data_nef_c16145_2kee save_entry_information _nef_nmr_meta_data.sf_category nef_nmr_meta_data _nef_nmr_meta_data.sf_framecode entry_information _nef_nmr_meta_data.format_name nmr_exchange_format _nef_nmr_meta_data.format_version 1.1 loop_ _nef_related_entries.database_name _nef_related_entries.database_accession_code BMRB 16142 BMRB 16143 stop_ 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 11 CYS SG 1 36 CYS SG 1 13 CYS SG 1 52 CYS SG 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 0 SER middle . . 3 A 1 LYS middle . . 4 A 2 PRO middle . false 5 A 3 VAL middle . . 6 A 4 SER middle . . 7 A 5 LEU middle . . 8 A 6 SER middle . . 9 A 7 TYR middle . . 10 A 8 ARG middle . . 11 A 9 CYS middle -HG . 12 A 10 PRO middle . false 13 A 11 CYS middle -HG . 14 A 12 ARG middle . . 15 A 13 PHE middle . . 16 A 14 PHE middle . . 17 A 15 GLU middle . . 18 A 16 SER middle . . 19 A 17 HIS middle . . 20 A 18 VAL middle . . 21 A 19 ALA middle . . 22 A 20 ARG middle . . 23 A 21 ALA middle . . 24 A 22 ASN middle . . 25 A 23 VAL middle . . 26 A 24 LYS middle . . 27 A 25 HIS middle . . 28 A 26 LEU middle . . 29 A 27 LYS middle . . 30 A 28 ILE middle . . 31 A 29 LEU middle . . 32 A 30 ASN middle . . 33 A 31 THR middle . . 34 A 32 PRO middle . false 35 A 33 ASN middle . . 36 A 34 CYS middle -HG . 37 A 35 ALA middle . . 38 A 36 LEU middle . . 39 A 37 GLN middle . . 40 A 38 ILE middle . . 41 A 39 VAL middle . . 42 A 40 ALA middle . . 43 A 41 ARG middle . . 44 A 42 LEU middle . . 45 A 43 LYS middle . . 46 A 44 ASN middle . . 47 A 45 ASN middle . . 48 A 46 ASN middle . . 49 A 47 ARG middle . . 50 A 48 GLN middle . . 51 A 49 VAL middle . . 52 A 50 CYS middle -HG . 53 A 51 ILE middle . . 54 A 52 ASP middle . . 55 A 53 PRO middle . false 56 A 54 LYS middle . . 57 A 55 LEU middle . . 58 A 56 LYS middle . . 59 A 57 TRP middle . . 60 A 58 ILE middle . . 61 A 59 GLN middle . . 62 A 60 GLU middle . . 63 A 61 TYR middle . . 64 A 62 LEU middle . . 65 A 63 GLU middle . . 66 A 64 LYS middle . . 67 A 65 ALA middle . . 68 A 66 LEU middle . . 69 A 67 ASN middle . . 70 A 68 LYS end . . stop_ save_ save_assigned_chem_shift_list_1 _nef_chemical_shift_list.sf_category nef_chemical_shift_list _nef_chemical_shift_list.sf_framecode assigned_chem_shift_list_1 loop_ _nef_chemical_shift.chain_code _nef_chemical_shift.sequence_code _nef_chemical_shift.residue_name _nef_chemical_shift.atom_name _nef_chemical_shift.element _nef_chemical_shift.isotope_number _nef_chemical_shift.value _nef_chemical_shift.value_uncertainty A 1 LYS H H 1 8.411 0.020 A 1 LYS HA H 1 4.607 0.020 A 1 LYS HBy H 1 1.790 0.020 A 1 LYS HBx H 1 1.697 0.020 A 1 LYS HDx H 1 1.667 0.009 A 1 LYS HDy H 1 1.667 0.009 A 1 LYS HEx H 1 2.976 0.020 A 1 LYS HEy H 1 2.976 0.020 A 1 LYS HGx H 1 1.450 0.020 A 1 LYS HGy H 1 1.450 0.020 A 1 LYS C C 13 174.545 0.200 A 1 LYS CA C 13 54.298 0.200 A 1 LYS CB C 13 32.620 0.200 A 1 LYS CD C 13 29.061 0.200 A 1 LYS CE C 13 42.003 0.200 A 1 LYS CG C 13 24.854 0.200 A 1 LYS N N 15 124.482 0.200 A 2 PRO HA H 1 4.447 0.020 A 2 PRO HBy H 1 2.250 0.002 A 2 PRO HBx H 1 1.840 0.002 A 2 PRO HDy H 1 3.825 0.003 A 2 PRO HDx H 1 3.601 0.002 A 2 PRO HGx H 1 1.991 0.006 A 2 PRO HGy H 1 1.991 0.006 A 2 PRO C C 13 176.996 0.200 A 2 PRO CA C 13 63.494 0.200 A 2 PRO CB C 13 32.161 0.200 A 2 PRO CD C 13 50.870 0.001 A 2 PRO CG C 13 27.560 0.200 A 3 VAL H H 1 8.292 0.020 A 3 VAL HA H 1 4.074 0.006 A 3 VAL HB H 1 2.040 0.020 A 3 VAL HGx% H 1 0.938 0.020 A 3 VAL HGy% H 1 0.938 0.020 A 3 VAL C C 13 176.376 0.012 A 3 VAL CA C 13 62.495 0.200 A 3 VAL CB C 13 32.808 0.200 A 3 VAL CG1 C 13 21.000 0.200 A 3 VAL N N 15 121.008 0.200 A 4 SER H H 1 8.313 0.020 A 4 SER HA H 1 4.419 0.002 A 4 SER HBx H 1 3.792 0.020 A 4 SER HBy H 1 3.792 0.020 A 4 SER C C 13 174.577 0.002 A 4 SER CA C 13 58.148 0.200 A 4 SER CB C 13 63.870 0.200 A 4 SER N N 15 119.573 0.200 A 5 LEU H H 1 8.326 0.020 A 5 LEU HA H 1 4.342 0.020 A 5 LEU HBy H 1 1.577 0.020 A 5 LEU HBx H 1 1.482 0.020 A 5 LEU HDx% H 1 0.846 0.020 A 5 LEU HDy% H 1 0.846 0.020 A 5 LEU HG H 1 1.579 0.004 A 5 LEU C C 13 177.341 0.005 A 5 LEU CA C 13 55.388 0.200 A 5 LEU CB C 13 42.650 0.200 A 5 LEU CD1 C 13 25.366 0.200 A 5 LEU CG C 13 27.495 0.200 A 5 LEU N N 15 125.039 0.200 A 6 SER H H 1 8.157 0.020 A 6 SER HA H 1 4.360 0.004 A 6 SER HBx H 1 3.760 0.020 A 6 SER HBy H 1 3.760 0.020 A 6 SER C C 13 174.189 0.001 A 6 SER CA C 13 58.433 0.200 A 6 SER CB C 13 63.870 0.200 A 6 SER N N 15 116.154 0.200 A 7 TYR H H 1 8.017 0.020 A 7 TYR HA H 1 4.512 0.001 A 7 TYR HBy H 1 3.018 0.020 A 7 TYR HBx H 1 2.880 0.020 A 7 TYR HD1 H 1 7.081 0.020 A 7 TYR HD2 H 1 7.081 0.020 A 7 TYR HE1 H 1 6.797 0.003 A 7 TYR HE2 H 1 6.797 0.003 A 7 TYR C C 13 175.520 0.001 A 7 TYR CA C 13 58.008 0.200 A 7 TYR CB C 13 38.956 0.200 A 7 TYR CD1 C 13 133.298 0.200 A 7 TYR CE1 C 13 118.338 0.200 A 7 TYR N N 15 122.213 0.200 A 8 ARG H H 1 8.152 0.020 A 8 ARG HA H 1 4.260 0.004 A 8 ARG HBy H 1 1.768 0.020 A 8 ARG HBx H 1 1.673 0.020 A 8 ARG HDx H 1 3.124 0.020 A 8 ARG HDy H 1 3.124 0.020 A 8 ARG HGx H 1 1.490 0.020 A 8 ARG HGy H 1 1.490 0.020 A 8 ARG C C 13 175.918 0.001 A 8 ARG CA C 13 56.104 0.200 A 8 ARG CB C 13 30.875 0.200 A 8 ARG CD C 13 43.809 0.200 A 8 ARG CG C 13 27.145 0.200 A 8 ARG N N 15 122.182 0.200 A 9 CYS H H 1 8.132 0.020 A 9 CYS HA H 1 4.935 0.020 A 9 CYS HBy H 1 3.200 0.005 A 9 CYS HBx H 1 2.693 0.002 A 9 CYS C C 13 173.615 0.200 A 9 CYS CA C 13 53.127 0.200 A 9 CYS CB C 13 40.201 0.028 A 9 CYS N N 15 121.280 0.200 A 10 PRO HA H 1 4.290 0.020 A 10 PRO HBy H 1 2.289 0.020 A 10 PRO HBx H 1 1.844 0.020 A 10 PRO HDx H 1 3.838 0.020 A 10 PRO HDy H 1 3.838 0.020 A 10 PRO HGx H 1 2.014 0.020 A 10 PRO HGy H 1 2.014 0.020 A 10 PRO C C 13 177.703 0.200 A 10 PRO CA C 13 64.835 0.200 A 10 PRO CB C 13 32.484 0.200 A 10 PRO CD C 13 51.088 0.086 A 10 PRO CG C 13 27.631 0.200 A 11 CYS H H 1 8.300 0.001 A 11 CYS HA H 1 4.891 0.020 A 11 CYS HBy H 1 2.894 0.020 A 11 CYS HBx H 1 2.830 0.020 A 11 CYS C C 13 174.202 0.200 A 11 CYS CA C 13 53.480 0.200 A 11 CYS CB C 13 39.603 0.200 A 11 CYS N N 15 114.161 0.200 A 12 ARG HA H 1 3.963 0.020 A 12 ARG HBy H 1 1.523 0.004 A 12 ARG HBx H 1 1.475 0.020 A 12 ARG HDx H 1 2.940 0.003 A 12 ARG HDy H 1 2.940 0.003 A 12 ARG HGy H 1 1.246 0.002 A 12 ARG HGx H 1 1.153 0.003 A 12 ARG C C 13 175.202 0.200 A 12 ARG CA C 13 57.293 0.200 A 12 ARG CB C 13 31.099 0.200 A 12 ARG CD C 13 43.350 0.200 A 12 ARG CG C 13 26.872 0.001 A 13 PHE H H 1 7.543 0.001 A 13 PHE HA H 1 4.496 0.004 A 13 PHE HBy H 1 3.078 0.007 A 13 PHE HBx H 1 2.785 0.020 A 13 PHE HD1 H 1 7.170 0.020 A 13 PHE HD2 H 1 7.170 0.020 A 13 PHE HE1 H 1 7.288 0.020 A 13 PHE HE2 H 1 7.288 0.020 A 13 PHE HZ H 1 7.261 0.020 A 13 PHE C C 13 174.226 0.010 A 13 PHE CA C 13 55.971 0.200 A 13 PHE CB C 13 41.032 0.200 A 13 PHE CD1 C 13 132.275 0.200 A 13 PHE CE1 C 13 132.754 0.200 A 13 PHE CZ C 13 129.771 0.200 A 13 PHE N N 15 116.175 0.200 A 14 PHE H H 1 8.305 0.004 A 14 PHE HA H 1 4.812 0.001 A 14 PHE HBy H 1 2.815 0.020 A 14 PHE HBx H 1 2.738 0.020 A 14 PHE HD1 H 1 6.976 0.006 A 14 PHE HD2 H 1 6.976 0.006 A 14 PHE HE1 H 1 7.264 0.007 A 14 PHE HE2 H 1 7.264 0.007 A 14 PHE HZ H 1 7.194 0.020 A 14 PHE C C 13 175.247 0.001 A 14 PHE CA C 13 55.559 0.200 A 14 PHE CB C 13 41.220 0.200 A 14 PHE CD1 C 13 131.888 0.200 A 14 PHE CE1 C 13 131.530 0.200 A 14 PHE CZ C 13 130.151 0.200 A 14 PHE N N 15 119.656 0.200 A 15 GLU H H 1 8.879 0.001 A 15 GLU HA H 1 4.536 0.003 A 15 GLU HBy H 1 2.086 0.007 A 15 GLU HBx H 1 1.934 0.011 A 15 GLU HGy H 1 2.366 0.002 A 15 GLU HGx H 1 2.283 0.006 A 15 GLU C C 13 176.747 0.012 A 15 GLU CA C 13 56.012 0.200 A 15 GLU CB C 13 30.876 0.016 A 15 GLU CG C 13 36.367 0.200 A 15 GLU N N 15 122.563 0.200 A 16 SER H H 1 8.810 0.020 A 16 SER HA H 1 4.673 0.020 A 16 SER HBy H 1 3.830 0.020 A 16 SER HBx H 1 3.643 0.020 A 16 SER C C 13 174.278 0.004 A 16 SER CA C 13 59.799 0.200 A 16 SER CB C 13 63.999 0.200 A 16 SER N N 15 119.679 0.200 A 17 HIS H H 1 8.712 0.005 A 17 HIS HA H 1 4.777 0.020 A 17 HIS HBy H 1 3.205 0.020 A 17 HIS HBx H 1 3.114 0.012 A 17 HIS HD2 H 1 7.076 0.020 A 17 HIS HE1 H 1 7.851 0.020 A 17 HIS C C 13 174.580 0.006 A 17 HIS CA C 13 56.240 0.200 A 17 HIS CB C 13 29.896 0.200 A 17 HIS CD2 C 13 119.956 0.200 A 17 HIS CE1 C 13 138.503 0.200 A 17 HIS N N 15 120.269 0.200 A 18 VAL H H 1 7.145 0.001 A 18 VAL HA H 1 4.132 0.001 A 18 VAL HB H 1 1.929 0.005 A 18 VAL HGx% H 1 0.866 0.008 A 18 VAL HGy% H 1 0.866 0.008 A 18 VAL C C 13 174.138 0.007 A 18 VAL CA C 13 61.605 0.200 A 18 VAL CB C 13 34.102 0.200 A 18 VAL CG1 C 13 21.854 0.200 A 18 VAL N N 15 120.100 0.200 A 19 ALA H H 1 8.554 0.009 A 19 ALA HA H 1 4.353 0.005 A 19 ALA HB% H 1 1.294 0.007 A 19 ALA C C 13 177.514 0.007 A 19 ALA CA C 13 50.666 0.200 A 19 ALA CB C 13 19.648 0.200 A 19 ALA N N 15 131.180 0.200 A 20 ARG H H 1 7.813 0.003 A 20 ARG HA H 1 2.621 0.008 A 20 ARG HBy H 1 1.003 0.004 A 20 ARG HBx H 1 0.301 0.020 A 20 ARG HDx H 1 2.660 0.020 A 20 ARG HDy H 1 2.660 0.020 A 20 ARG HGy H 1 1.055 0.006 A 20 ARG HGx H 1 0.817 0.007 A 20 ARG C C 13 178.531 0.007 A 20 ARG CA C 13 59.155 0.200 A 20 ARG CB C 13 29.167 0.200 A 20 ARG CD C 13 43.485 0.200 A 20 ARG CG C 13 26.337 0.200 A 20 ARG N N 15 124.436 0.200 A 21 ALA H H 1 8.191 0.004 A 21 ALA HA H 1 4.023 0.005 A 21 ALA HB% H 1 1.262 0.009 A 21 ALA C C 13 177.743 0.006 A 21 ALA CA C 13 53.809 0.200 A 21 ALA CB C 13 18.712 0.200 A 21 ALA N N 15 117.354 0.200 A 22 ASN H H 1 7.738 0.004 A 22 ASN HA H 1 4.928 0.003 A 22 ASN HBy H 1 3.063 0.005 A 22 ASN HBx H 1 2.670 0.010 A 22 ASN HD2y H 1 7.701 0.002 A 22 ASN HD2x H 1 7.088 0.020 A 22 ASN C C 13 174.889 0.200 A 22 ASN CA C 13 52.590 0.200 A 22 ASN CB C 13 40.335 0.016 A 22 ASN N N 15 112.797 0.200 A 22 ASN ND2 N 15 112.094 0.005 A 23 VAL H H 1 7.438 0.007 A 23 VAL HA H 1 4.349 0.007 A 23 VAL HB H 1 2.059 0.006 A 23 VAL HGx% H 1 0.809 0.016 A 23 VAL HGy% H 1 0.809 0.016 A 23 VAL C C 13 174.594 0.007 A 23 VAL CA C 13 62.406 0.200 A 23 VAL CB C 13 33.445 0.200 A 23 VAL CG1 C 13 21.948 0.200 A 23 VAL N N 15 118.653 0.200 A 24 LYS H H 1 9.262 0.003 A 24 LYS HA H 1 4.394 0.020 A 24 LYS HBy H 1 1.503 0.012 A 24 LYS HBx H 1 1.467 0.020 A 24 LYS HDx H 1 1.548 0.003 A 24 LYS HDy H 1 1.548 0.003 A 24 LYS HEy H 1 2.900 0.020 A 24 LYS HEx H 1 2.800 0.020 A 24 LYS HGx H 1 1.141 0.002 A 24 LYS HGy H 1 1.141 0.002 A 24 LYS C C 13 175.247 0.001 A 24 LYS CA C 13 56.483 0.200 A 24 LYS CB C 13 35.022 0.002 A 24 LYS CD C 13 29.834 0.200 A 24 LYS CE C 13 42.269 0.024 A 24 LYS CG C 13 24.674 0.200 A 24 LYS N N 15 125.308 0.200 A 25 HIS H H 1 7.749 0.007 A 25 HIS HA H 1 4.625 0.020 A 25 HIS HBy H 1 3.119 0.020 A 25 HIS HBx H 1 3.045 0.020 A 25 HIS HD2 H 1 6.854 0.020 A 25 HIS HE1 H 1 7.632 0.020 A 25 HIS C C 13 173.157 0.200 A 25 HIS CA C 13 55.916 0.200 A 25 HIS CB C 13 32.808 0.200 A 25 HIS CD2 C 13 120.304 0.200 A 25 HIS CE1 C 13 138.577 0.200 A 25 HIS N N 15 115.509 0.200 A 26 LEU H H 1 8.117 0.020 A 26 LEU HA H 1 4.990 0.008 A 26 LEU HBy H 1 1.339 0.003 A 26 LEU HBx H 1 1.214 0.002 A 26 LEU HDx% H 1 0.573 0.004 A 26 LEU HDy% H 1 0.510 0.020 A 26 LEU HG H 1 1.322 0.004 