H 1 1.652 0.020 A 3 PRO HDy H 1 3.706 0.020 A 3 PRO HDx H 1 3.574 0.020 A 3 PRO HGy H 1 1.866 0.020 A 3 PRO HGx H 1 1.800 0.020 A 3 PRO C C 13 171.755 0.3 A 3 PRO CA C 13 58.255 0.3 A 3 PRO CB C 13 27.018 0.3 A 3 PRO CD C 13 45.685 0.3 A 3 PRO CG C 13 22.113 0.3 A 4 GLY H H 1 7.870 0.020 A 4 GLY HAy H 1 3.349 0.020 A 4 GLY HAx H 1 3.219 0.020 A 4 GLY C C 13 167.958 0.3 A 4 GLY CA C 13 39.345 0.3 A 4 GLY N N 15 103.564 0.3 A 5 PHE H H 1 8.096 0.020 A 5 PHE HA H 1 4.868 0.020 A 5 PHE HB2 H 1 2.653 0.020 A 5 PHE HB3 H 1 1.728 0.020 A 5 PHE HDx H 1 7.045 0.020 A 5 PHE HDy H 1 7.045 0.020 A 5 PHE HEx H 1 7.287 0.020 A 5 PHE HEy H 1 7.287 0.020 A 5 PHE HZ H 1 7.147 0.020 A 5 PHE CA C 13 50.469 0.3 A 5 PHE CB C 13 36.478 0.3 A 5 PHE CDx C 13 126.580 0.3 A 5 PHE CDy C 13 126.580 0.3 A 5 PHE CEx C 13 126.876 0.3 A 5 PHE CEy C 13 126.876 0.3 A 5 PHE CZ C 13 124.256 0.3 A 5 PHE N N 15 115.076 0.3 A 6 THR H H 1 8.640 0.020 A 6 THR HA H 1 4.818 0.020 A 6 THR HB H 1 4.134 0.020 A 6 THR HG2% H 1 1.327 0.020 A 6 THR CA C 13 55.957 0.3 A 6 THR CB C 13 65.891 0.3 A 6 THR CG2 C 13 16.260 0.3 A 6 THR N N 15 112.643 0.3 A 7 CYS H H 1 9.060 0.020 A 7 CYS HA H 1 4.604 0.020 A 7 CYS HB2 H 1 3.188 0.020 A 7 CYS HB3 H 1 2.932 0.020 A 7 CYS CA C 13 56.099 0.3 A 7 CYS CB C 13 25.726 0.3 A 8 CYS H H 1 8.992 0.020 A 8 CYS HA H 1 4.850 0.020 A 8 CYS HB2 H 1 3.502 0.020 A 8 CYS HB3 H 1 3.179 0.020 A 8 CYS C C 13 169.640 0.3 A 8 CYS CA C 13 53.178 0.3 A 8 CYS CB C 13 23.953 0.3 A 9 VAL H H 1 8.979 0.020 A 9 VAL HA H 1 3.675 0.020 A 9 VAL HB H 1 2.331 0.020 A 9 VAL HG1% H 1 0.589 0.020 A 9 VAL HG2% H 1 0.802 0.020 A 9 VAL CA C 13 57.360 0.3 A 9 VAL CB C 13 26.932 0.3 A 9 VAL CG1 C 13 19.749 0.3 A 9 VAL CG2 C 13 15.781 0.3 A 9 VAL N N 15 125.631 0.3 A 10 PRO HA H 1 4.141 0.020 A 10 PRO HB2 H 1 2.132 0.020 A 10 PRO HB3 H 1 1.691 0.020 A 10 PRO HDy H 1 3.810 0.020 A 10 PRO HDx H 1 3.203 0.020 A 10 PRO HGy H 1 1.881 0.020 A 10 PRO HGx H 1 1.783 0.020 A 10 PRO CA C 13 59.074 0.3 A 10 PRO CB C 13 26.608 0.3 A 10 PRO CD C 13 46.181 0.3 A 10 PRO CG C 13 22.464 0.3 A 11 GLY H H 1 8.536 0.020 A 11 GLY HAy H 1 4.120 0.020 A 11 GLY HAx H 1 3.428 0.020 A 11 GLY C C 13 170.116 0.3 A 11 GLY CA C 13 40.181 0.3 A 11 GLY N N 15 106.531 0.3 A 12 CYS H H 1 8.389 0.020 A 12 CYS HA H 1 4.534 0.020 A 12 CYS HBy H 1 2.987 0.020 A 12 CYS HBx H 1 2.949 0.020 A 12 CYS CA C 13 52.311 0.3 A 12 CYS CB C 13 29.794 0.3 A 12 CYS N N 15 117.673 0.3 A 13 TYR H H 1 8.600 0.020 A 13 TYR HA H 1 4.209 0.020 A 13 TYR HB2 H 1 1.596 0.020 A 13 TYR HB3 H 1 1.442 0.020 A 13 TYR CA C 13 51.393 0.3 A 13 TYR CB C 13 38.140 0.3 A 13 TYR N N 15 126.755 0.3 A 14 ASN H H 1 8.569 0.020 A 14 ASN HA H 1 5.012 0.020 A 14 ASN HB2 H 1 2.621 0.020 A 14 ASN HB3 H 1 3.239 0.020 A 14 ASN HD21 H 1 8.318 0.020 A 14 ASN HD22 H 1 6.946 0.020 A 14 ASN C C 13 170.449 0.3 A 14 ASN CA C 13 49.288 0.3 A 14 ASN CB C 13 32.887 0.3 A 14 ASN N N 15 119.707 0.3 A 14 ASN ND2 N 15 114.592 0.3 A 15 ASN H H 1 9.678 0.020 A 15 ASN HA H 1 5.530 0.020 A 15 ASN HB2 H 1 2.725 0.020 A 15 ASN HB3 H 1 2.960 0.020 A 15 ASN HD21 H 1 7.556 0.020 A 15 ASN HD22 H 1 7.029 0.020 A 15 ASN C C 13 170.150 0.3 A 15 ASN CA C 13 48.018 0.3 A 15 ASN CB C 13 38.462 0.3 A 15 ASN N N 15 115.089 0.3 A 15 ASN ND2 N 15 111.830 0.3 A 16 SER H H 1 8.590 0.020 A 16 SER HA H 1 3.903 0.020 A 16 SER HB2 H 1 2.928 0.020 A 16 SER HB3 H 1 2.947 0.020 A 16 SER C C 13 169.950 0.3 A 16 SER CA C 13 55.927 0.3 A 16 SER CB C 13 57.851 0.3 A 16 SER N N 15 114.015 0.3 A 17 HIS H H 1 8.063 0.020 A 17 HIS HA H 1 4.469 0.020 A 17 HIS HB2 H 1 3.072 0.020 A 17 HIS HB3 H 1 2.990 0.020 A 17 HIS HD2 H 1 6.829 0.020 A 17 HIS HE1 H 1 7.655 0.020 A 17 HIS C C 13 171.412 0.3 A 17 HIS CA C 13 53.275 0.3 A 17 HIS CB C 13 25.804 0.3 A 17 HIS CD2 C 13 113.970 0.3 A 17 HIS CE1 C 13 133.855 0.3 A 17 HIS N N 15 117.910 0.3 A 18 ARG H H 1 7.985 0.020 A 18 ARG HA H 1 4.141 0.020 A 18 ARG HBy H 1 1.904 0.020 A 18 ARG HBx H 1 1.877 0.020 A 18 ARG HDy H 1 3.343 0.020 A 18 ARG HDx H 1 3.315 0.020 A 18 ARG HGy H 1 1.572 0.020 A 18 ARG HGx H 1 1.516 0.020 A 18 ARG C C 13 172.021 0.3 A 18 ARG CA C 13 52.834 0.3 A 18 ARG CB C 13 27.660 0.3 A 18 ARG CD C 13 38.692 0.3 A 18 ARG CG C 13 22.563 0.3 A 18 ARG N N 15 114.946 0.3 A 19 ASP H H 1 8.542 0.020 A 19 ASP HA H 1 4.969 0.020 A 19 ASP HB2 H 1 2.518 0.020 A 19 ASP HB3 H 1 2.953 0.020 A 19 ASP C C 13 171.351 0.3 A 19 ASP CA C 13 48.420 0.3 A 19 ASP CB C 13 36.012 0.3 A 19 ASP N N 15 116.589 0.3 A 20 LYS H H 1 7.647 0.020 A 20 LYS HA H 1 4.092 0.020 A 20 LYS HB2 H 1 1.888 0.020 A 20 LYS HB3 H 1 1.779 0.020 A 20 LYS HDy H 1 1.706 0.020 A 20 LYS HDx H 1 1.655 0.020 A 20 LYS HEx H 1 2.963 0.020 A 20 LYS HEy H 1 3.031 0.020 A 20 LYS HGy H 1 1.476 0.020 A 20 LYS HGx H 1 1.424 0.020 A 20 LYS C C 13 172.287 0.3 A 20 LYS CA C 13 54.257 0.3 A 20 LYS CB C 13 27.688 0.3 A 20 LYS CD C 13 23.991 0.3 A 20 LYS CE C 13 37.151 0.3 A 20 LYS CG C 13 20.007 0.3 A 20 LYS N N 15 115.022 0.3 A 21 ALA H H 1 8.464 0.020 A 21 ALA HA H 1 4.348 0.020 A 21 ALA HB% H 1 1.343 0.020 A 21 ALA C C 13 173.371 0.3 A 21 ALA CA C 13 47.090 0.3 A 21 ALA CB C 13 14.073 0.3 A 21 ALA N N 15 115.281 0.3 A 22 LEU H H 1 7.066 0.020 A 22 LEU HA H 1 3.976 0.020 A 22 LEU HB2 H 1 1.009 0.020 A 22 LEU HB3 H 1 1.732 0.020 A 22 LEU HD1% H 1 0.637 0.020 A 22 LEU HD2% H 1 0.845 0.020 A 22 LEU HG H 1 1.516 0.020 A 22 LEU C C 13 170.947 0.3 A 22 LEU CA C 13 49.122 0.3 A 22 LEU CB C 13 37.963 0.3 A 22 LEU CD1 C 13 17.027 0.3 A 22 LEU CD2 C 13 22.156 0.3 A 22 LEU CG C 13 22.119 0.3 A 22 LEU N N 15 113.217 0.3 A 23 HIS H H 1 7.902 0.020 A 23 HIS HA H 1 4.736 0.020 A 23 HIS HB2 H 1 2.378 0.020 A 23 HIS HB3 H 1 2.507 0.020 A 23 HIS HE1 H 1 7.774 0.020 A 23 HIS C C 13 168.323 0.3 A 23 HIS CA C 13 49.093 0.3 A 23 HIS CB C 13 27.962 0.3 A 23 HIS CE1 C 13 134.088 0.3 A 23 HIS N N 15 114.791 0.3 A 24 PHE H H 1 8.373 0.020 A 24 PHE HA H 1 4.398 0.020 A 24 PHE HBy H 1 2.678 0.020 A 24 PHE HBx H 1 2.202 0.020 A 24 PHE HDx H 1 6.844 0.020 A 24 PHE HDy H 1 6.844 0.020 A 24 PHE HEx H 1 7.069 0.020 A 24 PHE HEy H 1 7.069 0.020 A 24 PHE HZ H 1 6.750 0.020 A 24 PHE C C 13 170.283 0.3 A 24 PHE CA C 13 52.101 0.3 A 24 PHE CB C 13 36.348 0.3 A 24 PHE CDx C 13 125.915 0.3 A 24 PHE CDy C 13 125.915 0.3 A 24 PHE CEx C 13 126.843 0.3 A 24 PHE CEy C 13 126.843 0.3 A 24 PHE CZ C 13 123.676 0.3 A 24 PHE N N 15 114.253 0.3 A 25 TYR H H 1 9.066 0.020 A 25 TYR HA H 1 5.091 0.020 A 25 TYR HB2 H 1 3.568 0.020 A 25 TYR HB3 H 1 2.909 0.020 A 25 TYR HDx H 1 7.025 0.020 A 25 TYR HDy H 1 7.025 0.020 A 25 TYR HEx H 1 6.243 0.020 A 25 TYR HEy H 1 6.243 0.020 A 25 TYR C C 13 172.065 0.3 A 25 TYR CA C 13 51.810 0.3 A 25 TYR CB C 13 36.149 0.3 A 25 TYR CDx C 13 128.275 0.3 A 25 TYR CDy C 13 128.275 0.3 A 25 TYR CEx C 13 113.432 0.3 A 25 TYR CEy C 13 113.432 0.3 A 25 TYR N N 15 120.694 0.3 A 26 THR H H 1 8.321 0.020 A 26 THR HA H 1 4.739 0.020 A 26 THR HB H 1 4.527 0.020 A 26 THR HG2% H 1 1.273 0.020 A 26 THR C C 13 169.718 0.3 A 26 THR CA C 13 55.832 0.3 A 26 THR CB C 13 65.109 0.3 A 26 THR CG2 C 13 17.183 0.3 A 26 THR N N 15 108.139 0.3 A 27 PHE H H 1 9.151 0.020 A 27 PHE HA H 1 4.023 0.020 A 27 PHE HB2 H 1 2.405 0.020 A 27 PHE HB3 H 1 3.088 0.020 A 27 PHE HDx H 1 7.427 0.020 A 27 PHE HDy H 1 7.427 0.020 A 27 PHE HEx H 1 7.408 0.020 A 27 PHE HEy H 1 7.408 0.020 A 27 PHE HZ H 1 7.274 0.020 A 27 PHE CA C 13 52.275 0.3 A 27 PHE CB C 13 33.071 0.3 A 27 PHE CDx C 13 126.532 0.3 A 27 PHE CDy C 13 126.532 0.3 A 27 PHE CEx C 13 127.506 0.3 A 27 PHE CEy C 13 127.506 0.3 A 27 PHE CZ C 13 125.267 0.3 A 27 PHE N N 15 116.042 0.3 A 28 PRO HA H 1 4.086 0.020 A 28 PRO HBy H 1 2.207 0.020 A 28 PRO HBx H 1 1.520 0.020 A 28 PRO HDy H 1 2.128 0.020 A 28 PRO HDx H 1 1.295 0.020 A 28 PRO HGy H 1 0.887 0.020 A 28 PRO HGx H 1 0.650 0.020 A 28 PRO CA C 13 57.639 0.3 A 28 PRO CB C 13 27.566 0.3 A 28 PRO CD C 13 44.595 0.3 A 28 PRO CG C 13 22.070 0.3 A 29 LYS HA H 1 4.039 0.020 A 29 LYS HBy H 1 1.790 0.020 A 29 LYS HBx H 1 1.718 0.020 A 29 LYS HGy H 1 1.472 0.020 A 29 LYS HGx H 1 1.436 0.020 A 29 LYS C C 13 172.663 0.3 A 29 LYS CA C 13 52.734 0.3 A 29 LYS CB C 13 27.820 0.3 A 29 LYS CD C 13 23.909 0.3 A 29 LYS CE C 13 37.096 0.3 A 29 LYS CG C 13 20.213 0.3 A 30 ASP H H 1 7.568 0.020 A 30 ASP HA H 1 4.346 0.020 A 30 ASP HB2 H 1 2.659 0.020 A 30 ASP HB3 H 1 2.525 0.020 A 30 ASP C C 13 171.246 0.3 A 30 ASP CA C 13 49.645 0.3 A 30 ASP CB C 13 37.966 0.3 A 30 ASP N N 15 116.236 0.3 A 31 ALA H H 1 8.763 0.020 A 31 ALA HA H 1 3.814 0.020 A 31 ALA HB% H 1 1.456 0.020 A 31 ALA C C 13 175.254 0.3 A 31 ALA CA C 13 50.879 0.3 A 31 ALA CB C 13 13.959 0.3 A 31 ALA N N 15 125.611 0.3 A 32 GLU H H 1 8.174 0.020 A 32 GLU HA H 1 4.199 0.020 A 32 GLU HB2 H 1 2.092 0.020 A 32 GLU HB3 H 1 2.050 0.020 A 32 GLU HGy H 1 2.288 0.020 A 32 GLU HGx H 1 2.273 0.020 A 32 GLU C C 13 174.080 0.3 A 32 GLU CA C 13 54.175 0.3 A 32 GLU CB C 13 23.896 0.3 A 32 GLU CG C 13 30.839 0.3 A 32 GLU N N 15 114.737 0.3 A 33 LEU H H 1 8.311 0.020 A 33 LEU HA H 1 4.210 0.020 A 33 LEU HBy H 1 1.623 0.020 A 33 LEU HBx H 1 1.441 0.020 A 33 LEU HD1% H 1 1.079 0.020 A 33 LEU HD2% H 1 0.968 0.020 A 33 LEU HG H 1 1.649 0.020 A 33 LEU C C 13 174.169 0.3 A 33 LEU CA C 13 51.779 0.3 A 33 LEU CB C 13 36.840 0.3 A 33 LEU CD1 C 13 19.504 0.3 A 33 LEU CD2 C 13 19.709 0.3 A 33 LEU CG C 13 22.115 0.3 A 33 LEU N N 15 117.709 0.3 A 34 ARG H H 1 8.655 0.020 A 34 ARG HA H 1 3.466 0.020 A 34 ARG HB2 H 1 1.902 0.020 A 34 ARG HB3 H 1 1.801 0.020 A 34 ARG HDy H 1 3.170 0.020 A 34 ARG HDx H 1 3.122 0.020 A 34 ARG HGy H 1 1.450 0.020 A 34 ARG HGx H 1 1.437 0.020 A 34 ARG C C 13 173.017 0.3 A 34 ARG CA C 13 55.958 0.3 A 34 ARG CB C 13 24.988 0.3 A 34 ARG CD C 13 38.692 0.3 A 34 ARG CG C 13 23.741 0.3 A 34 ARG N N 15 114.665 0.3 A 35 ARG H H 1 7.882 0.020 A 35 ARG HA H 1 4.019 0.020 A 35 ARG HBy H 1 2.061 0.020 A 35 ARG HBx H 1 2.025 0.020 A 35 ARG HDy H 1 3.267 0.020 A 35 ARG HDx H 1 3.213 0.020 A 35 ARG HGy H 1 1.806 0.020 A 35 ARG HGx H 1 1.566 0.020 A 35 ARG C C 13 174.412 0.3 A 35 ARG CA C 13 55.091 0.3 A 35 ARG CB C 13 25.252 0.3 A 35 ARG CD C 13 38.356 0.3 A 35 ARG CG C 13 23.153 0.3 A 35 ARG N N 15 114.258 0.3 A 36 LEU H H 1 7.854 0.020 A 36 LEU HA H 1 4.207 0.020 A 36 LEU HBy H 1 2.214 0.020 A 36 LEU HBx H 1 1.734 0.020 A 36 LEU HD1% H 1 1.001 0.020 A 36 LEU HD2% H 1 0.933 0.020 A 36 LEU HG H 1 1.948 0.020 A 36 LEU C C 13 175.021 0.3 A 36 LEU CA C 13 52.805 0.3 A 36 LEU CB C 13 37.024 0.3 A 36 LEU CD1 C 13 20.067 0.3 A 36 LEU CD2 C 13 18.356 0.3 A 36 LEU CG C 13 22.141 0.3 A 36 LEU N N 15 116.479 0.3 A 37 TRP H H 1 8.925 0.020 A 37 TRP HA H 1 4.123 0.020 A 37 TRP HBy H 1 3.643 0.020 A 37 TRP HBx H 1 3.131 0.020 A 37 TRP HD1 H 1 7.433 0.020 A 37 TRP HE1 H 1 10.532 0.020 A 37 TRP HE3 H 1 6.485 0.020 A 37 TRP HH2 H 1 6.979 0.020 A 37 TRP HZ2 H 1 7.346 0.020 A 37 TRP HZ3 H 1 6.546 0.020 A 37 TRP C C 13 173.427 0.3 A 37 TRP CA C 13 57.596 0.3 A 37 TRP CB C 13 24.001 0.3 A 37 TRP CD1 C 13 120.124 0.3 A 37 TRP CE3 C 13 115.814 0.3 A 37 TRP CH2 C 13 120.710 0.3 A 37 TRP CZ2 C 13 109.526 0.3 A 37 TRP CZ3 C 13 118.200 0.3 A 37 TRP N N 15 115.964 0.3 A 37 TRP NE1 N 15 124.703 0.3 A 38 LEU H H 1 8.653 0.020 A 38 LEU HA H 1 4.100 0.020 A 38 LEU HB2 H 1 1.949 0.020 A 38 LEU HB3 H 1 1.660 0.020 A 38 LEU HD1% H 1 0.790 0.020 A 38 LEU HD2% H 1 0.861 0.020 A 38 LEU HG H 1 1.902 0.020 A 38 LEU C C 13 174.623 0.3 A 38 LEU CA C 13 53.431 0.3 A 38 LEU CB C 13 36.632 0.3 A 38 LEU CD1 C 13 18.759 0.3 A 38 LEU CD2 C 13 20.531 0.3 A 38 LEU CG C 13 22.397 0.3 A 38 LEU N N 15 113.757 0.3 A 39 LYS H H 1 8.442 0.020 A 39 LYS HA H 1 3.996 0.020 A 39 LYS HBy H 1 1.985 0.020 A 39 LYS HBx H 1 1.958 0.020 A 39 LYS HDy H 1 1.677 0.020 A 39 LYS HDx H 1 1.644 0.020 A 39 LYS HEy H 1 2.969 0.020 A 39 LYS HEx H 1 2.916 0.020 A 39 LYS HGy H 1 1.489 0.020 A 39 LYS HGx H 1 1.411 0.020 A 39 LYS C C 13 173.792 0.3 A 39 LYS CA C 13 54.307 0.3 A 39 LYS CB C 13 27.273 0.3 A 39 LYS CD C 13 24.831 0.3 A 39 LYS CG C 13 19.793 0.3 A 39 LYS N N 15 117.486 0.3 A 40 ASN H H 1 7.700 0.020 A 40 ASN HA H 1 4.336 0.020 A 40 ASN HBy H 1 2.754 0.020 A 40 ASN HBx H 1 2.735 0.020 A 40 ASN HD21 H 1 7.399 0.020 A 40 ASN HD22 H 1 7.144 0.020 A 40 ASN C C 13 172.253 0.3 A 40 ASN CA C 13 50.450 0.3 A 40 ASN CB C 13 32.433 0.3 A 40 ASN N N 15 114.729 0.3 A 40 ASN ND2 N 15 105.500 0.3 A 41 VAL H H 1 8.200 0.020 A 41 VAL HA H 1 2.710 0.020 A 41 VAL HB H 1 1.915 0.020 A 41 VAL HG1% H 1 0.923 0.020 A 41 VAL HG2% H 1 0.542 0.020 A 41 VAL C C 13 172.114 0.3 A 41 VAL CA C 13 60.204 0.3 A 41 VAL CB C 13 27.158 0.3 A 41 VAL CG1 C 13 18.098 0.3 A 41 VAL CG2 C 13 16.954 0.3 A 41 VAL N N 15 114.568 0.3 A 42 SER H H 1 7.812 0.020 A 42 SER HA H 1 4.101 0.020 A 42 SER HBy H 1 3.960 0.020 A 42 SER HBx H 1 3.941 0.020 A 42 SER C C 13 170.460 0.3 A 42 SER CA C 13 55.713 0.3 A 42 SER CB C 13 58.458 0.3 A 42 SER N N 15 109.724 0.3 A 43 ARG H H 1 7.324 0.020 A 43 ARG HA H 1 4.126 0.020 A 43 ARG HBy H 1 1.913 0.020 A 43 ARG HBx H 1 1.711 0.020 A 43 ARG HDy H 1 3.128 0.020 A 43 ARG HDx H 1 3.107 0.020 A 43 ARG HGy H 1 1.658 0.020 A 43 ARG HGx H 1 1.577 0.020 A 43 ARG C C 13 171.512 0.3 A 43 ARG CA C 13 51.894 0.3 A 43 ARG CB C 13 25.021 0.3 A 43 ARG CD C 13 38.440 0.3 A 43 ARG CG C 13 21.595 0.3 A 43 ARG N N 15 115.998 0.3 A 44 ALA H H 1 7.450 0.020 A 44 ALA HA H 1 4.103 0.020 A 44 ALA HB% H 1 1.133 0.020 A 44 ALA