A 26 LEU C C 13 175.514 0.200 A 26 LEU CA C 13 54.662 0.200 A 26 LEU CB C 13 45.594 0.001 A 26 LEU CD1 C 13 25.455 0.200 A 26 LEU CD2 C 13 25.645 0.200 A 26 LEU CG C 13 26.984 0.200 A 27 LYS H H 1 9.028 0.003 A 27 LYS HA H 1 4.585 0.020 A 27 LYS HBy H 1 1.743 0.020 A 27 LYS HBx H 1 1.666 0.020 A 27 LYS HDx H 1 1.616 0.021 A 27 LYS HDy H 1 1.616 0.021 A 27 LYS HEx H 1 2.849 0.020 A 27 LYS HEy H 1 2.849 0.020 A 27 LYS HGx H 1 1.297 0.002 A 27 LYS HGy H 1 1.297 0.002 A 27 LYS C C 13 173.758 0.200 A 27 LYS CA C 13 54.945 0.200 A 27 LYS CB C 13 36.358 0.200 A 27 LYS CD C 13 29.572 0.200 A 27 LYS CE C 13 42.191 0.200 A 27 LYS CG C 13 24.761 0.200 A 27 LYS N N 15 122.904 0.200 A 28 ILE H H 1 8.540 0.020 A 28 ILE HA H 1 4.626 0.020 A 28 ILE HB H 1 1.736 0.020 A 28 ILE HD1% H 1 0.793 0.020 A 28 ILE HG1y H 1 1.554 0.006 A 28 ILE HG1x H 1 1.004 0.003 A 28 ILE HG2% H 1 0.800 0.003 A 28 ILE C C 13 175.988 0.012 A 28 ILE CA C 13 60.122 0.200 A 28 ILE CB C 13 38.795 0.200 A 28 ILE CD1 C 13 13.833 0.200 A 28 ILE CG1 C 13 28.369 0.051 A 28 ILE CG2 C 13 18.190 0.200 A 28 ILE N N 15 123.517 0.200 A 29 LEU H H 1 8.961 0.020 A 29 LEU HA H 1 4.564 0.020 A 29 LEU HBx H 1 1.535 0.020 A 29 LEU HBy H 1 1.535 0.020 A 29 LEU HDx% H 1 0.785 0.020 A 29 LEU HDy% H 1 0.785 0.020 A 29 LEU HG H 1 1.497 0.002 A 29 LEU C C 13 176.005 0.200 A 29 LEU CA C 13 53.975 0.200 A 29 LEU CB C 13 43.485 0.200 A 29 LEU CD1 C 13 24.072 0.200 A 29 LEU CG C 13 26.984 0.200 A 29 LEU N N 15 128.881 0.200 A 30 ASN H H 1 8.763 0.020 A 30 ASN HA H 1 4.991 0.005 A 30 ASN HBy H 1 2.789 0.020 A 30 ASN HBx H 1 2.498 0.011 A 30 ASN HD2y H 1 7.521 0.020 A 30 ASN HD2x H 1 6.679 0.020 A 30 ASN C C 13 174.462 0.012 A 30 ASN CA C 13 52.413 0.200 A 30 ASN CB C 13 39.238 0.003 A 30 ASN N N 15 124.019 0.200 A 30 ASN ND2 N 15 111.443 0.200 A 31 THR H H 1 8.170 0.004 A 31 THR HA H 1 4.628 0.020 A 31 THR HB H 1 3.945 0.005 A 31 THR HG2% H 1 1.253 0.002 A 31 THR CA C 13 59.475 0.200 A 31 THR CB C 13 70.435 0.200 A 31 THR CG2 C 13 22.304 0.200 A 31 THR N N 15 119.276 0.200 A 32 PRO HA H 1 4.223 0.002 A 32 PRO HBy H 1 2.241 0.006 A 32 PRO HBx H 1 1.779 0.020 A 32 PRO HDy H 1 3.825 0.006 A 32 PRO HDx H 1 3.656 0.006 A 32 PRO HGy H 1 2.016 0.002 A 32 PRO HGx H 1 1.927 0.002 A 32 PRO C C 13 176.814 0.200 A 32 PRO CA C 13 64.445 0.200 A 32 PRO CB C 13 32.161 0.200 A 32 PRO CD C 13 51.329 0.054 A 32 PRO CG C 13 27.766 0.200 A 33 ASN H H 1 8.574 0.008 A 33 ASN HA H 1 4.320 0.007 A 33 ASN HBy H 1 2.762 0.020 A 33 ASN HBx H 1 2.726 0.020 A 33 ASN HD2y H 1 7.267 0.001 A 33 ASN HD2x H 1 6.899 0.003 A 33 ASN C C 13 174.344 0.001 A 33 ASN CA C 13 54.945 0.200 A 33 ASN CB C 13 38.122 0.200 A 33 ASN N N 15 113.042 0.200 A 33 ASN ND2 N 15 113.833 0.200 A 34 CYS H H 1 7.554 0.007 A 34 CYS HA H 1 4.891 0.020 A 34 CYS HBy H 1 3.144 0.020 A 34 CYS HBx H 1 2.884 0.006 A 34 CYS C C 13 173.880 0.007 A 34 CYS CA C 13 54.622 0.200 A 34 CYS CB C 13 44.780 0.200 A 34 CYS N N 15 116.301 0.200 A 35 ALA H H 1 8.418 0.006 A 35 ALA HA H 1 4.237 0.001 A 35 ALA HB% H 1 1.408 0.008 A 35 ALA C C 13 176.677 0.200 A 35 ALA CA C 13 52.413 0.200 A 35 ALA CB C 13 18.992 0.200 A 35 ALA N N 15 125.001 0.200 A 36 LEU H H 1 8.060 0.020 A 36 LEU HA H 1 4.203 0.009 A 36 LEU HBy H 1 1.553 0.009 A 36 LEU HBx H 1 1.436 0.005 A 36 LEU HDx% H 1 0.835 0.020 A 36 LEU HDy% H 1 0.807 0.020 A 36 LEU HG H 1 1.520 0.020 A 36 LEU C C 13 176.194 0.004 A 36 LEU CA C 13 56.563 0.200 A 36 LEU CB C 13 42.488 0.200 A 36 LEU CD1 C 13 25.254 0.200 A 36 LEU CD2 C 13 25.366 0.200 A 36 LEU CG C 13 27.536 0.039 A 36 LEU N N 15 121.548 0.200 A 37 GLN H H 1 8.434 0.001 A 37 GLN HA H 1 4.623 0.005 A 37 GLN HBy H 1 2.164 0.011 A 37 GLN HBx H 1 1.994 0.001 A 37 GLN HE2y H 1 7.261 0.003 A 37 GLN HE2x H 1 6.630 0.001 A 37 GLN HGy H 1 2.443 0.004 A 37 GLN HGx H 1 2.385 0.001 A 37 GLN C C 13 173.581 0.009 A 37 GLN CA C 13 54.109 0.200 A 37 GLN CB C 13 32.286 0.044 A 37 GLN CG C 13 34.102 0.200 A 37 GLN N N 15 123.271 0.200 A 37 GLN NE2 N 15 110.257 0.200 A 38 ILE H H 1 9.408 0.020 A 38 ILE HA H 1 4.735 0.001 A 38 ILE HB H 1 1.847 0.003 A 38 ILE HD1% H 1 0.703 0.020 A 38 ILE HG1y H 1 1.413 0.020 A 38 ILE HG1x H 1 0.968 0.020 A 38 ILE HG2% H 1 0.624 0.016 A 38 ILE C C 13 174.547 0.016 A 38 ILE CA C 13 60.122 0.200 A 38 ILE CB C 13 38.899 0.200 A 38 ILE CD1 C 13 55.781 0.200 A 38 ILE CG1 C 13 27.585 0.041 A 38 ILE CG2 C 13 18.793 0.200 A 38 ILE N N 15 124.702 0.200 A 39 VAL H H 1 8.826 0.001 A 39 VAL HA H 1 5.041 0.007 A 39 VAL HB H 1 1.889 0.005 A 39 VAL HGx% H 1 0.849 0.009 A 39 VAL HGy% H 1 0.849 0.009 A 39 VAL C C 13 174.772 0.012 A 39 VAL CA C 13 60.111 0.200 A 39 VAL CB C 13 34.767 0.200 A 39 VAL CG1 C 13 20.823 0.200 A 39 VAL N N 15 124.047 0.200 A 40 ALA H H 1 9.299 0.005 A 40 ALA HA H 1 5.276 0.020 A 40 ALA HB% H 1 1.274 0.005 A 40 ALA C C 13 175.955 0.007 A 40 ALA CA C 13 50.093 0.200 A 40 ALA CB C 13 23.800 0.200 A 40 ALA N N 15 126.567 0.200 A 41 ARG H H 1 8.398 0.003 A 41 ARG HA H 1 5.131 0.007 A 41 ARG HBy H 1 1.600 0.020 A 41 ARG HBx H 1 1.501 0.020 A 41 ARG HDx H 1 3.068 0.006 A 41 ARG HDy H 1 3.068 0.006 A 41 ARG HGy H 1 1.572 0.006 A 41 ARG HGx H 1 1.500 0.003 A 41 ARG C C 13 176.184 0.007 A 41 ARG CA C 13 53.900 0.200 A 41 ARG CB C 13 32.161 0.200 A 41 ARG CD C 13 43.136 0.200 A 41 ARG CG C 13 27.631 0.200 A 41 ARG N N 15 118.991 0.200 A 42 LEU H H 1 8.988 0.007 A 42 LEU HA H 1 4.925 0.005 A 42 LEU HBy H 1 2.198 0.009 A 42 LEU HBx H 1 1.701 0.020 A 42 LEU HDx% H 1 0.990 0.013 A 42 LEU HDy% H 1 0.762 0.010 A 42 LEU HG H 1 1.785 0.020 A 42 LEU C C 13 178.369 0.003 A 42 LEU CA C 13 54.329 0.200 A 42 LEU CB C 13 41.497 0.200 A 42 LEU CD1 C 13 25.767 0.200 A 42 LEU CD2 C 13 22.981 0.200 A 42 LEU CG C 13 27.126 0.055 A 42 LEU N N 15 125.637 0.200 A 43 LYS H H 1 8.470 0.004 A 43 LYS HA H 1 3.823 0.020 A 43 LYS HBy H 1 1.842 0.020 A 43 LYS HBx H 1 1.668 0.002 A 43 LYS HDx H 1 1.681 0.007 A 43 LYS HDy H 1 1.681 0.007 A 43 LYS HEy H 1 2.865 0.020 A 43 LYS HEx H 1 2.845 0.001 A 43 LYS HGy H 1 1.248 0.020 A 43 LYS HGx H 1 1.158 0.020 A 43 LYS CA C 13 59.340 0.200 A 43 LYS CB C 13 33.445 0.200 A 43 LYS CD C 13 29.883 0.200 A 43 LYS CE C 13 42.327 0.200 A 43 LYS CG C 13 26.660 0.200 A 43 LYS N N 15 120.489 0.200 A 44 ASN HA H 1 4.421 0.020 A 44 ASN HBy H 1 2.917 0.020 A 44 ASN HBx H 1 2.812 0.020 A 44 ASN HD2y H 1 7.623 0.020 A 44 ASN HD2x H 1 6.789 0.001 A 44 ASN C C 13 175.970 0.200 A 44 ASN CA C 13 55.457 0.200 A 44 ASN CB C 13 37.507 0.001 A 44 ASN ND2 N 15 112.400 0.200 A 45 ASN H H 1 7.483 0.020 A 45 ASN HA H 1 4.706 0.020 A 45 ASN HBy H 1 3.007 0.009 A 45 ASN HBx H 1 2.709 0.002 A 45 ASN HD2y H 1 7.467 0.002 A 45 ASN HD2x H 1 6.509 0.002 A 45 ASN C C 13 175.461 0.200 A 45 ASN CA C 13 52.769 0.200 A 45 ASN CB C 13 39.194 0.078 A 45 ASN N N 15 115.277 0.200 A 45 ASN ND2 N 15 109.712 0.001 A 46 ASN H H 1 7.995 0.020 A 46 ASN HA H 1 4.661 0.020 A 46 ASN HBy H 1 3.100 0.009 A 46 ASN HBx H 1 2.678 0.006 A 46 ASN HD2y H 1 7.593 0.006 A 46 ASN HD2x H 1 6.881 0.020 A 46 ASN C C 13 174.812 0.010 A 46 ASN CA C 13 54.298 0.200 A 46 ASN CB C 13 39.103 0.012 A 46 ASN N N 15 116.416 0.200 A 46 ASN ND2 N 15 113.088 0.200 A 47 ARG H H 1 7.940 0.020 A 47 ARG HA H 1 4.205 0.006 A 47 ARG HBy H 1 1.724 0.020 A 47 ARG HBx H 1 1.679 0.020 A 47 ARG HDy H 1 3.188 0.020 A 47 ARG HDx H 1 3.109 0.002 A 47 ARG HGx H 1 1.559 0.010 A 47 ARG HGy H 1 1.559 0.010 A 47 ARG C C 13 175.719 0.200 A 47 ARG CA C 13 57.084 0.200 A 47 ARG CB C 13 31.792 0.045 A 47 ARG CD C 13 43.818 0.002 A 47 ARG CG C 13 27.766 0.200 A 47 ARG N N 15 120.017 0.200 A 48 GLN H H 1 8.641 0.001 A 48 GLN HA H 1 5.240 0.005 A 48 GLN HBy H 1 1.958 0.005 A 48 GLN HBx H 1 1.868 0.020 A 48 GLN HE2y H 1 7.512 0.001 A 48 GLN HE2x H 1 6.849 0.002 A 48 GLN HGy H 1 2.197 0.003 A 48 GLN HGx H 1 2.101 0.003 A 48 GLN C C 13 175.697 0.007 A 48 GLN CA C 13 55.454 0.200 A 48 GLN CB C 13 30.959 0.043 A 48 GLN CG C 13 35.396 0.200 A 48 GLN N N 15 123.029 0.200 A 48 GLN NE2 N 15 111.657 0.200 A 49 VAL H H 1 9.018 0.005 A 49 VAL HA H 1 4.745 0.020 A 49 VAL HB H 1 2.159 0.001 A 49 VAL HGx% H 1 0.872 0.005 A 49 VAL HGy% H 1 0.778 0.005 A 49 VAL C C 13 174.561 0.002 A 49 VAL CA C 13 59.266 0.200 A 49 VAL CB C 13 35.845 0.200 A 49 VAL CG1 C 13 21.823 0.200 A 49 VAL CG2 C 13 18.900 0.200 A 49 VAL N N 15 119.358 0.200 A 50 CYS H H 1 8.895 0.020 A 50 CYS HA H 1 5.636 0.009 A 50 CYS HBy H 1 3.691 0.011 A 50 CYS HBx H 1 3.030 0.006 A 50 CYS C C 13 174.469 0.005 A 50 CYS CA C 13 56.377 0.200 A 50 CYS CB C 13 44.680 0.003 A 50 CYS N N 15 120.834 0.200 A 51 ILE H H 1 8.615 0.006 A 51 ILE HA H 1 4.512 0.020 A 51 ILE HB H 1 1.468 0.003 A 51 ILE HD1% H 1 0.642 0.010 A 51 ILE HG1y H 1 1.251 0.003 A 51 ILE HG1x H 1 1.037 0.020 A 51 ILE HG2% H 1 0.663 0.010 A 51 ILE C C 13 174.137 0.036 A 51 ILE CA C 13 59.397 0.200 A 51 ILE CB C 13 39.603 0.200 A 51 ILE CD1 C 13 13.170 0.200 A 51 ILE CG1 C 13 27.463 0.012 A 51 ILE CG2 C 13 18.314 0.200 A 51 ILE N N 15 122.392 0.200 A 52 ASP H H 1 7.766 0.004 A 52 ASP HA H 1 3.572 0.020 A 52 ASP HBy H 1 2.629 0.020 A 52 ASP HBx H 1 2.228 0.006 A 52 ASP CA C 13 51.578 0.200 A 52 ASP CB C 13 42.381 0.021 A 52 ASP N N 15 126.398 0.200 A 53 PRO HA H 1 4.011 0.005 A 53 PRO HBy H 1 1.923 0.020 A 53 PRO HBx H 1 1.779 0.003 A 53 PRO HDy H 1 3.584 0.020 A 53 PRO HDx H 1 3.296 0.020 A 53 PRO HGy H 1 1.789 0.004 A 53 PRO HGx H 1 1.742 0.020 A 53 PRO C C 13 176.274 0.200 A 53 PRO CA C 13 63.546 0.200 A 53 PRO CB C 13 32.270 0.027 A 53 PRO CD C 13 50.927 0.200 A 53 PRO CG C 13 27.307 0.200 A 54 LYS H H 1 8.053 0.004 A 54 LYS HA H 1 3.982 0.020 A 54 LYS HBx H 1 1.701 0.020 A 54 LYS HBy H 1 1.701 0.020 A 54 LYS HDx H 1 1.618 0.004 A 54 LYS HDy H 1 1.618 0.004 A 54 LYS HEx H 1 2.954 0.020 A 54 LYS HEy H 1 2.954 0.020 A 54 LYS HGx H 1 1.281 0.020 A 54 LYS HGy H 1 1.281 0.020 A 54 LYS C C 13 177.867 0.002 A 54 LYS CA C 13 56.189 0.200 A 54 LYS CB C 13 31.649 0.200 A 54 LYS CD C 13 28.756 0.200 A 54 LYS CE C 13 41.473 0.200 A 54 LYS CG C 13 24.854 0.200 A 54 LYS N N 15 115.161 0.200 A 55 LEU H H 1 7.145 0.003 A 55 LEU HA H 1 4.027 0.002 A 55 LEU HBy H 1 1.216 0.007 A 55 LEU HBx H 1 0.988 0.007 A 55 LEU HDx% H 1 1.007 0.020 A 55 LEU HDy% H 1 0.989 0.005 A 55 LEU HG H 1 1.740 0.020 A 55 LEU C C 13 179.221 0.010 A 55 LEU CA C 13 14.371 0.200 A 55 LEU CB C 13 41.739 0.200 A 55 LEU CD1 C 13 25.690 0.200 A 55 LEU CD2 C 13 23.386 0.200 A 55 LEU CG C 13 27.119 0.200 A 55 LEU N N 15 120.921 0.200 A 56 LYS H H 1 8.798 0.020 A 56 LYS HA H 1 3.937 0.020 A 56 LYS HBx H 1 1.975 0.020 A 56 LYS HBy H 1 1.975 0.020 A 56 LYS HDx H 1 1.727 0.020 A 56 LYS HDy H 1 1.727 0.020 A 56 LYS HEx H 1 3.025 0.002 A 56 LYS HEy H 1 3.025 0.002 A 56 LYS HGy H 1 1.552 0.004 A 56 LYS HGx H 1 1.492 0.002 A 56 LYS C C 13 179.161 0.007 A 56 LYS CA C 13 60.116 0.200 A 56 LYS CB C 13 32.100 0.200 A 56 LYS CD C 13 29.092 0.200 A 56 LYS CE C 13 42.327 0.200 A 56 LYS CG C 13 25.042 0.200 A 56 LYS N N 15 125.449 0.200 A 57 TRP H H 1 7.821 0.004 A 57 TRP HA H 1 4.636 0.005 A 57 TRP HBy H 1 3.610 0.020 A 57 TRP HBx H 1 3.253 0.006 A 57 TRP HD1 H 1 7.652 0.020 A 57 TRP HE1 H 1 10.294 0.003 A 57 