C C 13 173.003 0.3 A 44 ALA CA C 13 47.830 0.3 A 44 ALA CB C 13 14.379 0.3 A 44 ALA N N 15 118.089 0.3 A 45 GLY H H 1 7.960 0.020 A 45 GLY HAy H 1 3.913 0.020 A 45 GLY HAx H 1 3.849 0.020 A 45 GLY C C 13 169.430 0.3 A 45 GLY CA C 13 40.416 0.3 A 45 GLY N N 15 102.813 0.3 A 46 VAL H H 1 7.949 0.020 A 46 VAL HA H 1 4.105 0.020 A 46 VAL HB H 1 2.108 0.020 A 46 VAL HGx% H 1 0.902 0.020 A 46 VAL HGy% H 1 0.904 0.020 A 46 VAL C C 13 171.855 0.3 A 46 VAL CA C 13 57.893 0.3 A 46 VAL CB C 13 27.282 0.3 A 46 VAL CGy C 13 16.600 0.3 A 46 VAL CGx C 13 16.051 0.3 A 46 VAL N N 15 114.900 0.3 A 47 SER H H 1 8.411 0.020 A 47 SER HA H 1 4.381 0.020 A 47 SER HBy H 1 3.908 0.020 A 47 SER HBx H 1 3.871 0.020 A 47 SER C C 13 170.207 0.3 A 47 SER CA C 13 54.091 0.3 A 47 SER CB C 13 58.956 0.3 A 47 SER N N 15 114.467 0.3 A 48 GLY H H 1 8.343 0.020 A 48 GLY HAx H 1 3.923 0.020 A 48 GLY HAy H 1 4.002 0.020 A 48 GLY C C 13 167.958 0.3 A 48 GLY CA C 13 40.326 0.3 A 48 GLY N N 15 106.726 0.3 A 49 CYS H H 1 8.105 0.020 A 49 CYS HA H 1 4.400 0.020 A 49 CYS HBy H 1 2.829 0.020 A 49 CYS HBx H 1 2.806 0.020 A 49 CYS C C 13 169.729 0.3 A 49 CYS CA C 13 53.844 0.3 A 49 CYS CB C 13 22.789 0.3 A 49 CYS N N 15 114.545 0.3 A 50 PHE H H 1 8.444 0.020 A 50 PHE HA H 1 4.652 0.020 A 50 PHE HBy H 1 3.151 0.020 A 50 PHE HBx H 1 2.980 0.020 A 50 PHE HDx H 1 7.134 0.020 A 50 PHE HDy H 1 7.134 0.020 A 50 PHE C C 13 171.102 0.3 A 50 PHE CA C 13 53.077 0.3 A 50 PHE CB C 13 34.505 0.3 A 50 PHE CDx C 13 126.842 0.3 A 50 PHE CDy C 13 126.842 0.3 A 50 PHE N N 15 118.540 0.3 A 51 SER H H 1 8.156 0.020 A 51 SER HA H 1 4.392 0.020 A 51 SER HBy H 1 3.891 0.020 A 51 SER HBx H 1 3.874 0.020 A 51 SER C C 13 169.947 0.3 A 51 SER CA C 13 54.421 0.3 A 51 SER CB C 13 58.190 0.3 A 51 SER N N 15 112.478 0.3 A 52 THR H H 1 7.986 0.020 A 52 THR HA H 1 4.292 0.020 A 52 THR HB H 1 4.231 0.020 A 52 THR HG2% H 1 1.129 0.020 A 52 THR C C 13 169.142 0.3 A 52 THR CA C 13 57.140 0.3 A 52 THR CB C 13 64.488 0.3 A 52 THR CG2 C 13 16.769 0.3 A 52 THR N N 15 110.333 0.3 A 53 PHE H H 1 7.959 0.020 A 53 PHE HA H 1 4.408 0.020 A 53 PHE HBy H 1 2.895 0.020 A 53 PHE HBx H 1 2.704 0.020 A 53 PHE HDx H 1 6.930 0.020 A 53 PHE HDy H 1 6.930 0.020 A 53 PHE HEx H 1 6.740 0.020 A 53 PHE HEy H 1 6.740 0.020 A 53 PHE HZ H 1 6.311 0.020 A 53 PHE C C 13 169.297 0.3 A 53 PHE CA C 13 53.008 0.3 A 53 PHE CB C 13 34.703 0.3 A 53 PHE CDx C 13 126.724 0.3 A 53 PHE CDy C 13 126.724 0.3 A 53 PHE CEx C 13 126.698 0.3 A 53 PHE CEy C 13 126.698 0.3 A 53 PHE CZ C 13 122.078 0.3 A 53 PHE N N 15 120.210 0.3 A 54 GLN H H 1 7.824 0.020 A 54 GLN HA H 1 4.452 0.020 A 54 GLN HB2 H 1 1.819 0.020 A 54 GLN HB3 H 1 1.697 0.020 A 54 GLN HE21 H 1 7.373 0.020 A 54 GLN HE22 H 1 6.733 0.020 A 54 GLN HGy H 1 2.160 0.020 A 54 GLN HGx H 1 2.140 0.020 A 54 GLN CA C 13 46.896 0.3 A 54 GLN CB C 13 24.629 0.3 A 54 GLN CG C 13 28.220 0.3 A 54 GLN N N 15 121.621 0.3 A 54 GLN NE2 N 15 108.409 0.3 A 55 PRO HA H 1 4.146 0.020 A 55 PRO HBy H 1 1.611 0.020 A 55 PRO HBx H 1 1.516 0.020 A 55 PRO HDy H 1 3.395 0.020 A 55 PRO HDx H 1 2.970 0.020 A 55 PRO HGy H 1 1.114 0.020 A 55 PRO HGx H 1 1.064 0.020 A 55 PRO C C 13 172.198 0.3 A 55 PRO CA C 13 57.447 0.3 A 55 PRO CB C 13 26.985 0.3 A 55 PRO CD C 13 45.213 0.3 A 55 PRO CG C 13 21.715 0.3 A 56 THR HA H 1 4.185 0.020 A 56 THR HB H 1 4.293 0.020 A 56 THR HG2% H 1 1.289 0.020 A 56 THR CA C 13 59.525 0.3 A 56 THR CB C 13 64.091 0.3 A 56 THR CG2 C 13 16.686 0.3 A 57 THR H H 1 8.450 0.020 A 57 THR HA H 1 4.604 0.020 A 57 THR HB H 1 4.354 0.020 A 57 THR HG2% H 1 1.149 0.020 A 57 THR CA C 13 55.743 0.3 A 57 THR CB C 13 66.564 0.3 A 57 THR CG2 C 13 16.605 0.3 A 57 THR N N 15 105.615 0.3 A 58 GLY HAy H 1 4.119 0.020 A 58 GLY HAx H 1 3.807 0.020 A 58 GLY C C 13 169.696 0.3 A 58 GLY CA C 13 40.200 0.3 A 59 HIS H H 1 7.659 0.020 A 59 HIS HA H 1 4.806 0.020 A 59 HIS HBy H 1 3.436 0.020 A 59 HIS HBx H 1 3.328 0.020 A 59 HIS HD2 H 1 7.171 0.020 A 59 HIS HE1 H 1 7.774 0.020 A 59 HIS C C 13 171.345 0.3 A 59 HIS CA C 13 52.814 0.3 A 59 HIS CB C 13 28.018 0.3 A 59 HIS CD2 C 13 112.435 0.3 A 59 HIS CE1 C 13 128.421 0.3 A 59 HIS N N 15 116.743 0.3 A 60 ARG H H 1 9.427 0.020 A 60 ARG HA H 1 5.415 0.020 A 60 ARG HB2 H 1 1.512 0.020 A 60 ARG HB3 H 1 1.849 0.020 A 60 ARG HDx H 1 2.220 0.020 A 60 ARG HDy H 1 2.669 0.020 A 60 ARG HGy H 1 1.351 0.020 A 60 ARG HGx H 1 1.263 0.020 A 60 ARG C C 13 169.441 0.3 A 60 ARG CA C 13 48.686 0.3 A 60 ARG CB C 13 30.840 0.3 A 60 ARG CD C 13 38.020 0.3 A 60 ARG CG C 13 22.451 0.3 A 60 ARG N N 15 116.292 0.3 A 61 LEU H H 1 9.343 0.020 A 61 LEU HA H 1 5.703 0.020 A 61 LEU HB2 H 1 1.601 0.020 A 61 LEU HB3 H 1 1.889 0.020 A 61 LEU HD1% H 1 0.632 0.020 A 61 LEU HD2% H 1 0.694 0.020 A 61 LEU HG H 1 1.810 0.020 A 61 LEU C C 13 171.423 0.3 A 61 LEU CA C 13 49.327 0.3 A 61 LEU CB C 13 41.722 0.3 A 61 LEU CD1 C 13 22.831 0.3 A 61 LEU CD2 C 13 22.812 0.3 A 61 LEU CG C 13 23.059 0.3 A 61 LEU N N 15 119.748 0.3 A 62 CYS H H 1 10.116 0.020 A 62 CYS HA H 1 4.926 0.020 A 62 CYS HB2 H 1 2.532 0.020 A 62 CYS HB3 H 1 2.421 0.020 A 62 CYS C C 13 171.040 0.3 A 62 CYS CA C 13 53.983 0.3 A 62 CYS CB C 13 26.788 0.3 A 62 CYS N N 15 126.048 0.3 A 63 SER H H 1 7.531 0.020 A 63 SER HA H 1 4.148 0.020 A 63 SER HBy H 1 3.721 0.020 A 63 SER HBx H 1 3.694 0.020 A 63 SER C C 13 171.412 0.3 A 63 SER CA C 13 55.482 0.3 A 63 SER CB C 13 56.970 0.3 A 63 SER N N 15 103.779 0.3 A 64 VAL H H 1 7.985 0.020 A 64 VAL HA H 1 3.982 0.020 A 64 VAL HB H 1 1.895 0.020 A 64 VAL HG1% H 1 0.664 0.020 A 64 VAL HG2% H 1 0.316 0.020 A 64 VAL C C 13 171.591 0.3 A 64 VAL CA C 13 58.716 0.3 A 64 VAL CB C 13 25.540 0.3 A 64 VAL CG1 C 13 15.990 0.3 A 64 VAL CG2 C 13 14.790 0.3 A 64 VAL N N 15 114.730 0.3 A 65 HIS H H 1 6.407 0.020 A 65 HIS HA H 1 4.702 0.020 A 65 HIS HB2 H 1 2.441 0.020 A 65 HIS HB3 H 1 2.013 0.020 A 65 HIS HD1 H 1 11.290 0.020 A 65 HIS HD2 H 1 7.824 0.020 A 65 HIS HE1 H 1 8.090 0.020 A 65 HIS C C 13 168.695 0.3 A 65 HIS CA C 13 49.108 0.3 A 65 HIS CB C 13 23.593 0.3 A 65 HIS CE1 C 13 135.096 0.3 A 65 HIS N N 15 108.992 0.3 A 65 HIS ND1 N 15 127.022 0.3 A 66 PHE H H 1 7.374 0.020 A 66 PHE HA H 1 4.332 0.020 A 66 PHE HBy H 1 2.565 0.020 A 66 PHE HBx H 1 2.491 0.020 A 66 PHE HDx H 1 6.862 0.020 A 66 PHE HDy H 1 6.862 0.020 A 66 PHE HEx H 1 6.583 0.020 A 66 PHE HEy H 1 6.583 0.020 A 66 PHE HZ H 1 6.096 0.020 A 66 PHE C C 13 170.415 0.3 A 66 PHE CA C 13 51.095 0.3 A 66 PHE CB C 13 34.655 0.3 A 66 PHE CDx C 13 126.215 0.3 A 66 PHE CDy C 13 126.215 0.3 A 66 PHE CEx C 13 126.723 0.3 A 66 PHE CEy C 13 126.723 0.3 A 66 PHE CZ C 13 124.649 0.3 A 66 PHE N N 15 115.291 0.3 A 67 GLN H H 1 8.871 0.020 A 67 GLN HA H 1 3.934 0.020 A 67 GLN HB2 H 1 1.860 0.020 A 67 GLN HB3 H 1 2.055 0.020 A 67 GLN HE21 H 1 7.500 0.020 A 67 GLN HE22 H 1 6.830 0.020 A 67 GLN HGy H 1 2.294 0.020 A 67 GLN HGx H 1 2.272 0.020 A 67 GLN C C 13 171.700 0.3 A 67 GLN CA C 13 52.759 0.3 A 67 GLN CB C 13 23.359 0.3 A 67 GLN CG C 13 28.384 0.3 A 67 GLN N N 15 122.948 0.3 A 67 GLN NE2 N 15 108.436 0.3 A 68 GLY H H 1 9.115 0.020 A 68 GLY HAy H 1 4.214 0.020 A 68 GLY HAx H 1 3.710 0.020 A 68 GLY C C 13 170.489 0.3 A 68 GLY CA C 13 40.606 0.3 A 68 GLY N N 15 112.776 0.3 A 69 GLY H H 1 8.806 0.020 A 69 GLY HAy H 1 3.983 0.020 A 69 GLY HAx H 1 3.928 0.020 A 69 GLY C C 13 169.031 0.3 A 69 GLY CA C 13 40.956 0.3 A 69 GLY N N 15 104.018 0.3 A 70 ARG H H 1 7.027 0.020 A 70 ARG HA H 1 4.401 0.020 A 70 ARG HBy H 1 1.669 0.020 A 70 ARG HBx H 1 1.494 0.020 A 70 ARG HDy H 1 3.073 0.020 A 70 ARG HDx H 1 2.975 0.020 A 70 ARG HGy H 1 1.425 0.020 A 70 ARG HGx H 1 1.355 0.020 A 70 ARG C C 13 168.799 0.3 A 70 ARG CA C 13 50.146 0.3 A 70 ARG CB C 13 28.502 0.3 A 70 ARG CD C 13 38.649 0.3 A 70 ARG CG C 13 21.473 0.3 A 70 ARG N N 15 110.142 0.3 A 71 LYS H H 1 7.257 0.020 A 71 LYS HA H 1 4.066 0.020 A 71 LYS HB2 H 1 -0.530 0.020 A 71 LYS HB3 H 1 0.344 0.020 A 71 LYS HDy H 1 1.579 0.020 A 71 LYS HDx H 1 0.747 0.020 A 71 LYS HEy H 1 2.822 0.020 A 71 LYS HEx H 1 2.361 0.020 A 71 LYS HGy H 1 1.161 0.020 A 71 LYS HGx H 1 0.810 0.020 A 71 LYS C C 13 171.312 0.3 A 71 LYS CA C 13 50.524 0.3 A 71 LYS CB C 13 26.902 0.3 A 71 LYS CD C 13 24.161 0.3 A 71 LYS CE C 13 35.786 0.3 A 71 LYS CG C 13 18.160 0.3 A 71 LYS N N 15 119.921 0.3 A 72 THR H H 1 8.594 0.020 A 72 THR HA H 1 4.686 0.020 A 72 THR HB H 1 4.606 0.020 A 72 THR HG2% H 1 0.989 0.020 A 72 THR C C 13 170.800 0.3 A 72 THR CA C 13 54.774 0.3 A 72 THR CB C 13 67.951 0.3 A 72 THR CG2 C 13 16.633 0.3 A 72 THR N N 15 115.572 0.3 A 73 TYR H H 1 7.124 0.020 A 73 TYR HA H 1 4.253 0.020 A 73 TYR HBy H 1 3.132 0.020 A 73 TYR HBx H 1 3.029 0.020 A 73 TYR HDx H 1 7.137 0.020 A 73 TYR HDy H 1 7.137 0.020 A 73 TYR HEx H 1 6.816 0.020 A 73 TYR HEy H 1 6.816 0.020 A 73 TYR C C 13 171.902 0.3 A 73 TYR CA C 13 55.821 0.3 A 73 TYR CB C 13 33.150 0.3 A 73 TYR CDx C 13 128.328 0.3 A 73 TYR CDy C 13 128.328 0.3 A 73 TYR CEx C 13 113.089 0.3 A 73 TYR CEy C 13 113.089 0.3 A 73 TYR N N 15 105.371 0.3 A 74 THR H H 1 7.673 0.020 A 74 THR HA H 1 4.251 0.020 A 74 THR HB H 1 4.097 0.020 A 74 THR HG2% H 1 1.148 0.020 A 74 THR C C 13 170.017 0.3 A 74 THR CA C 13 57.912 0.3 A 74 THR CB C 13 64.495 0.3 A 74 THR CG2 C 13 16.771 0.3 A 74 THR N N 15 103.955 0.3 A 75 VAL H H 1 7.705 0.020 A 75 VAL HA H 1 4.182 0.020 A 75 VAL HB H 1 2.387 0.020 A 75 VAL HG1% H 1 0.897 0.020 A 75 VAL HG2% H 1 1.315 0.020 A 75 VAL C C 13 169.397 0.3 A 75 VAL CA C 13 57.630 0.3 A 75 VAL CB C 13 25.729 0.3 A 75 VAL CG1 C 13 15.593 0.3 A 75 VAL CG2 C 13 17.675 0.3 A 75 VAL N N 15 123.608 0.3 A 76 ARG H H 1 8.123 0.020 A 76 ARG HA H 1 4.594 0.020 A 76 ARG HB2 H 1 2.042 0.020 A 76 ARG HB3 H 1 1.861 0.020 A 76 ARG HDy H 1 3.186 0.020 A 76 ARG HDx H 1 3.158 0.020 A 76 ARG HGy H 1 1.609 0.020 A 76 ARG HGx H 1 1.474 0.020 A 76 ARG C C 13 171.662 0.3 A 76 ARG CA C 13 51.507 0.3 A 76 ARG CB C 13 27.941 0.3 A 76 ARG CD C 13 38.529 0.3 A 76 ARG CG C 13 22.223 0.3 A 76 ARG N N 15 116.481 0.3 A 77 VAL H H 1 7.629 0.020 A 77 VAL HA H 1 4.329 0.020 A 77 VAL HB H 1 1.876 0.020 A 77 VAL HG1% H 1 1.008 0.020 A 77 VAL HG2% H 1 0.849 0.020 A 77 VAL CA C 13 52.958 0.3 A 77 VAL CB C 13 31.178 0.3 A 77 VAL CG1 C 13 16.943 0.3 A 77 VAL CG2 C 13 16.134 0.3 A 77 VAL N N 15 113.786 0.3 A 78 PRO HA H 1 3.009 0.020 A 78 PRO HBy H 1 1.024 0.020 A 78 PRO HBx H 1 -0.096 0.020 A 78 PRO HDy H 1 2.603 0.020 A 78 PRO HDx H 1 1.364 0.020 A 78 PRO HGy H 1 1.708 0.020 A 78 PRO HGx H 1 0.671 0.020 A 78 PRO C C 13 170.009 0.3 A 78 PRO CA C 13 57.013 0.3 A 78 PRO CB C 13 26.119 0.3 A 78 PRO CD C 13 42.714 0.3 A 78 PRO CG C 13 20.195 0.3 A 79 THR H H 1 7.340 0.020 A 79 THR HA H 1 4.527 0.020 A 79 THR HB H 1 4.329 0.020 A 79 THR HG2% H 1 0.942 0.020 A 79 THR C C 13 169.231 0.3 A 79 THR CA C 13 56.392 0.3 A 79 THR CB C 13 66.561 0.3 A 79 THR CG2 C 13 16.488 0.3 A 79 THR N N 15 105.629 0.3 A 80 ILE H H 1 7.932 0.020 A 80 ILE HA H 1 3.974 0.020 A 80 ILE HB H 1 1.425 0.020 A 80 ILE HD1% H 1 0.563 0.020 A 80 ILE HG1y H 1 1.199 0.020 A 80 ILE HG1x H 1 0.743 0.020 A 80 ILE HG2% H 1 0.647 0.020 A 80 ILE CA C 13 56.550 0.3 A 80 ILE CB C 13 32.946 0.3 A 80 ILE CD1 C 13 7.898 0.3 A 80 ILE CG1 C 13 21.674 0.3 A 80 ILE CG2 C 13 12.129 0.3 A 80 ILE N N 15 122.484 0.3 A 81 PHE H H 1 8.402 0.020 A 81 PHE HA H 1 4.785 0.020 A 81 PHE HBy H 1 3.104 0.020 A 81 PHE HBx H 1 2.625 0.020 A 81 PHE HDx H 1 6.924 0.020 A 81 PHE HDy H 1 6.924 0.020 A 81 PHE HEx H 1 6.567 0.020 A 81 PHE HEy H 1 6.567 0.020 A 81 PHE HZ H 1 6.315 0.020 A 81 PHE CA C 13 51.965 0.3 A 81 PHE CB C 13 35.964 0.3 A 81 PHE CDx C 13 128.064 0.3 A 81 PHE CDy C 13 128.220 0.3 A 81 PHE CEx C 13 124.970 0.3 A 81 PHE CEy C 13 124.970 0.3 A 81 PHE CZ C 13 123.631 0.3 A 81 PHE N N 15 122.784 0.3 stop_ save_ save_CNS/XPLOR_distance_constraints_2 _nef_distance_restraint_list.sf_category nef_distance_restraint_list _nef_distance_restraint_list.sf_framecode CNS/XPLOR_distance_constraints_2 _nef_distance_restraint_list.restraint_origin noe _nef_distance_restraint_list.potential_type square-well-parabolic loop_ _nef_distance_restraint.index _nef_distance_restraint.restraint_id _nef_distance_restraint.chain_code_1 _nef_distance_restraint.sequence_code_1 _nef_distance_restraint.residue_name_1 _nef_distance_restraint.atom_name_1 _nef_distance_restraint.chain_code_2 _nef_distance_restraint.sequence_code_2 _nef_distance_restraint.residue_name_2 _nef_distance_restraint.atom_name_2 _nef_distance_restraint.weight _nef_distance_restraint.lower_limit _nef_distance_restraint.upper_limit 1 1 A 32 GLU HB3 A 33 LEU H 1.0 2.7 4.7 2 2 A 36 LEU HD1% A 32 GLU HGy 1.0 1.5 4.5 3 3 A 22 LEU HA A 23 HIS H 1.0 1.5 3.5 4 4 A 57 THR HA A 58 GLY H 1.0 2.7 4.7 5 5 A 41 VAL HA A 42 SER H 1.0 2.7 4.7 6 6 A 71 LYS HA A 75 VAL HG2% 1.0 2.7 5.7 7 7 A 71 LYS HA A 72 THR H 1.0 1.5 3.5 8 8 A 71 LYS HA A 72 THR HG2% 1.0 4.0 7.0 9 9 A 71 LYS HA A 75 VAL HB 1.0 4.0 6.0 10 10 A 71 LYS HGy A 76 ARG HA 1.0 2.7 4.7 11 11 A 75 VAL HG1% A 76 ARG H 1.0 2.7 5.7 12 12 A 75 VAL HG1% A 74 THR HB 1.0 1.5 4.5 13 13 A 73 TYR HBy A 74 THR HG2% 1.0 2.7 5.7 14 14 A 5 PHE HA A 6 THR H 1.0 1.5 3.5 15 15 A 34 ARG HGx A 27 PHE HE% 1.0 1.5 4.5 16 16 A 34 ARG HGx A 27 PHE HB3 1.0 4.0 6.0 17 17 A 77 VAL HB A 36 LEU HBx 1.0 4.0 6.0 18 18 A 77 VAL HB A 78 PRO HDy 1.0 2.7 4.7 19 19 A 40 ASN HBx A 41 VAL H 1.0 2.7 4.7 20 20 A 40 ASN HBx A 81 PHE HZ 1.0 4.0 6.0 21 21 A 40 ASN HBx A 37 TRP HA 1.0 4.0 6.0 22 22 A 40 ASN HBx A 81 PHE HE% 1.0 2.7 5.7 23 23 A 41 VAL H A 40 ASN HA 1.0 2.7 4.7 24 24 A 32 GLU HGy A 36 LEU HD2% 1.0 1.5 4.5 25 25 A 64 VAL HG2% A 65 HIS H 1.0 2.7 5.7 26 26 A 64 VAL HG2% A 14 ASN HD21 1.0 2.7 5.7 27 27 A 64 VAL HG2% A 14 ASN HD22 1.0 2.7 5.7 28 28 A 80 ILE HB A 65 HIS HA 1.0 1.5 3.5 29 29 A 41 VAL HG1% A 38 LEU HA 1.0 2.7 5.7 30 30 A 27 PHE HE% A 41 VAL HG1% 1.0 1.5 5.5 31 31 A 42 SER H A 41 VAL HG1% 1.0 2.7 5.7 32 32 A 41 VAL HG1% A 27 PHE HZ 1.0 1.5 4.5 33 33 A 41 VAL HG1% A 53 PHE HZ 1.0 2.7 5.7 34 34 A 81 PHE HE% A 41 VAL HG1% 1.0 2.7 6.7 35 35 A 46 VAL HGx% A 47 SER H 1.0 2.7 5.7 36 36 A 46 VAL HGx% A 47 SER HBx 1.0 1.5 4.5 37 37 A 54 GLN HGx A 55 PRO HDx 1.0 4.0 6.0 38 38 A 70 ARG HA A 71 LYS H 1.0 1.5 3.5 39 39 A 71 LYS HDx A 37 TRP HZ3 1.0 4.0 6.0 40 40 A 71 LYS HDx A 37 TRP HZ2 1.0 2.7 4.7 41 41 A 71 LYS HDx A 37 TRP HH2 1.0 2.7 4.7 42 42 A 75 VAL HG2% A 76 ARG H 1.0 2.7 5.7 43 43 A 75 VAL HG2% A 67 GLN H 1.0 2.7 5.7 44 44 A 75 VAL HG2% A 72 THR H 1.0 2.7 5.7 45 45 A 75 VAL HG2% A 67 GLN HB2 1.0 2.7 5.7 46 46 A 75 VAL HG2% A 67 GLN HB3 1.0 2.7 5.7 47 47 A 75 VAL HG2% A 66 PHE HD% 1.0 1.5 5.5 48 48 A 75 VAL HG2% A 66 PHE HE% 1.0 2.7 6.7 49 49 A 75 VAL HG2% A 77 VAL H 1.0 2.7 5.7 50 50 A 75 VAL HG2% A 66 PHE HBx 1.0 1.5 4.5 51 51 A 53 PHE HBy A 54 GLN H 1.0 2.7 4.7 52 52 A 32 GLU HA A 31 ALA HB% 1.0 2.7 5.7 53 53 A 32 GLU HA A 34 ARG H 1.0 4.0 6.0 54 54 A 33 LEU H A 32 GLU HA 1.0 4.0 6.0 55 55 A 32 GLU HA A 35 ARG HBx 1.0 1.5 3.5 56 56 A 32 GLU HA A 35 ARG HBy 1.0 2.7 4.7 57 57 A 32 GLU HA A 36 LEU H 1.0 1.5 3.5 58 58 A 34 ARG HGy A 27 PHE HD% 1.0 1.5 4.5 59 59 A 27 PHE HB3 A 34 ARG HGy 1.0 4.0 6.0 60 60 A 77 VAL HG1% A 37 TRP HD1 1.0 2.7 5.7 61 61 A 36 LEU HBx A 77 VAL HG1% 1.0 2.7 5.7 62 62 A 78 PRO HDy A 77 VAL HG1% 1.0 2.7 5.7 63 63 A 77 VAL HG1% A 37 TRP HE1 1.0 2.7 5.7 64 64 A 47 SER H A 46 VAL HGy% 1.0 2.7 5.7 65 65 A 47 SER HBx A 46 VAL HGy% 1.0 1.5 4.5 66 66 A 41 VAL H A 40 ASN HBy 1.0 2.7 4.7 67 67 A 40 ASN HBy A 77 VAL HG2% 1.0 2.7 5.7 68 68 A 81 PHE HZ A 40 ASN HBy 1.0 4.0 6.0 69 69 A 37 TRP HA A 40 ASN HBy 1.0 4.0 6.0 70 70 A 81 PHE HE% A 40 ASN HBy 1.0 2.7 5.7 71 71 A 6 THR HG2% A 15 ASN HB2 1.0 2.7 5.7 72 72 A 6 THR HG2% A 15 ASN HB3 1.0 2.7 5.7 73 73 A 36 LEU HG A 37 TRP H 1.0 4.0 6.0 74 74 A 39 LYS HA A 40 ASN H 1.0 2.7 4.7 75 75 A 38 LEU HD2% A 53 PHE HD% 1.0 2.7 6.7 76 76 A 55 PRO HDx A 38 LEU HD2% 1.0 2.7 5.7 77 77 A 38 LEU HD2% A 55 PRO HDy 1.0 2.7 5.7 78 78 A 38 LEU HD2% A 37 TRP HBy 1.0 2.7 5.7 79 79 A 38 LEU HD2% A 35 ARG HA 1.0 1.5 4.5 80 80 A 65 HIS H A 64 VAL HG1% 1.0 2.7 5.7 81 81 A 14 ASN HD21 A 64 VAL HG1% 1.0 2.7 5.7 82 82 A 14 ASN HD22 A 64 VAL HG1% 1.0 2.7 5.7 83 83 A 54 GLN HGx A 55 PRO HDx 1.0 2.7 4.7 84 84 A 55 PRO HDx A 38 LEU HD2% 1.0 4.0 7.0 85 85 A 55 PRO HDx A 54 GLN HA 1.0 1.5 3.5 86 86 A 55 PRO HDx A 54 GLN HB3 1.0 2.7 4.7 87 87 A 55 PRO HDx A 38 LEU HD1% 1.0 2.7 5.7 88 88 A 55 PRO HDx A 54 GLN HB2 1.0 2.7 4.7 89 89 A 10 PRO HDx A 41 VAL HG2% 1.0 4.0 7.0 90 90 A 10 PRO HDx A 9 VAL HG2% 1.0 2.7 5.7 91 91 A 55 PRO HDx A 54 GLN HGy 1.0 2.7 4.7 92 92 A 55 PRO HDy A 54 GLN HGy 1.0 2.7 4.7 93 93 A 72 THR HG2% A 70 ARG HBx 1.0 2.7 5.7 94 94 A 71 LYS H A 70 ARG HBx 1.0 2.7 4.7 95 95 A 37 TRP HZ2 A 71 LYS HDy 1.0 2.7 4.7 96 96 A 31 ALA HA A 35 ARG H 1.0 4.0 6.0 97 97 A 31 ALA HA A 32 GLU H 1.0 2.7 4.7 98 98 A 34 ARG H A 31 ALA HA 1.0 4.0 6.0 99 99 A 33 LEU H A 31 ALA HA 1.0 4.0 6.0 100 100 A 31 ALA HA A 34 ARG HB2 1.0 2.7 4.7 101 101 A 79 THR HG2% A 40 ASN HD21 1.0 2.7 5.7 102 102 A 79 THR HG2% A 40 ASN HD22 1.0 2.7 5.7 103 103 A 55 PRO HDx A 54 GLN HA 1.0 1.5 3.5 104 104 A 55 PRO HDy A 54 GLN HA 1.0 1.5 3.5 105 105 A 24 PHE HA A 62 CYS HA 1.0 1.5 3.5 106 106 A 24 PHE HA A 25 TYR H 1.0 1.5 3.5 107 107 A 67 GLN H A 66 PHE HA 1.0 1.5 3.5 108 108 A 66 PHE HA A 78 PRO HA 1.0 2.7 4.7 109 109 A 37 TRP HZ3 A 61 LEU HD2% 1.0 1.5 4.5 110 110 A 27 PHE HD% A 61 LEU HD2% 1.0 2.7 6.7 111 111 A 61 LEU HD2% A 65 HIS HD2 1.0 2.7 5.7 112 112 A 27 PHE HZ A 61 LEU HD2% 1.0 2.7 5.7 113 113 A 61 LEU HD2% A 81 PHE HD% 1.0 4.0 8.0 114 114 A 37 TRP HH2 A 61 LEU HD2% 1.0 2.7 5.7 115 115 A 37 TRP HD1 A 77 VAL HG2% 1.0 2.7 5.7 116 116 A 77 VAL HG2% A 40 ASN HD21 1.0 2.7 5.7 117 117 A 36 LEU HBx A 77 VAL HG2% 1.0 4.0 7.0 118 118 A 77 VAL HG2% A 40 ASN HD22 1.0 2.7 5.7 119 119 A 77 VAL HG2% A 36 LEU HBy 1.0 4.0 7.0 120 120 A 78 PRO HDy A 77 VAL HG2% 1.0 1.5 4.5 121 121 A 37 TRP HE1 A 77 VAL HG2% 1.0 2.7 5.7 122 122 A 37 TRP HD1 A 36 LEU HA 1.0 2.7 4.7 123 123 A 36 LEU HA A 39 LYS H 1.0 2.7 4.7 124 124 A 36 LEU HA A 38 LEU H 1.0 2.7 4.7 125 125 A 36 LEU HA A 39 LYS HGy 1.0 1.5 3.5 126 126 A 36 LEU HA A 39 LYS HBy 1.0 1.5 3.5 127 127 A 37 TRP H A 36 LEU HA 1.0 2.7 4.7 128 128 A 36 LEU HA A 39 LYS HDy 1.0 2.7 4.7 129 129 A 37 TRP HD1 A 34 ARG HA 1.0 2.7 4.7 130 130 A 34 ARG HA A 33 LEU HG 1.0 2.7 4.7 131 131 A 38 LEU H A 34 ARG HA 1.0 2.7 4.7 132 132 A 34 ARG HA A 28 PRO HGx 1.0 4.0 6.0 133 133 A 34 ARG HA A 28 PRO HGy 1.0 4.0 6.0 134 134 A 34 ARG HA A 28 PRO HDy 1.0 2.7 4.7 135 135 A 37 TRP HBy A 34 ARG HA 1.0 1.5 3.5 136 136 A 37 TRP H A 34 ARG HA 1.0 2.7 4.7 137 137 A 36 LEU H A 34 ARG HA 1.0 2.7 4.7 138 138 A 55 PRO HDy A 54 GLN HA 1.0 1.5 3.5 139 139 A 55 PRO HDy A 38 LEU HD1% 1.0 2.7 5.7 140 140 A 55 PRO HDy A 54 GLN HB2 1.0 2.7 4.7 141 141 A 62 CYS HB2 A 22 LEU HD2% 1.0 4.0 7.0 142 142 A 62 CYS HB2 A 7 CYS HB3 1.0 2.7 4.7 143 143 A 62 CYS HB2 A 7 CYS HB2 1.0 2.7 4.7 144 144 A 62 CYS HB2 A 63 SER H 1.0 2.7 4.7 145 145 A 62 CYS HB2 A 24 PHE HE% 1.0 2.7 5.7 146 146 A 62 CYS HB2 A 24 PHE HD% 1.0 2.7 5.7 147 147 A 41 VAL HG2% A 10 PRO HDy 1.0 4.0 7.0 148 148 A 10 PRO HDy A 9 VAL HA 1.0 1.5 3.5 149 149 A 9 VAL HG2% A 10 PRO HDy 1.0 2.7 5.7 150 150 A 60 ARG HB3 A 24 PHE HBx 1.0 2.7 4.7 151 151 A 60 ARG HB3 A 24 PHE HBy 1.0 2.7 4.7 152 152 A 60 ARG HB3 A 61 LEU H 1.0 2.7 4.7 153 153 A 24 PHE HD% A 60 ARG HB3 1.0 2.7 5.7 154 154 A 44 ALA HA A 45 GLY H 1.0 2.7 4.7 155 155 A 47 SER HA A 48 GLY H 1.0 4.0 6.0 156 156 A 75 VAL HG1% A 74 THR HB 1.0 2.7 5.7 157 157 A 74 THR HB A 75 VAL H 1.0 2.7 4.7 158 158 A 37 TRP HZ2 A 71 LYS HEx 1.0 2.7 4.7 159 159 A 37 TRP HH2 A 71 LYS HEx 1.0 2.7 4.7 160 160 A 32 GLU HA A 31 ALA HB% 1.0 4.0 7.0 161 161 A 31 ALA HB% A 30 ASP HA 1.0 2.7 5.7 162 162 A 31 ALA HB% A 32 GLU H 1.0 2.7 5.7 163 163 A 55 PRO HDx A 54 GLN HB3 1.0 2.7 4.7 164 164 A 60 ARG HB3 A 24 PHE HBx 1.0 2.7 4.7 165 165 A 24 PHE HBx A 26 THR HG2% 1.0 2.7 5.7 166 166 A 75 VAL HG2% A 66 PHE HBy 1.0 2.7 5.7 167 167 A 45 GLY HAx A 46 VAL H 1.0 2.7 4.7 168 168 A 46 VAL HGx% A 45 GLY HAx 1.0 2.7 5.7 169 169 A 45 GLY HAx A 52 THR HG2% 1.0 2.7 5.7 170 170 A 22 LEU HG A 19 ASP HB3 1.0 2.7 4.7 171 171 A 22 LEU HG A 19 ASP HB2 1.0 2.7 4.7 172 172 A 37 TRP HD1 A 33 LEU HG 1.0 2.7 4.7 173 173 A 33 LEU HG A 28 PRO HBx 1.0 2.7 4.7 174 174 A 33 LEU HG A 28 PRO HGy 1.0 2.7 4.7 175 175 A 34 ARG H A 33 LEU HG 1.0 4.0 6.0 176 176 A 37 TRP HE1 A 33 LEU HG 1.0 2.7 4.7 177 177 A 10 PRO HDx A 41 VAL HG2% 1.0 4.0 7.0 178 178 A 41 VAL HG2% A 10 PRO HDy 1.0 4.0 7.0 179 179 A 41 VAL HG2% A 9 VAL HA 1.0 4.0 7.0 180 180 A 38 LEU HA A 41 VAL HG2% 1.0 2.7 5.7 181 181 A 42 SER H A 41 VAL HG2% 1.0 2.7 5.7 182 182 A 27 PHE HZ A 41 VAL HG2% 1.0 4.0 7.0 183 183 A 6 THR H A 5 PHE HB2 1.0 2.7 4.7 184 184 A 71 LYS HGy A 76 ARG HA 1.0 2.7 4.7 185 185 A 76 ARG HA A 77 VAL H 1.0 2.7 4.7 186 186 A 76 ARG HA A 71 LYS HGx 1.0 2.7 4.7 187 187 A 22 LEU HD2% A 62 CYS HB3 1.0 4.0 7.0 188 188 A 7 CYS HB3 A 62 CYS HB3 1.0 2.7 4.7 189 189 A 7 CYS HB2 A 62 CYS HB3 1.0 2.7 4.7 190 190 A 63 SER H A 62 CYS HB3 1.0 2.7 4.7 191 191 A 24 PHE HE% A 62 CYS HB3 1.0 2.7 5.7 192 192 A 71 LYS HEy A 70 ARG H 1.0 2.7 4.7 193 193 A 10 PRO HDy A 9 VAL HA 1.0 1.5 3.5 194 194 A 41 VAL HG2% A 9 VAL HA 1.0 4.0 7.0 195 195 A 16 SER HA A 24 PHE HZ 1.0 2.7 4.7 196 196 A 16 SER HA A 17 HIS H 1.0 2.7 4.7 197 197 A 24 PHE HE% A 16 SER HA 1.0 1.5 4.5 198 198 A 24 PHE HD% A 16 SER HA 1.0 2.7 5.7 199 199 A 60 ARG HB3 A 24 PHE HBy 1.0 2.7 4.7 200 200 A 24 PHE HBy A 26 THR HG2% 1.0 2.7 5.7 201 201 A 43 ARG HA A 44 ALA H 1.0 2.7 4.7 202 202 A 22 LEU HD2% A 24 PHE HZ 1.0 2.7 5.7 203 203 A 62 CYS HB2 A 22 LEU HD2% 1.0 4.0 7.0 204 204 A 22 LEU HD2% A 62 CYS HB3 1.0 4.0 7.0 205 205 A 22 LEU HD2% A 14 ASN HB2 1.0 2.7 5.7 206 206 A 23 HIS H A 22 LEU HD2% 1.0 4.0 7.0 207 207 A 22 LEU HD2% A 19 ASP HB2 1.0 2.7 5.7 208 208 A 14 ASN HD21 A 22 LEU HD2% 1.0 2.7 5.7 209 209 A 22 LEU HD2% A 24 PHE HE% 1.0 1.5 5.5 210 210 A 14 ASN HD22 A 22 LEU HD2% 1.0 2.7 5.7 211 211 A 75 VAL HG2% A 67 GLN HB2 1.0 2.7 5.7 212 212 A 67 GLN HB2 A 80 ILE HD1% 1.0 2.7 5.7 213 213 A 53 PHE HD% A 38 LEU HD1% 1.0 2.7 6.7 214 214 A 55 PRO HDx A 38 LEU HD1% 1.0 2.7 5.7 215 215 A 55 PRO HDy A 38 LEU HD1% 1.0 2.7 5.7 216 216 A 27 PHE HE% A 38 LEU HD1% 1.0 1.5 5.5 217 217 A 27 PHE HZ A 38 LEU HD1% 1.0 1.5 4.5 218 218 A 62 CYS HB2 A 7 CYS HB3 1.0 2.7 4.7 219 219 A 7 CYS HB3 A 62 CYS HB3 1.0 2.7 4.7 220 220 A 10 PRO HDy A 9 VAL HG1% 1.0 2.7 5.7 221 221 A 65 HIS HD2 A 9 VAL HG1% 1.0 4.0 7.0 222 222 A 81 PHE HE% A 9 VAL HG1% 1.0 2.7 6.7 223 223 A 58 GLY HAx A 59 HIS H 1.0 2.7 4.7 224 224 A 28 PRO HA A 29 LYS H 1.0 2.7 4.7 225 225 A 38 LEU HA A 39 LYS H 1.0 2.7 4.7 226 226 A 41 VAL H A 38 LEU HA 1.0 2.7 4.7 227 227 A 38 LEU HA A 41 VAL HG2% 1.0 2.7 5.7 228 228 A 21 ALA HA A 22 LEU H 1.0 2.7 4.7 229 229 A 31 ALA HB% A 30 ASP HA 1.0 2.7 5.7 230 230 A 30 ASP HA A 31 ALA H 1.0 1.5 3.5 231 231 A 10 PRO HA A 11 GLY H 1.0 2.7 4.7 232 232 A 52 THR HG2% A 53 PHE H 1.0 4.0 7.0 233 233 A 45 GLY HAx A 52 THR HG2% 1.0 4.0 7.0 234 234 A 65 HIS HD2 A 61 LEU HD1% 1.0 2.7 5.7 235 235 A 61 LEU HD1% A 66 PHE HZ 1.0 2.7 5.7 236 236 A 37 TRP HH2 A 61 LEU HD1% 1.0 4.0 7.0 237 237 A 61 LEU HD1% A 37 TRP HE3 1.0 1.5 4.5 238 238 A 81 PHE HE% A 61 LEU HD1% 1.0 1.5 5.5 239 239 A 23 HIS H A 22 LEU HD1% 1.0 4.0 7.0 240 240 A 19 ASP HB3 A 22 LEU HD1% 1.0 2.7 5.7 241 241 A 19 ASP HB2 A 22 LEU HD1% 1.0 2.7 5.7 242 242 A 14 ASN HD21 A 22 LEU HD1% 1.0 2.7 5.7 243 243 A 63 SER H A 22 LEU HD1% 1.0 4.0 7.0 244 244 A 14 ASN HD22 A 22 LEU HD1% 1.0 4.0 7.0 245 245 A 75 VAL HG2% A 67 GLN HB3 1.0 2.7 5.7 246 246 A 67 GLN HB3 A 80 ILE HD1% 1.0 2.7 5.7 247 247 A 31 ALA HA A 34 ARG HB3 1.0 2.7 4.7 248 248 A 35 ARG H A 34 ARG HB3 1.0 2.7 4.7 249 249 A 33 LEU H A 34 ARG HB3 1.0 4.0 6.0 250 250 A 62 CYS HB2 A 7 CYS HB2 1.0 2.7 4.7 251 251 A 7 CYS HB2 A 62 CYS HB3 1.0 2.7 4.7 252 252 A 80 ILE HG1y A 67 GLN HA 1.0 4.0 6.0 253 253 A 80 ILE HB A 65 HIS HA 1.0 1.5 3.5 254 254 A 28 PRO HBx A 30 ASP H 1.0 2.7 4.7 255 255 A 33 LEU HG A 28 PRO HBx 1.0 1.5 3.5 256 256 A 28 PRO HBx A 30 ASP HB2 1.0 2.7 4.7 257 257 A 28 PRO HBx A 33 LEU HD2% 1.0 2.7 5.7 258 258 A 6 THR HA A 15 ASN HA 1.0 2.7 4.7 259 259 A 47 SER HBx A 46 VAL HGy% 1.0 2.7 5.7 260 260 A 10 PRO HDx A 9 VAL HG2% 1.0 4.0 7.0 261 261 A 9 VAL HG2% A 10 PRO HDy 1.0 2.7 5.7 262 262 A 9 VAL HG2% A 65 HIS HE1 1.0 1.5 4.5 263 263 A 9 VAL HG2% A 81 PHE HD% 1.0 1.5 5.5 264 264 A 81 PHE HE% A 9 VAL HG2% 1.0 2.7 6.7 265 265 A 39 LYS H A 38 LEU HB3 1.0 2.7 4.7 266 266 A 35 ARG HA A 38 LEU HB3 1.0 1.5 3.5 267 267 A 22 LEU H A 21 ALA HB% 1.0 2.7 5.7 268 268 A 31 ALA H A 30 ASP HB3 1.0 2.7 4.7 269 269 A 30 ASP HB3 A 33 LEU HD1% 1.0 4.0 7.0 270 270 A 30 ASP HB3 A 33 LEU HBx 1.0 2.7 4.7 271 271 A 30 ASP HB3 A 33 LEU HBy 1.0 2.7 4.7 272 272 A 33 LEU H A 30 ASP HB3 1.0 2.7 4.7 273 273 A 33 LEU HD2% A 30 ASP HB3 1.0 4.0 7.0 274 274 A 70 ARG H A 69 GLY HAx 1.0 2.7 4.7 275 275 A 14 ASN HA A 15 ASN H 1.0 1.5 3.5 276 276 A 65 HIS HA A 80 ILE HG2% 1.0 2.7 5.7 277 277 A 80 ILE HG2% A 66 PHE H 1.0 2.7 5.7 278 278 A 80 ILE HG2% A 81 PHE H 1.0 2.7 5.7 279 279 A 33 LEU HD1% A 76 ARG HB3 1.0 4.0 7.0 280 280 A 33 LEU HD2% A 76 ARG HB3 1.0 2.7 5.7 281 281 A 4 GLY HAy A 5 PHE H 1.0 2.7 4.7 282 282 A 30 ASP H A 28 PRO HBy 1.0 2.7 4.7 283 283 A 33 LEU HG A 28 PRO HBy 1.0 1.5 3.5 284 284 A 30 ASP HB2 A 28 PRO HBy 1.0 2.7 4.7 285 285 A 33 LEU HD1% A 28 PRO HBy 1.0 2.7 5.7 286 286 A 34 ARG H A 28 PRO HBy 1.0 2.7 4.7 287 287 A 17 HIS HB3 A 18 ARG H 1.0 4.0 6.0 288 288 A 53 PHE H A 52 THR HA 1.0 1.5 3.5 289 289 A 80 ILE HD1% A 67 GLN HGx 1.0 2.7 5.7 290 290 A 37 TRP HZ3 A 25 TYR HB2 1.0 2.7 4.7 291 291 A 37 TRP HH2 A 25 TYR HB2 1.0 2.7 4.7 292 292 A 72 THR HG2% A 70 ARG HDx 1.0 2.7 5.7 293 293 A 46 VAL H A 45 GLY HAy 1.0 2.7 4.7 294 294 A 39 LYS H A 38 LEU HB2 1.0 2.7 4.7 295 295 A 35 ARG HA A 38 LEU HB2 1.0 2.7 4.7 296 296 A 5 PHE H A 16 SER HB2 1.0 4.0 6.0 297 297 A 36 LEU HA A 39 LYS HGy 1.0 4.0 6.0 298 298 A 28 PRO HBx A 30 ASP HB2 1.0 2.7 4.7 299 299 A 30 ASP HB2 A 33 LEU HD1% 1.0 2.7 5.7 300 300 A 30 ASP HB2 A 33 LEU HBx 1.0 1.5 3.5 301 301 A 30 ASP HB2 A 33 LEU HBy 1.0 1.5 3.5 302 302 A 33 LEU H A 30 ASP HB2 1.0 2.7 4.7 303 303 A 30 ASP HB2 A 33 LEU HD2% 1.0 4.0 7.0 304 304 A 26 THR HB A 27 PHE H 1.0 2.7 4.7 305 305 A 61 LEU H A 60 ARG HB2 1.0 2.7 4.7 306 306 A 49 CYS HA A 50 PHE H 1.0 2.7 4.7 307 307 A 67 GLN HB2 A 80 ILE HD1% 1.0 4.0 7.0 308 308 A 67 GLN HB3 A 80 ILE HD1% 1.0 2.7 5.7 309 309 A 65 HIS HA A 80 ILE HD1% 1.0 2.7 5.7 310 310 A 80 ILE HD1% A 66 PHE H 1.0 4.0 7.0 311 311 A 80 ILE HD1% A 67 GLN HGx 1.0 4.0 7.0 312 312 A 80 ILE HD1% A 67 GLN HGy 1.0 2.7 5.7 313 313 A 80 ILE HD1% A 67 GLN HA 1.0 1.5 4.5 314 314 A 36 LEU H A 35 ARG HGx 1.0 2.7 4.7 315 315 A 5 PHE H A 4 GLY HAx 1.0 2.7 4.7 316 316 A 75 VAL H A 