TRP HE3 H 1 6.572 0.020 A 57 TRP HH2 H 1 6.633 0.010 A 57 TRP HZ2 H 1 6.965 0.007 A 57 TRP HZ3 H 1 7.353 0.004 A 57 TRP C C 13 178.642 0.004 A 57 TRP CA C 13 58.388 0.200 A 57 TRP CB C 13 27.954 0.200 A 57 TRP CD1 C 13 128.405 0.200 A 57 TRP CE3 C 13 121.713 0.200 A 57 TRP CH2 C 13 123.812 0.200 A 57 TRP CZ2 C 13 113.720 0.200 A 57 TRP CZ3 C 13 121.013 0.200 A 57 TRP N N 15 113.650 0.200 A 57 TRP NE1 N 15 130.632 0.200 A 58 ILE H H 1 6.340 0.002 A 58 ILE HA H 1 3.620 0.005 A 58 ILE HB H 1 1.386 0.001 A 58 ILE HD1% H 1 0.073 0.007 A 58 ILE HG1y H 1 0.599 0.002 A 58 ILE HG1x H 1 -0.058 0.006 A 58 ILE HG2% H 1 0.561 0.011 A 58 ILE C C 13 177.104 0.002 A 58 ILE CA C 13 61.605 0.200 A 58 ILE CB C 13 36.043 0.200 A 58 ILE CD1 C 13 11.981 0.200 A 58 ILE CG1 C 13 27.307 0.200 A 58 ILE CG2 C 13 17.793 0.200 A 58 ILE N N 15 123.265 0.200 A 59 GLN H H 1 7.710 0.007 A 59 GLN HA H 1 3.824 0.004 A 59 GLN HBx H 1 2.152 0.015 A 59 GLN HBy H 1 2.152 0.015 A 59 GLN HE2y H 1 7.573 0.001 A 59 GLN HE2x H 1 6.768 0.001 A 59 GLN HGy H 1 2.373 0.020 A 59 GLN HGx H 1 2.341 0.003 A 59 GLN C C 13 178.933 0.009 A 59 GLN CA C 13 59.663 0.200 A 59 GLN CB C 13 27.972 0.200 A 59 GLN CG C 13 34.102 0.200 A 59 GLN N N 15 120.515 0.200 A 59 GLN NE2 N 15 113.241 0.200 A 60 GLU H H 1 8.042 0.004 A 60 GLU HA H 1 4.093 0.001 A 60 GLU HBy H 1 2.187 0.016 A 60 GLU HBx H 1 2.067 0.020 A 60 GLU HGy H 1 2.393 0.020 A 60 GLU HGx H 1 2.218 0.003 A 60 GLU C C 13 178.539 0.015 A 60 GLU CA C 13 59.152 0.200 A 60 GLU CB C 13 29.896 0.200 A 60 GLU CG C 13 36.691 0.200 A 60 GLU N N 15 117.976 0.200 A 61 TYR H H 1 7.882 0.002 A 61 TYR HA H 1 4.214 0.002 A 61 TYR HBx H 1 3.276 0.007 A 61 TYR HBy H 1 3.276 0.007 A 61 TYR HD1 H 1 7.076 0.020 A 61 TYR HD2 H 1 7.076 0.020 A 61 TYR HE1 H 1 6.764 0.005 A 61 TYR HE2 H 1 6.764 0.005 A 61 TYR C C 13 178.157 0.200 A 61 TYR CA C 13 61.281 0.200 A 61 TYR CB C 13 38.956 0.200 A 61 TYR CD1 C 13 132.955 0.200 A 61 TYR CE1 C 13 118.329 0.200 A 61 TYR N N 15 120.743 0.200 A 62 LEU H H 1 8.438 0.004 A 62 LEU HA H 1 3.886 0.004 A 62 LEU HBy H 1 1.871 0.020 A 62 LEU HBx H 1 1.451 0.001 A 62 LEU HDx% H 1 0.798 0.020 A 62 LEU HDy% H 1 0.799 0.001 A 62 LEU HG H 1 1.874 0.020 A 62 LEU C C 13 178.678 0.003 A 62 LEU CA C 13 57.619 0.200 A 62 LEU CB C 13 41.868 0.200 A 62 LEU CD1 C 13 25.887 0.200 A 62 LEU CD2 C 13 23.237 0.200 A 62 LEU CG C 13 26.984 0.200 A 62 LEU N N 15 119.052 0.200 A 63 GLU H H 1 7.884 0.001 A 63 GLU HA H 1 3.998 0.004 A 63 GLU HBy H 1 2.121 0.020 A 63 GLU HBx H 1 2.080 0.020 A 63 GLU HGy H 1 2.400 0.007 A 63 GLU HGx H 1 2.250 0.020 A 63 GLU C C 13 178.447 0.009 A 63 GLU CA C 13 59.143 0.200 A 63 GLU CB C 13 29.708 0.200 A 63 GLU CG C 13 36.534 0.070 A 63 GLU N N 15 118.310 0.200 A 64 LYS H H 1 7.576 0.003 A 64 LYS HA H 1 4.208 0.003 A 64 LYS HBx H 1 1.827 0.016 A 64 LYS HBy H 1 1.827 0.016 A 64 LYS HDx H 1 1.641 0.020 A 64 LYS HDy H 1 1.641 0.020 A 64 LYS HEx H 1 2.986 0.020 A 64 LYS HEy H 1 2.986 0.020 A 64 LYS HGy H 1 1.531 0.020 A 64 LYS HGx H 1 1.449 0.020 A 64 LYS C C 13 177.941 0.005 A 64 LYS CA C 13 57.543 0.200 A 64 LYS CB C 13 32.620 0.200 A 64 LYS CD C 13 29.061 0.200 A 64 LYS CE C 13 42.340 0.200 A 64 LYS CG C 13 25.340 0.026 A 64 LYS N N 15 117.398 0.200 A 65 ALA H H 1 7.934 0.003 A 65 ALA HA H 1 4.106 0.012 A 65 ALA HB% H 1 1.181 0.004 A 65 ALA C C 13 178.624 0.200 A 65 ALA CA C 13 53.790 0.200 A 65 ALA CB C 13 19.106 0.200 A 65 ALA N N 15 121.561 0.200 A 66 LEU H H 1 7.835 0.020 A 66 LEU HA H 1 4.268 0.020 A 66 LEU HBy H 1 1.700 0.020 A 66 LEU HBx H 1 1.567 0.020 A 66 LEU HDx% H 1 0.836 0.020 A 66 LEU HDy% H 1 0.836 0.020 A 66 LEU HG H 1 1.690 0.004 A 66 LEU CA C 13 55.593 0.200 A 66 LEU CB C 13 42.191 0.200 A 66 LEU CD1 C 13 23.237 0.200 A 66 LEU CG C 13 27.178 0.200 A 66 LEU N N 15 117.270 0.200 A 67 ASN H H 1 7.914 0.020 A 67 ASN HA H 1 4.731 0.013 A 67 ASN HBy H 1 2.849 0.002 A 67 ASN HBx H 1 2.756 0.005 A 67 ASN HD2y H 1 7.673 0.001 A 67 ASN HD2x H 1 6.999 0.020 A 67 ASN C C 13 174.039 0.200 A 67 ASN CA C 13 53.328 0.200 A 67 ASN CB C 13 39.091 0.200 A 67 ASN N N 15 118.309 0.200 A 67 ASN ND2 N 15 113.408 0.009 A 68 LYS H H 1 7.730 0.020 A 68 LYS HA H 1 4.152 0.020 A 68 LYS HBy H 1 1.810 0.020 A 68 LYS HBx H 1 1.708 0.006 A 68 LYS HDx H 1 1.658 0.020 A 68 LYS HDy H 1 1.658 0.020 A 68 LYS HEx H 1 2.986 0.020 A 68 LYS HEy H 1 2.986 0.020 A 68 LYS HGx H 1 1.387 0.020 A 68 LYS HGy H 1 1.387 0.020 A 68 LYS C C 13 181.391 0.200 A 68 LYS CA C 13 57.922 0.200 A 68 LYS CB C 13 33.781 0.006 A 68 LYS CD C 13 29.061 0.200 A 68 LYS CE C 13 42.327 0.200 A 68 LYS CG C 13 24.819 0.200 A 68 LYS N N 15 126.177 0.200 stop_ save_ save_DYANA/DIANA_distance_constraints_3 _nef_distance_restraint_list.sf_category nef_distance_restraint_list _nef_distance_restraint_list.sf_framecode DYANA/DIANA_distance_constraints_3 _nef_distance_restraint_list.restraint_origin noe _nef_distance_restraint_list.potential_type upper-bound-parabolic loop_ _nef_distance_restraint.index _nef_distance_restraint.restraint_id _nef_distance_restraint.chain_code_1 _nef_distance_restraint.sequence_code_1 _nef_distance_restraint.residue_name_1 _nef_distance_restraint.atom_name_1 _nef_distance_restraint.chain_code_2 _nef_distance_restraint.sequence_code_2 _nef_distance_restraint.residue_name_2 _nef_distance_restraint.atom_name_2 _nef_distance_restraint.weight _nef_distance_restraint.lower_limit _nef_distance_restraint.upper_limit 1 1 A 1 LYS H A 1 LYS HEx 1.0 . 5.50 2 1 A 1 LYS H A 1 LYS HEy 1.0 . 5.50 3 2 A 1 LYS H A 1 LYS HGx 1.0 . 4.89 4 2 A 1 LYS H A 1 LYS HGy 1.0 . 4.89 5 3 A 1 LYS HA A 1 LYS HDx 1.0 . 5.50 6 3 A 1 LYS HA A 1 LYS HDy 1.0 . 5.50 7 4 A 1 LYS HA A 1 LYS HEx 1.0 . 4.94 8 4 A 1 LYS HEy A 1 LYS HA 1.0 . 4.94 9 5 A 1 LYS HA A 2 PRO HDy 1.0 . 3.41 10 6 A 1 LYS HA A 2 PRO HDx 1.0 . 3.41 11 7 A 1 LYS HA A 2 PRO HDx 1.0 . 2.92 12 7 A 1 LYS HA A 2 PRO HDy 1.0 . 2.92 13 8 A 1 LYS HBx A 1 LYS HDx 1.0 . 3.14 14 8 A 1 LYS HBy A 1 LYS HDx 1.0 . 3.14 15 8 A 1 LYS HDy A 1 LYS HBy 1.0 . 3.14 16 8 A 1 LYS HDy A 1 LYS HBx 1.0 . 3.14 17 9 A 1 LYS HBx A 1 LYS HEx 1.0 . 4.35 18 9 A 1 LYS HBy A 1 LYS HEx 1.0 . 4.35 19 9 A 1 LYS HEy A 1 LYS HBy 1.0 . 4.35 20 9 A 1 LYS HEy A 1 LYS HBx 1.0 . 4.35 21 10 A 1 LYS HDx A 1 LYS HGx 1.0 . 2.45 22 10 A 1 LYS HDy A 1 LYS HGx 1.0 . 2.45 23 10 A 1 LYS HGy A 1 LYS HDx 1.0 . 2.45 24 10 A 1 LYS HGy A 1 LYS HDy 1.0 . 2.45 25 11 A 1 LYS HGx A 2 PRO HDx 1.0 . 4.88 26 11 A 1 LYS HGy A 2 PRO HDx 1.0 . 4.88 27 11 A 2 PRO HDy A 1 LYS HGx 1.0 . 4.88 28 11 A 1 LYS HGy A 2 PRO HDy 1.0 . 4.88 29 12 A 2 PRO HA A 3 VAL H 1.0 . 3.20 30 13 A 3 VAL H A 3 VAL HB 1.0 . 4.11 31 14 A 3 VAL H A 3 VAL HGx% 1.0 . 4.01 32 14 A 3 VAL H A 3 VAL HGy% 1.0 . 4.01 33 15 A 3 VAL HA A 3 VAL HGx% 1.0 . 3.64 34 15 A 3 VAL HGy% A 3 VAL HA 1.0 . 3.64 35 16 A 5 LEU H A 5 LEU HDx% 1.0 . 5.50 36 16 A 5 LEU H A 5 LEU HDy% 1.0 . 5.50 37 17 A 5 LEU HA A 5 LEU HDx% 1.0 . 3.48 38 17 A 5 LEU HDy% A 5 LEU HA 1.0 . 3.48 39 18 A 5 LEU HBy A 5 LEU HDx% 1.0 . 3.05 40 18 A 5 LEU HDy% A 5 LEU HBy 1.0 . 3.05 41 19 A 5 LEU HBx A 5 LEU HDx% 1.0 . 3.05 42 19 A 5 LEU HDy% A 5 LEU HBx 1.0 . 3.05 43 20 A 7 TYR H A 7 TYR HD% 1.0 . 5.50 44 21 A 7 TYR HD% A 7 TYR HA 1.0 . 3.36 45 22 A 7 TYR HE% A 10 PRO HGx 1.0 . 4.94 46 22 A 7 TYR HE% A 10 PRO HGy 1.0 . 4.94 47 23 A 8 ARG H A 8 ARG HDx 1.0 . 5.50 48 23 A 8 ARG H A 8 ARG HDy 1.0 . 5.50 49 24 A 8 ARG H A 8 ARG HGx 1.0 . 5.50 50 24 A 8 ARG H A 8 ARG HGy 1.0 . 5.50 51 25 A 8 ARG HA A 8 ARG HDx 1.0 . 4.47 52 25 A 8 ARG HDy A 8 ARG HA 1.0 . 4.47 53 26 A 8 ARG HA A 8 ARG HGx 1.0 . 3.42 54 26 A 8 ARG HGy A 8 ARG HA 1.0 . 3.42 55 27 A 8 ARG HDy A 8 ARG HBy 1.0 . 3.72 56 27 A 8 ARG HBy A 8 ARG HDx 1.0 . 3.72 57 28 A 8 ARG HGy A 8 ARG HBy 1.0 . 2.74 58 28 A 8 ARG HBy A 8 ARG HGx 1.0 . 2.74 59 29 A 8 ARG HDy A 8 ARG HBx 1.0 . 3.72 60 29 A 8 ARG HBx A 8 ARG HDx 1.0 . 3.72 61 30 A 8 ARG HGy A 8 ARG HBx 1.0 . 2.74 62 30 A 8 ARG HBx A 8 ARG HGx 1.0 . 2.74 63 31 A 8 ARG HBy A 8 ARG HDx 1.0 . 3.25 64 31 A 8 ARG HBx A 8 ARG HDx 1.0 . 3.25 65 31 A 8 ARG HDy A 8 ARG HBy 1.0 . 3.25 66 31 A 8 ARG HDy A 8 ARG HBx 1.0 . 3.25 67 32 A 9 CYS CB A 34 CYS SG 1.0 . 3.10 68 33 A 9 CYS HA A 10 PRO HDx 1.0 . 3.08 69 33 A 9 CYS HA A 10 PRO HDy 1.0 . 3.08 70 34 A 9 CYS HA A 31 THR HB 1.0 . 5.38 71 35 A 9 CYS HA A 31 THR HG2% 1.0 . 4.28 72 36 A 10 PRO HDy A 9 CYS HBy 1.0 . 4.17 73 36 A 9 CYS HBy A 10 PRO HDx 1.0 . 4.17 74 37 A 37 GLN HE2y A 9 CYS HBy 1.0 . 5.39 75 38 A 37 GLN HE2x A 9 CYS HBy 1.0 . 5.39 76 39 A 10 PRO HDy A 9 CYS HBx 1.0 . 4.17 77 39 A 9 CYS HBx A 10 PRO HDx 1.0 . 4.17 78 40 A 37 GLN HE2y A 9 CYS HBx 1.0 . 5.39 79 41 A 37 GLN HE2x A 9 CYS HBx 1.0 . 5.39 80 42 A 9 CYS HBx A 10 PRO HDx 1.0 . 3.53 81 42 A 9 CYS HBy A 10 PRO HDx 1.0 . 3.53 82 42 A 10 PRO HDy A 9 CYS HBx 1.0 . 3.53 83 42 A 10 PRO HDy A 9 CYS HBy 1.0 . 3.53 84 43 A 11 CYS H A 9 CYS HBx 1.0 . 4.10 85 43 A 9 CYS HBy A 11 CYS H 1.0 . 4.10 86 44 A 37 GLN HE2y A 9 CYS HBy 1.0 . 4.21 87 44 A 37 GLN HE2x A 9 CYS HBx 1.0 . 4.21 88 44 A 37 GLN HE2y A 9 CYS HBx 1.0 . 4.21 89 44 A 37 GLN HE2x A 9 CYS HBy 1.0 . 4.21 90 45 A 9 CYS SG A 34 CYS CB 1.0 . 3.10 91 46 A 34 CYS SG A 9 CYS SG 1.0 . 2.10 92 47 A 11 CYS H A 10 PRO HBy 1.0 . 4.48 93 48 A 11 CYS H A 10 PRO HBx 1.0 . 4.48 94 49 A 11 CYS H A 10 PRO HBx 1.0 . 3.85 95 49 A 11 CYS H A 10 PRO HBy 1.0 . 3.85 96 50 A 10 PRO HBx A 29 LEU HDx% 1.0 . 4.40 97 50 A 10 PRO HBy A 29 LEU HDx% 1.0 . 4.40 98 50 A 29 LEU HDy% A 10 PRO HBx 1.0 . 4.40 99 50 A 10 PRO HBy A 29 LEU HDy% 1.0 . 4.40 100 51 A 11 CYS H A 10 PRO HDx 1.0 . 4.27 101 51 A 10 PRO HDy A 11 CYS H 1.0 . 4.27 102 52 A 10 PRO HDx A 29 LEU HDx% 1.0 . 4.87 103 52 A 10 PRO HDy A 29 LEU HDx% 1.0 . 4.87 104 52 A 29 LEU HDy% A 10 PRO HDx 1.0 . 4.87 105 52 A 10 PRO HDy A 29 LEU HDy% 1.0 . 4.87 106 53 A 37 GLN HE2y A 10 PRO HDx 1.0 . 4.77 107 53 A 10 PRO HDy A 37 GLN HE2y 1.0 . 4.77 108 54 A 37 GLN HE2x A 10 PRO HDx 1.0 . 4.77 109 54 A 10 PRO HDy A 37 GLN HE2x 1.0 . 4.77 110 55 A 37 GLN HE2x A 10 PRO HDx 1.0 . 4.17 111 55 A 37 GLN HE2y A 10 PRO HDx 1.0 . 4.17 112 55 A 10 PRO HDy A 37 GLN HE2y 1.0 . 4.17 113 55 A 10 PRO HDy A 37 GLN HE2x 1.0 . 4.17 114 56 A 11 CYS H A 10 PRO HGx 1.0 . 3.92 115 56 A 10 PRO HGy A 11 CYS H 1.0 . 3.92 116 57 A 10 PRO HGy A 29 LEU HDx% 1.0 . 3.96 117 57 A 10 PRO HGx A 29 LEU HDx% 1.0 . 3.96 118 57 A 29 LEU HDy% A 10 PRO HGx 1.0 . 3.96 119 57 A 10 PRO HGy A 29 LEU HDy% 1.0 . 3.96 120 58 A 37 GLN HE2y A 10 PRO HGx 1.0 . 5.46 121 58 A 10 PRO HGy A 37 GLN HE2y 1.0 . 5.46 122 59 A 37 GLN HE2x A 10 PRO HGx 1.0 . 5.46 123 59 A 10 PRO HGy A 37 GLN HE2x 1.0 . 5.46 124 60 A 37 GLN HE2x A 10 PRO HGx 1.0 . 4.76 125 60 A 37 GLN HE2y A 10 PRO HGx 1.0 . 4.76 126 60 A 10 PRO HGy A 37 GLN HE2x 1.0 . 4.76 127 60 A 10 PRO HGy A 37 GLN HE2y 1.0 . 4.76 128 61 A 11 CYS CB A 50 CYS SG 1.0 . 3.10 129 62 A 11 CYS H A 11 CYS HBy 1.0 . 3.86 130 63 A 11 CYS H A 11 CYS HBx 1.0 . 3.86 131 64 A 11 CYS H A 11 CYS HBx 1.0 . 3.34 132 64 A 11 CYS H A 11 CYS HBy 1.0 . 3.34 133 65 A 37 GLN HE2y A 11 CYS H 1.0 . 5.43 134 66 A 37 GLN HE2x A 11 CYS H 1.0 . 5.43 135 67 A 37 GLN HE2y A 11 CYS H 1.0 . 4.75 136 67 A 37 GLN HE2x A 11 CYS H 1.0 . 