74 THR HA 1.0 2.7 4.7 317 317 A 72 THR HG2% A 70 ARG HBy 1.0 2.7 5.7 318 318 A 71 LYS H A 70 ARG HBy 1.0 2.7 4.7 319 319 A 33 LEU HG A 28 PRO HGx 1.0 2.7 4.7 320 320 A 28 PRO HGx A 27 PHE HA 1.0 2.7 4.7 321 321 A 66 PHE HA A 78 PRO HA 1.0 2.7 4.7 322 322 A 78 PRO HA A 80 ILE H 1.0 2.7 4.7 323 323 A 78 PRO HA A 79 THR H 1.0 1.5 3.5 324 324 A 80 ILE HD1% A 67 GLN HGy 1.0 4.0 7.0 325 325 A 37 TRP HZ3 A 25 TYR HB3 1.0 2.7 4.7 326 326 A 37 TRP HH2 A 25 TYR HB3 1.0 2.7 4.7 327 327 A 25 TYR HB3 A 26 THR H 1.0 2.7 4.7 328 328 A 72 THR HG2% A 70 ARG HDy 1.0 2.7 5.7 329 329 A 40 ASN HBx A 37 TRP HA 1.0 2.7 4.7 330 330 A 37 TRP HA A 38 LEU H 1.0 4.0 6.0 331 331 A 78 PRO HDy A 37 TRP HA 1.0 2.7 4.7 332 332 A 16 SER HB3 A 5 PHE HD% 1.0 2.7 5.7 333 333 A 5 PHE H A 16 SER HB3 1.0 4.0 6.0 334 334 A 36 LEU HBx A 33 LEU HA 1.0 2.7 4.7 335 335 A 34 ARG H A 33 LEU HA 1.0 2.7 4.7 336 336 A 36 LEU HBy A 33 LEU HA 1.0 1.5 3.5 337 337 A 36 LEU H A 33 LEU HA 1.0 2.7 4.7 338 338 A 59 HIS HBx A 60 ARG H 1.0 2.7 4.7 339 339 A 42 SER HBy A 43 ARG H 1.0 4.0 6.0 340 340 A 68 GLY HAx A 69 GLY H 1.0 2.7 4.7 341 341 A 26 THR HG2% A 27 PHE H 1.0 2.7 5.7 342 342 A 24 PHE HBx A 26 THR HG2% 1.0 2.7 5.7 343 343 A 24 PHE HBy A 26 THR HG2% 1.0 2.7 5.7 344 344 A 45 GLY H A 44 ALA HB% 1.0 2.7 5.7 345 345 A 23 HIS H A 22 LEU HB2 1.0 2.7 4.7 346 346 A 37 TRP HD1 A 33 LEU HD1% 1.0 2.7 5.7 347 347 A 28 PRO HBx A 33 LEU HD1% 1.0 2.7 5.7 348 348 A 33 LEU HD1% A 76 ARG HB3 1.0 2.7 5.7 349 349 A 30 ASP HB2 A 33 LEU HD1% 1.0 2.7 5.7 350 350 A 33 LEU HD1% A 76 ARG HB2 1.0 4.0 7.0 351 351 A 33 LEU HD1% A 76 ARG HDy 1.0 1.5 4.5 352 352 A 37 TRP HE1 A 33 LEU HD1% 1.0 2.7 5.7 353 353 A 33 LEU HD1% A 76 ARG HB2 1.0 4.0 7.0 354 354 A 33 LEU HD2% A 76 ARG HB2 1.0 2.7 5.7 355 355 A 34 ARG HA A 28 PRO HGy 1.0 2.7 4.7 356 356 A 28 PRO HGy A 33 LEU HBx 1.0 2.7 4.7 357 357 A 28 PRO HGy A 33 LEU HBy 1.0 2.7 4.7 358 358 A 81 PHE H A 80 ILE HA 1.0 1.5 3.5 359 359 A 81 PHE HZ A 78 PRO HBx 1.0 2.7 4.7 360 360 A 78 PRO HBx A 65 HIS HB2 1.0 2.7 4.7 361 361 A 78 PRO HBx A 65 HIS HB3 1.0 2.7 4.7 362 362 A 81 PHE HE% A 78 PRO HBx 1.0 2.7 5.7 363 363 A 23 HIS HB2 A 63 SER HBy 1.0 4.0 6.0 364 364 A 26 THR H A 25 TYR HA 1.0 1.5 3.5 365 365 A 33 LEU HD1% A 76 ARG HDx 1.0 2.7 5.7 366 366 A 33 LEU HD2% A 76 ARG HDx 1.0 2.7 5.7 367 367 A 27 PHE HD% A 37 TRP HBx 1.0 1.5 4.5 368 368 A 38 LEU H A 37 TRP HBx 1.0 2.7 4.7 369 369 A 28 PRO HBx A 33 LEU HBx 1.0 2.7 4.7 370 370 A 30 ASP HB3 A 33 LEU HBx 1.0 4.0 6.0 371 371 A 30 ASP HB2 A 33 LEU HBx 1.0 2.7 4.7 372 372 A 28 PRO HGy A 33 LEU HBx 1.0 2.7 4.7 373 373 A 34 ARG H A 33 LEU HBx 1.0 2.7 4.7 374 374 A 27 PHE HE% A 59 HIS HBy 1.0 2.7 5.7 375 375 A 60 ARG H A 59 HIS HBy 1.0 4.0 6.0 376 376 A 43 ARG H A 42 SER HBx 1.0 2.7 4.7 377 377 A 22 LEU HD2% A 14 ASN HB2 1.0 2.7 5.7 378 378 A 20 LYS HB2 A 21 ALA H 1.0 2.7 4.7 379 379 A 40 ASN H A 39 LYS HBy 1.0 2.7 4.7 380 380 A 36 LEU H A 35 ARG HGy 1.0 2.7 4.7 381 381 A 37 TRP HZ3 A 28 PRO HDy 1.0 2.7 4.7 382 382 A 27 PHE HD% A 28 PRO HDy 1.0 2.7 5.7 383 383 A 34 ARG HA A 28 PRO HDy 1.0 2.7 4.7 384 384 A 28 PRO HDy A 37 TRP HE3 1.0 4.0 6.0 385 385 A 28 PRO HDy A 27 PHE HA 1.0 1.5 3.5 386 386 A 28 PRO HDy A 27 PHE HB2 1.0 2.7 4.7 387 387 A 34 ARG HB2 A 28 PRO HDy 1.0 4.0 6.0 388 388 A 27 PHE HB3 A 28 PRO HDy 1.0 2.7 4.7 389 389 A 18 ARG HA A 19 ASP H 1.0 2.7 4.7 390 390 A 51 SER HA A 52 THR H 1.0 2.7 4.7 391 391 A 61 LEU HA A 62 CYS H 1.0 1.5 3.5 392 392 A 33 LEU HD1% A 76 ARG HDy 1.0 4.0 7.0 393 393 A 33 LEU HD2% A 76 ARG HDy 1.0 4.0 7.0 394 394 A 38 LEU HD2% A 37 TRP HBy 1.0 2.7 5.7 395 395 A 37 TRP HBy A 38 LEU H 1.0 2.7 4.7 396 396 A 27 PHE HE% A 37 TRP HBy 1.0 1.5 4.5 397 397 A 28 PRO HBx A 33 LEU HBy 1.0 2.7 4.7 398 398 A 30 ASP HB3 A 33 LEU HBy 1.0 4.0 6.0 399 399 A 30 ASP HB2 A 33 LEU HBy 1.0 2.7 4.7 400 400 A 28 PRO HGy A 33 LEU HBy 1.0 2.7 4.7 401 401 A 34 ARG H A 33 LEU HBy 1.0 2.7 4.7 402 402 A 36 LEU HBx A 37 TRP HD1 1.0 2.7 4.7 403 403 A 36 LEU HBx A 77 VAL HG1% 1.0 1.5 4.5 404 404 A 36 LEU HBx A 37 TRP H 1.0 2.7 4.7 405 405 A 23 HIS HB2 A 63 SER HBx 1.0 4.0 6.0 406 406 A 23 HIS H A 63 SER HBx 1.0 4.0 6.0 407 407 A 63 SER HBx A 25 TYR HE% 1.0 4.0 7.0 408 408 A 63 SER HBx A 23 HIS HB3 1.0 4.0 6.0 409 409 A 46 VAL HGx% A 47 SER HBy 1.0 4.0 7.0 410 410 A 46 VAL HGy% A 47 SER HBy 1.0 4.0 7.0 411 411 A 22 LEU HG A 19 ASP HB3 1.0 2.7 4.7 412 412 A 22 LEU HD2% A 19 ASP HB3 1.0 1.5 4.5 413 413 A 19 ASP HB3 A 22 LEU H 1.0 2.7 4.7 414 414 A 19 ASP HB3 A 22 LEU HD1% 1.0 2.7 5.7 415 415 A 6 THR H A 5 PHE HB3 1.0 2.7 4.7 416 416 A 6 THR HA A 15 ASN HA 1.0 2.7 4.7 417 417 A 15 ASN HA A 16 SER H 1.0 2.7 4.7 418 418 A 37 TRP HZ3 A 28 PRO HDx 1.0 4.0 6.0 419 419 A 27 PHE HD% A 28 PRO HDx 1.0 2.7 5.7 420 420 A 34 ARG HA A 28 PRO HDx 1.0 4.0 6.0 421 421 A 37 TRP HE3 A 28 PRO HDx 1.0 4.0 6.0 422 422 A 27 PHE HA A 28 PRO HDx 1.0 1.5 3.5 423 423 A 27 PHE HB2 A 28 PRO HDx 1.0 2.7 4.7 424 424 A 27 PHE HB3 A 28 PRO HDx 1.0 2.7 4.7 425 425 A 15 ASN H A 18 ARG HBy 1.0 4.0 6.0 426 426 A 18 ARG HBy A 15 ASN HD22 1.0 4.0 6.0 427 427 A 19 ASP H A 18 ARG HBy 1.0 2.7 4.7 428 428 A 37 TRP HZ3 A 61 LEU HB3 1.0 2.7 4.7 429 429 A 37 TRP HZ3 A 27 PHE HA 1.0 2.7 4.7 430 430 A 28 PRO HGx A 27 PHE HA 1.0 2.7 4.7 431 431 A 28 PRO HGy A 27 PHE HA 1.0 2.7 4.7 432 432 A 28 PRO HDy A 27 PHE HA 1.0 1.5 3.5 433 433 A 27 PHE HA A 28 PRO HDx 1.0 1.5 3.5 434 434 A 66 PHE HD% A 63 SER HA 1.0 1.5 4.5 435 435 A 63 SER HA A 64 VAL H 1.0 2.7 4.7 436 436 A 66 PHE H A 63 SER HA 1.0 4.0 6.0 437 437 A 25 TYR HE% A 63 SER HA 1.0 2.7 5.7 438 438 A 37 TRP HD1 A 36 LEU HBy 1.0 2.7 4.7 439 439 A 77 VAL HG1% A 36 LEU HBy 1.0 1.5 4.5 440 440 A 37 TRP H A 36 LEU HBy 1.0 2.7 4.7 441 441 A 23 HIS HB2 A 63 SER HBy 1.0 4.0 6.0 442 442 A 23 HIS H A 63 SER HBy 1.0 4.0 6.0 443 443 A 63 SER HBy A 25 TYR HE% 1.0 2.7 5.7 444 444 A 69 GLY H A 68 GLY HAy 1.0 2.7 4.7 445 445 A 19 ASP HB2 A 15 ASN H 1.0 2.7 4.7 446 446 A 22 LEU HG A 19 ASP HB2 1.0 2.7 4.7 447 447 A 22 LEU HD2% A 19 ASP HB2 1.0 2.7 5.7 448 448 A 19 ASP HB2 A 22 LEU H 1.0 4.0 6.0 449 449 A 19 ASP HB2 A 22 LEU HD1% 1.0 2.7 5.7 450 450 A 33 LEU H A 32 GLU HB2 1.0 4.0 6.0 451 451 A 71 LYS HA A 72 THR HG2% 1.0 2.7 5.7 452 452 A 72 THR HG2% A 70 ARG HBx 1.0 2.7 5.7 453 453 A 72 THR HG2% A 70 ARG HDx 1.0 4.0 7.0 454 454 A 72 THR HG2% A 70 ARG HDy 1.0 2.7 5.7 455 455 A 72 THR HG2% A 70 ARG HGx 1.0 1.5 4.5 456 456 A 72 THR HG2% A 75 VAL H 1.0 4.0 7.0 457 457 A 72 THR HG2% A 75 VAL HB 1.0 2.7 5.7 458 458 A 23 HIS H A 22 LEU HB3 1.0 2.7 4.7 459 459 A 36 LEU H A 35 ARG HDy 1.0 2.7 4.7 460 460 A 15 ASN HB2 A 16 SER H 1.0 2.7 4.7 461 461 A 15 ASN HD22 A 18 ARG HBx 1.0 4.0 6.0 462 462 A 19 ASP H A 18 ARG HBx 1.0 2.7 4.7 463 463 A 61 LEU H A 60 ARG HA 1.0 1.5 3.5 464 464 A 60 ARG HA A 26 THR HA 1.0 2.7 4.7 465 465 A 37 TRP HZ3 A 61 LEU HB2 1.0 2.7 4.7 466 466 A 62 CYS H A 61 LEU HB2 1.0 2.7 4.7 467 467 A 28 PRO HDy A 27 PHE HB2 1.0 4.0 6.0 468 468 A 27 PHE HB2 A 28 PRO HDx 1.0 4.0 6.0 469 469 A 47 SER H A 46 VAL HA 1.0 2.7 4.7 470 470 A 38 LEU HD2% A 35 ARG HA 1.0 1.5 4.5 471 471 A 35 ARG HA A 38 LEU H 1.0 2.7 4.7 472 472 A 36 LEU H A 35 ARG HA 1.0 1.5 3.5 473 473 A 72 THR HG2% A 70 ARG HGx 1.0 2.7 5.7 474 474 A 71 LYS H A 70 ARG HGx 1.0 4.0 6.0 475 475 A 24 PHE HZ A 14 ASN HB3 1.0 2.7 4.7 476 476 A 15 ASN H A 14 ASN HB3 1.0 2.7 4.7 477 477 A 22 LEU HD2% A 14 ASN HB3 1.0 2.7 5.7 478 478 A 24 PHE HE% A 14 ASN HB3 1.0 4.0 7.0 479 479 A 31 ALA HA A 34 ARG HB2 1.0 2.7 4.7 480 480 A 35 ARG H A 34 ARG HB2 1.0 2.7 4.7 481 481 A 34 ARG HB2 A 28 PRO HDy 1.0 2.7 4.7 482 482 A 36 LEU HD1% A 32 GLU HGx 1.0 2.7 5.7 483 483 A 33 LEU H A 32 GLU HGx 1.0 4.0 6.0 484 484 A 73 TYR HBy A 74 THR HG2% 1.0 2.7 5.7 485 485 A 74 THR HG2% A 75 VAL H 1.0 2.7 5.7 486 486 A 74 THR HG2% A 73 TYR HD% 1.0 2.7 6.7 487 487 A 74 THR HG2% A 73 TYR HBx 1.0 4.0 7.0 488 488 A 40 ASN H A 39 LYS HBx 1.0 2.7 4.7 489 489 A 36 LEU HA A 39 LYS HBx 1.0 2.7 4.7 490 490 A 36 LEU HA A 39 LYS HDx 1.0 2.7 4.7 491 491 A 15 ASN HB3 A 16 SER H 1.0 2.7 4.7 492 492 A 55 PRO HA A 56 THR H 1.0 2.7 4.7 493 493 A 77 VAL HB A 78 PRO HDy 1.0 2.7 4.7 494 494 A 78 PRO HDy A 37 TRP HD1 1.0 2.7 4.7 495 495 A 78 PRO HDy A 77 VAL HG2% 1.0 2.7 5.7 496 496 A 78 PRO HDy A 66 PHE HE% 1.0 4.0 7.0 497 497 A 78 PRO HDy A 37 TRP HA 1.0 2.7 4.7 498 498 A 78 PRO HDy A 37 TRP HE1 1.0 2.7 4.7 499 499 A 78 PRO HDy A 77 VAL HA 1.0 1.5 3.5 500 500 A 30 ASP H A 29 LYS HA 1.0 2.7 4.7 501 501 A 55 PRO HDx A 54 GLN HB2 1.0 2.7 4.7 502 502 A 55 PRO HDy A 54 GLN HB2 1.0 2.7 4.7 503 503 A 81 PHE HE% A 79 THR HA 1.0 2.7 5.7 504 504 A 24 PHE HA A 62 CYS HA 1.0 2.7 4.7 505 505 A 62 CYS HA A 63 SER H 1.0 1.5 3.5 506 506 A 62 CYS HA A 25 TYR H 1.0 2.7 4.7 507 507 A 27 PHE HB3 A 28 PRO HDy 1.0 2.7 4.7 508 508 A 27 PHE HB3 A 28 PRO HDx 1.0 2.7 4.7 509 509 A 32 GLU HA A 35 ARG HBx 1.0 2.7 4.7 510 510 A 35 ARG HBx A 36 LEU H 1.0 2.7 4.7 511 511 A 72 THR HG2% A 70 ARG HGy 1.0 2.7 5.7 512 512 A 78 PRO HBx A 65 HIS HB2 1.0 2.7 4.7 513 513 A 37 TRP HD1 A 33 LEU HD2% 1.0 2.7 5.7 514 514 A 28 PRO HBx A 33 LEU HD2% 1.0 2.7 5.7 515 515 A 33 LEU HD2% A 76 ARG HB3 1.0 2.7 5.7 516 516 A 33 LEU HD2% A 76 ARG HDy 1.0 2.7 5.7 517 517 A 37 TRP HE1 A 33 LEU HD2% 1.0 2.7 5.7 518 518 A 32 GLU HGy A 36 LEU HD2% 1.0 2.7 5.7 519 519 A 67 GLN HA A 68 GLY H 1.0 2.7 4.7 520 520 A 80 ILE HD1% A 67 GLN HA 1.0 1.5 4.5 521 521 A 42 SER H A 41 VAL HB 1.0 2.7 4.7 522 522 A 27 PHE HD% A 55 PRO HBx 1.0 2.7 5.7 523 523 A 56 THR HA A 57 THR H 1.0 4.0 6.0 524 524 A 77 VAL HB A 78 PRO HDx 1.0 4.0 6.0 525 525 A 77 VAL HG2% A 78 PRO HDx 1.0 2.7 5.7 526 526 A 66 PHE HE% A 78 PRO HDx 1.0 2.7 5.7 527 527 A 37 TRP HA A 78 PRO HDx 1.0 4.0 6.0 528 528 A 66 PHE HZ A 78 PRO HDx 1.0 2.7 4.7 529 529 A 37 TRP HE1 A 78 PRO HDx 1.0 2.7 4.7 530 530 A 77 VAL HA A 78 PRO HDx 1.0 1.5 3.5 531 531 A 76 ARG H A 75 VAL HA 1.0 1.5 3.5 532 532 A 77 VAL H A 75 VAL HA 1.0 4.0 6.0 533 533 A 73 TYR HA A 74 THR H 1.0 2.7 4.7 534 534 A 19 ASP HA A 20 LYS H 1.0 1.5 3.5 535 535 A 32 GLU HA A 35 ARG HBy 1.0 2.7 4.7 536 536 A 35 ARG HBy A 36 LEU H 1.0 2.7 4.7 537 537 A 78 PRO HBx A 65 HIS HB3 1.0 2.7 4.7 538 538 A 65 HIS H A 64 VAL HA 1.0 2.7 4.7 539 539 A 66 PHE H A 64 VAL HA 1.0 2.7 4.7 540 540 A 27 PHE HE% A 38 LEU HG 1.0 1.5 4.5 541 541 A 75 VAL HG2% A 66 PHE HBx 1.0 2.7 5.7 542 542 A 3 PRO HA A 4 GLY H 1.0 2.7 4.7 543 543 A 27 PHE HD% A 55 PRO HBy 1.0 2.7 5.7 544 544 A 38 LEU HD2% A 55 PRO HBy 1.0 2.7 5.7 545 545 A 30 ASP H A 29 LYS HBy 1.0 2.7 4.7 546 546 A 71 LYS HA A 75 VAL HB 1.0 4.0 6.0 547 547 A 72 THR H A 75 VAL HB 1.0 2.7 4.7 548 548 A 74 THR HG2% A 73 TYR HBx 1.0 2.7 5.7 549 549 A 54 GLN H A 53 PHE HA 1.0 1.5 3.5 550 550 A 63 SER HBy A 23 HIS HB3 1.0 4.0 6.0 551 551 A 23 HIS HB3 A 24 PHE H 1.0 2.7 4.7 552 552 A 37 TRP HD1 A 77 VAL HA 1.0 2.7 4.7 553 553 A 78 PRO HDy A 77 VAL HA 1.0 1.5 3.5 554 554 A 77 VAL HA A 78 PRO HDx 1.0 1.5 3.5 555 555 A 80 ILE HB A 65 HIS HA 1.0 1.5 3.5 556 556 A 6 THR HA A 15 ASN HA 1.0 2.7 4.7 557 557 A 60 ARG HA A 26 THR HA 1.0 2.7 4.7 558 558 A 80 ILE HB A 65 HIS HA 1.0 1.5 3.5 559 559 A 6 THR HA A 15 ASN HA 1.0 2.7 4.7 560 560 A 60 ARG HA A 26 THR HA 1.0 2.7 4.7 561 561 A 37 TRP HE1 A 77 VAL HA 1.0 1.5 3.5 562 562 A 18 ARG H A 19 ASP H 1.0 1.5 3.5 563 563 A 18 ARG H A 17 HIS HA 1.0 2.7 4.7 564 564 A 18 ARG H A 17 HIS HB2 1.0 2.7 4.7 565 565 A 63 SER H A 22 LEU HB3 1.0 4.0 6.0 566 566 A 62 CYS HA A 63 SER H 1.0 1.5 3.5 567 567 A 63 SER H A 25 TYR HD% 1.0 4.0 7.0 568 568 A 24 PHE HA A 63 SER H 1.0 4.0 6.0 569 569 A 62 CYS HB2 A 63 SER H 1.0 2.7 4.7 570 570 A 66 PHE HD% A 63 SER H 1.0 4.0 7.0 571 571 A 63 SER H A 64 VAL H 1.0 1.5 3.5 572 572 A 63 SER H A 22 LEU HB2 1.0 4.0 6.0 573 573 A 63 SER H A 62 CYS H 1.0 4.0 6.0 574 574 A 23 HIS H A 63 SER H 1.0 2.7 4.7 575 575 A 76 ARG H A 75 VAL H 1.0 4.0 6.0 576 576 A 72 THR H A 75 VAL H 1.0 2.7 4.7 577 577 A 59 HIS HBx A 60 ARG H 1.0 2.7 4.7 578 578 A 59 HIS H A 60 ARG H 1.0 4.0 6.0 579 579 A 60 ARG H A 59 HIS HA 1.0 1.5 3.5 580 580 A 71 LYS H A 70 ARG HGx 1.0 2.7 4.7 581 581 A 71 LYS H A 25 TYR HE% 1.0 4.0 7.0 582 582 A 70 ARG HA A 71 LYS H 1.0 2.7 4.7 583 583 A 71 LYS H A 70 ARG HBx 1.0 2.7 4.7 584 584 A 71 LYS H A 70 ARG HBy 1.0 2.7 4.7 585 585 A 33 LEU H A 32 GLU HB2 1.0 1.5 3.5 586 586 A 33 LEU H A 32 GLU HA 1.0 1.5 3.5 587 587 A 33 LEU H A 31 ALA HA 1.0 4.0 6.0 588 588 A 33 LEU H A 35 ARG H 1.0 2.7 4.7 589 589 A 33 LEU H A 30 ASP HB2 1.0 2.7 4.7 590 590 A 33 LEU H A 34 ARG H 1.0 1.5 3.5 591 591 A 5 PHE H A 16 SER H 1.0 2.7 4.7 592 592 A 16 SER HA A 5 PHE H 1.0 2.7 4.7 593 593 A 4 GLY HAy A 5 PHE H 1.0 2.7 4.7 594 594 A 5 PHE H A 4 GLY HAx 1.0 2.7 4.7 595 595 A 5 PHE H A 16 SER HB3 1.0 2.7 4.7 596 596 A 43 ARG H A 42 SER HA 1.0 1.5 3.5 597 597 A 42 SER H A 43 ARG H 1.0 2.7 4.7 598 598 A 42 SER HBy A 43 ARG H 1.0 1.5 3.5 599 599 A 64 VAL HG2% A 14 ASN HD22 1.0 2.7 5.7 600 600 A 14 ASN HD22 A 22 LEU HD2% 1.0 4.0 7.0 601 601 A 80 ILE HG2% A 81 PHE H 1.0 2.7 5.7 602 602 A 81 PHE H A 80 ILE HG1x 1.0 4.0 6.0 603 603 A 81 PHE H A 80 ILE HA 1.0 1.5 3.5 604 604 A 53 PHE H A 52 THR H 1.0 2.7 4.7 605 605 A 51 SER HA A 52 THR H 1.0 2.7 4.7 606 606 A 62 CYS HA A 25 TYR H 1.0 2.7 4.7 607 607 A 25 TYR H A 24 PHE H 1.0 4.0 6.0 608 608 A 24 PHE HA A 25 TYR H 1.0 1.5 3.5 609 609 A 25 TYR H A 24 PHE HBx 1.0 2.7 4.7 610 610 A 25 TYR H A 24 PHE HBy 1.0 4.0 6.0 611 611 A 25 TYR H A 61 LEU H 1.0 2.7 4.7 612 612 A 25 TYR H A 26 THR H 1.0 4.0 6.0 613 613 A 15 ASN HB3 A 16 SER H 1.0 2.7 4.7 614 614 A 24 PHE HZ A 16 SER H 1.0 4.0 6.0 615 615 A 15 ASN H A 16 SER H 1.0 4.0 6.0 616 616 A 17 HIS H A 16 SER H 1.0 2.7 4.7 617 617 A 5 PHE HD% A 16 SER H 1.0 4.0 7.0 618 618 A 15 ASN HA A 16 SER H 1.0 2.7 4.7 619 619 A 18 ARG H A 19 ASP H 1.0 1.5 3.5 620 620 A 19 ASP H A 18 ARG HBx 1.0 2.7 4.7 621 621 A 19 ASP H A 18 ARG HGy 1.0 2.7 4.7 622 622 A 15 ASN H A 19 ASP H 1.0 2.7 4.7 623 623 A 19 ASP H A 20 LYS H 1.0 2.7 4.7 624 624 A 18 ARG HA A 19 ASP H 1.0 2.7 4.7 625 625 A 19 ASP H A 18 ARG HBy 1.0 2.7 4.7 626 626 A 25 TYR H A 24 PHE H 1.0 4.0 6.0 627 627 A 23 HIS HB3 A 24 PHE H 1.0 2.7 4.7 628 628 A 23 HIS H A 24 PHE H 1.0 4.0 6.0 629 629 A 24 PHE H A 23 HIS HA 1.0 1.5 3.5 630 630 A 36 LEU H A 35 ARG HDy 1.0 1.5 3.5 631 631 A 36 LEU H A 35 ARG HA 1.0 1.5 3.5 632 632 A 33 LEU H A 36 LEU H 1.0 2.7 4.7 633 633 A 35 ARG HBx A 36 LEU H 1.0 2.7 4.7 634 634 A 35 ARG HBy A 36 LEU H 1.0 2.7 4.7 635 635 A 36 LEU H A 37 TRP HD1 1.0 4.0 6.0 636 636 A 36 LEU H A 34 ARG HA 1.0 2.7 4.7 637 637 A 36 LEU H A 35 ARG HGx 1.0 2.7 4.7 638 638 A 36 LEU H A 35 ARG HGy 1.0 2.7 4.7 639 639 A 36 LEU H A 37 TRP H 1.0 1.5 3.5 640 640 A 34 ARG H A 36 LEU H 1.0 1.5 3.5 641 641 A 78 PRO HDy A 37 TRP HE1 1.0 2.7 5.7 642 642 A 37 TRP HE1 A 78 PRO HDx 1.0 2.7 5.7 643 643 A 37 TRP HE1 A 77 VAL HA 1.0 1.5 4.5 644 644 A 77 VAL HG1% A 37 TRP HE1 1.0 1.5 5.5 645 645 A 37 TRP HE1 A 77 VAL HG2% 1.0 1.5 5.5 646 646 A 37 TRP HE1 A 33 LEU HG 1.0 2.7 5.7 647 647 A 37 TRP HE1 A 76 ARG HB3 1.0 4.0 7.0 648 648 A 37 TRP HE1 A 76 ARG HB2 1.0 4.0 7.0 649 649 A 71 LYS HEy A 70 ARG H 1.0 4.0 6.0 650 650 A 70 ARG H A 69 GLY H 1.0 4.0 6.0 651 651 A 70 ARG H A 69 GLY HAx 1.0 2.7 4.7 652 652 A 47 SER HA A 48 GLY H 1.0 4.0 6.0 653 653 A 48 GLY H A 47 SER HBy 1.0 1.5 3.5 654 654 A 48 GLY H A 47 SER HBy 1.0 4.0 6.0 655 655 A 3 PRO HA A 4 GLY H 1.0 1.5 3.5 656 656 A 4 GLY H A 3 PRO HBy 1.0 4.0 6.0 657 657 A 9 VAL H A 8 CYS HB2 1.0 2.7 4.7 658 658 A 26 THR HB A 27 PHE H 1.0 2.7 4.7 659 659 A 26 THR HG2% A 27 PHE H 1.0 2.7 5.7 660 660 A 27 PHE H A 26 THR HA 1.0 2.7 4.7 661 661 A 27 PHE H A 26 THR H 1.0 4.0 6.0 662 662 A 28 PRO HDy A 27 PHE H 1.0 4.0 6.0 663 663 A 52 THR HG2% A 53 PHE H 1.0 4.0 7.0 664 664 A 53 PHE H A 52 THR HA 1.0 1.5 3.5 665 665 A 76 ARG H A 75 VAL HA 1.0 1.5 3.5 666 666 A 75 VAL HB A 76 ARG H 1.0 4.0 6.0 667 667 A 75 VAL HG1% A 76 ARG H 1.0 2.7 5.7 668 668 A 75 VAL HG2% A 76 ARG H 1.0 4.0 7.0 669 669 A 76 ARG H A 77 VAL H 1.0 1.5 3.5 670 670 A 46 VAL H A 45 GLY HAy 1.0 1.5 3.5 671 671 A 45 GLY H A 46 VAL H 1.0 1.5 3.5 672 672 A 40 ASN H A 39 LYS HBx 1.0 1.5 3.5 673 673 A 41 VAL HG1% A 40 ASN H 1.0 2.7 5.7 674 674 A 39 LYS HA A 40 ASN H 1.0 1.5 3.5 675 675 A 40 ASN H A 39 LYS H 1.0 2.7 4.7 676 676 A 41 VAL H A 40 ASN H 1.0 1.5 3.5 677 677 A 40 ASN H A 38 LEU H 1.0 4.0 6.0 678 678 A 37 TRP HA A 40 ASN H 1.0 1.5 3.5 679 679 A 73 TYR HA A 74 THR H 1.0 1.5 3.5 680 680 A 73 TYR HBx A 74 THR H 1.0 2.7 4.7 681 681 A 73 TYR HBy A 74 THR H 1.0 2.7 4.7 682 682 A 80 ILE H A 79 THR HA 1.0 1.5 3.5 683 683 A 80 ILE H A 65 HIS HB2 1.0 4.0 6.0 684 684 A 81 PHE H A 80 ILE H 1.0 4.0 6.0 685 685 A 80 ILE H A 65 HIS HB3 1.0 4.0 6.0 686 686 A 79 THR HG2% A 80 ILE H 1.0 2.7 5.7 687 687 A 65 HIS HA A 80 ILE H 1.0 2.7 4.7 688 688 A 80 ILE H A 79 THR H 1.0 2.7 4.7 689 689 A 78 PRO HA A 80 ILE H 1.0 2.7 4.7 690 690 A 80 ILE H A 79 THR HB 1.0 4.0 6.0 691 691 A 19 ASP HB2 A 15 ASN H 1.0 2.7 4.7 692 692 A 15 ASN H A 14 ASN HB3 1.0 2.7 4.7 693 693 A 15 ASN H A 19 ASP H 1.0 2.7 4.7 694 694 A 24 PHE HZ A 15 ASN H 1.0 4.0 6.0 695 695 A 14 ASN HA A 15 ASN H 1.0 1.5 3.5 696 696 A 14 ASN HB2 A 15 ASN H 1.0 2.7 4.7 697 697 A 15 ASN H A 18 ARG HBy 1.0 4.0 6.0 698 698 A 44 ALA H A 43 ARG HGx 1.0 2.7 4.7 699 699 A 44 ALA H A 43 ARG HBx 1.0 2.7 4.7 700 700 A 43 ARG HA A 44 ALA H 1.0 2.7 4.7 701 701 A 45 GLY H A 44 ALA H 1.0 4.0 6.0 702 702 A 40 ASN H A 39 LYS H 1.0 1.5 3.5 703 703 A 38 LEU HD2% A 39 LYS H 1.0 2.7 5.7 704 704 A 36 LEU HA A 39 LYS H 1.0 1.5 3.5 705 705 A 39 LYS H A 38 LEU HB2 1.0 1.5 3.5 706 706 A 37 TRP H A 39 LYS H 1.0 2.7 4.7 707 707 A 41 VAL H A 38 LEU H 1.0 4.0 6.0 708 708 A 41 VAL H A 38 LEU HA 1.0 4.0 6.0 709 709 A 42 SER H A 41 VAL H 1.0 1.5 3.5 710 710 A 30 ASP H A 29 LYS HA 1.0 2.7 4.7 711 711 A 30 ASP H A 29 LYS HBy 1.0 1.5 3.5 712 712 A 30 ASP H A 29 LYS HGx 1.0 1.5 3.5 713 713 A 28 PRO HBx A 30 ASP H 1.0 2.7 4.7 714 714 A 31 ALA H A 30 ASP H 1.0 4.0 6.0 715 715 A 51 SER H A 50 PHE HA 1.0 2.7 4.7 716 716 A 67 GLN H A 66 PHE HBx 1.0 2.7 4.7 717 717 A 75 VAL HG1% A 67 GLN H 1.0 4.0 7.0 718 718 A 75 VAL HG2% A 67 GLN H 1.0 2.7 5.7 719 719 A 67 GLN H A 66 PHE HA 1.0 2.7 4.7 720 720 A 67 GLN H A 66 PHE H 1.0 2.7 4.7 721 721 A 67 GLN H A 80 ILE HD1% 1.0 4.0 7.0 722 722 A 35 ARG HA A 38 LEU H 1.0 1.5 3.5 723 723 A 36 LEU H A 38 LEU H 1.0 2.7 4.7 724 724 A 37 TRP HD1 A 38 LEU H 1.0 2.7 4.7 725 725 A 41 VAL H A 38 LEU H 1.0 4.0 6.0 726 726 A 37 TRP HA A 38 LEU H 1.0 1.5 3.5 727 727 A 38 LEU H A 37 TRP HBx 1.0 1.5 3.5 728 728 A 37 TRP HBy A 38 LEU H 1.0 2.7 4.7 729 729 A 38 LEU H A 37 TRP HE3 1.0 4.0 6.0 730 730 A 72 THR H A 75 VAL H 1.0 4.0 6.0 731 731 A 72 THR H A 75 VAL HB 1.0 2.7 4.7 732 732 A 71 LYS HA A 72 THR H 1.0 1.5 3.5 733 733 A 72 THR H A 71 LYS HGy 1.0 2.7 4.7 734 734 A 75 VAL HG2% A 72 THR H 1.0 4.0 7.0 735 735 A 72 THR H A 71 LYS HB3 1.0 2.7 4.7 736 736 A 47 SER H A 46 VAL HA 1.0 2.7 4.7 737 737 A 46 VAL HGx% A 47 SER H 1.0 4.0 7.0 738 738 A 47 SER H A 46 VAL HGy% 1.0 4.0 7.0 739 739 A 33 LEU H A 35 ARG H 1.0 2.7 4.7 740 740 A 35 ARG H A 34 ARG HDy 1.0 1.5 3.5 741 741 A 36 LEU H A 35 ARG H 1.0 1.5 3.5 742 742 A 35 ARG H A 34 ARG HA 1.0 1.5 3.5 743 743 A 35 ARG H A 33 LEU HA 1.0 2.7 4.7 744 744 A 37 TRP H A 35 ARG H 1.0 4.0 6.0 745 745 A 34 ARG H A 35 ARG H 1.0 1.5 3.5 746 746 A 19 ASP HB2 A 22 LEU H 1.0 2.7 4.7 747 747 A 22 LEU H A 19 ASP HA 1.0 4.0 6.0 748 748 A 21 ALA HA A 22 LEU H 1.0 2.7 4.7 749 749 A 22 LEU H A 21 ALA HB% 1.0 2.7 5.7 750 750 A 22 LEU H A 20 LYS H 1.0 4.0 6.0 751 751 A 22 LEU H A 21 ALA H 1.0 1.5 3.5 752 752 A 23 HIS H A 22 LEU H 1.0 4.0 6.0 753 753 A 19 ASP HB3 A 22 LEU H 1.0 2.7 4.7 754 754 A 65 HIS H A 64 VAL HA 1.0 2.7 4.7 755 755 A 64 VAL HG2% A 65 HIS H 1.0 2.7 5.7 756 756 A 65 HIS H A 64 VAL HG1% 1.0 2.7 5.7 757 757 A 65 HIS H A 66 PHE HD% 1.0 2.7 5.7 758 758 A 65 HIS H A 64 VAL H 1.0 1.5 3.5 759 759 A 65 HIS H A 66 PHE H 1.0 2.7 4.7 760 760 A 18 ARG HBx A 15 ASN HD21 1.0 2.7 4.7 761 761 A 70 ARG H A 69 GLY H 1.0 4.0 6.0 762 762 A 69 GLY H A 68 GLY H 1.0 4.0 6.0 763 763 A 31 ALA H A 30 ASP H 1.0 4.0 6.0 764 764 A 30 ASP HA A 31 ALA H 1.0 1.5 3.5 765 765 A 31 ALA H A 30 ASP HB3 1.0 4.0 6.0 766 766 A 31 ALA H A 30 ASP HB2 1.0 4.0 6.0 767 767 A 32 GLU H A 31 ALA H 1.0 2.7 4.7 768 768 A 67 GLN HA A 68 GLY H 1.0 2.7 4.7 769 769 A 69 GLY H A 68 GLY H 1.0 4.0 6.0 770 770 A 54 GLN H A 53 PHE HA 1.0 1.5 3.5 771 771 A 54 GLN H A 53 PHE HBx 1.0 2.7 4.7 772 772 A 54 GLN H A 53 PHE HD% 1.0 2.7 5.7 773 773 A 53 PHE HBy A 54 GLN H 1.0 4.0 6.0 774 774 A 17 HIS H A 16 SER H 1.0 2.7 4.7 775 775 A 17 HIS H A 18 ARG HDy 1.0 4.0 6.0 776 776 A 16 SER HA A 17 HIS H 1.0 2.7 4.7 777 777 A 63 SER H A 64 VAL H 1.0 1.5 3.5 778 778 A 65 HIS H A 64 VAL H 1.0 1.5 3.5 779 779 A 63 SER HA A 64 VAL H 1.0 2.7 4.7 780 780 A 66 PHE H A 65 HIS HB3 1.0 4.0 6.0 781 781 A 66 PHE H A 64 VAL HA 1.0 2.7 4.7 782 782 A 67 GLN H A 66 PHE H 1.0 2.7 4.7 783 783 A 65 HIS H A 66 PHE H 1.0 1.5 3.5 784 784 A 65 HIS HA A 66 PHE H 1.0 2.7 4.7 785 785 A 80 ILE HG2% A 66 PHE H 1.0 2.7 5.7 786 786 A 19 ASP HA A 20 LYS H 1.0 1.5 3.5 787 787 A 22 LEU H A 20 LYS H 1.0 4.0 6.0 788 788 A 21 ALA H A 20 LYS H 1.0 2.7 4.7 789 789 A 19 ASP HB3 A 20 LYS H 1.0 2.7 4.7 790 790 A 15 ASN HD22 A 18 ARG HBx 1.0 2.7 4.7 791 791 A 42 SER H A 43 ARG H 1.0 2.7 4.7 792 792 A 42 SER H A 41 VAL HB 1.0 2.7 4.7 793 793 A 41 VAL HA A 42 SER H 1.0 2.7 4.7 794 794 A 42 SER H A 41 VAL HG1% 1.0 2.7 5.7 795 795 A 42 SER H A 41 VAL H 1.0 2.7 4.7 796 796 A 42 SER H A 41 VAL HG2% 1.0 2.7 5.7 797 797 A 80 ILE H A 79 THR H 1.0 2.7 4.7 798 798 A 78 PRO HA A 79 THR H 1.0 2.7 4.7 799 799 A 61 LEU H A 60 ARG HA 1.0 1.5 3.5 800 800 A 61 LEU H A 60 ARG HB2 1.0 1.5 3.5 801 801 A 61 LEU H A 62 CYS H 1.0 4.0 6.0 802 802 A 31 ALA HA A 32 GLU H 1.0 2.7 4.7 803 803 A 31 ALA HB% A 32 GLU H 1.0 1.5 4.5 804 804 A 32 GLU H A 30 ASP HB2 1.0 4.0 6.0 805 805 A 34 ARG H A 32 GLU H 1.0 2.7 4.7 806 806 A 59 HIS H A 60 ARG H 1.0 4.0 6.0 807 807 A 58 GLY HAx A 59 HIS H 1.0 2.7 4.7 808 808 A 59 HIS H A 58 GLY HAy 1.0 2.7 4.7 809 809 A 40 ASN HD21 A 79 THR HA 1.0 2.7 4.7 810 810 A 26 THR H A 25 TYR HD% 1.0 2.7 5.7 811 811 A 25 TYR H A 26 THR H 1.0 4.0 6.0 812 812 A 25 TYR HB2 A 26 THR H 1.0 2.7 4.7 813 813 A 25 TYR HB3 A 26 THR H 1.0 2.7 4.7 814 814 A 26 THR H A 25 TYR HA 1.0 1.5 3.5 815 815 A 45 GLY H A 46 VAL H 1.0 2.7 4.7 816 816 A 45 GLY H A 44 ALA H 1.0 4.0 6.0 817 817 A 44 ALA HA A 45 GLY H 1.0 2.7 4.7 818 818 A 45 GLY H A 44 ALA HB% 1.0 4.0 7.0 819 819 A 62 CYS H A 61 LEU HB2 1.0 2.7 4.7 820 820 A 61 LEU HA A 62 CYS H 1.0 2.7 4.7 821 821 A 62 CYS H A 61 LEU HB3 1.0 2.7 4.7 822 822 A 36 LEU H A 37 TRP H 1.0 1.5 3.5 823 823 A 36 LEU HD2% A 37 TRP H 1.0 2.7 5.7 824 824 A 36 LEU HG A 37 TRP H 1.0 2.7 4.7 825 825 A 37 TRP H A 39 LYS H 1.0 4.0 6.0 826 826 A 37 TRP H A 38 LEU H 1.0 2.7 4.7 827 827 A 36 LEU HBx A 37 TRP H 1.0 2.7 4.7 828 828 A 37 TRP H A 36 LEU HBy 1.0 2.7 4.7 829 829 A 33 LEU H A 34 ARG H 1.0 1.5 3.5 830 830 A 34 ARG H A 33 LEU HD2% 1.0 1.5 4.5 831 831 A 34 ARG H A 36 LEU H 1.0 4.0 6.0 832 832 A 32 GLU HA A 34 ARG H 1.0 1.5 3.5 833 833 A 34 ARG H A 31 ALA HA 1.0 2.7 4.7 834 834 A 34 ARG H A 35 ARG H 1.0 1.5 3.5 835 835 A 34 ARG H A 30 ASP HB2 1.0 2.7 4.7 836 836 A 34 ARG H A 28 PRO HGy 1.0 2.7 4.7 837 837 A 34 ARG H A 33 LEU HBx 1.0 1.5 3.5 838 838 A 21 ALA H A 19 ASP HA 1.0 2.7 4.7 839 839 A 21 ALA H A 20 LYS HGx 1.0 2.7 4.7 840 840 A 22 LEU H A 21 ALA H 1.0 1.5 3.5 841 841 A 21 ALA H A 20 LYS H 1.0 2.7 4.7 842 842 A 21 ALA H A 20 LYS HA 1.0 2.7 4.7 843 843 A 20 LYS HB2 A 21 ALA H 1.0 2.7 4.7 844 844 A 23 HIS H A 63 SER H 1.0 2.7 4.7 845 845 A 23 HIS H A 22 LEU HB3 1.0 1.5 3.5 846 846 A 23 HIS H A 24 PHE HD% 1.0 4.0 7.0 847 847 A 23 HIS H A 24 PHE H 1.0 4.0 6.0 848 848 A 22 LEU HA A 23 HIS H 1.0 1.5 3.5 849 849 A 23 HIS H A 22 LEU H 1.0 4.0 6.0 850 850 A 23 HIS H A 22 LEU HD1% 1.0 2.7 5.7 851 851 A 23 HIS H A 22 LEU HB2 1.0 2.7 4.7 852 852 A 77 VAL H A 75 VAL HA 1.0 2.7 4.7 853 853 A 75 VAL HG1% A 77 VAL H 1.0 2.7 5.7 854 854 A 76 ARG H A 77 VAL H 1.0 1.5 3.5 855 855 A 75 VAL HG2% A 77 VAL H 1.0 2.7 5.7 856 856 A 76 ARG HA A 77 VAL H 1.0 2.7 4.7 857 857 A 77 VAL H A 76 ARG HB2 1.0 2.7 4.7 858 858 A 77 VAL H A 76 ARG HGy 1.0 4.0 6.0 859 859 A 40 ASN HD22 A 79 THR HA 1.0 4.0 6.0 860 860 A 18 ARG H A 17 HIS HB2 1.0 2.7 4.7 861 861 A 30 ASP H A 29 LYS HA 1.0 2.7 4.7 862 862 A 38 LEU HA A 39 LYS H 1.0 4.0 6.0 863 863 A 41 VAL H A 38 LEU HA 1.0 2.7 4.7 864 864 A 71 LYS HDx A 37 TRP HZ2 1.0 1.5 3.5 865 865 A 71 LYS HDx A 37 TRP HH2 1.0 2.7 4.7 866 866 A 21 ALA HA A 22 LEU H 1.0 2.7 4.7 867 867 A 30 ASP HA A 31 ALA H 1.0 1.5 3.5 868 868 A 32 GLU H A 30 ASP HA 1.0 2.7 4.7 869 869 A 31 ALA HB% A 30 ASP HA 1.0 2.7 5.7 870 870 A 16 SER HB2 A 42 SER HBx 1.0 2.7 4.7 871 871 A 67 GLN H A 80 ILE HD1% 1.0 2.7 5.7 872 872 A 75 VAL HG2% A 67 GLN H 1.0 2.7 5.7 873 873 A 67 GLN H A 66 PHE HA 1.0 2.7 4.7 874 874 A 36 LEU HA A 38 LEU H 1.0 2.7 4.7 875 875 A 37 TRP HD1 A 38 LEU H 1.0 2.7 4.7 876 876 A 38 LEU H A 37 TRP HBx 1.0 2.7 4.7 877 877 A 37 TRP HBy A 38 LEU H 1.0 2.7 4.7 878 878 A 37 TRP H A 38 LEU H 1.0 1.5 3.5 879 879 A 38 LEU H A 34 ARG HA 1.0 2.7 4.7 880 880 A 35 ARG HA A 38 LEU H 1.0 2.7 4.7 881 881 A 36 LEU H A 38 LEU H 1.0 4.0 6.0 882 882 A 39 LYS H A 38 LEU H 1.0 2.7 4.7 883 883 A 71 LYS HA A 72 THR H 1.0 1.5 3.5 884 884 A 72 THR H A 75 VAL H 1.0 2.7 4.7 885 885 A 72 THR H A 75 VAL HB 1.0 2.7 4.7 886 886 A 75 VAL HG2% A 72 THR H 1.0 2.7 5.7 887 887 A 47 SER H A 46 VAL HGy% 1.0 2.7 5.7 888 888 A 48 GLY H A 47 SER HBy 1.0 2.7 4.7 889 889 A 34 ARG H A 35 ARG H 1.0 1.5 3.5 890 890 A 35 ARG H A 34 ARG HA 1.0 2.7 4.7 891 891 A 35 ARG H A 34 ARG HB3 1.0 2.7 4.7 892 892 A 32 GLU HA A 35 ARG H 1.0 1.5 3.5 893 893 A 31 ALA HA A 35 ARG H 1.0 2.7 4.7 894 894 A 37 TRP HD1 A 77 VAL HG2% 1.0 1.5 4.5 895 895 A 78 PRO HDy A 77 VAL HG2% 1.0 1.5 4.5 896 896 A 37 TRP HE1 A 77 VAL HG2% 1.0 2.7 5.7 897 897 A 77 VAL HG2% A 36 LEU HBy 1.0 2.7 5.7 898 898 A 21 ALA HA A 22 LEU H 1.0 2.7 4.7 899 899 A 22 LEU H A 21 ALA HB% 1.0 2.7 5.7 900 900 A 22 LEU H A 21 ALA H 1.0 2.7 4.7 901 901 A 19 ASP HB2 A 22 LEU H 1.0 2.7 4.7 902 902 A 65 HIS H A 64 VAL HG1% 1.0 2.7 5.7 903 903 A 65 HIS H A 64 VAL H 1.0 1.5 3.5 904 904 A 65 HIS H A 66 PHE H 1.0 2.7 4.7 905 905 A 65 HIS H A 64 VAL HA 1.0 2.7 4.7 906 906 A 64 VAL HG2% A 65 HIS H 1.0 2.7 5.7 907 907 A 65 HIS H A 66 PHE HD% 1.0 2.7 5.7 908 908 A 37 TRP HD1 A 36 LEU HA 1.0 2.7 4.7 909 909 A 37 TRP H A 36 LEU HA 1.0 2.7 4.7 910 910 A 36 LEU HA A 39 LYS HBy 1.0 1.5 3.5 911 911 A 36 LEU HA A 39 LYS H 1.0 2.7 4.7 912 912 A 33 LEU H A 32 GLU HGx 1.0 2.7 4.7 913 913 A 40 ASN H A 39 LYS HBx 1.0 2.7 4.7 914 914 A 80 ILE HG2% A 81 PHE H 1.0 2.7 5.7 915 915 A 37 TRP HD1 A 38 LEU H 1.0 2.7 5.7 916 916 A 37 TRP HD1 A 77 VAL HG2% 1.0 1.5 5.5 917 917 A 37 TRP