4.75 137 68 A 14 PHE HD% A 11 CYS HBx 1.0 . 3.71 138 68 A 11 CYS HBy A 14 PHE HD% 1.0 . 3.71 139 69 A 14 PHE HE% A 11 CYS HBx 1.0 . 3.84 140 69 A 11 CYS HBy A 14 PHE HE% 1.0 . 3.84 141 70 A 11 CYS SG A 50 CYS CB 1.0 . 3.10 142 71 A 50 CYS SG A 11 CYS SG 1.0 . 2.10 143 72 A 12 ARG HA A 12 ARG HGy 1.0 . 3.85 144 73 A 12 ARG HA A 12 ARG HGx 1.0 . 3.85 145 74 A 12 ARG HA A 12 ARG HDx 1.0 . 4.10 146 74 A 12 ARG HA A 12 ARG HDy 1.0 . 4.10 147 75 A 12 ARG HDy A 12 ARG HBy 1.0 . 3.63 148 75 A 12 ARG HBy A 12 ARG HDx 1.0 . 3.63 149 76 A 13 PHE H A 12 ARG HBy 1.0 . 5.50 150 77 A 12 ARG HDy A 12 ARG HBx 1.0 . 3.63 151 77 A 12 ARG HBx A 12 ARG HDx 1.0 . 3.63 152 78 A 13 PHE H A 12 ARG HBx 1.0 . 5.50 153 79 A 12 ARG HBy A 12 ARG HDx 1.0 . 3.17 154 79 A 12 ARG HBx A 12 ARG HDx 1.0 . 3.17 155 79 A 12 ARG HDy A 12 ARG HBy 1.0 . 3.17 156 79 A 12 ARG HDy A 12 ARG HBx 1.0 . 3.17 157 80 A 13 PHE HD% A 12 ARG HBy 1.0 . 3.95 158 80 A 12 ARG HBx A 13 PHE HD% 1.0 . 3.95 159 81 A 13 PHE H A 13 PHE HBy 1.0 . 3.64 160 81 A 13 PHE H A 13 PHE HBx 1.0 . 3.64 161 82 A 13 PHE H A 13 PHE HD% 1.0 . 5.15 162 83 A 13 PHE H A 13 PHE HE% 1.0 . 5.45 163 84 A 13 PHE H A 14 PHE H 1.0 . 5.45 164 85 A 13 PHE HD% A 13 PHE HA 1.0 . 3.48 165 86 A 14 PHE H A 13 PHE HA 1.0 . 3.34 166 87 A 14 PHE H A 13 PHE HBy 1.0 . 4.00 167 88 A 13 PHE HBx A 14 PHE H 1.0 . 4.00 168 89 A 14 PHE H A 13 PHE HBy 1.0 . 3.46 169 89 A 13 PHE HBx A 14 PHE H 1.0 . 3.46 170 90 A 14 PHE H A 14 PHE HBy 1.0 . 3.78 171 91 A 14 PHE H A 14 PHE HBx 1.0 . 3.78 172 92 A 14 PHE HD% A 14 PHE H 1.0 . 4.26 173 93 A 14 PHE H A 15 GLU H 1.0 . 5.00 174 94 A 14 PHE HD% A 14 PHE HA 1.0 . 4.05 175 95 A 14 PHE HE% A 14 PHE HA 1.0 . 4.89 176 96 A 15 GLU H A 14 PHE HA 1.0 . 3.50 177 97 A 14 PHE HA A 50 CYS HBy 1.0 . 4.29 178 98 A 14 PHE HA A 50 CYS HBx 1.0 . 4.29 179 99 A 14 PHE HA A 50 CYS HBx 1.0 . 3.68 180 99 A 14 PHE HA A 50 CYS HBy 1.0 . 3.68 181 100 A 15 GLU H A 14 PHE HBy 1.0 . 4.16 182 101 A 52 ASP H A 14 PHE HBy 1.0 . 4.65 183 102 A 52 ASP HA A 14 PHE HBy 1.0 . 4.39 184 103 A 15 GLU H A 14 PHE HBx 1.0 . 4.16 185 104 A 52 ASP H A 14 PHE HBx 1.0 . 4.65 186 105 A 52 ASP HA A 14 PHE HBx 1.0 . 4.39 187 106 A 15 GLU H A 14 PHE HBy 1.0 . 3.59 188 106 A 15 GLU H A 14 PHE HBx 1.0 . 3.59 189 107 A 14 PHE HBx A 50 CYS HBx 1.0 . 4.49 190 107 A 14 PHE HBy A 50 CYS HBx 1.0 . 4.49 191 107 A 50 CYS HBy A 14 PHE HBy 1.0 . 4.49 192 107 A 50 CYS HBy A 14 PHE HBx 1.0 . 4.49 193 108 A 52 ASP H A 14 PHE HBy 1.0 . 3.98 194 108 A 52 ASP H A 14 PHE HBx 1.0 . 3.98 195 109 A 14 PHE HBy A 52 ASP HBx 1.0 . 4.04 196 109 A 14 PHE HBx A 52 ASP HBx 1.0 . 4.04 197 109 A 52 ASP HBy A 14 PHE HBy 1.0 . 4.04 198 109 A 14 PHE HBx A 52 ASP HBy 1.0 . 4.04 199 110 A 14 PHE HD% A 15 GLU H 1.0 . 4.50 200 111 A 14 PHE HD% A 50 CYS HBy 1.0 . 4.07 201 112 A 14 PHE HD% A 50 CYS HBx 1.0 . 4.07 202 113 A 14 PHE HD% A 50 CYS HBx 1.0 . 3.51 203 113 A 14 PHE HD% A 50 CYS HBy 1.0 . 3.51 204 114 A 14 PHE HD% A 51 ILE H 1.0 . 5.50 205 115 A 14 PHE HD% A 52 ASP H 1.0 . 4.65 206 116 A 14 PHE HD% A 52 ASP HA 1.0 . 3.89 207 117 A 14 PHE HD% A 52 ASP HBx 1.0 . 3.93 208 117 A 14 PHE HD% A 52 ASP HBy 1.0 . 3.93 209 118 A 14 PHE HD% A 53 PRO HDx 1.0 . 4.37 210 118 A 14 PHE HD% A 53 PRO HDy 1.0 . 4.37 211 119 A 14 PHE HE% A 50 CYS HBy 1.0 . 4.64 212 120 A 14 PHE HE% A 50 CYS HBx 1.0 . 4.64 213 121 A 14 PHE HE% A 50 CYS HBx 1.0 . 3.90 214 121 A 14 PHE HE% A 50 CYS HBy 1.0 . 3.90 215 122 A 14 PHE HE% A 52 ASP HA 1.0 . 4.33 216 123 A 14 PHE HE% A 52 ASP HBx 1.0 . 4.16 217 123 A 14 PHE HE% A 52 ASP HBy 1.0 . 4.16 218 124 A 14 PHE HE% A 53 PRO HDy 1.0 . 5.18 219 125 A 14 PHE HE% A 53 PRO HDx 1.0 . 5.18 220 126 A 14 PHE HE% A 53 PRO HDx 1.0 . 4.56 221 126 A 14 PHE HE% A 53 PRO HDy 1.0 . 4.56 222 127 A 15 GLU H A 15 GLU HBy 1.0 . 3.76 223 128 A 15 GLU H A 15 GLU HBx 1.0 . 3.76 224 129 A 15 GLU H A 15 GLU HGy 1.0 . 4.29 225 130 A 15 GLU H A 15 GLU HGx 1.0 . 4.29 226 131 A 15 GLU H A 15 GLU HBy 1.0 . 3.24 227 131 A 15 GLU H A 15 GLU HBx 1.0 . 3.24 228 132 A 15 GLU H A 15 GLU HGy 1.0 . 3.73 229 132 A 15 GLU H A 15 GLU HGx 1.0 . 3.73 230 133 A 15 GLU H A 18 VAL HGx% 1.0 . 4.54 231 133 A 15 GLU H A 18 VAL HGy% 1.0 . 4.54 232 134 A 15 GLU H A 50 CYS HBy 1.0 . 5.01 233 135 A 15 GLU H A 50 CYS HBx 1.0 . 5.01 234 136 A 15 GLU H A 50 CYS HBx 1.0 . 4.38 235 136 A 15 GLU H A 50 CYS HBy 1.0 . 4.38 236 137 A 15 GLU H A 51 ILE H 1.0 . 5.24 237 138 A 15 GLU H A 52 ASP H 1.0 . 4.60 238 139 A 15 GLU HA A 15 GLU HGy 1.0 . 3.73 239 139 A 15 GLU HGx A 15 GLU HA 1.0 . 3.73 240 140 A 15 GLU HA A 49 VAL HGx% 1.0 . 5.08 241 141 A 15 GLU HA A 49 VAL HGy% 1.0 . 5.08 242 142 A 15 GLU HA A 49 VAL HGy% 1.0 . 3.98 243 142 A 15 GLU HA A 49 VAL HGx% 1.0 . 3.98 244 143 A 16 SER H A 15 GLU HBy 1.0 . 5.27 245 144 A 18 VAL HGy% A 15 GLU HBy 1.0 . 3.69 246 144 A 15 GLU HBy A 18 VAL HGx% 1.0 . 3.69 247 145 A 15 GLU HBx A 16 SER H 1.0 . 5.27 248 146 A 15 GLU HBx A 18 VAL HGy% 1.0 . 3.69 249 146 A 15 GLU HBx A 18 VAL HGx% 1.0 . 3.69 250 147 A 16 SER H A 15 GLU HGy 1.0 . 5.46 251 148 A 18 VAL HGy% A 15 GLU HGy 1.0 . 3.70 252 148 A 15 GLU HGy A 18 VAL HGx% 1.0 . 3.70 253 149 A 15 GLU HGx A 16 SER H 1.0 . 5.46 254 150 A 15 GLU HGx A 18 VAL HGy% 1.0 . 3.70 255 150 A 15 GLU HGx A 18 VAL HGx% 1.0 . 3.70 256 151 A 15 GLU HBy A 18 VAL HGx% 1.0 . 3.19 257 151 A 15 GLU HBx A 18 VAL HGx% 1.0 . 3.19 258 151 A 18 VAL HGy% A 15 GLU HBy 1.0 . 3.19 259 151 A 15 GLU HBx A 18 VAL HGy% 1.0 . 3.19 260 152 A 15 GLU HBx A 49 VAL HGy% 1.0 . 4.12 261 152 A 49 VAL HGx% A 15 GLU HBy 1.0 . 4.12 262 152 A 15 GLU HBx A 49 VAL HGx% 1.0 . 4.12 263 152 A 15 GLU HBy A 49 VAL HGy% 1.0 . 4.12 264 153 A 15 GLU HGy A 49 VAL HGy% 1.0 . 4.08 265 153 A 15 GLU HGx A 49 VAL HGy% 1.0 . 4.08 266 153 A 49 VAL HGx% A 15 GLU HGy 1.0 . 4.08 267 153 A 15 GLU HGx A 49 VAL HGx% 1.0 . 4.08 268 154 A 52 ASP HBy A 16 SER HA 1.0 . 4.61 269 155 A 16 SER HA A 52 ASP HBx 1.0 . 4.61 270 156 A 16 SER HA A 55 LEU HDy% 1.0 . 4.40 271 156 A 16 SER HA A 55 LEU HDx% 1.0 . 4.40 272 157 A 52 ASP HA A 16 SER HBy 1.0 . 5.13 273 157 A 52 ASP HA A 16 SER HBx 1.0 . 5.13 274 158 A 16 SER HBy A 52 ASP HBx 1.0 . 4.76 275 158 A 16 SER HBx A 52 ASP HBx 1.0 . 4.76 276 158 A 52 ASP HBy A 16 SER HBy 1.0 . 4.76 277 158 A 52 ASP HBy A 16 SER HBx 1.0 . 4.76 278 159 A 16 SER HBx A 55 LEU HDy% 1.0 . 4.27 279 159 A 55 LEU HDx% A 16 SER HBy 1.0 . 4.27 280 159 A 55 LEU HDx% A 16 SER HBx 1.0 . 4.27 281 159 A 16 SER HBy A 55 LEU HDy% 1.0 . 4.27 282 160 A 17 HIS H A 18 VAL H 1.0 . 5.03 283 161 A 17 HIS HA A 17 HIS HE1 1.0 . 4.75 284 162 A 18 VAL H A 17 HIS HBy 1.0 . 4.78 285 163 A 18 VAL H A 17 HIS HBx 1.0 . 4.78 286 164 A 17 HIS HD2 A 17 HIS HBy 1.0 . 3.40 287 164 A 17 HIS HBx A 17 HIS HD2 1.0 . 3.40 288 165 A 18 VAL H A 18 VAL HB 1.0 . 3.49 289 166 A 18 VAL H A 18 VAL HGx% 1.0 . 3.61 290 166 A 18 VAL HGy% A 18 VAL H 1.0 . 3.61 291 167 A 18 VAL H A 19 ALA H 1.0 . 4.69 292 168 A 18 VAL H A 51 ILE HD1% 1.0 . 5.50 293 169 A 18 VAL H A 57 TRP HE1 1.0 . 5.39 294 170 A 18 VAL HA A 18 VAL HGx% 1.0 . 3.34 295 170 A 18 VAL HGy% A 18 VAL HA 1.0 . 3.34 296 171 A 19 ALA H A 18 VAL HA 1.0 . 2.93 297 172 A 18 VAL HB A 19 ALA H 1.0 . 4.63 298 173 A 18 VAL HB A 51 ILE HD1% 1.0 . 4.01 299 174 A 18 VAL HB A 51 ILE HG1x 1.0 . 3.78 300 174 A 18 VAL HB A 51 ILE HG1y 1.0 . 3.78 301 175 A 18 VAL HB A 51 ILE HG2% 1.0 . 3.81 302 176 A 18 VAL HB A 57 TRP HE1 1.0 . 5.47 303 177 A 18 VAL HB A 57 TRP HZ2 1.0 . 4.25 304 178 A 19 ALA H A 18 VAL HGx% 1.0 . 3.67 305 178 A 18 VAL HGy% A 19 ALA H 1.0 . 3.67 306 179 A 57 TRP HZ2 A 18 VAL HGx% 1.0 . 3.90 307 179 A 18 VAL HGy% A 57 TRP HZ2 1.0 . 3.90 308 180 A 19 ALA H A 19 ALA HB% 1.0 . 3.20 309 181 A 19 ALA H A 20 ARG H 1.0 . 5.29 310 182 A 19 ALA H A 22 ASN H 1.0 . 4.36 311 183 A 19 ALA H A 22 ASN HBy 1.0 . 4.72 312 184 A 19 ALA H A 22 ASN HBx 1.0 . 4.72 313 185 A 19 ALA H A 22 ASN HBx 1.0 . 4.12 314 185 A 19 ALA H A 22 ASN HBy 1.0 . 4.12 315 186 A 19 ALA H A 22 ASN HD2y 1.0 . 4.31 316 186 A 19 ALA H A 22 ASN HD2x 1.0 . 4.31 317 187 A 20 ARG H A 19 ALA HA 1.0 . 3.29 318 188 A 19 ALA HA A 21 ALA H 1.0 . 5.15 319 189 A 22 ASN H A 19 ALA HA 1.0 . 4.86 320 190 A 19 ALA HA A 57 TRP HD1 1.0 . 4.27 321 191 A 57 TRP HE1 A 19 ALA HA 1.0 . 4.21 322 192 A 57 TRP HZ2 A 19 ALA HA 1.0 . 4.70 323 193 A 19 ALA HB% A 20 ARG H 1.0 . 3.74 324 194 A 19 ALA HB% A 21 ALA H 1.0 . 4.32 325 195 A 19 ALA HB% A 22 ASN HBy 1.0 . 4.40 326 196 A 19 ALA HB% A 22 ASN HBx 1.0 . 4.40 327 197 A 19 ALA HB% A 22 ASN HBx 1.0 . 3.70 328 197 A 19 ALA HB% A 22 ASN HBy 1.0 . 3.70 329 198 A 19 ALA HB% A 22 ASN HD2y 1.0 . 4.20 330 198 A 19 ALA HB% A 22 ASN HD2x 1.0 . 4.20 331 199 A 19 ALA HB% A 23 VAL H 1.0 . 5.50 332 200 A 57 TRP HE1 A 19 ALA HB% 1.0 . 5.19 333 201 A 20 ARG H A 20 ARG HBy 1.0 . 3.72 334 202 A 20 ARG H A 20 ARG HBx 1.0 . 3.72 335 203 A 20 ARG H A 20 ARG HDx 1.0 . 4.11 336 203 A 20 ARG H A 20 ARG HDy 1.0 . 4.11 337 204 A 20 ARG H A 20 ARG HGx 1.0 . 4.29 338 204 A 20 ARG H A 20 ARG HGy 1.0 . 4.29 339 205 A 20 ARG H A 21 ALA H 1.0 . 4.31 340 206 A 57 TRP HE1 A 20 ARG H 1.0 . 4.93 341 207 A 57 TRP HZ2 A 20 ARG H 1.0 . 5.50 342 208 A 20 ARG HGy A 20 ARG HA 1.0 . 3.79 343 209 A 20 ARG HA A 20 ARG HGx 1.0 . 3.79 344 210 A 20 ARG HA A 20 ARG HDx 1.0 . 2.69 345 210 A 20 ARG HDy A 20 ARG HA 1.0 . 2.69 346 211 A 20 ARG HA A 20 ARG HGx 1.0 . 3.24 347 211 A 20 ARG HGy A 20 ARG HA 1.0 . 3.24 348 212 A 23 VAL H A 20 ARG HA 1.0 . 4.18 349 213 A 20 ARG HA A 23 VAL HB 1.0 . 4.65 350 214 A 57 TRP HE1 A 20 ARG HA 1.0 . 5.50 351 215 A 20 ARG HA A 57 TRP HH2 1.0 . 4.26 352 216 A 57 TRP HZ2 A 20 ARG HA 1.0 . 4.08 353 217 A 20 ARG HDy A 20 ARG HBy 1.0 . 3.70 354 217 A 20 ARG HBy A 20 ARG HDx 1.0 . 3.70 355 218 A 21 ALA H A 20 ARG HBy 1.0 . 4.59 356 219 A 20 ARG HDy A 20 ARG HBx 1.0 . 3.70 357 219 A 20 ARG HBx A 20 ARG HDx 1.0 . 3.70 358 220 A 21 ALA H A 20 ARG HBx 1.0 . 4.59 359 221 A 20 ARG HBy A 20 ARG HGx 1.0 . 2.36 360 221 A 20 ARG HBx A 20 ARG HGx 1.0 . 2.36 361 221 A 20 ARG HGy A 20 ARG HBy 1.0 . 2.36 362 221 A 20 ARG HGy A 20 ARG HBx 1.0 . 2.36 363 222 A 21 ALA H A 20 ARG HBy 1.0 . 3.76 364 222 A 21 ALA H A 20 ARG HBx 1.0 . 3.76 365 223 A 57 TRP HE1 A 20 ARG HBy 1.0 . 5.34 366 223 A 57 TRP HE1 A 20 ARG HBx 1.0 . 5.34 367 224 A 57 TRP HH2 A 20 ARG HBy 1.0 . 5.34 368 224 A 57 TRP HH2 A 20 ARG HBx 1.0 . 5.34 369 225 A 57 TRP HZ3 A 20 ARG HBy 1.0 . 4.60 370 225 A 20 ARG HBx A 57 TRP HZ3 1.0 . 4.60 371 226 A 20 ARG HDx A 57 TRP HBy 1.0 . 5.37 372 226 A 20 ARG HDy A 57 TRP HBy 1.0 . 5.37 373 227 A 20 ARG HDy A 57 TRP HBx 1.0 . 5.37 374 227 A 57 TRP HBx A 20 ARG HDx 1.0 . 5.37 375 228 A 57 TRP HE3 A 20 ARG HDx 1.0 . 4.64 376 228 A 20 ARG HDy A 57 TRP HE3 1.0 . 4.64 377 229 A 57 TRP HH2 A 20 ARG HDx 1.0 . 4.70 378 229 A 20 ARG HDy A 57 TRP HH2 1.0 . 4.70 379 230 A 57 TRP HZ3 A 20 ARG HDx 1.0 . 4.22 380 230 A 20 ARG HDy A 57 TRP HZ3 1.0 . 4.22 381 231 A 20 ARG HDx A 57 TRP HBy 1.0 . 4.63 382 231 A 20 ARG HDy A 57 TRP HBy 1.0 . 4.63 383 231 A 57 TRP HBx A 20 ARG HDx 1.0 . 4.63 384 231 A 20 ARG HDy A 57 TRP HBx 1.0 . 4.63 385 232 A 21 ALA H A 20 ARG HGx 1.0 . 4.62 386 232 A 21 ALA H A 20 ARG HGy 1.0 . 4.62 387 233 A 57 TRP HE3 A 20 ARG HGx 1.0 . 