HD1 A 36 LEU HA 1.0 2.7 5.7 918 918 A 37 TRP HD1 A 33 LEU HG 1.0 4.0 7.0 919 919 A 78 PRO HDy A 37 TRP HD1 1.0 2.7 5.7 920 920 A 36 LEU HBx A 37 TRP HD1 1.0 2.7 5.7 921 921 A 37 TRP HD1 A 36 LEU HBy 1.0 2.7 5.7 922 922 A 37 TRP HD1 A 34 ARG HA 1.0 2.7 5.7 923 923 A 37 TRP HD1 A 33 LEU HD1% 1.0 1.5 5.5 924 924 A 37 TRP HD1 A 77 VAL HA 1.0 2.7 5.7 925 925 A 36 LEU H A 37 TRP HD1 1.0 2.7 5.7 926 926 A 77 VAL HG1% A 37 TRP HD1 1.0 1.5 5.5 927 927 A 36 LEU HD2% A 37 TRP HD1 1.0 2.7 6.7 928 928 A 81 PHE HE% A 9 VAL HG2% 1.0 2.7 6.7 929 929 A 10 PRO HDx A 9 VAL HG2% 1.0 2.7 5.7 930 930 A 9 VAL HG2% A 10 PRO HDy 1.0 2.7 5.7 931 931 A 9 VAL HG2% A 65 HIS HE1 1.0 1.5 4.5 932 932 A 9 VAL HG2% A 81 PHE HD% 1.0 1.5 5.5 933 933 A 22 LEU H A 21 ALA HB% 1.0 2.7 5.7 934 934 A 31 ALA H A 30 ASP HB3 1.0 2.7 4.7 935 935 A 33 LEU H A 30 ASP HB3 1.0 2.7 4.7 936 936 A 80 ILE HG2% A 81 PHE H 1.0 2.7 5.7 937 937 A 81 PHE H A 80 ILE HA 1.0 1.5 3.5 938 938 A 37 TRP HD1 A 33 LEU HD2% 1.0 2.7 5.7 939 939 A 37 TRP HE1 A 33 LEU HD2% 1.0 2.7 5.7 940 940 A 34 ARG H A 33 LEU HD2% 1.0 4.0 7.0 941 941 A 37 TRP HZ2 A 33 LEU HD2% 1.0 2.7 5.7 942 942 A 33 LEU HD2% A 76 ARG HB3 1.0 4.0 7.0 943 943 A 33 LEU HD2% A 76 ARG HDy 1.0 2.7 5.7 944 944 A 28 PRO HBx A 33 LEU HD2% 1.0 2.7 5.7 945 945 A 26 THR HB A 27 PHE H 1.0 1.5 3.5 946 946 A 67 GLN HA A 68 GLY H 1.0 2.7 4.7 947 947 A 80 ILE HD1% A 67 GLN HA 1.0 1.5 4.5 948 948 A 42 SER H A 41 VAL HB 1.0 2.7 4.7 949 949 A 65 HIS H A 64 VAL HG1% 1.0 2.7 5.7 950 950 A 14 ASN HD22 A 64 VAL HG1% 1.0 2.7 5.7 951 951 A 62 CYS HB2 A 24 PHE HE% 1.0 4.0 8.0 952 952 A 24 PHE HE% A 14 ASN HB3 1.0 4.0 8.0 953 953 A 22 LEU HD2% A 24 PHE HE% 1.0 2.7 7.7 954 954 A 24 PHE HE% A 62 CYS HB3 1.0 2.7 6.7 955 955 A 24 PHE HE% A 16 SER HA 1.0 1.5 5.5 956 956 A 60 ARG HB3 A 61 LEU H 1.0 2.7 4.7 957 957 A 24 PHE HD% A 60 ARG HB3 1.0 2.7 5.7 958 958 A 53 PHE H A 52 THR HA 1.0 2.7 4.7 959 959 A 33 LEU HD2% A 28 PRO HBy 1.0 4.0 7.0 960 960 A 30 ASP HB2 A 28 PRO HBy 1.0 2.7 4.7 961 961 A 34 ARG H A 28 PRO HBy 1.0 2.7 4.7 962 962 A 30 ASP H A 28 PRO HBy 1.0 2.7 4.7 963 963 A 37 TRP HH2 A 25 TYR HB2 1.0 2.7 4.7 964 964 A 25 TYR HB2 A 26 THR H 1.0 2.7 4.7 965 965 A 39 LYS H A 38 LEU HB2 1.0 1.5 3.5 966 966 A 18 ARG H A 17 HIS HA 1.0 2.7 4.7 967 967 A 46 VAL H A 45 GLY HAy 1.0 1.5 3.5 968 968 A 16 SER HB2 A 42 SER HBx 1.0 2.7 4.7 969 969 A 30 ASP HB2 A 28 PRO HBy 1.0 4.0 6.0 970 970 A 33 LEU H A 30 ASP HB2 1.0 2.7 4.7 971 971 A 30 ASP HA A 31 ALA H 1.0 1.5 3.5 972 972 A 31 ALA H A 30 ASP HB3 1.0 4.0 6.0 973 973 A 32 GLU H A 31 ALA H 1.0 2.7 4.7 974 974 A 31 ALA H A 30 ASP H 1.0 4.0 6.0 975 975 A 67 GLN HA A 68 GLY H 1.0 2.7 4.7 976 976 A 54 GLN H A 53 PHE HA 1.0 2.7 4.7 977 977 A 81 PHE HE% A 9 VAL HG2% 1.0 2.7 7.7 978 978 A 81 PHE HE% A 61 LEU HD2% 1.0 2.7 7.7 979 979 A 81 PHE HE% A 41 VAL HG1% 1.0 2.7 7.7 980 980 A 40 ASN HBx A 81 PHE HE% 1.0 2.7 6.7 981 981 A 81 PHE HE% A 78 PRO HBx 1.0 2.7 6.7 982 982 A 81 PHE HE% A 40 ASN HBy 1.0 2.7 6.7 983 983 A 81 PHE HE% A 9 VAL HG1% 1.0 4.0 9.0 984 984 A 17 HIS H A 18 ARG H 1.0 1.5 3.5 985 985 A 17 HIS H A 16 SER H 1.0 2.7 4.7 986 986 A 17 HIS H A 19 ASP H 1.0 4.0 6.0 987 987 A 16 SER HA A 17 HIS H 1.0 2.7 4.7 988 988 A 65 HIS H A 64 VAL H 1.0 1.5 3.5 989 989 A 63 SER H A 64 VAL H 1.0 1.5 3.5 990 990 A 14 ASN HA A 15 ASN H 1.0 1.5 3.5 991 991 A 65 HIS H A 66 PHE H 1.0 2.7 4.7 992 992 A 66 PHE H A 64 VAL HA 1.0 2.7 4.7 993 993 A 66 PHE H A 63 SER HA 1.0 4.0 6.0 994 994 A 21 ALA H A 20 LYS H 1.0 2.7 4.7 995 995 A 19 ASP H A 20 LYS H 1.0 2.7 4.7 996 996 A 74 THR HG2% A 73 TYR HD% 1.0 2.7 7.7 997 997 A 27 PHE HD% A 38 LEU HG 1.0 2.7 5.7 998 998 A 23 HIS H A 22 LEU HB3 1.0 2.7 4.7 999 999 A 74 THR HG2% A 73 TYR HD% 1.0 1.5 5.5 1000 1000 A 74 THR HG2% A 75 VAL H 1.0 4.0 7.0 1001 1001 A 72 THR HG2% A 70 ARG HBy 1.0 2.7 5.7 1002 1002 A 54 GLN HGx A 55 PRO HDx 1.0 2.7 4.7 1003 1003 A 55 PRO HDx A 54 GLN HA 1.0 1.5 3.5 1004 1004 A 30 ASP H A 29 LYS HBx 1.0 2.7 4.7 1005 1005 A 37 TRP HH2 A 25 TYR HB3 1.0 2.7 4.7 1006 1006 A 25 TYR HB3 A 26 THR H 1.0 2.7 4.7 1007 1007 A 78 PRO HDy A 37 TRP HA 1.0 4.0 6.0 1008 1008 A 40 ASN HBx A 37 TRP HA 1.0 2.7 4.7 1009 1009 A 37 TRP HZ2 A 71 LYS HDy 1.0 2.7 4.7 1010 1010 A 36 LEU HBx A 33 LEU HA 1.0 2.7 4.7 1011 1011 A 36 LEU HBy A 33 LEU HA 1.0 2.7 4.7 1012 1012 A 34 ARG H A 33 LEU HA 1.0 1.5 3.5 1013 1013 A 36 LEU H A 33 LEU HA 1.0 1.5 3.5 1014 1014 A 79 THR HG2% A 40 ASN HD21 1.0 1.5 4.5 1015 1015 A 79 THR HG2% A 40 ASN HD22 1.0 2.7 5.7 1016 1016 A 59 HIS HBx A 60 ARG H 1.0 2.7 4.7 1017 1017 A 27 PHE HE% A 59 HIS HBx 1.0 4.0 7.0 1018 1018 A 27 PHE HD% A 59 HIS HBx 1.0 4.0 7.0 1019 1019 A 63 SER HBx A 25 TYR HE% 1.0 4.0 7.0 1020 1020 A 22 LEU HG A 19 ASP HB3 1.0 2.7 4.7 1021 1021 A 22 LEU HG A 19 ASP HB2 1.0 2.7 4.7 1022 1022 A 37 TRP HD1 A 33 LEU HG 1.0 2.7 4.7 1023 1023 A 34 ARG H A 33 LEU HG 1.0 2.7 4.7 1024 1024 A 42 SER H A 41 VAL HB 1.0 4.0 6.0 1025 1025 A 42 SER H A 41 VAL HG1% 1.0 2.7 5.7 1026 1026 A 42 SER H A 41 VAL HG2% 1.0 2.7 5.7 1027 1027 A 42 SER H A 41 VAL H 1.0 2.7 4.7 1028 1028 A 37 TRP HZ3 A 61 LEU HD2% 1.0 2.7 5.7 1029 1029 A 37 TRP HZ3 A 61 LEU HB3 1.0 2.7 4.7 1030 1030 A 37 TRP HZ3 A 27 PHE HA 1.0 2.7 4.7 1031 1031 A 37 TRP HZ3 A 61 LEU HB2 1.0 2.7 4.7 1032 1032 A 27 PHE HE% A 37 TRP HZ3 1.0 4.0 7.0 1033 1033 A 37 TRP HZ3 A 27 PHE HD% 1.0 2.7 5.7 1034 1034 A 78 PRO HA A 79 THR H 1.0 2.7 4.7 1035 1035 A 80 ILE H A 79 THR H 1.0 2.7 4.7 1036 1036 A 18 ARG H A 17 HIS HB2 1.0 2.7 4.7 1037 1037 A 18 ARG H A 17 HIS HA 1.0 2.7 4.7 1038 1038 A 17 HIS H A 18 ARG H 1.0 1.5 3.5 1039 1039 A 18 ARG H A 19 ASP H 1.0 1.5 3.5 1040 1040 A 17 HIS HB3 A 18 ARG H 1.0 2.7 4.7 1041 1041 A 67 GLN H A 80 ILE HD1% 1.0 4.0 7.0 1042 1042 A 80 ILE HD1% A 67 GLN HA 1.0 1.5 4.5 1043 1043 A 39 LYS HA A 40 ASN H 1.0 2.7 4.7 1044 1044 A 62 CYS HB2 A 24 PHE HE% 1.0 2.7 5.7 1045 1045 A 62 CYS HB2 A 63 SER H 1.0 2.7 4.7 1046 1046 A 78 PRO HDy A 77 VAL HG2% 1.0 2.7 5.7 1047 1047 A 78 PRO HDy A 37 TRP HD1 1.0 2.7 4.7 1048 1048 A 78 PRO HDy A 37 TRP HA 1.0 4.0 6.0 1049 1049 A 78 PRO HDy A 37 TRP HE1 1.0 2.7 4.7 1050 1050 A 78 PRO HDy A 77 VAL HA 1.0 2.7 4.7 1051 1051 A 78 PRO HDy A 66 PHE HE% 1.0 2.7 5.7 1052 1052 A 78 PRO HDy A 66 PHE HZ 1.0 4.0 6.0 1053 1053 A 26 THR H A 25 TYR HA 1.0 1.5 3.5 1054 1054 A 38 LEU H A 37 TRP HBx 1.0 2.7 4.7 1055 1055 A 27 PHE HD% A 37 TRP HBx 1.0 2.7 5.7 1056 1056 A 30 ASP HB2 A 33 LEU HBx 1.0 2.7 4.7 1057 1057 A 60 ARG H A 59 HIS HBy 1.0 4.0 6.0 1058 1058 A 27 PHE HE% A 59 HIS HBy 1.0 4.0 7.0 1059 1059 A 27 PHE HD% A 59 HIS HBy 1.0 4.0 7.0 1060 1060 A 60 ARG HB3 A 61 LEU H 1.0 2.7 4.7 1061 1061 A 61 LEU H A 60 ARG HA 1.0 1.5 3.5 1062 1062 A 61 LEU H A 60 ARG H 1.0 4.0 6.0 1063 1063 A 25 TYR H A 61 LEU H 1.0 2.7 4.7 1064 1064 A 32 GLU H A 30 ASP HA 1.0 4.0 6.0 1065 1065 A 32 GLU H A 31 ALA H 1.0 2.7 4.7 1066 1066 A 34 ARG H A 32 GLU H 1.0 2.7 4.7 1067 1067 A 33 LEU H A 32 GLU H 1.0 1.5 3.5 1068 1068 A 31 ALA HA A 32 GLU H 1.0 2.7 4.7 1069 1069 A 31 ALA HB% A 32 GLU H 1.0 1.5 4.5 1070 1070 A 24 PHE HE% A 14 ASN HB3 1.0 4.0 7.0 1071 1071 A 24 PHE HZ A 14 ASN HB3 1.0 2.7 4.7 1072 1072 A 15 ASN H A 14 ASN HB3 1.0 2.7 4.7 1073 1073 A 37 TRP HZ3 A 61 LEU HD2% 1.0 1.5 4.5 1074 1074 A 41 VAL HG1% A 61 LEU HD2% 1.0 1.5 5.5 1075 1075 A 27 PHE HE% A 61 LEU HD2% 1.0 2.7 6.7 1076 1076 A 27 PHE HZ A 61 LEU HD2% 1.0 2.7 5.7 1077 1077 A 61 LEU HD2% A 66 PHE HZ 1.0 2.7 5.7 1078 1078 A 37 TRP HH2 A 61 LEU HD2% 1.0 2.7 5.7 1079 1079 A 27 PHE HD% A 61 LEU HD2% 1.0 2.7 6.7 1080 1080 A 61 LEU HD2% A 37 TRP HE3 1.0 2.7 5.7 1081 1081 A 61 LEU HD2% A 65 HIS HD2 1.0 2.7 5.7 1082 1082 A 37 TRP HE1 A 77 VAL HG2% 1.0 2.7 6.7 1083 1083 A 37 TRP HE1 A 33 LEU HD2% 1.0 2.7 6.7 1084 1084 A 78 PRO HDy A 37 TRP HE1 1.0 4.0 7.0 1085 1085 A 37 TRP HE1 A 33 LEU HD1% 1.0 2.7 6.7 1086 1086 A 37 TRP HE1 A 77 VAL HA 1.0 2.7 5.7 1087 1087 A 77 VAL HG1% A 37 TRP HE1 1.0 2.7 6.7 1088 1088 A 26 THR HG2% A 27 PHE H 1.0 2.7 5.7 1089 1089 A 24 PHE HBx A 26 THR HG2% 1.0 2.7 5.7 1090 1090 A 41 VAL HG1% A 53 PHE HD% 1.0 4.0 9.0 1091 1091 A 53 PHE HD% A 38 LEU HD1% 1.0 2.7 7.7 1092 1092 A 81 PHE HE% A 41 VAL HG1% 1.0 2.7 6.7 1093 1093 A 42 SER H A 41 VAL HG1% 1.0 2.7 5.7 1094 1094 A 41 VAL HG1% A 61 LEU HD2% 1.0 1.5 5.5 1095 1095 A 41 VAL HG1% A 53 PHE HD% 1.0 2.7 6.7 1096 1096 A 41 VAL HG1% A 61 LEU HD1% 1.0 2.7 6.7 1097 1097 A 41 VAL HG1% A 27 PHE HZ 1.0 2.7 5.7 1098 1098 A 41 VAL HG1% A 27 PHE HD% 1.0 2.7 6.7 1099 1099 A 41 VAL HG1% A 53 PHE HZ 1.0 4.0 7.0 1100 1100 A 14 ASN HD22 A 64 VAL HG1% 1.0 2.7 5.7 1101 1101 A 64 VAL HG2% A 14 ASN HD22 1.0 1.5 4.5 1102 1102 A 24 PHE HD% A 60 ARG HB3 1.0 2.7 6.7 1103 1103 A 24 PHE HD% A 16 SER HA 1.0 2.7 6.7 1104 1104 A 4 GLY HAy A 5 PHE H 1.0 1.5 3.5 1105 1105 A 61 LEU HA A 62 CYS H 1.0 2.7 4.7 1106 1106 A 78 PRO HA A 79 THR H 1.0 2.7 4.7 1107 1107 A 66 PHE HA A 78 PRO HA 1.0 2.7 4.7 1108 1108 A 78 PRO HA A 80 ILE H 1.0 2.7 4.7 1109 1109 A 37 TRP HBy A 38 LEU H 1.0 2.7 4.7 1110 1110 A 27 PHE HD% A 37 TRP HBy 1.0 1.5 4.5 1111 1111 A 30 ASP HB2 A 33 LEU HBy 1.0 2.7 4.7 1112 1112 A 36 LEU HBx A 37 TRP HD1 1.0 2.7 4.7 1113 1113 A 36 LEU HBx A 37 TRP H 1.0 2.7 4.7 1114 1114 A 36 LEU HBx A 77 VAL HG1% 1.0 2.7 5.7 1115 1115 A 5 PHE H A 16 SER HB3 1.0 2.7 4.7 1116 1116 A 16 SER HB3 A 42 SER HBy 1.0 2.7 4.7 1117 1117 A 34 ARG HGx A 27 PHE HE% 1.0 2.7 5.7 1118 1118 A 24 PHE HZ A 14 ASN HB3 1.0 2.7 4.7 1119 1119 A 22 LEU HD2% A 24 PHE HZ 1.0 2.7 5.7 1120 1120 A 24 PHE HZ A 15 ASN H 1.0 2.7 4.7 1121 1121 A 16 SER HA A 24 PHE HZ 1.0 2.7 4.7 1122 1122 A 81 PHE HE% A 61 LEU HD1% 1.0 1.5 5.5 1123 1123 A 37 TRP HZ3 A 61 LEU HD1% 1.0 1.5 4.5 1124 1124 A 41 VAL HG1% A 61 LEU HD1% 1.0 2.7 6.7 1125 1125 A 27 PHE HE% A 61 LEU HD1% 1.0 4.0 8.0 1126 1126 A 81 PHE HD% A 61 LEU HD1% 1.0 4.0 8.0 1127 1127 A 61 LEU HD1% A 66 PHE HZ 1.0 2.7 5.7 1128 1128 A 37 TRP HH2 A 61 LEU HD1% 1.0 2.7 5.7 1129 1129 A 61 LEU HD1% A 37 TRP HE3 1.0 2.7 5.7 1130 1130 A 65 HIS HD2 A 61 LEU HD1% 1.0 1.5 4.5 1131 1131 A 66 PHE HD% A 61 LEU HD1% 1.0 2.7 6.7 1132 1132 A 55 PRO HDx A 38 LEU HD2% 1.0 2.7 5.7 1133 1133 A 38 LEU HD2% A 53 PHE HD% 1.0 2.7 6.7 1134 1134 A 38 LEU HD2% A 35 ARG HA 1.0 1.5 4.5 1135 1135 A 75 VAL HG2% A 66 PHE HBx 1.0 2.7 5.7 1136 1136 A 5 PHE H A 4 GLY HAx 1.0 1.5 3.5 1137 1137 A 71 LYS HA A 72 THR H 1.0 1.5 3.5 1138 1138 A 71 LYS HA A 75 VAL HB 1.0 4.0 6.0 1139 1139 A 71 LYS HA A 75 VAL HG2% 1.0 2.7 5.7 1140 1140 A 71 LYS HA A 66 PHE HD% 1.0 2.7 5.7 1141 1141 A 55 PRO HDy A 54 GLN HA 1.0 2.7 4.7 1142 1142 A 30 ASP H A 29 LYS HBy 1.0 2.7 4.7 1143 1143 A 23 HIS HB2 A 24 PHE H 1.0 4.0 6.0 1144 1144 A 23 HIS HB2 A 25 TYR HE% 1.0 2.7 5.7 1145 1145 A 9 VAL HG2% A 10 PRO HDy 1.0 2.7 5.7 1146 1146 A 37 TRP HZ3 A 61 LEU HB3 1.0 2.7 4.7 1147 1147 A 37 TRP HZ3 A 27 PHE HA 1.0 2.7 4.7 1148 1148 A 28 PRO HDy A 27 PHE HA 1.0 2.7 4.7 1149 1149 A 27 PHE HA A 28 PRO HDx 1.0 2.7 4.7 1150 1150 A 37 TRP HE3 A 27 PHE HA 1.0 4.0 6.0 1151 1151 A 24 PHE H A 23 HIS HA 1.0 1.5 3.5 1152 1152 A 77 VAL HG2% A 36 LEU HBy 1.0 2.7 5.7 1153 1153 A 37 TRP HD1 A 36 LEU HBy 1.0 2.7 4.7 1154 1154 A 37 TRP H A 36 LEU HBy 1.0 2.7 4.7 1155 1155 A 77 VAL HG1% A 36 LEU HBy 1.0 1.5 4.5 1156 1156 A 63 SER HBy A 25 TYR HE% 1.0 2.7 5.7 1157 1157 A 61 LEU HA A 62 CYS H 1.0 2.7 4.7 1158 1158 A 65 HIS HD2 A 62 CYS H 1.0 2.7 4.7 1159 1159 A 37 TRP H A 38 LEU H 1.0 2.7 4.7 1160 1160 A 37 TRP H A 36 LEU HA 1.0 2.7 4.7 1161 1161 A 36 LEU HBx A 37 TRP H 1.0 2.7 4.7 1162 1162 A 37 TRP H A 36 LEU HBy 1.0 2.7 4.7 1163 1163 A 37 TRP H A 34 ARG HA 1.0 2.7 4.7 1164 1164 A 36 LEU H A 37 TRP H 1.0 1.5 3.5 1165 1165 A 36 LEU HD1% A 37 TRP H 1.0 2.7 5.7 1166 1166 A 36 LEU HD2% A 37 TRP H 1.0 2.7 5.7 1167 1167 A 36 LEU HG A 37 TRP H 1.0 4.0 6.0 1168 1168 A 34 ARG H A 35 ARG H 1.0 1.5 3.5 1169 1169 A 34 ARG H A 33 LEU HD2% 1.0 2.7 5.7 1170 1170 A 34 ARG H A 33 LEU HG 1.0 2.7 4.7 1171 1171 A 34 ARG H A 32 GLU H 1.0 2.7 4.7 1172 1172 A 34 ARG H A 28 PRO HGy 1.0 2.7 4.7 1173 1173 A 33 LEU H A 34 ARG H 1.0 1.5 3.5 1174 1174 A 34 ARG H A 33 LEU HD1% 1.0 2.7 5.7 1175 1175 A 34 ARG H A 31 ALA HA 1.0 2.7 4.7 1176 1176 A 34 ARG H A 32 GLU HB2 1.0 4.0 6.0 1177 1177 A 22 LEU H A 21 ALA H 1.0 2.7 4.7 1178 1178 A 21 ALA H A 20 LYS H 1.0 2.7 4.7 1179 1179 A 23 HIS H A 22 LEU HB3 1.0 2.7 4.7 1180 1180 A 23 HIS H A 22 LEU HD2% 1.0 4.0 7.0 1181 1181 A 23 HIS H A 63 SER H 1.0 2.7 4.7 1182 1182 A 23 HIS H A 22 LEU HD1% 1.0 2.7 5.7 1183 1183 A 22 LEU HA A 23 HIS H 1.0 2.7 4.7 1184 1184 A 23 HIS H A 22 LEU HB2 1.0 2.7 4.7 1185 1185 A 40 ASN HBx A 81 PHE HE% 1.0 2.7 5.7 1186 1186 A 40 ASN HBx A 41 VAL H 1.0 2.7 4.7 1187 1187 A 22 LEU HD2% A 24 PHE HZ 1.0 2.7 5.7 1188 1188 A 23 HIS H A 22 LEU HD2% 1.0 2.7 5.7 1189 1189 A 22 LEU HD2% A 19 ASP HB3 1.0 1.5 4.5 1190 1190 A 22 LEU HD2% A 19 ASP HB2 1.0 2.7 5.7 1191 1191 A 77 VAL H A 75 VAL HA 1.0 2.7 4.7 1192 1192 A 75 VAL HG2% A 77 VAL H 1.0 2.7 5.7 1193 1193 A 76 ARG H A 77 VAL H 1.0 1.5 3.5 1194 1194 A 75 VAL HG2% A 67 GLN HB2 1.0 2.7 5.7 1195 1195 A 65 HIS H A 64 VAL HA 1.0 2.7 4.7 1196 1196 A 66 PHE H A 64 VAL HA 1.0 2.7 4.7 1197 1197 A 35 ARG H A 34 ARG HA 1.0 2.7 4.7 1198 1198 A 37 TRP HD1 A 34 ARG HA 1.0 2.7 4.7 1199 1199 A 37 TRP H A 34 ARG HA 1.0 2.7 4.7 1200 1200 A 34 ARG HA A 28 PRO HDy 1.0 2.7 4.7 1201 1201 A 41 VAL HA A 42 SER H 1.0 2.7 4.7 1202 1202 A 70 ARG HA A 71 LYS H 1.0 2.7 4.7 1203 1203 A 24 PHE