3.93 388 233 A 20 ARG HGy A 57 TRP HE3 1.0 . 3.93 389 234 A 57 TRP HZ3 A 20 ARG HGx 1.0 . 4.22 390 234 A 20 ARG HGy A 57 TRP HZ3 1.0 . 4.22 391 235 A 21 ALA H A 21 ALA HB% 1.0 . 3.07 392 236 A 22 ASN H A 21 ALA H 1.0 . 3.76 393 237 A 21 ALA H A 23 VAL H 1.0 . 5.28 394 238 A 23 VAL H A 21 ALA HA 1.0 . 4.32 395 239 A 22 ASN H A 21 ALA HB% 1.0 . 3.41 396 240 A 21 ALA HB% A 22 ASN HA 1.0 . 4.80 397 241 A 23 VAL H A 21 ALA HB% 1.0 . 4.14 398 242 A 22 ASN H A 22 ASN HBy 1.0 . 3.54 399 243 A 22 ASN H A 22 ASN HBx 1.0 . 3.54 400 244 A 22 ASN H A 22 ASN HBx 1.0 . 3.02 401 244 A 22 ASN H A 22 ASN HBy 1.0 . 3.02 402 245 A 22 ASN H A 23 VAL H 1.0 . 3.12 403 246 A 22 ASN H A 43 LYS HDx 1.0 . 5.15 404 246 A 22 ASN H A 43 LYS HDy 1.0 . 5.15 405 247 A 22 ASN HA A 43 LYS HBy 1.0 . 4.41 406 248 A 22 ASN HA A 43 LYS HBx 1.0 . 4.41 407 249 A 22 ASN HA A 43 LYS HBy 1.0 . 3.87 408 249 A 22 ASN HA A 43 LYS HBx 1.0 . 3.87 409 250 A 22 ASN HBy A 23 VAL H 1.0 . 4.97 410 251 A 22 ASN HBy A 43 LYS H 1.0 . 5.50 411 252 A 23 VAL H A 22 ASN HBx 1.0 . 4.97 412 253 A 43 LYS H A 22 ASN HBx 1.0 . 5.50 413 254 A 22 ASN HD2y A 42 LEU HDx% 1.0 . 4.83 414 255 A 22 ASN HD2y A 42 LEU HDy% 1.0 . 4.83 415 256 A 22 ASN HD2x A 42 LEU HDx% 1.0 . 4.83 416 257 A 22 ASN HD2x A 42 LEU HDy% 1.0 . 4.83 417 258 A 23 VAL H A 22 ASN HBx 1.0 . 4.19 418 258 A 22 ASN HBy A 23 VAL H 1.0 . 4.19 419 259 A 22 ASN HBx A 42 LEU HDy% 1.0 . 3.70 420 259 A 22 ASN HBy A 42 LEU HDy% 1.0 . 3.70 421 259 A 42 LEU HDx% A 22 ASN HBx 1.0 . 3.70 422 259 A 22 ASN HBy A 42 LEU HDx% 1.0 . 3.70 423 260 A 43 LYS H A 22 ASN HBx 1.0 . 4.66 424 260 A 22 ASN HBy A 43 LYS H 1.0 . 4.66 425 261 A 22 ASN HD2x A 42 LEU HDy% 1.0 . 3.74 426 261 A 22 ASN HD2y A 42 LEU HDx% 1.0 . 3.74 427 261 A 22 ASN HD2x A 42 LEU HDx% 1.0 . 3.74 428 261 A 22 ASN HD2y A 42 LEU HDy% 1.0 . 3.74 429 262 A 23 VAL H A 23 VAL HB 1.0 . 3.15 430 263 A 23 VAL H A 23 VAL HGx% 1.0 . 3.14 431 263 A 23 VAL H A 23 VAL HGy% 1.0 . 3.14 432 264 A 23 VAL H A 24 LYS H 1.0 . 4.89 433 265 A 23 VAL H A 43 LYS H 1.0 . 5.30 434 266 A 23 VAL H A 43 LYS HDx 1.0 . 4.77 435 266 A 23 VAL H A 43 LYS HDy 1.0 . 4.77 436 267 A 23 VAL HA A 23 VAL HGx% 1.0 . 3.30 437 267 A 23 VAL HGy% A 23 VAL HA 1.0 . 3.30 438 268 A 24 LYS H A 23 VAL HA 1.0 . 3.15 439 269 A 23 VAL HA A 40 ALA HB% 1.0 . 4.56 440 270 A 23 VAL HA A 42 LEU H 1.0 . 5.39 441 271 A 23 VAL HA A 42 LEU HA 1.0 . 4.12 442 272 A 23 VAL HA A 42 LEU HDy% 1.0 . 3.67 443 272 A 42 LEU HDx% A 23 VAL HA 1.0 . 3.67 444 273 A 43 LYS H A 23 VAL HA 1.0 . 3.98 445 274 A 23 VAL HA A 43 LYS HGy 1.0 . 4.72 446 274 A 23 VAL HA A 43 LYS HGx 1.0 . 4.72 447 275 A 51 ILE HD1% A 23 VAL HA 1.0 . 5.18 448 276 A 23 VAL HB A 24 LYS H 1.0 . 4.16 449 277 A 23 VAL HB A 40 ALA HB% 1.0 . 3.80 450 278 A 23 VAL HB A 57 TRP HH2 1.0 . 4.75 451 279 A 24 LYS H A 23 VAL HGx% 1.0 . 3.59 452 279 A 23 VAL HGy% A 24 LYS H 1.0 . 3.59 453 280 A 24 LYS HA A 23 VAL HGx% 1.0 . 4.44 454 280 A 23 VAL HGy% A 24 LYS HA 1.0 . 4.44 455 281 A 23 VAL HGx% A 24 LYS HBy 1.0 . 4.89 456 281 A 23 VAL HGy% A 24 LYS HBy 1.0 . 4.89 457 282 A 23 VAL HGy% A 24 LYS HBx 1.0 . 4.89 458 282 A 24 LYS HBx A 23 VAL HGx% 1.0 . 4.89 459 283 A 23 VAL HGx% A 24 LYS HBy 1.0 . 4.30 460 283 A 23 VAL HGy% A 24 LYS HBy 1.0 . 4.30 461 283 A 24 LYS HBx A 23 VAL HGx% 1.0 . 4.30 462 283 A 23 VAL HGy% A 24 LYS HBx 1.0 . 4.30 463 284 A 25 HIS H A 23 VAL HGx% 1.0 . 4.37 464 284 A 23 VAL HGy% A 25 HIS H 1.0 . 4.37 465 285 A 23 VAL HGy% A 26 LEU HBy 1.0 . 4.05 466 285 A 26 LEU HBy A 23 VAL HGx% 1.0 . 4.05 467 286 A 23 VAL HGy% A 26 LEU HBx 1.0 . 4.05 468 286 A 23 VAL HGx% A 26 LEU HBx 1.0 . 4.05 469 287 A 40 ALA HA A 23 VAL HGx% 1.0 . 4.24 470 287 A 23 VAL HGy% A 40 ALA HA 1.0 . 4.24 471 288 A 40 ALA HB% A 23 VAL HGx% 1.0 . 2.63 472 288 A 23 VAL HGy% A 40 ALA HB% 1.0 . 2.63 473 289 A 41 ARG H A 23 VAL HGx% 1.0 . 3.79 474 289 A 23 VAL HGy% A 41 ARG H 1.0 . 3.79 475 290 A 41 ARG HA A 23 VAL HGx% 1.0 . 4.44 476 290 A 23 VAL HGy% A 41 ARG HA 1.0 . 4.44 477 291 A 57 TRP HE1 A 23 VAL HGx% 1.0 . 4.68 478 291 A 57 TRP HE1 A 23 VAL HGy% 1.0 . 4.68 479 292 A 57 TRP HH2 A 23 VAL HGx% 1.0 . 3.23 480 292 A 57 TRP HH2 A 23 VAL HGy% 1.0 . 3.23 481 293 A 57 TRP HZ2 A 23 VAL HGx% 1.0 . 3.13 482 293 A 57 TRP HZ2 A 23 VAL HGy% 1.0 . 3.13 483 294 A 24 LYS H A 24 LYS HBy 1.0 . 3.70 484 295 A 24 LYS H A 24 LYS HBx 1.0 . 3.70 485 296 A 24 LYS H A 24 LYS HBy 1.0 . 3.24 486 296 A 24 LYS H A 24 LYS HBx 1.0 . 3.24 487 297 A 24 LYS H A 24 LYS HDx 1.0 . 3.80 488 297 A 24 LYS H A 24 LYS HDy 1.0 . 3.80 489 298 A 24 LYS H A 24 LYS HEx 1.0 . 5.34 490 298 A 24 LYS H A 24 LYS HEy 1.0 . 5.34 491 299 A 24 LYS H A 24 LYS HGx 1.0 . 3.93 492 299 A 24 LYS H A 24 LYS HGy 1.0 . 3.93 493 300 A 24 LYS H A 25 HIS H 1.0 . 3.53 494 301 A 24 LYS H A 41 ARG H 1.0 . 4.53 495 302 A 24 LYS H A 41 ARG HDx 1.0 . 5.44 496 302 A 24 LYS H A 41 ARG HDy 1.0 . 5.44 497 303 A 24 LYS H A 42 LEU HA 1.0 . 4.33 498 304 A 43 LYS H A 24 LYS H 1.0 . 4.34 499 305 A 24 LYS HA A 24 LYS HEy 1.0 . 4.68 500 306 A 24 LYS HA A 24 LYS HEx 1.0 . 4.68 501 307 A 24 LYS HA A 24 LYS HDx 1.0 . 4.85 502 307 A 24 LYS HA A 24 LYS HDy 1.0 . 4.85 503 308 A 24 LYS HA A 24 LYS HEx 1.0 . 4.09 504 308 A 24 LYS HA A 24 LYS HEy 1.0 . 4.09 505 309 A 24 LYS HA A 24 LYS HGx 1.0 . 3.74 506 309 A 24 LYS HA A 24 LYS HGy 1.0 . 3.74 507 310 A 24 LYS HA A 43 LYS HGy 1.0 . 4.72 508 311 A 43 LYS HGx A 24 LYS HA 1.0 . 4.72 509 312 A 24 LYS HA A 43 LYS HEy 1.0 . 4.48 510 312 A 24 LYS HA A 43 LYS HEx 1.0 . 4.48 511 313 A 41 ARG HDy A 24 LYS HBy 1.0 . 5.50 512 313 A 24 LYS HBy A 41 ARG HDx 1.0 . 5.50 513 314 A 24 LYS HBx A 41 ARG HDy 1.0 . 5.50 514 314 A 24 LYS HBx A 41 ARG HDx 1.0 . 5.50 515 315 A 25 HIS H A 24 LYS HBy 1.0 . 3.41 516 315 A 24 LYS HBx A 25 HIS H 1.0 . 3.41 517 316 A 24 LYS HBy A 41 ARG HDx 1.0 . 4.84 518 316 A 24 LYS HBx A 41 ARG HDx 1.0 . 4.84 519 316 A 41 ARG HDy A 24 LYS HBy 1.0 . 4.84 520 316 A 24 LYS HBx A 41 ARG HDy 1.0 . 4.84 521 317 A 43 LYS HA A 24 LYS HBy 1.0 . 4.51 522 317 A 24 LYS HBx A 43 LYS HA 1.0 . 4.51 523 318 A 24 LYS HBy A 43 LYS HEy 1.0 . 4.23 524 318 A 43 LYS HEx A 24 LYS HBy 1.0 . 4.23 525 318 A 24 LYS HBx A 43 LYS HEx 1.0 . 4.23 526 318 A 24 LYS HBx A 43 LYS HEy 1.0 . 4.23 527 319 A 43 LYS H A 24 LYS HDx 1.0 . 4.59 528 319 A 43 LYS H A 24 LYS HDy 1.0 . 4.59 529 320 A 43 LYS HA A 24 LYS HDx 1.0 . 4.25 530 320 A 24 LYS HDy A 43 LYS HA 1.0 . 4.25 531 321 A 24 LYS HEx A 41 ARG HBy 1.0 . 4.47 532 321 A 24 LYS HEy A 41 ARG HBy 1.0 . 4.47 533 321 A 41 ARG HBx A 24 LYS HEx 1.0 . 4.47 534 321 A 24 LYS HEy A 41 ARG HBx 1.0 . 4.47 535 322 A 43 LYS HA A 24 LYS HEx 1.0 . 3.97 536 322 A 24 LYS HEy A 43 LYS HA 1.0 . 3.97 537 323 A 24 LYS HEx A 43 LYS HGy 1.0 . 3.25 538 323 A 24 LYS HEy A 43 LYS HGy 1.0 . 3.25 539 323 A 43 LYS HGx A 24 LYS HEx 1.0 . 3.25 540 323 A 43 LYS HGx A 24 LYS HEy 1.0 . 3.25 541 324 A 24 LYS HEy A 24 LYS HGy 1.0 . 3.76 542 324 A 24 LYS HEy A 24 LYS HGx 1.0 . 3.76 543 325 A 24 LYS HGy A 24 LYS HEx 1.0 . 3.76 544 325 A 24 LYS HEx A 24 LYS HGx 1.0 . 3.76 545 326 A 24 LYS HEx A 24 LYS HGx 1.0 . 3.29 546 326 A 24 LYS HEy A 24 LYS HGx 1.0 . 3.29 547 326 A 24 LYS HGy A 24 LYS HEx 1.0 . 3.29 548 326 A 24 LYS HEy A 24 LYS HGy 1.0 . 3.29 549 327 A 25 HIS H A 24 LYS HGx 1.0 . 4.64 550 327 A 25 HIS H A 24 LYS HGy 1.0 . 4.64 551 328 A 24 LYS HGy A 25 HIS HBy 1.0 . 5.06 552 328 A 24 LYS HGx A 25 HIS HBy 1.0 . 5.06 553 329 A 25 HIS HBx A 24 LYS HGx 1.0 . 5.06 554 329 A 24 LYS HGy A 25 HIS HBx 1.0 . 5.06 555 330 A 24 LYS HGy A 25 HIS HBy 1.0 . 4.45 556 330 A 24 LYS HGx A 25 HIS HBy 1.0 . 4.45 557 330 A 25 HIS HBx A 24 LYS HGx 1.0 . 4.45 558 330 A 24 LYS HGy A 25 HIS HBx 1.0 . 4.45 559 331 A 24 LYS HGy A 41 ARG HDx 1.0 . 4.90 560 331 A 24 LYS HGx A 41 ARG HDx 1.0 . 4.90 561 331 A 41 ARG HDy A 24 LYS HGx 1.0 . 4.90 562 331 A 24 LYS HGy A 41 ARG HDy 1.0 . 4.90 563 332 A 43 LYS HA A 24 LYS HGx 1.0 . 4.73 564 332 A 24 LYS HGy A 43 LYS HA 1.0 . 4.73 565 333 A 25 HIS H A 25 HIS HD2 1.0 . 4.82 566 334 A 40 ALA HB% A 25 HIS H 1.0 . 4.76 567 335 A 25 HIS H A 41 ARG H 1.0 . 3.96 568 336 A 25 HIS H A 41 ARG HBy 1.0 . 5.25 569 337 A 25 HIS H A 41 ARG HBx 1.0 . 5.25 570 338 A 42 LEU HA A 25 HIS H 1.0 . 5.50 571 339 A 25 HIS HD2 A 25 HIS HA 1.0 . 4.37 572 340 A 26 LEU H A 25 HIS HBy 1.0 . 5.28 573 341 A 41 ARG H A 25 HIS HBy 1.0 . 5.18 574 342 A 25 HIS HBy A 41 ARG HBy 1.0 . 4.35 575 343 A 41 ARG HBx A 25 HIS HBy 1.0 . 4.35 576 344 A 25 HIS HBx A 26 LEU H 1.0 . 5.28 577 345 A 41 ARG H A 25 HIS HBx 1.0 . 5.18 578 346 A 25 HIS HBx A 41 ARG HBy 1.0 . 4.35 579 347 A 41 ARG HBx A 25 HIS HBx 1.0 . 4.35 580 348 A 40 ALA HB% A 25 HIS HD2 1.0 . 4.57 581 349 A 25 HIS HD2 A 25 HIS HBy 1.0 . 3.44 582 349 A 25 HIS HBx A 25 HIS HD2 1.0 . 3.44 583 350 A 25 HIS HBx A 41 ARG HBy 1.0 . 3.38 584 350 A 25 HIS HBy A 41 ARG HBy 1.0 . 3.38 585 350 A 41 ARG HBx A 25 HIS HBy 1.0 . 3.38 586 350 A 41 ARG HBx A 25 HIS HBx 1.0 . 3.38 587 351 A 26 LEU H A 26 LEU HG 1.0 . 5.50 588 352 A 26 LEU HG A 26 LEU HA 1.0 . 3.52 589 353 A 26 LEU HA A 26 LEU HDx% 1.0 . 4.44 590 354 A 26 LEU HA A 26 LEU HDy% 1.0 . 4.44 591 355 A 26 LEU HA A 26 LEU HDy% 1.0 . 3.71 592 355 A 26 LEU HA A 26 LEU HDx% 1.0 . 3.71 593 356 A 26 LEU HA A 27 LYS H 1.0 . 3.48 594 357 A 40 ALA HA A 26 LEU HA 1.0 . 3.65 595 358 A 40 ALA HB% A 26 LEU HA 1.0 . 3.67 596 359 A 41 ARG H A 26 LEU HA 1.0 . 4.50 597 360 A 26 LEU HDx% A 26 LEU HBy 1.0 . 4.00 598 361 A 26 LEU HBy A 26 LEU HDy% 1.0 . 4.00 599 362 A 27 LYS H A 26 LEU HBy 1.0 . 4.75 600 363 A 61 TYR HE% A 26 LEU HBy 1.0 . 5.50 601 364 A 26 LEU HDx% A 26 LEU HBx 1.0 . 4.00 602 365 A 26 LEU HBx A 26 LEU HDy% 1.0 . 4.00 603 366 A 27 LYS H A 26 LEU HBx 1.0 . 4.75 604 367 A 61 TYR HE% A 26 LEU HBx 1.0 . 5.50 605 368 A 26 LEU HG A 27 LYS H 1.0 . 5.19 606 369 A 27 LYS H A 26 LEU HBx 1.0 . 4.11 607 369 A 27 LYS H A 26 LEU HBy 1.0 . 4.11 608 370 A 26 LEU HDx% A 27 LYS H 1.0 . 5.18 609 371 A 40 ALA HB% A 26 LEU HDx% 1.0 . 4.07 610 372 A 57 TRP HH2 A 26 LEU HDx% 1.0 . 4.24 611 373 A 26 LEU HDx% A 61 TYR HD% 1.0 . 4.08 612 374 A 26 LEU HDx% A 61 TYR HE% 1.0 . 4.13 613 375 A 27 LYS H A 26 LEU HDy% 1.0 . 5.18 614 376 A 40 ALA HB% A 26 LEU HDy% 1.0 . 4.07 615 377 A 57 TRP HH2 A 26 LEU HDy% 1.0 . 4.24 616 378 A 61 TYR HD% A 26 LEU HDy% 1.0 . 4.08 617 379 A 61 TYR HE% A 26 LEU HDy% 1.0 . 4.13 618 380 A 27 LYS H A 26 LEU HDy% 1.0 . 4.47 619 380 A 26 LEU HDx% A 27 LYS H 1.0 . 4.47 620 381 A 40 ALA HA A 26 LEU HDy% 1.0 . 4.17 621 381 A 40 ALA HA A 26 LEU HDx% 1.0 . 4.17 622 382 A 40 ALA HB% A 26 LEU HDy% 1.0 . 2.98 623 382 A 40 ALA HB% A 26 LEU HDx% 1.0 . 2.98 624 383 A 26 LEU HDx% A 61 TYR HBx 1.0 . 5.44 625 383 A 26 LEU HDy% A 61 TYR HBx 1.0 . 5.44 626 383 A 61 TYR HBy A 26 LEU HDy% 1.0 . 5.44 627 383 A 26 LEU HDx% A 61 TYR HBy 1.0 . 5.44 628 384 A 61 TYR HD% A 26 LEU HDy% 1.0 . 3.56 629 384 A 26 LEU HDx% A 61 TYR HD% 1.0 . 3.56 630 385 A 27 LYS H A 27 LYS HBy 1.0 . 4.15 631 386 A 27 LYS H A 27 LYS HBx 1.0 . 4.15 632 387 A 27 LYS H A 27 LYS HDx 1.0 . 4.49 633 387 A 27 LYS H A 27 LYS HDy 1.0 . 4.49 634 388 A 27 LYS H A 27 LYS HEx 1.0 . 5.50 635 388 A 27 LYS H A 27 LYS HEy 1.0 . 5.50 636 389 A 27 LYS H A 27 LYS HGx 1.0 . 4.30 637 389 A 27 LYS H A 27 LYS HGy 1.0 . 4.30 638 390 A 27 LYS H A 38 ILE HG2% 1.0 . 4.25 639 391 A 27 LYS H A 39 VAL H 1.0 . 4.32 640 392 A 27 LYS H A 39 VAL HB 1.0 . 4.45 641 393 A 27 LYS H A 39 VAL HGx% 1.0 . 4.06 642 393 A 27 LYS H A 39 VAL HGy% 1.0 . 4.06 643 394 A 40 ALA HA A 27 LYS H 1.0 . 4.43 644 395 A 27 LYS HA A 27 LYS HDx 1.0 . 4.42 645 395 A 27 LYS HDy A 27 LYS HA 1.0 . 4.42 646 396 A 27 LYS HA A 27 LYS HEx 1.0 . 4.50 647 396 A 27 LYS HEy A 27 LYS HA 1.0 . 4.50 648 397 A 27 LYS HA A 27 LYS HGx 1.0 . 3.79 649 397 A 27 LYS HGy A 27 LYS HA 1.0 . 3.79 650 398 A 39 VAL H A 27 LYS HBy 1.0 . 5.48 651 399 A 39 VAL HB A 27 LYS HBy 1.0 . 4.04 652 400 A 39 VAL HGy% A 27 LYS HBy 1.0 . 3.81 653 400 A 27 LYS HBy A 39 VAL HGx% 1.0 . 3.81 654 401 A 39 VAL H A 27 LYS HBx 1.0 . 5.48 655 402 A 39 VAL HB A 27 LYS HBx 1.0 . 4.04 656 403 A 39 VAL HGy% A 27 LYS HBx 1.0 . 3.81 657 403 A 27 LYS HBx A 39 VAL HGx% 1.0 . 3.81 658 404 A 27 LYS HBy A 27 LYS HEx 1.0 . 3.48 659 404 A 27 LYS HBx A 27 LYS HEx 1.0 . 3.48 660 404 A 27 LYS HEy A 27 LYS HBy 1.0 . 3.48 661 404 A 27 LYS HEy A 27 LYS HBx 1.0 . 3.48 662 405 A 28 ILE H A 27 LYS HBy 1.0 . 4.20 663 405 A 27 LYS HBx A 28 ILE H 1.0 . 4.20 664 406 A 39 VAL H A 27 LYS HBy 1.0 . 4.79 665 406 A 39 VAL H A 27 LYS HBx 1.0 . 4.79 666 407 A 39 VAL HB A 27 LYS HBy 1.0 . 3.36 667 407 A 39 VAL HB A 27 LYS HBx 1.0 . 3.36 668 408 A 28 ILE H A 27 LYS HDx 1.0 . 4.30 669 408 A 27 LYS HDy A 28 ILE H 1.0 . 4.30 670 409 A 27 LYS HDx A 27 LYS HGx 1.0 . 2.95 671 409 A 27 LYS HDy A 27 LYS HGx 1.0 . 2.95 672 409 A 27 LYS HGy A 27 LYS HDx 1.0 . 2.95 673 409 A 27 LYS HDy A 27 LYS HGy 1.0 . 2.95 674 410 A 27 LYS HEx A 27 LYS HGx 1.0 . 3.22 675 410 A 27 LYS HEy A 27 LYS HGx 1.0 . 3.22 676 410 A 27 LYS HGy A 27 LYS HEx 1.0 . 3.22 677 410 A 27 LYS HEy A 27 LYS HGy 1.0 . 3.22 678 411 A 28 ILE H A 27 LYS HGx 1.0 . 4.28 679 411 A 27 LYS HGy A 28 ILE H 1.0 . 4.28 680 412 A 39 VAL HB A 27 LYS HGx 1.0 . 4.00 681 412 A 27 LYS HGy A 39 VAL HB 1.0 . 4.00 682 413 A 28 ILE H A 28 ILE HB 1.0 . 3.62 683 414 A 28 ILE H A 28 ILE HD1% 1.0 . 4.65 684 415 A 28 ILE H A 28 ILE HG1x 1.0 . 4.36 685 415 A 28 ILE H A 28 ILE HG1y 1.0 . 4.36 686 416 A 28 ILE H A 28 ILE HG2% 1.0 . 4.21 687 417 A 28 ILE HD1% A 28 ILE HA 1.0 . 4.08 688 418 A 28 ILE HA A 28 ILE HG1x 1.0 . 3.73 689 418 A 28 ILE HG1y A 28 ILE HA 1.0 . 3.73 690 419 A 28 ILE HG2% A 28 ILE HA 1.0 . 3.38 691 420 A 28 ILE HA A 38 ILE HA 1.0 . 3.38 692 421 A 28 ILE HA A 38 ILE HG1y 1.0 . 5.22 693 422 A 28 ILE HA A 38 ILE HG1x 1.0 . 5.22 694 423 A 28 ILE HA A 38 ILE HD1% 1.0 . 4.62 695 424 A 38 ILE HG2% A 28 ILE HA 1.0 . 4.45 696 425 A 39 VAL H A 28 ILE HA 1.0 . 4.38 697 426 A 28 ILE HB A 28 ILE HD1% 1.0 . 2.98 698 427 A 28 ILE HB A 28 ILE HG1x 1.0 . 2.58 699 427 A 28 ILE HB A 28 ILE HG1y 1.0 . 2.58 700 428 A 28 ILE HB A 29 LEU H 1.0 . 5.16 701 429 A 28 ILE HB A 38 ILE HA 1.0 . 5.43 702 430 A 28 ILE HG1y A 29 LEU H 1.0 . 5.49 703 431 A 28 ILE HG1y A 38 ILE HA 1.0 . 5.09 704 432 A 39 VAL H A 28 ILE HG1y 1.0 . 5.50 705 433 A 29 LEU H A 28 ILE HG1x 1.0 . 5.49 706 434 A 38 ILE HA A 28 ILE HG1x 1.0 . 5.09 707 435 A 39 VAL H A 28 ILE HG1x 1.0 . 5.50 708 436 A 28 ILE HD1% A 29 LEU H 1.0 . 5.50 709 437 A 28 ILE HD1% A 38 ILE HA 1.0 . 4.72 710 438 A 28 ILE HD1% A 38 ILE HD1% 1.0 . 2.40 711 439 A 39 VAL H A 28 ILE HD1% 1.0 . 5.50 712 440 A 61 TYR HD% A 28 ILE HD1% 1.0 . 5.50 713 441 A 61 TYR HE% A 28 ILE HD1% 1.0 . 4.74 714 442 A 29 LEU H A 28 ILE HG1x 1.0 . 4.77 715 442 A 28 ILE HG1y A 29 LEU H 1.0 . 4.77 716 443 A 38 ILE HA A 28 ILE HG1x 1.0 . 4.33 717 443 A 28 ILE HG1y A 38 ILE HA 1.0 . 4.33 718 444 A 38 ILE HD1% A 28 ILE HG1x 1.0 . 2.92 719 444 A 28 ILE HG1y A 38 ILE HD1% 1.0 . 2.92 720 445 A 28 ILE HG1y A 38 ILE HG1x 1.0 . 2.83 721 445 A 38 ILE HG1y A 28 ILE HG1x 1.0 . 2.83 722 445 A 28 ILE HG1y A 38 ILE HG1y 1.0 . 2.83 723 445 A 28 ILE HG1x A 38 ILE HG1x 1.0 . 2.83 724 446 A 38 ILE HG2% A 28 ILE HG1x 1.0 . 3.29 725 446 A 38 ILE HG2% A 28 ILE HG1y 1.0 . 3.29 726 447 A 39 VAL H A 28 ILE HG1x 1.0 . 4.75 727 447 A 39 VAL H A 28 ILE HG1y 1.0 . 4.75 728 448 A 28 ILE HG1y A 28 ILE HG2% 1.0 . 3.36 729 449 A 28 ILE HG2% A 28 ILE HG1x 1.0 . 3.36 730 450 A 28 ILE HG2% A 28 ILE HG1x 1.0 . 2.74 731 450 A 28 ILE HG1y A 28 ILE HG2% 1.0 . 2.74 732 451 A 28 ILE HG2% A 29 LEU H 1.0 . 3.79 733 452 A 28 ILE HG2% A 38 ILE HA 1.0 . 3.90 734 453 A 28 ILE HG2% A 38 ILE HD1% 1.0 . 2.58 735 454 A 28 ILE HG2% A 38 ILE HG1x 1.0 . 3.42 736 454 A 28 ILE HG2% A 38 ILE HG1y 1.0 . 3.42 737 455 A 38 ILE HG2% A 28 ILE HG2% 1.0 . 2.85 738 456 A 39 VAL H A 28 ILE HG2% 1.0 . 5.25 739 457 A 61 TYR HE% A 28 ILE HG2% 1.0 . 3.37 740 458 A 29 LEU H A 29 LEU HG 1.0 . 4.35 741 459 A 29 LEU H A 29 LEU HBx 1.0 . 3.96 742 459 A 29 LEU H A 29 LEU HBy 1.0 . 3.96 743 460 A 29 LEU H A 29 LEU HDx% 1.0 . 4.03 744 460 A 29 LEU HDy% A 29 LEU H 1.0 . 4.03 745 461 A 29 LEU H A 37 GLN H 1.0 . 5.06 746 462 A 38 ILE HA A 29 LEU H 1.0 . 4.87 747 463 A 29 LEU HA A 29 LEU HDx% 1.0 . 3.33 748 463 A 29 LEU HDy% A 29 LEU HA 1.0 . 3.33 749 464 A 29 LEU HBy A 29 LEU HDx% 1.0 . 2.95 750 464 A 29 LEU HBx A 29 LEU HDx% 1.0 . 2.95 751 464 A 29 LEU HDy% A 29 LEU HBx 1.0 . 2.95 752 464 A 29 LEU HDy% A 29 LEU HBy 1.0 . 2.95 753 465 A 37 GLN H A 29 LEU HBx 1.0 . 5.27 754 465 A 29 LEU HBy A 37 GLN H 1.0 . 5.27 755 466 A 29 LEU HBy A 37 GLN HBy 1.0 . 4.44 756 466 A 29 LEU HBx A 37 GLN HBy 1.0 . 4.44 757 467 A 29 LEU HBy A 37 GLN HBx 1.0 . 4.44 758 467 A 37 GLN HBx A 29 LEU HBx 1.0 . 4.44 759 468 A 29 LEU HBy A 37 GLN HBy 1.0 . 3.87 760 468 A 29 LEU HBx A 37 GLN HBy 1.0 . 3.87 761 468 A 37 GLN HBx A 29 LEU HBx 1.0 . 3.87 762 468 A 29 LEU HBy A 37 GLN HBx 1.0 . 3.87 763 469 A 30 ASN HA A 30 ASN HD2x 1.0 . 4.60 764 469 A 30 ASN HA A 30 ASN HD2y 1.0 . 4.60 765 470 A 30 ASN HA A 31 THR H 1.0 . 3.35 766 471 A 30 ASN HA A 36 LEU HA 1.0 . 5.48 767 472 A 30 ASN HA A 36 LEU HDx% 1.0 . 4.80 768 473 A 30 ASN HA A 36 LEU HDy% 1.0 . 4.80 769 474 A 30 ASN HA A 36 LEU HDy% 1.0 . 4.05 770 474 A 30 ASN HA A 36 LEU HDx% 1.0 . 4.05 771 475 A 37 GLN H A 30 ASN HA 1.0 . 4.54 772 476 A 31 THR H A 30 ASN HBy 1.0 . 5.05 773 477 A 36 LEU HDx% A 30 ASN HBy 1.0 . 4.35 774 478 A 30 ASN HBy A 36 LEU HDy% 1.0 . 4.35 775 479 A 31 THR H A 30 ASN HBx 1.0 . 5.05 776 480 A 36 LEU HDx% A 30 ASN HBx 1.0 . 4.35 777 481 A 30 ASN HBx A 36 LEU HDy% 1.0 . 4.35 778 482 A 31 THR H A 30 ASN HBx 1.0 . 4.44 779 482 A 31 THR H A 30 ASN HBy 1.0 . 4.44 780 483 A 30 ASN HBy A 36 LEU HDy% 1.0 . 3.33 781 483 A 36 LEU HDx% A 30 ASN HBx 1.0 . 3.33 782 483 A 36 LEU HDx% A 30 ASN HBy 1.0 . 3.33 783 483 A 30 ASN HBx A 36 LEU HDy% 1.0 . 3.33 784 484 A 30 ASN HD2x A 36 LEU HDy% 1.0 . 3.93 785 484 A 30 ASN HD2y A 36 LEU HDy% 1.0 . 3.93 786 484 A 36 LEU HDx% A 30 ASN HD2x 1.0 . 3.93 787 484 A 30 ASN HD2y A 36 LEU HDx% 1.0 . 3.93 788 485 A 31 THR HB A 31 THR H 1.0 . 4.15 789 486 A 31 THR HG2% A 31 THR H 1.0 . 4.35 790 487 A 31 THR H A 34 CYS H 1.0 . 5.02 791 488 A 31 THR H A 35 ALA HA 1.0 . 4.91 792 489 A 31 THR H A 36 LEU HDy% 1.0 . 4.72 793 489 A 31 THR H A 36 LEU HDx% 1.0 . 4.72 794 490 A 37 GLN HE2y A 31 THR H 1.0 . 5.50 795 491 A 37 GLN HE2x A 31 THR H 1.0 . 5.50 796 492 A 31 THR HG2% A 31 THR HA 1.0 . 3.55 797 493 A 31 THR HA A 32 PRO HDy 1.0 . 3.38 798 494 A 31 THR HA A 32 PRO HDx 1.0 . 3.38 799 495 A 31 THR HA A 32 PRO HDx 1.0 . 2.88 800 495 A 31 THR HA A 32 PRO HDy 1.0 . 2.88 801 496 A 31 THR HB A 32 PRO HDx 1.0 . 4.01 802 496 A 31 THR HB A 32 PRO HDy 1.0 . 4.01 803 497 A 31 THR HB A 34 CYS H 1.0 . 4.57 804 498 A 31 THR HB A 34 CYS HBy 1.0 . 4.33 805 499 A 31 THR HB A 34 CYS HBx 1.0 . 4.33 806 500 A 31 THR HB A 34 CYS HBx 1.0 . 3.73 807 500 A 31 THR HB A 34 CYS HBy 1.0 . 3.73 808 501 A 31 THR HB A 37 GLN HE2y 1.0 . 5.25 809 502 A 31 THR HB A 37 GLN HE2x 1.0 . 5.25 810 503 A 31 THR HB A 37 GLN HE2y 1.0 . 4.60 811 503 A 31 THR HB A 37 GLN HE2x 1.0 . 4.60 812 504 A 31 THR HG2% A 32 PRO HDy 1.0 . 3.64 813 505 A 31 THR HG2% A 32 PRO HDx 1.0 . 3.64 814 506 A 31 THR HG2% A 32 PRO HDx 1.0 . 3.19 815 506 A 31 THR HG2% A 32 PRO HDy 1.0 . 3.19 816 507 A 31 THR HG2% A 34 CYS H 1.0 . 4.69 817 508 A 31 THR HG2% A 34 CYS HBy 1.0 . 4.92 818 509 A 31 THR HG2% A 34 CYS HBx 1.0 . 4.92 819 510 A 31 THR HG2% A 34 CYS HBx 1.0 . 4.23 820 510 A 31 THR HG2% A 34 CYS HBy 1.0 . 4.23 821 511 A 31 THR HG2% A 37 GLN HE2y 1.0 . 5.50 822 512 A 31 THR HG2% A 37 GLN HE2x 1.0 . 5.50 823 513 A 34 CYS H A 32 PRO HA 1.0 . 5.27 824 514 A 33 ASN HD2y A 32 PRO HBy 1.0 . 5.50 825 515 A 33 ASN HD2x A 32 PRO HBy 1.0 . 5.50 826 516 A 33 ASN HD2y A 32 PRO HBx 1.0 . 5.50 827 517 A 33 ASN HD2x A 32 PRO HBx 1.0 . 5.50 828 518 A 33 ASN HD2y A 32 PRO HBy 1.0 . 4.23 829 518 A 33 ASN HD2y A 32 PRO HBx 1.0 . 4.23 830 518 A 33 ASN HD2x A 32 PRO HBy 1.0 . 4.23 831 518 A 33 ASN HD2x A 32 PRO HBx 1.0 . 4.23 832 519 A 33 ASN HD2y A 33 ASN H 1.0 . 5.50 833 520 A 33 ASN HD2x A 33 ASN H 1.0 . 5.50 834 521 A 34 CYS H A 33 ASN H 1.0 . 4.34 835 522 A 33 ASN HD2y A 33 ASN HA 1.0 . 5.20 836 523 A 33 ASN HD2x A 33 ASN HA 1.0 . 5.20 837 524 A 34 CYS H A 33 ASN HBy 1.0 . 4.03 838 524 A 34 CYS H A 33 ASN HBx 1.0 . 4.03 839 525 A 34 CYS H A 34 CYS HBy 1.0 . 3.93 840 526 A 34 CYS H A 34 CYS HBx 1.0 . 3.93 841 527 A 34 CYS H A 34 CYS HBx 1.0 . 3.32 842 527 A 34 CYS H A 34 CYS HBy 1.0 . 3.32 843 528 A 34 CYS H A 35 ALA H 1.0 . 4.58 844 529 A 34 CYS HBy A 35 ALA H 1.0 . 4.76 845 530 A 37 GLN HE2y A 34 CYS HBy 1.0 . 4.79 846 531 A 37 GLN HE2x A 34 CYS HBy 1.0 . 4.79 847 532 A 35 ALA H A 34 CYS HBx 1.0 . 4.76 848 533 A 37 GLN HE2y A 34 CYS HBx 1.0 . 4.79 849 534 A 37 GLN HE2x A 34 CYS HBx 1.0 . 4.79 850 535 A 35 ALA H A 34 CYS HBx 1.0 . 4.09 851 535 A 34 CYS HBy A 35 ALA H 1.0 . 4.09 852 536 A 37 GLN HE2x A 34 CYS HBy 1.0 . 3.71 853 536 A 37 GLN HE2x A 34 CYS HBx 1.0 . 3.71 854 536 A 37 GLN HE2y A 34 CYS HBy 1.0 . 3.71 855 536 A 37 GLN HE2y A 34 CYS HBx 1.0 . 3.71 856 537 A 35 ALA H A 35 ALA HB% 1.0 . 3.58 857 538 A 35 ALA HA A 36 LEU H 1.0 . 3.03 858 539 A 35 ALA HA A 36 LEU HDy% 1.0 . 4.76 859 539 A 36 LEU HDx% A 35 ALA HA 1.0 . 4.76 860 540 A 35 ALA HB% A 36 LEU H 1.0 . 3.26 861 541 A 37 GLN HE2y A 35 ALA HB% 1.0 . 4.91 862 542 A 37 GLN HE2x A 35 ALA HB% 1.0 . 4.91 863 543 A 37 GLN HE2y A 35 ALA HB% 1.0 . 4.20 864 543 A 37 GLN HE2x A 35 ALA HB% 1.0 . 4.20 865 544 A 36 LEU H A 36 LEU HBy 1.0 . 3.82 866 545 A 36 LEU H A 36 LEU HBx 1.0 . 3.82 867 546 A 36 LEU H A 36 LEU HG 1.0 . 4.80 868 547 A 36 LEU H A 36 LEU HBx 1.0 . 3.10 869 547 A 36 LEU H A 36 LEU HBy 1.0 . 3.10 870 548 A 36 LEU HDx% A 36 LEU H 1.0 . 4.62 871 549 A 36 LEU H A 36 LEU HDy% 1.0 . 4.62 872 550 A 36 LEU H A 36 LEU HDy% 1.0 . 3.90 873 550 A 36 LEU HDx% A 36 LEU H 1.0 . 3.90 874 551 A 36 LEU HA A 36 LEU HDx% 1.0 . 3.73 875 552 A 36 LEU HA A 36 LEU HDy% 1.0 . 3.73 876 553 A 36 LEU HA A 36 LEU HDy% 1.0 . 3.20 877 553 A 36 LEU HA A 36 LEU HDx% 1.0 . 3.20 878 554 A 37 GLN H A 36 LEU HA 1.0 . 3.21 879 555 A 37 GLN H A 36 LEU HG 1.0 . 4.50 880 556 A 36 LEU HBy A 36 LEU HDy% 1.0 . 2.66 881 556 A 36 LEU HBx A 36 LEU HDy% 1.0 . 2.66 882 556 A 36 LEU HDx% A 36 LEU HBx 1.0 . 2.66 883 556 A 36 LEU HDx% A 36 LEU HBy 1.0 . 