HE% A 62 CYS HB3 1.0 2.7 5.7 1204 1204 A 27 PHE HE% A 55 PRO HBx 1.0 4.0 7.0 1205 1205 A 27 PHE HD% A 55 PRO HBx 1.0 2.7 5.7 1206 1206 A 18 ARG HA A 19 ASP H 1.0 2.7 4.7 1207 1207 A 61 LEU H A 60 ARG HA 1.0 2.7 4.7 1208 1208 A 37 TRP HZ3 A 61 LEU HB2 1.0 2.7 4.7 1209 1209 A 37 TRP HD1 A 78 PRO HDx 1.0 2.7 4.7 1210 1210 A 37 TRP HE1 A 78 PRO HDx 1.0 2.7 4.7 1211 1211 A 66 PHE HE% A 78 PRO HDx 1.0 2.7 5.7 1212 1212 A 66 PHE HZ A 78 PRO HDx 1.0 2.7 4.7 1213 1213 A 47 SER H A 46 VAL HA 1.0 2.7 4.7 1214 1214 A 73 TYR HA A 74 THR H 1.0 2.7 4.7 1215 1215 A 35 ARG HA A 38 LEU H 1.0 2.7 4.7 1216 1216 A 35 ARG HA A 38 LEU HB3 1.0 4.0 6.0 1217 1217 A 38 LEU HD2% A 35 ARG HA 1.0 1.5 4.5 1218 1218 A 32 GLU HB3 A 33 LEU H 1.0 2.7 4.7 1219 1219 A 60 ARG HA A 26 THR HA 1.0 2.7 4.7 1220 1220 A 27 PHE H A 26 THR HA 1.0 1.5 3.5 1221 1221 A 63 SER H A 64 VAL H 1.0 1.5 3.5 1222 1222 A 62 CYS HB2 A 63 SER H 1.0 2.7 4.7 1223 1223 A 23 HIS H A 63 SER H 1.0 2.7 4.7 1224 1224 A 63 SER H A 62 CYS HB3 1.0 2.7 4.7 1225 1225 A 42 SER H A 41 VAL HG2% 1.0 2.7 5.7 1226 1226 A 27 PHE HZ A 41 VAL HG2% 1.0 4.0 7.0 1227 1227 A 46 VAL HGx% A 47 SER H 1.0 4.0 7.0 1228 1228 A 66 PHE HE% A 25 TYR HD% 1.0 1.5 6.5 1229 1229 A 66 PHE HZ A 25 TYR HD% 1.0 2.7 6.7 1230 1230 A 26 THR H A 25 TYR HD% 1.0 2.7 6.7 1231 1231 A 63 SER HA A 25 TYR HD% 1.0 2.7 6.7 1232 1232 A 66 PHE HD% A 25 TYR HD% 1.0 1.5 6.5 1233 1233 A 72 THR HG2% A 70 ARG HBx 1.0 4.0 7.0 1234 1234 A 34 ARG H A 28 PRO HGy 1.0 4.0 6.0 1235 1235 A 34 ARG HA A 28 PRO HGy 1.0 2.7 4.7 1236 1236 A 81 PHE HE% A 79 THR HA 1.0 2.7 5.7 1237 1237 A 40 ASN HD21 A 79 THR HA 1.0 2.7 4.7 1238 1238 A 80 ILE H A 79 THR HA 1.0 1.5 3.5 1239 1239 A 62 CYS HA A 63 SER H 1.0 1.5 3.5 1240 1240 A 62 CYS HA A 25 TYR H 1.0 2.7 4.7 1241 1241 A 24 PHE HA A 62 CYS HA 1.0 2.7 4.7 1242 1242 A 81 PHE HE% A 78 PRO HBx 1.0 2.7 5.7 1243 1243 A 81 PHE HZ A 78 PRO HBx 1.0 4.0 6.0 1244 1244 A 33 LEU HD2% A 76 ARG HDx 1.0 4.0 7.0 1245 1245 A 35 ARG HBx A 36 LEU H 1.0 4.0 6.0 1246 1246 A 34 ARG HGy A 27 PHE HD% 1.0 2.7 5.7 1247 1247 A 72 THR H A 75 VAL H 1.0 4.0 6.0 1248 1248 A 74 THR HG2% A 75 VAL H 1.0 4.0 7.0 1249 1249 A 76 ARG H A 75 VAL H 1.0 4.0 6.0 1250 1250 A 74 THR HB A 75 VAL H 1.0 2.7 4.7 1251 1251 A 59 HIS HBx A 60 ARG H 1.0 2.7 4.7 1252 1252 A 60 ARG H A 59 HIS HBy 1.0 4.0 6.0 1253 1253 A 70 ARG HA A 71 LYS H 1.0 2.7 4.7 1254 1254 A 33 LEU H A 32 GLU HGx 1.0 2.7 4.7 1255 1255 A 33 LEU H A 30 ASP HB3 1.0 4.0 6.0 1256 1256 A 33 LEU H A 30 ASP HB2 1.0 2.7 4.7 1257 1257 A 33 LEU H A 32 GLU HGy 1.0 4.0 6.0 1258 1258 A 33 LEU H A 32 GLU H 1.0 1.5 3.5 1259 1259 A 33 LEU H A 34 ARG H 1.0 1.5 3.5 1260 1260 A 32 GLU HB3 A 33 LEU H 1.0 2.7 4.7 1261 1261 A 33 LEU H A 32 GLU HA 1.0 4.0 6.0 1262 1262 A 33 LEU H A 32 GLU HB2 1.0 2.7 4.7 1263 1263 A 4 GLY HAy A 5 PHE H 1.0 2.7 4.7 1264 1264 A 5 PHE H A 4 GLY HAx 1.0 1.5 3.5 1265 1265 A 5 PHE H A 16 SER H 1.0 2.7 4.7 1266 1266 A 42 SER H A 43 ARG H 1.0 4.0 6.0 1267 1267 A 19 ASP HB3 A 22 LEU H 1.0 4.0 6.0 1268 1268 A 19 ASP HB3 A 20 LYS H 1.0 2.7 4.7 1269 1269 A 22 LEU HG A 19 ASP HB3 1.0 2.7 4.7 1270 1270 A 22 LEU HD2% A 19 ASP HB3 1.0 2.7 5.7 1271 1271 A 55 PRO HDx A 38 LEU HD1% 1.0 4.0 7.0 1272 1272 A 53 PHE HD% A 38 LEU HD1% 1.0 2.7 6.7 1273 1273 A 27 PHE HZ A 38 LEU HD1% 1.0 2.7 5.7 1274 1274 A 27 PHE HD% A 38 LEU HD1% 1.0 2.7 6.7 1275 1275 A 79 THR HG2% A 40 ASN HD21 1.0 1.5 4.5 1276 1276 A 40 ASN HD21 A 79 THR HA 1.0 4.0 6.0 1277 1277 A 37 TRP HD1 A 33 LEU HD1% 1.0 1.5 4.5 1278 1278 A 37 TRP HE1 A 33 LEU HD1% 1.0 2.7 5.7 1279 1279 A 34 ARG H A 33 LEU HD1% 1.0 4.0 7.0 1280 1280 A 33 LEU HD1% A 76 ARG HB3 1.0 4.0 7.0 1281 1281 A 33 LEU HD1% A 76 ARG HDy 1.0 2.7 5.7 1282 1282 A 28 PRO HBx A 33 LEU HD1% 1.0 2.7 5.7 1283 1283 A 3 PRO HA A 4 GLY H 1.0 2.7 4.7 1284 1284 A 77 VAL H A 75 VAL HA 1.0 2.7 4.7 1285 1285 A 76 ARG H A 75 VAL HA 1.0 1.5 3.5 1286 1286 A 19 ASP HA A 20 LYS H 1.0 1.5 3.5 1287 1287 A 32 GLU HA A 35 ARG HBy 1.0 2.7 4.7 1288 1288 A 81 PHE HZ A 78 PRO HBx 1.0 2.7 4.7 1289 1289 A 81 PHE HE% A 40 ASN HBy 1.0 4.0 7.0 1290 1290 A 23 HIS H A 22 LEU HD1% 1.0 2.7 5.7 1291 1291 A 27 PHE HE% A 38 LEU HG 1.0 2.7 6.7 1292 1292 A 27 PHE HE% A 37 TRP HZ3 1.0 4.0 8.0 1293 1293 A 27 PHE HE% A 61 LEU HD2% 1.0 2.7 7.7 1294 1294 A 27 PHE HE% A 61 LEU HD1% 1.0 4.0 9.0 1295 1295 A 27 PHE HE% A 55 PRO HBx 1.0 4.0 8.0 1296 1296 A 27 PHE HE% A 38 LEU HD1% 1.0 1.5 6.5 1297 1297 A 27 PHE HE% A 55 PRO HBy 1.0 4.0 8.0 1298 1298 A 27 PHE HE% A 37 TRP HE3 1.0 2.7 6.7 1299 1299 A 75 VAL HG2% A 67 GLN HB3 1.0 2.7 5.7 1300 1300 A 22 LEU HA A 23 HIS H 1.0 1.5 3.5 1301 1301 A 35 ARG H A 34 ARG HB3 1.0 2.7 4.7 1302 1302 A 31 ALA HA A 34 ARG HB3 1.0 2.7 4.7 1303 1303 A 43 ARG H A 42 SER HA 1.0 4.0 6.0 1304 1304 A 65 HIS H A 64 VAL HB 1.0 2.7 4.7 1305 1305 A 27 PHE HE% A 55 PRO HBy 1.0 4.0 7.0 1306 1306 A 27 PHE HD% A 55 PRO HBy 1.0 2.7 5.7 1307 1307 A 72 THR H A 75 VAL HB 1.0 2.7 4.7 1308 1308 A 71 LYS HA A 75 VAL HB 1.0 4.0 6.0 1309 1309 A 72 THR HG2% A 75 VAL HB 1.0 2.7 5.7 1310 1310 A 72 THR H A 71 LYS HGx 1.0 4.0 6.0 1311 1311 A 54 GLN H A 53 PHE HA 1.0 1.5 3.5 1312 1312 A 23 HIS HB3 A 24 PHE H 1.0 2.7 4.7 1313 1313 A 25 TYR HE% A 23 HIS HB3 1.0 2.7 5.7 1314 1314 A 37 TRP HD1 A 77 VAL HA 1.0 2.7 4.7 1315 1315 A 78 PRO HDy A 77 VAL HA 1.0 2.7 4.7 1316 1316 A 37 TRP HE1 A 77 VAL HA 1.0 1.5 3.5 1317 1317 A 25 TYR H A 61 LEU H 1.0 2.7 4.7 1318 1318 A 24 PHE HA A 25 TYR H 1.0 2.7 4.7 1319 1319 A 17 HIS H A 16 SER H 1.0 2.7 4.7 1320 1320 A 5 PHE H A 16 SER H 1.0 2.7 4.7 1321 1321 A 15 ASN HA A 16 SER H 1.0 2.7 4.7 1322 1322 A 17 HIS H A 19 ASP H 1.0 4.0 6.0 1323 1323 A 18 ARG H A 19 ASP H 1.0 1.5 3.5 1324 1324 A 18 ARG HA A 19 ASP H 1.0 2.7 4.7 1325 1325 A 19 ASP H A 18 ARG HBy 1.0 4.0 6.0 1326 1326 A 19 ASP H A 18 ARG HBx 1.0 2.7 4.7 1327 1327 A 15 ASN H A 19 ASP H 1.0 2.7 4.7 1328 1328 A 23 HIS HB2 A 24 PHE H 1.0 4.0 6.0 1329 1329 A 24 PHE H A 23 HIS HA 1.0 2.7 4.7 1330 1330 A 23 HIS HB3 A 24 PHE H 1.0 2.7 4.7 1331 1331 A 36 LEU H A 35 ARG H 1.0 1.5 3.5 1332 1332 A 36 LEU H A 37 TRP HD1 1.0 2.7 4.7 1333 1333 A 36 LEU H A 37 TRP H 1.0 1.5 3.5 1334 1334 A 34 ARG H A 36 LEU H 1.0 1.5 3.5 1335 1335 A 36 LEU H A 35 ARG HA 1.0 2.7 4.7 1336 1336 A 35 ARG HBx A 36 LEU H 1.0 4.0 6.0 1337 1337 A 35 ARG HBy A 36 LEU H 1.0 2.7 4.7 1338 1338 A 41 VAL H A 40 ASN HA 1.0 2.7 4.7 1339 1339 A 78 PRO HDy A 66 PHE HE% 1.0 4.0 8.0 1340 1340 A 66 PHE HE% A 61 LEU HD1% 1.0 1.5 6.5 1341 1341 A 66 PHE HE% A 25 TYR HD% 1.0 1.5 6.5 1342 1342 A 37 TRP HZ2 A 66 PHE HE% 1.0 1.5 5.5 1343 1343 A 66 PHE HE% A 25 TYR HE% 1.0 2.7 7.7 1344 1344 A 75 VAL HG2% A 66 PHE HE% 1.0 2.7 7.7 1345 1345 A 66 PHE HE% A 63 SER HA 1.0 2.7 6.7 1346 1346 A 71 LYS HDx A 37 TRP HZ2 1.0 2.7 4.7 1347 1347 A 37 TRP HZ2 A 71 LYS HDy 1.0 2.7 4.7 1348 1348 A 37 TRP HZ2 A 66 PHE HE% 1.0 2.7 5.7 1349 1349 A 37 TRP HZ2 A 66 PHE HZ 1.0 2.7 4.7 1350 1350 A 33 LEU HD2% A 76 ARG HB3 1.0 2.7 5.7 1351 1351 A 77 VAL H A 76 ARG HB3 1.0 2.7 4.7 1352 1352 A 33 LEU HD1% A 76 ARG HB3 1.0 2.7 5.7 1353 1353 A 76 ARG HA A 77 VAL H 1.0 2.7 4.7 1354 1354 A 81 PHE HE% A 9 VAL HG1% 1.0 2.7 6.7 1355 1355 A 9 VAL HG1% A 65 HIS HE1 1.0 2.7 5.7 1356 1356 A 81 PHE HD% A 9 VAL HG1% 1.0 2.7 6.7 1357 1357 A 65 HIS HD2 A 9 VAL HG1% 1.0 4.0 7.0 1358 1358 A 23 HIS HB2 A 25 TYR HE% 1.0 2.7 6.7 1359 1359 A 25 TYR HE% A 23 HIS HB3 1.0 2.7 6.7 1360 1360 A 66 PHE HE% A 25 TYR HE% 1.0 2.7 7.7 1361 1361 A 25 TYR HE% A 63 SER HA 1.0 1.5 5.5 1362 1362 A 66 PHE HD% A 25 TYR HE% 1.0 2.7 7.7 1363 1363 A 28 PRO HDy A 27 PHE HA 1.0 1.5 3.5 1364 1364 A 34 ARG HA A 28 PRO HDy 1.0 2.7 4.7 1365 1365 A 27 PHE HD% A 28 PRO HDy 1.0 2.7 5.7 1366 1366 A 75 VAL HG1% A 76 ARG H 1.0 2.7 5.7 1367 1367 A 75 VAL HG1% A 74 THR HB 1.0 1.5 4.5 1368 1368 A 33 LEU HD2% A 76 ARG HDy 1.0 2.7 5.7 1369 1369 A 33 LEU HD1% A 76 ARG HDy 1.0 2.7 5.7 1370 1370 A 19 ASP HB2 A 22 LEU H 1.0 2.7 4.7 1371 1371 A 22 LEU HD2% A 19 ASP HB2 1.0 2.7 5.7 1372 1372 A 19 ASP HB2 A 15 ASN H 1.0 2.7 4.7 1373 1373 A 36 LEU HD1% A 32 GLU HGx 1.0 1.5 4.5 1374 1374 A 36 LEU HD1% A 37 TRP H 1.0 2.7 5.7 1375 1375 A 51 SER H A 50 PHE HA 1.0 4.0 6.0 1376 1376 A 24 PHE HE% A 15 ASN HA 1.0 4.0 7.0 1377 1377 A 24 PHE HZ A 15 ASN HA 1.0 4.0 6.0 1378 1378 A 15 ASN HA A 16 SER H 1.0 2.7 4.7 1379 1379 A 58 GLY HAx A 59 HIS H 1.0 2.7 4.7 1380 1380 A 75 VAL HG2% A 67 GLN H 1.0 2.7 5.7 1381 1381 A 75 VAL HG2% A 72 THR H 1.0 4.0 7.0 1382 1382 A 75 VAL HG2% A 66 PHE HBx 1.0 2.7 5.7 1383 1383 A 71 LYS HA A 75 VAL HG2% 1.0 2.7 5.7 1384 1384 A 75 VAL HG2% A 77 VAL H 1.0 2.7 5.7 1385 1385 A 75 VAL HG2% A 67 GLN HB2 1.0 2.7 5.7 1386 1386 A 75 VAL HG2% A 66 PHE HE% 1.0 2.7 6.7 1387 1387 A 75 VAL HG2% A 76 ARG H 1.0 2.7 5.7 1388 1388 A 75 VAL HG2% A 66 PHE HBy 1.0 2.7 5.7 1389 1389 A 75 VAL HG2% A 66 PHE HD% 1.0 1.5 5.5 1390 1390 A 32 GLU HA A 35 ARG H 1.0 2.7 4.7 1391 1391 A 32 GLU HA A 34 ARG H 1.0 1.5 3.5 1392 1392 A 33 LEU H A 32 GLU HA 1.0 2.7 4.7 1393 1393 A 32 GLU HA A 36 LEU H 1.0 2.7 4.7 1394 1394 A 77 VAL HG1% A 37 TRP HD1 1.0 1.5 4.5 1395 1395 A 77 VAL HG1% A 37 TRP HE1 1.0 2.7 5.7 1396 1396 A 36 LEU HBx A 77 VAL HG1% 1.0 1.5 4.5 1397 1397 A 77 VAL HG1% A 36 LEU HBy 1.0 1.5 4.5 1398 1398 A 72 THR HG2% A 70 ARG HGy 1.0 2.7 5.7 1399 1399 A 26 THR HB A 27 PHE H 1.0 2.7 4.7 1400 1400 A 26 THR HG2% A 27 PHE H 1.0 2.7 5.7 1401 1401 A 53 PHE H A 52 THR HA 1.0 1.5 3.5 1402 1402 A 54 GLN H A 53 PHE H 1.0 2.7 4.7 1403 1403 A 76 ARG H A 77 VAL H 1.0 1.5 3.5 1404 1404 A 76 ARG H A 75 VAL H 1.0 4.0 6.0 1405 1405 A 76 ARG H A 75 VAL HA 1.0 1.5 3.5 1406 1406 A 75 VAL HG1% A 76 ARG H 1.0 2.7 5.7 1407 1407 A 75 VAL HG2% A 76 ARG H 1.0 2.7 5.7 1408 1408 A 46 VAL H A 45 GLY HAy 1.0 1.5 3.5 1409 1409 A 45 GLY HAx A 46 VAL H 1.0 1.5 3.5 1410 1410 A 39 LYS HA A 40 ASN H 1.0 2.7 4.7 1411 1411 A 40 ASN H A 39 LYS HBy 1.0 2.7 4.7 1412 1412 A 40 ASN H A 39 LYS H 1.0 2.7 4.7 1413 1413 A 41 VAL H A 40 ASN H 1.0 2.7 4.7 1414 1414 A 27 PHE HZ A 61 LEU HD2% 1.0 2.7 5.7 1415 1415 A 41 VAL HG1% A 27 PHE HZ 1.0 2.7 5.7 1416 1416 A 27 PHE HZ A 41 VAL HG2% 1.0 4.0 7.0 1417 1417 A 27 PHE HZ A 38 LEU HD1% 1.0 2.7 5.7 1418 1418 A 36 LEU HD2% A 37 TRP H 1.0 4.0 7.0 1419 1419 A 64 VAL HG2% A 65 HIS H 1.0 1.5 4.5 1420 1420 A 64 VAL HG2% A 14 ASN HD22 1.0 2.7 5.7 1421 1421 A 64 VAL HG2% A 65 HIS HE1 1.0 2.7 5.7 1422 1422 A 64 VAL HG2% A 65 HIS HD2 1.0 2.7 5.7 1423 1423 A 9 VAL HG2% A 65 HIS HE1 1.0 1.5 4.5 1424 1424 A 64 VAL HG2% A 65 HIS HE1 1.0 2.7 5.7 1425 1425 A 65 HIS HA A 80 ILE HG2% 1.0 2.7 5.7 1426 1426 A 65 HIS HA A 66 PHE H 1.0 2.7 4.7 1427 1427 A 80 ILE HB A 65 HIS HA 1.0 2.7 4.7 1428 1428 A 65 HIS HA A 80 ILE HG1x 1.0 4.0 6.0 1429 1429 A 65 HIS HA A 80 ILE H 1.0 2.7 4.7 1430 1430 A 17 HIS HB3 A 18 ARG H 1.0 2.7 4.7 1431 1431 A 19 ASP H A 18 ARG HBx 1.0 2.7 4.7 1432 1432 A 31 ALA HA A 35 ARG H 1.0 2.7 4.7 1433 1433 A 31 ALA HA A 32 GLU H 1.0 2.7 4.7 1434 1434 A 34 ARG H A 31 ALA HA 1.0 2.7 4.7 1435 1435 A 31 ALA HA A 34 ARG HB3 1.0 2.7 4.7 1436 1436 A 55 PRO HDx A 54 GLN HA 1.0 1.5 3.5 1437 1437 A 55 PRO HDy A 54 GLN HA 1.0 2.7 4.7 1438 1438 A 24 PHE HA A 25 TYR H 1.0 1.5 3.5 1439 1439 A 67 GLN H A 66 PHE HA 1.0 2.7 4.7 1440 1440 A 66 PHE HA A 78 PRO HA 1.0 2.7 4.7 1441 1441 A 16 SER HB3 A 42 SER HBy 1.0 2.7 4.7 1442 1442 A 9 VAL HG2% A 81 PHE HD% 1.0 1.5 6.5 1443 1443 A 61 LEU HD2% A 81 PHE HD% 1.0 4.0 9.0 1444 1444 A 41 VAL HG2% A 81 PHE HD% 1.0 2.7 7.7 1445 1445 A 81 PHE HD% A 9 VAL HG1% 1.0 2.7 7.7 1446 1446 A 61 LEU HD2% A 66 PHE HZ 1.0 4.0 7.0 1447 1447 A 61 LEU HD1% A 66 PHE HZ 1.0 2.7 5.7 1448 1448 A 66 PHE HZ A 25 TYR HD% 1.0 2.7 5.7 1449 1449 A 37 TRP HZ2 A 66 PHE HZ 1.0 2.7 4.7 1450 1450 A 37 TRP HH2 A 66 PHE HZ 1.0 2.7 4.7 1451 1451 A 34 ARG H A 32 GLU HB2 1.0 4.0 6.0 1452 1452 A 33 LEU H A 32 GLU HB2 1.0 2.7 4.7 1453 1453 A 37 TRP HH2 A 25 TYR HB2 1.0 2.7 4.7 1454 1454 A 37 TRP HH2 A 25 TYR HB3 1.0 2.7 4.7 1455 1455 A 37 TRP HH2 A 66 PHE HZ 1.0 2.7 4.7 1456 1456 A 73 TYR HA A 74 THR H 1.0 2.7 4.7 1457 1457 A 25 TYR HB2 A 26 THR H 1.0 2.7 4.7 1458 1458 A 25 TYR HB3 A 26 THR H 1.0 2.7 4.7 1459 1459 A 26 THR H A 25 TYR HA 1.0 2.7 4.7 1460 1460 A 26 THR H A 25 TYR HD% 1.0 2.7 5.7 1461 1461 A 36 LEU HA A 39 LYS HBy 1.0 1.5 3.5 1462 1462 A 40 ASN H A 39 LYS HBy 1.0 2.7 4.7 1463 1463 A 27 PHE HD% A 38 LEU HG 1.0 2.7 6.7 1464 1464 A 37 TRP HZ3 A 27 PHE HD% 1.0 2.7 6.7 1465 1465 A 27 PHE HD% A 61 LEU HD2% 1.0 4.0 9.0 1466 1466 A 27 PHE HD% A 55 PRO HBx 1.0 2.7 6.7 1467 1467 A 34 ARG HGy A 27 PHE HD% 1.0 2.7 6.7 1468 1468 A 27 PHE HD% A 55 PRO HBy 1.0 2.7 6.7 1469 1469 A 27 PHE HD% A 28 PRO HDy 1.0 2.7 6.7 1470 1470 A 27 PHE HD% A 37 TRP HE3 1.0 2.7 6.7 1471 1471 A 27 PHE HA A 28 PRO HDx 1.0 1.5 3.5 1472 1472 A 27 PHE HD% A 28 PRO HDx 1.0 2.7 5.7 1473 1473 A 74 THR HB A 75 VAL H 1.0 2.7 4.7 1474 1474 A 75 VAL HG1% A 74 THR HB 1.0 1.5 4.5 1475 1475 A 31 ALA HB% A 30 ASP HA 1.0 2.7 5.7 1476 1476 A 31 ALA HB% A 32 GLU H 1.0 1.5 4.5 1477 1477 A 24 PHE HBx A 26 THR HG2% 1.0 2.7 5.7 1478 1478 A 65 HIS H A 63 SER HA 1.0 2.7 4.7 1479 1479 A 66 PHE H A 63 SER HA 1.0 4.0 6.0 1480 1480 A 63 SER HA A 25 TYR HD% 1.0 2.7 5.7 1481 1481 A 66 PHE HE% A 63 SER HA 1.0 2.7 5.7 1482 1482 A 25 TYR HE% A 63 SER HA 1.0 1.5 4.5 1483 1483 A 66 PHE HD% A 63 SER HA 1.0 1.5 4.5 1484 1484 A 75 VAL HG2% A 66 PHE HBy 1.0 2.7 5.7 1485 1485 A 45 GLY HAx A 46 VAL H 1.0 1.5 3.5 1486 1486 A 80 ILE H A 79 THR H 1.0 2.7 4.7 1487 