2.66 884 557 A 37 GLN H A 36 LEU HBx 1.0 . 3.85 885 557 A 37 GLN H A 36 LEU HBy 1.0 . 3.85 886 558 A 37 GLN H A 36 LEU HDx% 1.0 . 4.06 887 559 A 37 GLN H A 36 LEU HDy% 1.0 . 4.06 888 560 A 37 GLN H A 36 LEU HDy% 1.0 . 3.54 889 560 A 37 GLN H A 36 LEU HDx% 1.0 . 3.54 890 561 A 37 GLN HE2y A 36 LEU HDx% 1.0 . 4.47 891 561 A 37 GLN HE2x A 36 LEU HDx% 1.0 . 4.47 892 561 A 37 GLN HE2y A 36 LEU HDy% 1.0 . 4.47 893 561 A 37 GLN HE2x A 36 LEU HDy% 1.0 . 4.47 894 562 A 37 GLN HE2y A 37 GLN H 1.0 . 5.50 895 563 A 37 GLN HE2x A 37 GLN H 1.0 . 5.50 896 564 A 37 GLN HE2y A 37 GLN H 1.0 . 4.72 897 564 A 37 GLN HE2x A 37 GLN H 1.0 . 4.72 898 565 A 37 GLN H A 37 GLN HGx 1.0 . 4.03 899 565 A 37 GLN H A 37 GLN HGy 1.0 . 4.03 900 566 A 37 GLN HE2y A 37 GLN HA 1.0 . 5.50 901 567 A 37 GLN HE2x A 37 GLN HA 1.0 . 5.50 902 568 A 37 GLN HGy A 37 GLN HA 1.0 . 4.16 903 569 A 37 GLN HA A 37 GLN HGx 1.0 . 4.16 904 570 A 37 GLN HE2y A 37 GLN HA 1.0 . 4.76 905 570 A 37 GLN HE2x A 37 GLN HA 1.0 . 4.76 906 571 A 37 GLN HA A 37 GLN HGx 1.0 . 3.54 907 571 A 37 GLN HGy A 37 GLN HA 1.0 . 3.54 908 572 A 37 GLN HA A 38 ILE H 1.0 . 3.49 909 573 A 37 GLN HE2y A 37 GLN HBy 1.0 . 5.03 910 574 A 37 GLN HE2x A 37 GLN HBy 1.0 . 5.03 911 575 A 38 ILE H A 37 GLN HBy 1.0 . 4.91 912 576 A 37 GLN HE2y A 37 GLN HBx 1.0 . 5.03 913 577 A 37 GLN HE2x A 37 GLN HBx 1.0 . 5.03 914 578 A 37 GLN HBx A 38 ILE H 1.0 . 4.91 915 579 A 37 GLN HE2x A 37 GLN HBy 1.0 . 3.74 916 579 A 37 GLN HE2y A 37 GLN HBy 1.0 . 3.74 917 579 A 37 GLN HE2x A 37 GLN HBx 1.0 . 3.74 918 579 A 37 GLN HE2y A 37 GLN HBx 1.0 . 3.74 919 580 A 37 GLN HBy A 37 GLN HGx 1.0 . 2.36 920 580 A 37 GLN HGy A 37 GLN HBy 1.0 . 2.36 921 580 A 37 GLN HBx A 37 GLN HGy 1.0 . 2.36 922 580 A 37 GLN HBx A 37 GLN HGx 1.0 . 2.36 923 581 A 38 ILE H A 37 GLN HBy 1.0 . 4.10 924 581 A 37 GLN HBx A 38 ILE H 1.0 . 4.10 925 582 A 37 GLN HE2x A 37 GLN HGx 1.0 . 3.23 926 582 A 37 GLN HE2y A 37 GLN HGy 1.0 . 3.23 927 582 A 37 GLN HE2x A 37 GLN HGy 1.0 . 3.23 928 582 A 37 GLN HE2y A 37 GLN HGx 1.0 . 3.23 929 583 A 38 ILE H A 37 GLN HGx 1.0 . 5.27 930 583 A 37 GLN HGy A 38 ILE H 1.0 . 5.27 931 584 A 38 ILE H A 38 ILE HB 1.0 . 3.82 932 585 A 38 ILE HG1y A 38 ILE H 1.0 . 4.64 933 586 A 38 ILE H A 38 ILE HG1x 1.0 . 4.64 934 587 A 38 ILE HD1% A 38 ILE H 1.0 . 4.53 935 588 A 38 ILE H A 38 ILE HG1x 1.0 . 3.89 936 588 A 38 ILE HG1y A 38 ILE H 1.0 . 3.89 937 589 A 38 ILE HG2% A 38 ILE H 1.0 . 4.52 938 590 A 39 VAL H A 38 ILE H 1.0 . 5.40 939 591 A 51 ILE H A 38 ILE H 1.0 . 5.26 940 592 A 38 ILE HA A 38 ILE HD1% 1.0 . 3.82 941 593 A 38 ILE HG2% A 38 ILE HA 1.0 . 3.45 942 594 A 38 ILE HD1% A 38 ILE HB 1.0 . 3.17 943 595 A 39 VAL H A 38 ILE HB 1.0 . 5.42 944 596 A 51 ILE H A 38 ILE HB 1.0 . 4.19 945 597 A 38 ILE HB A 51 ILE HB 1.0 . 3.61 946 598 A 38 ILE HB A 51 ILE HG1x 1.0 . 4.67 947 598 A 51 ILE HG1y A 38 ILE HB 1.0 . 4.67 948 599 A 38 ILE HB A 58 ILE HD1% 1.0 . 4.67 949 600 A 39 VAL H A 38 ILE HG1y 1.0 . 5.50 950 601 A 38 ILE HG1y A 53 PRO HA 1.0 . 5.50 951 602 A 39 VAL H A 38 ILE HG1x 1.0 . 5.50 952 603 A 53 PRO HA A 38 ILE HG1x 1.0 . 5.50 953 604 A 39 VAL H A 38 ILE HD1% 1.0 . 5.50 954 605 A 38 ILE HD1% A 53 PRO HA 1.0 . 3.57 955 606 A 38 ILE HD1% A 53 PRO HDx 1.0 . 4.73 956 606 A 53 PRO HDy A 38 ILE HD1% 1.0 . 4.73 957 607 A 38 ILE HD1% A 58 ILE HD1% 1.0 . 3.51 958 608 A 61 TYR HD% A 38 ILE HD1% 1.0 . 5.50 959 609 A 61 TYR HE% A 38 ILE HD1% 1.0 . 5.50 960 610 A 38 ILE HG2% A 38 ILE HG1y 1.0 . 3.53 961 611 A 38 ILE HG2% A 38 ILE HG1x 1.0 . 3.53 962 612 A 38 ILE HG2% A 38 ILE HD1% 1.0 . 2.40 963 613 A 38 ILE HG2% A 39 VAL H 1.0 . 3.74 964 614 A 51 ILE H A 38 ILE HG2% 1.0 . 4.65 965 615 A 38 ILE HG2% A 58 ILE HD1% 1.0 . 3.39 966 616 A 39 VAL H A 39 VAL HB 1.0 . 3.86 967 617 A 39 VAL H A 39 VAL HGx% 1.0 . 3.55 968 617 A 39 VAL H A 39 VAL HGy% 1.0 . 3.55 969 618 A 39 VAL H A 40 ALA H 1.0 . 5.50 970 619 A 39 VAL HA A 39 VAL HGx% 1.0 . 3.55 971 619 A 39 VAL HGy% A 39 VAL HA 1.0 . 3.55 972 620 A 40 ALA H A 39 VAL HA 1.0 . 3.35 973 621 A 39 VAL HA A 50 CYS HA 1.0 . 3.97 974 622 A 51 ILE H A 39 VAL HA 1.0 . 4.19 975 623 A 51 ILE HG1y A 39 VAL HA 1.0 . 5.50 976 624 A 39 VAL HA A 51 ILE HG1x 1.0 . 5.50 977 625 A 51 ILE HD1% A 39 VAL HA 1.0 . 5.43 978 626 A 51 ILE HG2% A 39 VAL HA 1.0 . 5.50 979 627 A 39 VAL HB A 40 ALA H 1.0 . 4.29 980 628 A 39 VAL HB A 50 CYS HA 1.0 . 5.50 981 629 A 40 ALA H A 39 VAL HGx% 1.0 . 3.81 982 629 A 39 VAL HGy% A 40 ALA H 1.0 . 3.81 983 630 A 48 GLN HE2y A 39 VAL HGx% 1.0 . 4.43 984 630 A 39 VAL HGy% A 48 GLN HE2y 1.0 . 4.43 985 631 A 48 GLN HE2x A 39 VAL HGx% 1.0 . 4.43 986 631 A 39 VAL HGy% A 48 GLN HE2x 1.0 . 4.43 987 632 A 48 GLN HGy A 39 VAL HGx% 1.0 . 3.77 988 632 A 39 VAL HGy% A 48 GLN HGy 1.0 . 3.77 989 633 A 39 VAL HGx% A 48 GLN HGx 1.0 . 3.77 990 633 A 39 VAL HGy% A 48 GLN HGx 1.0 . 3.77 991 634 A 48 GLN HE2x A 39 VAL HGx% 1.0 . 3.81 992 634 A 39 VAL HGy% A 48 GLN HE2y 1.0 . 3.81 993 634 A 48 GLN HE2y A 39 VAL HGx% 1.0 . 3.81 994 634 A 39 VAL HGy% A 48 GLN HE2x 1.0 . 3.81 995 635 A 39 VAL HGx% A 48 GLN HGx 1.0 . 3.30 996 635 A 39 VAL HGy% A 48 GLN HGx 1.0 . 3.30 997 635 A 48 GLN HGy A 39 VAL HGx% 1.0 . 3.30 998 635 A 39 VAL HGy% A 48 GLN HGy 1.0 . 3.30 999 636 A 49 VAL HA A 39 VAL HGx% 1.0 . 4.34 1000 636 A 39 VAL HGy% A 49 VAL HA 1.0 . 4.34 1001 637 A 50 CYS HA A 39 VAL HGx% 1.0 . 4.25 1002 637 A 39 VAL HGy% A 50 CYS HA 1.0 . 4.25 1003 638 A 50 CYS HBy A 39 VAL HGx% 1.0 . 5.06 1004 638 A 50 CYS HBy A 39 VAL HGy% 1.0 . 5.06 1005 639 A 39 VAL HGx% A 50 CYS HBx 1.0 . 5.06 1006 639 A 39 VAL HGy% A 50 CYS HBx 1.0 . 5.06 1007 640 A 51 ILE H A 39 VAL HGx% 1.0 . 4.37 1008 640 A 51 ILE H A 39 VAL HGy% 1.0 . 4.37 1009 641 A 40 ALA HB% A 40 ALA H 1.0 . 3.30 1010 642 A 40 ALA H A 48 GLN HGy 1.0 . 5.50 1011 643 A 40 ALA H A 48 GLN HGx 1.0 . 5.50 1012 644 A 40 ALA H A 48 GLN HGx 1.0 . 4.84 1013 644 A 40 ALA H A 48 GLN HGy 1.0 . 4.84 1014 645 A 40 ALA H A 49 VAL H 1.0 . 3.93 1015 646 A 40 ALA H A 49 VAL HGy% 1.0 . 4.23 1016 646 A 49 VAL HGx% A 40 ALA H 1.0 . 4.23 1017 647 A 40 ALA H A 50 CYS HA 1.0 . 4.80 1018 648 A 51 ILE H A 40 ALA H 1.0 . 4.96 1019 649 A 51 ILE HG1y A 40 ALA H 1.0 . 5.50 1020 650 A 40 ALA H A 51 ILE HG1x 1.0 . 5.50 1021 651 A 51 ILE HD1% A 40 ALA H 1.0 . 4.74 1022 652 A 51 ILE HG2% A 40 ALA H 1.0 . 5.50 1023 653 A 40 ALA HA A 41 ARG H 1.0 . 3.19 1024 654 A 40 ALA HB% A 41 ARG H 1.0 . 3.51 1025 655 A 40 ALA HB% A 49 VAL H 1.0 . 3.99 1026 656 A 40 ALA HB% A 49 VAL HB 1.0 . 4.67 1027 657 A 41 ARG H A 41 ARG HBy 1.0 . 3.60 1028 658 A 41 ARG H A 41 ARG HBx 1.0 . 3.60 1029 659 A 41 ARG H A 41 ARG HGy 1.0 . 4.73 1030 660 A 41 ARG H A 41 ARG HGx 1.0 . 4.73 1031 661 A 41 ARG H A 41 ARG HDx 1.0 . 4.38 1032 661 A 41 ARG H A 41 ARG HDy 1.0 . 4.38 1033 662 A 41 ARG H A 41 ARG HGx 1.0 . 4.10 1034 662 A 41 ARG H A 41 ARG HGy 1.0 . 4.10 1035 663 A 42 LEU H A 41 ARG H 1.0 . 4.70 1036 664 A 41 ARG HA A 41 ARG HGy 1.0 . 4.12 1037 665 A 41 ARG HA A 41 ARG HGx 1.0 . 4.12 1038 666 A 41 ARG HA A 41 ARG HDx 1.0 . 3.73 1039 666 A 41 ARG HA A 41 ARG HDy 1.0 . 3.73 1040 667 A 41 ARG HA A 41 ARG HGx 1.0 . 3.35 1041 667 A 41 ARG HA A 41 ARG HGy 1.0 . 3.35 1042 668 A 42 LEU H A 41 ARG HA 1.0 . 3.04 1043 669 A 41 ARG HA A 48 GLN HA 1.0 . 3.05 1044 670 A 41 ARG HA A 48 GLN HGy 1.0 . 4.85 1045 671 A 41 ARG HA A 48 GLN HGx 1.0 . 4.85 1046 672 A 41 ARG HA A 49 VAL H 1.0 . 3.96 1047 673 A 41 ARG HDy A 41 ARG HBy 1.0 . 4.12 1048 673 A 41 ARG HBy A 41 ARG HDx 1.0 . 4.12 1049 674 A 48 GLN HA A 41 ARG HBy 1.0 . 5.17 1050 675 A 41 ARG HDy A 41 ARG HBx 1.0 . 4.12 1051 675 A 41 ARG HBx A 41 ARG HDx 1.0 . 4.12 1052 676 A 41 ARG HBx A 48 GLN HA 1.0 . 5.17 1053 677 A 42 LEU H A 41 ARG HGy 1.0 . 4.69 1054 678 A 41 ARG HGy A 48 GLN HA 1.0 . 4.50 1055 679 A 42 LEU H A 41 ARG HGx 1.0 . 4.69 1056 680 A 48 GLN HA A 41 ARG HGx 1.0 . 4.50 1057 681 A 41 ARG HBy A 41 ARG HDx 1.0 . 3.57 1058 681 A 41 ARG HBx A 41 ARG HDx 1.0 . 3.57 1059 681 A 41 ARG HDy A 41 ARG HBy 1.0 . 3.57 1060 681 A 41 ARG HDy A 41 ARG HBx 1.0 . 3.57 1061 682 A 48 GLN HA A 41 ARG HBy 1.0 . 4.40 1062 682 A 41 ARG HBx A 48 GLN HA 1.0 . 4.40 1063 683 A 42 LEU H A 41 ARG HDx 1.0 . 4.33 1064 683 A 42 LEU H A 41 ARG HDy 1.0 . 4.33 1065 684 A 48 GLN H A 41 ARG HDx 1.0 . 5.23 1066 684 A 41 ARG HDy A 48 GLN H 1.0 . 5.23 1067 685 A 48 GLN HA A 41 ARG HDx 1.0 . 4.25 1068 685 A 41 ARG HDy A 48 GLN HA 1.0 . 4.25 1069 686 A 41 ARG HDy A 48 GLN HBy 1.0 . 4.70 1070 686 A 41 ARG HDx A 48 GLN HBy 1.0 . 4.70 1071 687 A 41 ARG HDy A 48 GLN HBx 1.0 . 4.70 1072 687 A 48 GLN HBx A 41 ARG HDx 1.0 . 4.70 1073 688 A 41 ARG HDy A 48 GLN HGy 1.0 . 4.61 1074 688 A 48 GLN HGy A 41 ARG HDx 1.0 . 4.61 1075 689 A 41 ARG HDx A 48 GLN HGx 1.0 . 4.61 1076 689 A 41 ARG HDy A 48 GLN HGx 1.0 . 4.61 1077 690 A 41 ARG HDx A 48 GLN HBy 1.0 . 4.00 1078 690 A 41 ARG HDy A 48 GLN HBy 1.0 . 4.00 1079 690 A 48 GLN HBx A 41 ARG HDx 1.0 . 4.00 1080 690 A 41 ARG HDy A 48 GLN HBx 1.0 . 4.00 1081 691 A 41 ARG HDy A 48 GLN HE2y 1.0 . 4.85 1082 691 A 48 GLN HE2y A 41 ARG HDx 1.0 . 4.85 1083 691 A 41 ARG HDy A 48 GLN HE2x 1.0 . 4.85 1084 691 A 48 GLN HE2x A 41 ARG HDx 1.0 . 4.85 1085 692 A 41 ARG HDx A 48 GLN HGx 1.0 . 3.95 1086 692 A 41 ARG HDy A 48 GLN HGx 1.0 . 3.95 1087 692 A 48 GLN HGy A 41 ARG HDx 1.0 . 3.95 1088 692 A 41 ARG HDy A 48 GLN HGy 1.0 . 3.95 1089 693 A 42 LEU H A 41 ARG HGx 1.0 . 3.99 1090 693 A 42 LEU H A 41 ARG HGy 1.0 . 3.99 1091 694 A 42 LEU H A 42 LEU HG 1.0 . 3.36 1092 695 A 42 LEU H A 42 LEU HBx 1.0 . 3.36 1093 695 A 42 LEU H A 42 LEU HBy 1.0 . 3.36 1094 696 A 42 LEU HDx% A 42 LEU H 1.0 . 4.20 1095 697 A 42 LEU H A 42 LEU HDy% 1.0 . 4.20 1096 698 A 42 LEU H A 42 LEU HDy% 1.0 . 3.59 1097 698 A 42 LEU HDx% A 42 LEU H 1.0 . 3.59 1098 699 A 43 LYS H A 42 LEU H 1.0 . 4.82 1099 700 A 42 LEU H A 47 ARG H 1.0 . 4.15 1100 701 A 42 LEU H A 47 ARG HBy 1.0 . 5.50 1101 702 A 42 LEU H A 47 ARG HBx 1.0 . 5.50 1102 703 A 42 LEU H A 47 ARG HGx 1.0 . 3.89 1103 703 A 42 LEU H A 47 ARG HGy 1.0 . 3.89 1104 704 A 42 LEU H A 48 GLN HA 1.0 . 4.07 1105 705 A 42 LEU HDx% A 42 LEU HA 1.0 . 4.78 1106 706 A 42 LEU HA A 42 LEU HDy% 1.0 . 4.78 1107 707 A 42 LEU HA A 42 LEU HDy% 1.0 . 3.25 1108 707 A 42 LEU HDx% A 42 LEU HA 1.0 . 3.25 1109 708 A 43 LYS H A 42 LEU HA 1.0 . 3.40 1110 709 A 42 LEU HDx% A 42 LEU HBy 1.0 . 3.85 1111 710 A 42 LEU HBy A 42 LEU HDy% 1.0 . 3.85 1112 711 A 43 LYS H A 42 LEU HBy 1.0 . 4.29 1113 712 A 42 LEU HBy A 45 ASN HD2y 1.0 . 5.50 1114 713 A 42 LEU HBy A 45 ASN HD2x 1.0 . 5.50 1115 714 A 42 LEU HDx% A 42 LEU HBx 1.0 . 3.85 1116 715 A 42 LEU HBx A 42 LEU HDy% 1.0 . 3.85 1117 716 A 43 LYS H A 42 LEU HBx 1.0 . 4.29 1118 717 A 45 ASN HD2y A 42 LEU HBx 1.0 . 5.50 1119 718 A 45 ASN HD2x A 42 LEU HBx 1.0 . 5.50 1120 719 A 43 LYS H A 42 LEU HG 1.0 . 5.21 1121 720 A 42 LEU HBx A 42 LEU HDy% 1.0 . 2.66 1122 720 A 42 LEU HBy A 42 LEU HDy% 1.0 . 2.66 1123 720 A 42 LEU HDx% A 42 LEU HBx 1.0 . 2.66 1124 720 A 42 LEU HDx% A 42 LEU HBy 1.0 . 2.66 1125 721 A 45 ASN HD2x A 42 LEU HBx 1.0 . 3.96 1126 721 A 42 LEU HBy A 45 ASN HD2y 1.0 . 3.96 1127 721 A 45 ASN HD2y A 42 LEU HBx 1.0 . 3.96 1128 721 A 42 LEU HBy A 45 ASN HD2x 1.0 . 3.96 1129 722 A 47 ARG H A 42 LEU HBx 1.0 . 