1487 A 78 PRO HA A 80 ILE H 1.0 2.7 4.7 1488 1488 A 14 ASN HA A 15 ASN H 1.0 2.7 4.7 1489 1489 A 14 ASN HB2 A 15 ASN H 1.0 2.7 4.7 1490 1490 A 15 ASN H A 14 ASN HB3 1.0 2.7 4.7 1491 1491 A 24 PHE HZ A 15 ASN H 1.0 2.7 4.7 1492 1492 A 15 ASN H A 19 ASP H 1.0 4.0 6.0 1493 1493 A 19 ASP HB2 A 15 ASN H 1.0 2.7 4.7 1494 1494 A 44 ALA H A 43 ARG H 1.0 2.7 4.7 1495 1495 A 38 LEU HA A 39 LYS H 1.0 2.7 4.7 1496 1496 A 39 LYS H A 38 LEU H 1.0 1.5 3.5 1497 1497 A 36 LEU HA A 39 LYS H 1.0 2.7 4.7 1498 1498 A 39 LYS H A 38 LEU HB2 1.0 1.5 3.5 1499 1499 A 37 TRP H A 39 LYS H 1.0 4.0 6.0 1500 1500 A 38 LEU HD1% A 39 LYS H 1.0 2.7 5.7 1501 1501 A 40 ASN H A 39 LYS H 1.0 2.7 4.7 1502 1502 A 41 VAL H A 38 LEU HA 1.0 4.0 6.0 1503 1503 A 42 SER H A 41 VAL H 1.0 2.7 4.7 1504 1504 A 41 VAL H A 40 ASN HBy 1.0 2.7 4.7 1505 1505 A 41 VAL H A 40 ASN HA 1.0 2.7 4.7 1506 1506 A 41 VAL H A 40 ASN H 1.0 2.7 4.7 1507 1507 A 30 ASP H A 29 LYS HA 1.0 2.7 4.7 1508 1508 A 31 ALA H A 30 ASP H 1.0 4.0 6.0 1509 1509 A 35 ARG H A 34 ARG HB2 1.0 2.7 4.7 1510 1510 A 31 ALA HA A 34 ARG HB2 1.0 2.7 4.7 1511 1511 A 41 VAL HG1% A 53 PHE HZ 1.0 2.7 5.7 1512 1512 A 79 THR HG2% A 40 ASN HD22 1.0 1.5 4.5 1513 1513 A 75 VAL H A 74 THR HA 1.0 2.7 4.7 1514 1514 A 61 LEU HD2% A 37 TRP HE3 1.0 2.7 6.7 1515 1515 A 61 LEU HD1% A 37 TRP HE3 1.0 2.7 6.7 1516 1516 A 37 TRP HE3 A 27 PHE HA 1.0 4.0 7.0 1517 1517 A 27 PHE HD% A 37 TRP HE3 1.0 1.5 5.5 1518 1518 A 59 HIS H A 58 GLY HAy 1.0 2.7 4.7 1519 1519 A 55 PRO HDx A 54 GLN HGy 1.0 2.7 4.7 1520 1520 A 28 PRO HBx A 33 LEU HD1% 1.0 2.7 5.7 1521 1521 A 28 PRO HBx A 30 ASP H 1.0 2.7 4.7 1522 1522 A 24 PHE HE% A 16 SER HA 1.0 1.5 4.5 1523 1523 A 16 SER HA A 17 HIS H 1.0 2.7 4.7 1524 1524 A 24 PHE HD% A 16 SER HA 1.0 2.7 5.7 1525 1525 A 16 SER HA A 24 PHE HZ 1.0 2.7 4.7 1526 1526 A 61 LEU HD2% A 65 HIS HD2 1.0 2.7 5.7 1527 1527 A 65 HIS HD2 A 61 LEU HA 1.0 4.0 6.0 1528 1528 A 65 HIS HD2 A 61 LEU HD1% 1.0 2.7 5.7 1529 1529 A 65 HIS HD2 A 62 CYS H 1.0 2.7 4.7 1530 1530 A 65 HIS HD2 A 9 VAL HG1% 1.0 4.0 7.0 1531 1531 A 64 VAL HG2% A 65 HIS HD2 1.0 2.7 5.7 1532 1532 A 21 ALA H A 20 LYS HA 1.0 2.7 4.7 1533 1533 A 36 LEU HG A 37 TRP H 1.0 2.7 4.7 1534 1534 A 23 HIS H A 22 LEU HB2 1.0 2.7 4.7 1535 1535 A 72 THR HG2% A 70 ARG HBy 1.0 2.7 5.7 1536 1536 A 72 THR HG2% A 70 ARG HBx 1.0 2.7 5.7 1537 1537 A 72 THR HG2% A 75 VAL HB 1.0 4.0 7.0 1538 1538 A 65 HIS H A 66 PHE HD% 1.0 2.7 6.7 1539 1539 A 66 PHE HD% A 61 LEU HD1% 1.0 2.7 7.7 1540 1540 A 71 LYS HA A 66 PHE HD% 1.0 2.7 6.7 1541 1541 A 66 PHE HD% A 25 TYR HD% 1.0 1.5 6.5 1542 1542 A 66 PHE HD% A 25 TYR HE% 1.0 2.7 7.7 1543 1543 A 75 VAL HG2% A 66 PHE HD% 1.0 1.5 6.5 1544 1544 A 24 PHE HD% A 22 LEU HB2 1.0 2.7 5.7 1545 1545 A 24 PHE HZ A 22 LEU HB2 1.0 2.7 4.7 1546 1546 A 70 ARG HA A 25 TYR HE% 1.0 2.7 5.7 1547 1547 A 70 ARG HA A 25 TYR HE% 1.0 4.0 8.0 1548 1548 A 57 THR HG2% A 59 HIS HE1 1.0 1.5 3.5 1549 1549 A 57 THR HG2% A 59 HIS HE1 1.0 1.5 3.5 1550 1550 A 27 PHE HE% A 38 LEU HA 1.0 4.0 8.0 1551 1551 A 27 PHE HE% A 38 LEU HA 1.0 2.7 5.7 1552 1552 A 55 PRO HA A 59 HIS HE1 1.0 2.7 4.7 1553 1553 A 55 PRO HA A 59 HIS HE1 1.0 2.7 4.7 1554 1554 A 60 ARG H A 59 HIS HA 1.0 1.5 3.5 1555 1555 A 5 PHE HA A 6 THR H 1.0 2.7 4.7 1556 1556 A 61 LEU HA A 7 CYS HA 1.0 2.7 4.7 1557 1557 A 60 ARG H A 59 HIS HD2 1.0 2.7 4.7 1558 1558 A 60 ARG H A 59 HIS HD2 1.0 2.7 4.7 1559 1559 A 9 VAL HG2% A 13 TYR HA 1.0 2.7 4.7 1560 1560 A 9 VAL HG2% A 13 TYR HA 1.0 2.7 4.7 1561 1561 A 77 VAL HG1% A 40 ASN HD21 1.0 2.7 4.7 1562 1562 A 77 VAL HG1% A 40 ASN HD21 1.0 2.7 4.7 1563 1563 A 77 VAL HG2% A 40 ASN HD21 1.0 1.5 3.5 1564 1564 A 77 VAL HG2% A 40 ASN HD21 1.0 1.5 3.5 1565 1565 A 77 VAL HG2% A 40 ASN HD22 1.0 1.5 3.5 1566 1566 A 77 VAL HG2% A 40 ASN HD22 1.0 1.5 3.5 1567 1567 A 41 VAL H A 39 LYS HBy 1.0 4.0 6.0 1568 1568 A 41 VAL H A 39 LYS HBx 1.0 4.0 6.0 1569 1569 A 41 VAL H A 39 LYS HBy 1.0 4.0 6.0 1570 1570 A 41 VAL H A 39 LYS HBx 1.0 4.0 6.0 1571 1571 A 76 ARG H A 77 VAL HG1% 1.0 2.7 4.7 1572 1572 A 76 ARG H A 77 VAL HG1% 1.0 2.7 4.7 1573 1573 A 24 PHE HA A 63 SER H 1.0 2.7 4.7 1574 1574 A 66 PHE HD% A 63 SER HA 1.0 1.5 5.5 1575 1575 A 66 PHE HE% A 78 PRO HA 1.0 4.0 8.0 1576 1576 A 66 PHE HD% A 78 PRO HA 1.0 4.0 7.0 1577 1577 A 66 PHE HE% A 78 PRO HA 1.0 4.0 7.0 1578 1578 A 71 LYS HEy A 25 TYR HD% 1.0 4.0 8.0 1579 1579 A 71 LYS HEx A 25 TYR HD% 1.0 4.0 8.0 1580 1580 A 71 LYS HEy A 25 TYR HD% 1.0 4.0 7.0 1581 1581 A 37 TRP HH2 A 71 LYS HEy 1.0 4.0 6.0 1582 1582 A 37 TRP HH2 A 71 LYS HEx 1.0 4.0 6.0 1583 1583 A 37 TRP HZ2 A 71 LYS HEy 1.0 4.0 6.0 1584 1584 A 37 TRP HZ2 A 71 LYS HEx 1.0 4.0 6.0 1585 1585 A 37 TRP HZ2 A 71 LYS HEy 1.0 4.0 6.0 1586 1586 A 37 TRP HH2 A 71 LYS HEx 1.0 4.0 6.0 1587 1587 A 37 TRP HZ2 A 71 LYS HEx 1.0 4.0 6.0 1588 1588 A 81 PHE HD% A 65 HIS HE1 1.0 4.0 8.0 1589 1589 A 81 PHE HD% A 65 HIS HE1 1.0 4.0 7.0 1590 1590 A 81 PHE HE% A 65 HIS HD2 1.0 4.0 8.0 1591 1591 A 81 PHE HE% A 65 HIS HD2 1.0 4.0 7.0 1592 1592 A 62 CYS HB3 A 65 HIS HE1 1.0 4.0 6.0 1593 1593 A 62 CYS HB3 A 65 HIS HE1 1.0 4.0 6.0 1594 1594 A 62 CYS HB2 A 24 PHE HD% 1.0 4.0 8.0 1595 1595 A 62 CYS HB2 A 24 PHE HD% 1.0 4.0 7.0 1596 1596 A 37 TRP HZ3 A 25 TYR HB2 1.0 2.7 4.7 1597 1597 A 23 HIS HB3 A 25 TYR HD% 1.0 4.0 7.0 1598 1598 A 37 TRP HZ3 A 25 TYR HB3 1.0 2.7 4.7 1599 1599 A 23 HIS HB2 A 25 TYR HD% 1.0 4.0 8.0 1600 1600 A 37 TRP HZ3 A 25 TYR HB2 1.0 2.7 4.7 1601 1601 A 37 TRP HZ3 A 25 TYR HB3 1.0 2.7 4.7 1602 1602 A 23 HIS HB2 A 25 TYR HD% 1.0 4.0 7.0 1603 1603 A 24 PHE HE% A 14 ASN HB2 1.0 4.0 8.0 1604 1604 A 24 PHE HZ A 14 ASN HB2 1.0 4.0 6.0 1605 1605 A 24 PHE HE% A 14 ASN HB2 1.0 4.0 7.0 1606 1606 A 24 PHE HZ A 14 ASN HB2 1.0 4.0 6.0 1607 1607 A 19 ASP HB2 A 24 PHE HZ 1.0 4.0 6.0 1608 1608 A 19 ASP HB3 A 24 PHE HZ 1.0 4.0 6.0 1609 1609 A 19 ASP HB2 A 24 PHE HZ 1.0 4.0 6.0 1610 1610 A 19 ASP HB3 A 24 PHE HZ 1.0 4.0 6.0 1611 1611 A 24 PHE HD% A 60 ARG HB2 1.0 4.0 7.0 1612 1612 A 24 PHE HD% A 60 ARG HB2 1.0 4.0 8.0 1613 1613 A 81 PHE HE% A 78 PRO HBy 1.0 4.0 7.0 1614 1614 A 81 PHE HZ A 78 PRO HBy 1.0 4.0 6.0 1615 1615 A 81 PHE HE% A 78 PRO HBy 1.0 4.0 8.0 1616 1616 A 25 TYR HE% A 71 LYS HB2 1.0 4.0 7.0 1617 1617 A 61 LEU HD2% A 25 TYR HD% 1.0 4.0 8.0 1618 1618 A 61 LEU HD2% A 25 TYR HD% 1.0 4.0 9.0 1619 1619 A 61 LEU HD1% A 25 TYR HD% 1.0 4.0 9.0 1620 1620 A 25 TYR HE% A 71 LYS HB2 1.0 4.0 8.0 1621 1621 A 25 TYR HE% A 71 LYS HB3 1.0 4.0 8.0 1622 1622 A 25 TYR HE% A 71 LYS HB3 1.0 4.0 7.0 1623 1623 A 61 LEU HD1% A 25 TYR HD% 1.0 4.0 8.0 1624 1624 A 59 HIS HD2 A 8 CYS HB3 1.0 4.0 6.0 1625 1625 A 8 CYS HB2 A 59 HIS HD2 1.0 4.0 6.0 1626 1626 A 59 HIS HD2 A 8 CYS HB3 1.0 4.0 6.0 1627 1627 A 59 HIS HD2 A 8 CYS HB3 1.0 4.0 6.0 1628 1628 A 70 ARG HA A 25 TYR HE% 1.0 4.0 8.0 1629 1629 A 70 ARG HA A 25 TYR HE% 1.0 4.0 7.0 1630 1630 A 63 SER HBx A 13 TYR HA 1.0 2.7 4.7 1631 1631 A 63 SER HBx A 13 TYR HA 1.0 2.7 4.7 1632 1632 A 63 SER HBy A 13 TYR HA 1.0 2.7 4.7 1633 1633 A 63 SER HBy A 13 TYR HA 1.0 2.7 4.7 1634 1634 A 6 THR HG2% A 15 ASN HB3 1.0 4.0 7.0 1635 1635 A 6 THR HG2% A 15 ASN HB2 1.0 4.0 7.0 1636 1636 A 6 THR HG2% A 15 ASN HB3 1.0 4.0 7.0 1637 1637 A 6 THR HG2% A 15 ASN HB2 1.0 4.0 7.0 1638 1638 A 33 LEU HD1% A 76 ARG HB2 1.0 4.0 7.0 1639 1639 A 57 THR HG2% A 59 HIS HE1 1.0 4.0 7.0 1640 1640 A 57 THR HG2% A 59 HIS HE1 1.0 4.0 7.0 1641 1641 A 55 PRO HA A 59 HIS HE1 1.0 4.0 6.0 1642 1642 A 55 PRO HA A 59 HIS HE1 1.0 4.0 6.0 1643 1643 A 27 PHE HZ A 61 LEU HD1% 1.0 4.0 7.0 1644 1644 A 27 PHE HZ A 61 LEU HD1% 1.0 4.0 7.0 1645 1645 A 71 LYS HGy A 37 TRP HZ2 1.0 4.0 6.0 1646 1646 A 37 TRP HZ2 A 28 PRO HGx 1.0 4.0 6.0 1647 1647 A 37 TRP HZ2 A 71 LYS HGx 1.0 4.0 6.0 1648 1648 A 37 TRP HZ2 A 28 PRO HGy 1.0 4.0 6.0 1649 1649 A 37 TRP HZ2 A 28 PRO HGx 1.0 4.0 6.0 1650 1650 A 37 TRP HZ2 A 28 PRO HGy 1.0 4.0 6.0 1651 1651 A 37 TRP HD1 A 28 PRO HGy 1.0 4.0 7.0 1652 1652 A 37 TRP HD1 A 28 PRO HGy 1.0 4.0 6.0 1653 1653 A 27 PHE HE% A 41 VAL HG2% 1.0 4.0 9.0 1654 1654 A 27 PHE HE% A 41 VAL HG2% 1.0 4.0 8.0 1655 1655 A 81 PHE HD% A 79 THR HA 1.0 4.0 8.0 1656 1656 A 81 PHE HD% A 79 THR HA 1.0 4.0 7.0 1657 1657 A 22 LEU HD2% A 19 ASP HA 1.0 4.0 7.0 1658 1658 A 62 CYS HA A 24 PHE HE% 1.0 4.0 8.0 1659 1659 A 62 CYS HA A 24 PHE HE% 1.0 4.0 7.0 1660 1660 A 62 CYS HA A 24 PHE HD% 1.0 4.0 7.0 1661 1661 A 62 CYS HA A 24 PHE HD% 1.0 4.0 8.0 1662 1662 A 81 PHE HZ A 40 ASN HBy 1.0 4.0 6.0 1663 1663 A 40 ASN HBx A 81 PHE HZ 1.0 4.0 6.0 1664 1664 A 81 PHE HZ A 40 ASN HBy 1.0 4.0 6.0 1665 1665 A 40 ASN HBx A 81 PHE HZ 1.0 4.0 6.0 1666 1666 A 30 ASP HB3 A 33 LEU HBx 1.0 4.0 6.0 1667 1667 A 30 ASP HB3 A 33 LEU HBx 1.0 4.0 6.0 1668 1668 A 30 ASP HB3 A 33 LEU HD1% 1.0 4.0 7.0 1669 1669 A 30 ASP HB3 A 33 LEU HBy 1.0 4.0 6.0 1670 1670 A 30 ASP HB2 A 33 LEU HD2% 1.0 4.0 7.0 1671 1671 A 30 ASP HB2 A 33 LEU HD1% 1.0 4.0 7.0 1672 1672 A 30 ASP HB2 A 33 LEU HD2% 1.0 4.0 7.0 1673 1673 A 30 ASP HB2 A 33 LEU HD1% 1.0 4.0 7.0 1674 1674 A 4 GLY HAx A 20 LYS HB2 1.0 4.0 6.0 1675 1675 A 4 GLY HAy A 20 LYS HB2 1.0 4.0 6.0 1676 1676 A 4 GLY HAx A 20 LYS HB3 1.0 4.0 6.0 1677 1677 A 4 GLY HAy A 20 LYS HB3 1.0 4.0 6.0 1678 1678 A 4 GLY HAx A 20 LYS HB2 1.0 4.0 6.0 1679 1679 A 4 GLY HAx A 20 LYS HB3 1.0 4.0 6.0 1680 1680 A 4 GLY HAy A 20 LYS HB2 1.0 4.0 6.0 1681 1681 A 4 GLY HAy A 20 LYS HB3 1.0 4.0 6.0 1682 1682 A 55 PRO HDx A 54 GLN HB2 1.0 4.0 6.0 1683 1683 A 55 PRO HDx A 54 GLN HB3 1.0 4.0 6.0 1684 1684 A 34 ARG HA A 28 PRO HBy 1.0 4.0 6.0 1685 1685 A 34 ARG HA A 28 PRO HDx 1.0 4.0 6.0 1686 1686 A 34 ARG HA A 28 PRO HDx 1.0 4.0 6.0 1687 1687 A 34 ARG HA A 33 LEU HBx 1.0 4.0 6.0 1688 1688 A 34 ARG HA A 33 LEU HG 1.0 4.0 6.0 1689 1689 A 78 PRO HDy A 77 VAL HG1% 1.0 4.0 7.0 1690 1690 A 62 CYS HB3 A 9 VAL HB 1.0 4.0 6.0 1691 1691 A 62 CYS HB3 A 9 VAL HB 1.0 4.0 6.0 1692 1692 A 14 ASN HB2 A 9 VAL HB 1.0 4.0 6.0 1693 1693 A 14 ASN HB2 A 9 VAL HB 1.0 4.0 6.0 1694 1694 A 62 CYS HB3 A 14 ASN HB2 1.0 4.0 6.0 1695 1695 A 62 CYS HB3 A 14 ASN HB2 1.0 4.0 6.0 1696 1696 A 61 LEU HA A 7 CYS HA 1.0 2.7 4.7 1697 1697 A 61 LEU HA A 7 CYS HA 1.0 2.7 4.7 1698 1698 A 65 HIS HD2 A 61 LEU HB3 1.0 2.7 4.7 1699 1699 A 65 HIS HD2 A 61 LEU HB3 1.0 2.7 4.7 1700 1700 A 65 HIS HD2 A 61 LEU HB2 1.0 4.0 6.0 1701 1701 A 65 HIS HD2 A 61 LEU HB2 1.0 4.0 6.0 1702 1702 A 28 PRO HBx A 33 LEU HBx 1.0 2.7 4.7 1703 1703 A 28 PRO HBx A 33 LEU HBx 1.0 2.7 4.7 1704 1704 A 28 PRO HBx A 33 LEU HBy 1.0 2.7 4.7 1705 1705 A 27 PHE HB3 A 28 PRO HDy 1.0 2.7 4.7 1706 1706 A 27 PHE HB3 A 28 PRO HDy 1.0 2.7 4.7 1707 1707 A 28 PRO HDy A 27 PHE HB2 1.0 2.7 4.7 1708 1708 A 7 CYS HB3 A 62 CYS HB3 1.0 2.7 4.7 1709 1709 A 7 CYS HB3 A 62 CYS HB3 1.0 2.7 4.7 1710 1710 A 10 PRO HDy A 9 VAL HA 1.0 1.5 3.5 1711 1711 A 10 PRO HDy A 9 VAL HA 1.0 1.5 3.5 1712 1712 A 9 VAL HG2% A 14 ASN HB2 1.0 2.7 4.7 1713 1713 A 22 LEU HD2% A 14 ASN HB2 1.0 2.7 4.7 1714 1714 A 19 ASP HB3 A 22 LEU HD1% 1.0 2.7 4.7 1715 1715 A 5 PHE HD% A 60 ARG HGx 1.0 4.0 7.0 1716 1716 A 5 PHE HD% A 60 ARG HGx 1.0 4.0 8.0 1717 1717 A 5 PHE HD% A 60 ARG HGy 1.0 2.7 5.7 1718 1718 A 5 PHE HD% A 60 ARG HGy 1.0 2.7 6.7 1719 1719 A 5 PHE HD% A 60 ARG HDx 1.0 2.7 5.7 1720 1720 A 5 PHE HD% A 60 ARG HDx 1.0 2.7 6.7 1721 1721 A 5 PHE HD% A 60 ARG HDy 1.0 2.7 5.7 1722 1722 A 5 PHE HD% A 60 ARG HDy 1.0 2.7 6.7 1723 1723 A 9 VAL HG2% A 13 TYR HA 1.0 2.7 4.7 1724 1724 A 9 VAL HG2% A 13 TYR HA 1.0 2.7 4.7 1725 1725 A 5 PHE HB2 A 16 SER HB3 1.0 2.7 4.7 1726 1726 A 5 PHE HB2 A 16 SER HB3 1.0 2.7 4.7 1727 1727 A 5 PHE HB2 A 16 SER HA 1.0 2.7 4.7 1728 1728 A 5 PHE HB2 A 16 SER HA 1.0 2.7 4.7 1729 1729 A 5 PHE HB2 A 16 SER HB2 1.0 2.7 4.7 1730 1730 A 5 PHE HB2 A 16 SER HB2 1.0 2.7 4.7 1731 1731 A 40 ASN HBy A 79 THR HA 1.0 4.0 6.0 1732 1732 A 40 ASN HBy A 79 THR HA 1.0 4.0 6.0 1733 1733 A 40 ASN HBx A 79 THR HA 1.0 2.7 4.7 1734 1734 A 40 ASN HBx A 79 THR HA 1.0 2.7 4.7 1735 1735 A 55 PRO HBy A 53 PHE HE% 1.0 4.0 7.0 1736 1736 A 55 PRO HBy A 53 PHE HE% 1.0 2.7 6.7 1737 1737 A 53 PHE HD% A 55 PRO HBy 1.0 2.7 6.7 1738 1738 A 53 PHE HD% A 55 PRO HBy 1.0 4.0 7.0 1739 1739 A 53 PHE HD% A 55 PRO HDy 1.0 2.7 6.7 1740 1740 A 53 PHE HD% A 55 PRO HDy 1.0 4.0 7.0 1741 1741 A 55 PRO HA A 53 PHE HE% 1.0 4.0 7.0 1742 1742 A 55 PRO HA A 53 PHE HE% 1.0 2.7 6.7 1743 1743 A 53 PHE HD% A 55 PRO HA 1.0 2.7 6.7 1744 1744 A 53 PHE HD% A 55 PRO HA 1.0 4.0 7.0 1745 1745 A 53 PHE HD% A 59 HIS HD2 1.0 2.7 6.7 1746 1746 A 53 PHE HD% A 59 HIS HD2 1.0 2.7 5.7 1747 1747 A 59 HIS HE1 A 53 PHE HE% 1.0 2.7 5.7 1748 1748 A 59 HIS HE1 A 53 PHE HE% 1.0 4.0 8.0 1749 1749 A 23 HIS HB2 A 63 SER HA 1.0 4.0 6.0 1750 1750 A 23 HIS HB2 A 63 SER HA 1.0 4.0 6.0 1751 1751 A 23 HIS HB3 A 63 SER HA 1.0 2.7 4.7 1752 1752 A 23 HIS HB3 A 63 SER HA 1.0 2.7 4.7 1753 1753 A 23 HIS HB2 A 63 SER HBy 1.0 2.7 4.7 1754 1754 A 23 HIS HB2 A 63 SER HBy 1.0 2.7 4.7 1755 1755 A 63 SER HBy A 23 HIS HB3 1.0 2.7 4.7 1756 1756 A 63 SER HBy A 23 HIS HB3 1.0 2.7 4.7 1757 1757 A 75 VAL HB A 66 PHE HD% 1.0 2.7 6.7 1758 1758 A 75 VAL HB A 66 PHE HD% 1.0 2.7 5.7 1759 1759 A 17 HIS HB3 A 53 PHE HBx 1.0 2.7 4.7 1760 1760 A 17 HIS HB3 A 53 PHE HBx 1.0 2.7 4.7 1761 1761 A 74 THR HG2% A 73 TYR HE% 1.0 4.0 7.0 1762 1762 A 74 THR HG2% A 73 TYR HD% 1.0 1.5 5.5 1763 1763 A 74 THR HG2% A 73 TYR HD% 1.0 1.5 4.5 1764 1764 A 65 HIS HD2 A 61 LEU HG 1.0 2.7 4.7 1765 1765 A 65 HIS HD2 A 61 LEU HG 1.0 2.7 4.7 1766 1766 A 66 PHE HD% A 78 PRO HA 1.0 4.0 8.0 stop_ save_