3.60 1130 722 A 42 LEU HBy A 47 ARG H 1.0 . 3.60 1131 723 A 42 LEU HBy A 47 ARG HBy 1.0 . 4.21 1132 723 A 42 LEU HBx A 47 ARG HBy 1.0 . 4.21 1133 723 A 47 ARG HBx A 42 LEU HBx 1.0 . 4.21 1134 723 A 42 LEU HBy A 47 ARG HBx 1.0 . 4.21 1135 724 A 43 LYS H A 42 LEU HDx% 1.0 . 4.73 1136 725 A 42 LEU HDx% A 47 ARG H 1.0 . 4.94 1137 726 A 43 LYS H A 42 LEU HDy% 1.0 . 4.73 1138 727 A 47 ARG H A 42 LEU HDy% 1.0 . 4.94 1139 728 A 43 LYS H A 42 LEU HDy% 1.0 . 3.70 1140 728 A 43 LYS H A 42 LEU HDx% 1.0 . 3.70 1141 729 A 45 ASN HD2x A 42 LEU HDy% 1.0 . 3.83 1142 729 A 42 LEU HDx% A 45 ASN HD2x 1.0 . 3.83 1143 729 A 45 ASN HD2y A 42 LEU HDy% 1.0 . 3.83 1144 729 A 42 LEU HDx% A 45 ASN HD2y 1.0 . 3.83 1145 730 A 47 ARG H A 42 LEU HDy% 1.0 . 4.03 1146 730 A 42 LEU HDx% A 47 ARG H 1.0 . 4.03 1147 731 A 43 LYS H A 43 LYS HBy 1.0 . 3.74 1148 732 A 43 LYS HBx A 43 LYS H 1.0 . 3.74 1149 733 A 43 LYS H A 43 LYS HGy 1.0 . 4.12 1150 734 A 43 LYS H A 43 LYS HGx 1.0 . 4.12 1151 735 A 43 LYS H A 43 LYS HDx 1.0 . 4.76 1152 735 A 43 LYS HDy A 43 LYS H 1.0 . 4.76 1153 736 A 43 LYS H A 43 LYS HEy 1.0 . 5.23 1154 736 A 43 LYS H A 43 LYS HEx 1.0 . 5.23 1155 737 A 43 LYS H A 43 LYS HGy 1.0 . 3.37 1156 737 A 43 LYS H A 43 LYS HGx 1.0 . 3.37 1157 738 A 43 LYS HA A 43 LYS HGy 1.0 . 3.61 1158 739 A 43 LYS HGx A 43 LYS HA 1.0 . 3.61 1159 740 A 43 LYS HA A 43 LYS HEy 1.0 . 3.97 1160 740 A 43 LYS HEx A 43 LYS HA 1.0 . 3.97 1161 741 A 43 LYS HA A 43 LYS HGy 1.0 . 3.13 1162 741 A 43 LYS HGx A 43 LYS HA 1.0 . 3.13 1163 742 A 43 LYS HBy A 43 LYS HEy 1.0 . 3.41 1164 742 A 43 LYS HBx A 43 LYS HEy 1.0 . 3.41 1165 742 A 43 LYS HEx A 43 LYS HBy 1.0 . 3.41 1166 742 A 43 LYS HBx A 43 LYS HEx 1.0 . 3.41 1167 743 A 43 LYS HEy A 43 LYS HGy 1.0 . 2.83 1168 743 A 43 LYS HEx A 43 LYS HGy 1.0 . 2.83 1169 743 A 43 LYS HGx A 43 LYS HEy 1.0 . 2.83 1170 743 A 43 LYS HGx A 43 LYS HEx 1.0 . 2.83 1171 744 A 45 ASN HD2y A 47 ARG HGx 1.0 . 5.31 1172 744 A 47 ARG HGy A 45 ASN HD2y 1.0 . 5.31 1173 745 A 45 ASN HD2x A 47 ARG HGx 1.0 . 5.31 1174 745 A 47 ARG HGy A 45 ASN HD2x 1.0 . 5.31 1175 746 A 45 ASN HD2y A 45 ASN HBx 1.0 . 3.21 1176 746 A 45 ASN HD2x A 45 ASN HBy 1.0 . 3.21 1177 746 A 45 ASN HD2y A 45 ASN HBy 1.0 . 3.21 1178 746 A 45 ASN HD2x A 45 ASN HBx 1.0 . 3.21 1179 747 A 47 ARG H A 45 ASN HD2y 1.0 . 4.62 1180 747 A 47 ARG H A 45 ASN HD2x 1.0 . 4.62 1181 748 A 45 ASN HD2y A 47 ARG HBx 1.0 . 4.76 1182 748 A 45 ASN HD2y A 47 ARG HBy 1.0 . 4.76 1183 748 A 45 ASN HD2x A 47 ARG HBx 1.0 . 4.76 1184 748 A 45 ASN HD2x A 47 ARG HBy 1.0 . 4.76 1185 749 A 45 ASN HD2y A 47 ARG HDy 1.0 . 4.40 1186 749 A 45 ASN HD2y A 47 ARG HDx 1.0 . 4.40 1187 749 A 45 ASN HD2x A 47 ARG HDy 1.0 . 4.40 1188 749 A 45 ASN HD2x A 47 ARG HDx 1.0 . 4.40 1189 750 A 47 ARG H A 46 ASN HBy 1.0 . 4.52 1190 751 A 47 ARG H A 46 ASN HBx 1.0 . 4.52 1191 752 A 46 ASN HBy A 46 ASN HD2x 1.0 . 3.22 1192 752 A 46 ASN HBx A 46 ASN HD2x 1.0 . 3.22 1193 752 A 46 ASN HD2y A 46 ASN HBx 1.0 . 3.22 1194 752 A 46 ASN HBy A 46 ASN HD2y 1.0 . 3.22 1195 753 A 47 ARG H A 46 ASN HBx 1.0 . 3.88 1196 753 A 47 ARG H A 46 ASN HBy 1.0 . 3.88 1197 754 A 47 ARG H A 47 ARG HBy 1.0 . 3.67 1198 755 A 47 ARG H A 47 ARG HBx 1.0 . 3.67 1199 756 A 47 ARG H A 47 ARG HBy 1.0 . 2.86 1200 756 A 47 ARG H A 47 ARG HBx 1.0 . 2.86 1201 757 A 47 ARG H A 47 ARG HDx 1.0 . 4.54 1202 757 A 47 ARG H A 47 ARG HDy 1.0 . 4.54 1203 758 A 47 ARG H A 47 ARG HGx 1.0 . 3.34 1204 758 A 47 ARG H A 47 ARG HGy 1.0 . 3.34 1205 759 A 48 GLN H A 47 ARG H 1.0 . 5.24 1206 760 A 47 ARG HDy A 47 ARG HA 1.0 . 5.08 1207 761 A 47 ARG HA A 47 ARG HDx 1.0 . 5.08 1208 762 A 47 ARG HA A 47 ARG HDx 1.0 . 4.33 1209 762 A 47 ARG HDy A 47 ARG HA 1.0 . 4.33 1210 763 A 47 ARG HA A 47 ARG HGx 1.0 . 3.17 1211 763 A 47 ARG HGy A 47 ARG HA 1.0 . 3.17 1212 764 A 48 GLN H A 47 ARG HA 1.0 . 2.90 1213 765 A 47 ARG HGy A 47 ARG HBy 1.0 . 2.84 1214 765 A 47 ARG HBy A 47 ARG HGx 1.0 . 2.84 1215 766 A 47 ARG HGy A 47 ARG HBx 1.0 . 2.84 1216 766 A 47 ARG HBx A 47 ARG HGx 1.0 . 2.84 1217 767 A 47 ARG HBx A 47 ARG HDx 1.0 . 2.94 1218 767 A 47 ARG HDy A 47 ARG HBy 1.0 . 2.94 1219 767 A 47 ARG HBx A 47 ARG HDy 1.0 . 2.94 1220 767 A 47 ARG HBy A 47 ARG HDx 1.0 . 2.94 1221 768 A 48 GLN H A 47 ARG HBy 1.0 . 4.39 1222 768 A 48 GLN H A 47 ARG HBx 1.0 . 4.39 1223 769 A 48 GLN H A 47 ARG HDx 1.0 . 5.34 1224 769 A 48 GLN H A 47 ARG HDy 1.0 . 5.34 1225 770 A 48 GLN H A 47 ARG HGx 1.0 . 3.89 1226 770 A 48 GLN H A 47 ARG HGy 1.0 . 3.89 1227 771 A 48 GLN H A 48 GLN HBy 1.0 . 3.59 1228 772 A 48 GLN H A 48 GLN HBx 1.0 . 3.59 1229 773 A 48 GLN HGy A 48 GLN H 1.0 . 4.30 1230 774 A 48 GLN H A 48 GLN HGx 1.0 . 4.30 1231 775 A 48 GLN H A 48 GLN HGx 1.0 . 3.76 1232 775 A 48 GLN HGy A 48 GLN H 1.0 . 3.76 1233 776 A 49 VAL H A 48 GLN H 1.0 . 4.89 1234 777 A 48 GLN HGy A 48 GLN HA 1.0 . 4.07 1235 778 A 48 GLN HA A 48 GLN HGx 1.0 . 4.07 1236 779 A 48 GLN HA A 48 GLN HGx 1.0 . 3.57 1237 779 A 48 GLN HGy A 48 GLN HA 1.0 . 3.57 1238 780 A 49 VAL H A 48 GLN HA 1.0 . 3.04 1239 781 A 48 GLN HE2y A 48 GLN HBy 1.0 . 5.32 1240 782 A 48 GLN HE2x A 48 GLN HBy 1.0 . 5.32 1241 783 A 49 VAL H A 48 GLN HBy 1.0 . 4.24 1242 784 A 48 GLN HE2y A 48 GLN HBx 1.0 . 5.32 1243 785 A 48 GLN HE2x A 48 GLN HBx 1.0 . 5.32 1244 786 A 49 VAL H A 48 GLN HBx 1.0 . 4.24 1245 787 A 48 GLN HGy A 49 VAL H 1.0 . 4.35 1246 788 A 49 VAL H A 48 GLN HGx 1.0 . 4.35 1247 789 A 48 GLN HE2x A 48 GLN HBx 1.0 . 3.90 1248 789 A 48 GLN HE2y A 48 GLN HBy 1.0 . 3.90 1249 789 A 48 GLN HE2y A 48 GLN HBx 1.0 . 3.90 1250 789 A 48 GLN HE2x A 48 GLN HBy 1.0 . 3.90 1251 790 A 48 GLN HBx A 48 GLN HGx 1.0 . 2.30 1252 790 A 48 GLN HBy A 48 GLN HGx 1.0 . 2.30 1253 790 A 48 GLN HGy A 48 GLN HBy 1.0 . 2.30 1254 790 A 48 GLN HGy A 48 GLN HBx 1.0 . 2.30 1255 791 A 48 GLN HE2y A 48 GLN HGy 1.0 . 3.22 1256 791 A 48 GLN HE2y A 48 GLN HGx 1.0 . 3.22 1257 791 A 48 GLN HE2x A 48 GLN HGy 1.0 . 3.22 1258 791 A 48 GLN HE2x A 48 GLN HGx 1.0 . 3.22 1259 792 A 49 VAL H A 49 VAL HB 1.0 . 4.02 1260 793 A 49 VAL H A 49 VAL HGy% 1.0 . 3.40 1261 793 A 49 VAL HGx% A 49 VAL H 1.0 . 3.40 1262 794 A 49 VAL HB A 50 CYS H 1.0 . 3.63 1263 795 A 49 VAL HGx% A 50 CYS H 1.0 . 4.19 1264 796 A 50 CYS H A 49 VAL HGy% 1.0 . 4.19 1265 797 A 50 CYS H A 49 VAL HGy% 1.0 . 3.59 1266 797 A 49 VAL HGx% A 50 CYS H 1.0 . 3.59 1267 798 A 50 CYS H A 50 CYS HBx 1.0 . 3.54 1268 798 A 50 CYS HBy A 50 CYS H 1.0 . 3.54 1269 799 A 51 ILE H A 50 CYS HA 1.0 . 3.26 1270 800 A 50 CYS HBy A 51 ILE H 1.0 . 4.73 1271 801 A 51 ILE H A 50 CYS HBx 1.0 . 4.73 1272 802 A 51 ILE H A 50 CYS HBx 1.0 . 3.87 1273 802 A 50 CYS HBy A 51 ILE H 1.0 . 3.87 1274 803 A 51 ILE H A 51 ILE HB 1.0 . 3.66 1275 804 A 51 ILE H A 51 ILE HG1y 1.0 . 3.91 1276 805 A 51 ILE H A 51 ILE HG1x 1.0 . 3.91 1277 806 A 51 ILE H A 51 ILE HD1% 1.0 . 4.10 1278 807 A 51 ILE H A 51 ILE HG2% 1.0 . 3.74 1279 808 A 52 ASP H A 51 ILE H 1.0 . 5.14 1280 809 A 51 ILE HD1% A 51 ILE HA 1.0 . 3.93 1281 810 A 51 ILE HG2% A 51 ILE HA 1.0 . 3.52 1282 811 A 52 ASP H A 51 ILE HA 1.0 . 3.17 1283 812 A 51 ILE HD1% A 51 ILE HB 1.0 . 3.09 1284 813 A 52 ASP H A 51 ILE HB 1.0 . 4.54 1285 814 A 51 ILE HB A 58 ILE HD1% 1.0 . 4.60 1286 815 A 51 ILE HB A 58 ILE HG1x 1.0 . 5.34 1287 815 A 51 ILE HB A 58 ILE HG1y 1.0 . 5.34 1288 816 A 52 ASP H A 51 ILE HG1y 1.0 . 5.50 1289 817 A 51 ILE HG1y A 58 ILE HD1% 1.0 . 4.99 1290 818 A 52 ASP H A 51 ILE HG1x 1.0 . 5.50 1291 819 A 58 ILE HD1% A 51 ILE HG1x 1.0 . 4.99 1292 820 A 52 ASP H A 51 ILE HD1% 1.0 . 5.06 1293 821 A 51 ILE HD1% A 57 TRP HE1 1.0 . 5.50 1294 822 A 51 ILE HD1% A 57 TRP HH2 1.0 . 3.57 1295 823 A 51 ILE HD1% A 57 TRP HZ2 1.0 . 3.39 1296 824 A 51 ILE HD1% A 58 ILE HD1% 1.0 . 3.70 1297 825 A 52 ASP H A 51 ILE HG1x 1.0 . 4.63 1298 825 A 52 ASP H A 51 ILE HG1y 1.0 . 4.63 1299 826 A 57 TRP HE1 A 51 ILE HG1x 1.0 . 5.20 1300 826 A 57 TRP HE1 A 51 ILE HG1y 1.0 . 5.20 1301 827 A 57 TRP HH2 A 51 ILE HG1x 1.0 . 5.34 1302 827 A 51 ILE HG1y A 57 TRP HH2 1.0 . 5.34 1303 828 A 57 TRP HZ2 A 51 ILE HG1x 1.0 . 4.54 1304 828 A 51 ILE HG1y A 57 TRP HZ2 1.0 . 4.54 1305 829 A 58 ILE HD1% A 51 ILE HG1x 1.0 . 4.36 1306 829 A 51 ILE HG1y A 58 ILE HD1% 1.0 . 4.36 1307 830 A 51 ILE HG1y A 58 ILE HG1x 1.0 . 5.18 1308 830 A 51 ILE HG1x A 58 ILE HG1x 1.0 . 5.18 1309 830 A 58 ILE HG1y A 51 ILE HG1x 1.0 . 5.18 1310 830 A 51 ILE HG1y A 58 ILE HG1y 1.0 . 5.18 1311 831 A 51 ILE HG1y A 51 ILE HG2% 1.0 . 3.29 1312 832 A 51 ILE HG2% A 51 ILE HG1x 1.0 . 3.29 1313 833 A 52 ASP H A 51 ILE HG2% 1.0 . 3.72 1314 834 A 51 ILE HG2% A 55 LEU H 1.0 . 4.75 1315 835 A 51 ILE HG2% A 55 LEU HBx 1.0 . 4.42 1316 835 A 51 ILE HG2% A 55 LEU HBy 1.0 . 4.42 1317 836 A 51 ILE HG2% A 55 LEU HDy% 1.0 . 3.26 1318 836 A 55 LEU HDx% A 51 ILE HG2% 1.0 . 3.26 1319 837 A 57 TRP HE1 A 51 ILE HG2% 1.0 . 5.42 1320 838 A 51 ILE HG2% A 57 TRP HH2 1.0 . 5.15 1321 839 A 51 ILE HG2% A 57 TRP HZ2 1.0 . 4.51 1322 840 A 51 ILE HG2% A 58 ILE HD1% 1.0 . 3.48 1323 841 A 51 ILE HG2% A 58 ILE HG1x 1.0 . 3.86 1324 841 A 51 ILE HG2% A 58 ILE HG1y 1.0 . 3.86 1325 842 A 52 ASP H A 52 ASP HBy 1.0 . 3.60 1326 843 A 52 ASP H A 52 ASP HBx 1.0 . 3.60 1327 844 A 52 ASP H A 52 ASP HBx 1.0 . 3.14 1328 844 A 52 ASP H A 52 ASP HBy 1.0 . 3.14 1329 845 A 52 ASP H A 55 LEU HG 1.0 . 4.54 1330 846 A 52 ASP H A 55 LEU HDy% 1.0 . 4.11 1331 846 A 52 ASP H A 55 LEU HDx% 1.0 . 4.11 1332 847 A 52 ASP HA A 54 LYS H 1.0 . 5.01 1333 848 A 52 ASP HBy A 54 LYS H 1.0 . 5.34 1334 849 A 52 ASP HBy A 55 LEU H 1.0 . 5.12 1335 850 A 52 ASP HBy A 55 LEU HG 1.0 . 4.24 1336 851 A 54 LYS H A 52 ASP HBx 1.0 . 5.34 1337 852 A 55 LEU H A 52 ASP HBx 1.0 . 5.12 1338 853 A 55 LEU HG A 52 ASP HBx 1.0 . 4.24 1339 854 A 54 LYS H A 52 ASP HBx 1.0 . 4.70 1340 854 A 52 ASP HBy A 54 LYS H 1.0 . 4.70 1341 855 A 55 LEU H A 52 ASP HBx 1.0 . 4.32 1342 855 A 52 ASP HBy A 55 LEU H 1.0 . 4.32 1343 856 A 55 LEU HG A 52 ASP HBx 1.0 . 3.66 1344 856 A 52 ASP HBy A 55 LEU HG 1.0 . 3.66 1345 857 A 52 ASP HBy A 55 LEU HBx 1.0 . 4.76 1346 857 A 52 ASP HBx A 55 LEU HBx 1.0 . 4.76 1347 857 A 55 LEU HBy A 52 ASP HBx 1.0 . 4.76 1348 857 A 52 ASP HBy A 55 LEU HBy 1.0 . 4.76 1349 858 A 52 ASP HBx A 55 LEU HDy% 1.0 . 3.46 1350 858 A 52 ASP HBy A 55 LEU HDy% 1.0 . 3.46 1351 858 A 55 LEU HDx% A 52 ASP HBx 1.0 . 3.46 1352 858 A 52 ASP HBy A 55 LEU HDx% 1.0 . 3.46 1353 859 A 53 PRO HA A 55 LEU H 1.0 . 4.78 1354 860 A 53 PRO HA A 58 ILE HB 1.0 . 4.43 1355 861 A 53 PRO HA A 58 ILE HG1y 1.0 . 5.31 1356 862 A 53 PRO HA A 58 ILE HG1x 1.0 . 5.31 1357 863 A 58 ILE HD1% A 53 PRO HA 1.0 . 4.24 1358 864 A 53 PRO HA A 58 ILE HG2% 1.0 . 3.31 1359 865 A 53 PRO HDy A 54 LYS H 1.0 . 4.26 1360 866 A 54 LYS H A 53 PRO HDx 1.0 . 4.26 1361 867 A 54 LYS H A 53 PRO HGy 1.0 . 4.42 1362 868 A 54 LYS H A 53 PRO HGx 1.0 . 4.42 1363 869 A 54 LYS H A 53 PRO HDx 1.0 . 3.72 1364 869 A 53 PRO HDy A 54 LYS H 1.0 . 3.72 1365 870 A 54 LYS H A 54 LYS HBx 1.0 . 3.28 1366 870 A 54 LYS H A 54 LYS HBy 1.0 . 3.28 1367 871 A 54 LYS H A 54 LYS HDx 1.0 . 4.96 1368 871 A 54 LYS H A 54 LYS HDy 1.0 . 4.96 1369 872 A 54 LYS H A 54 LYS HEx 1.0 . 5.50 1370 872 A 54 LYS H A 54 LYS HEy 1.0 . 5.50 1371 873 A 54 LYS H A 54 LYS HGx 1.0 . 3.56 1372 873 A 54 LYS H A 54 LYS HGy 1.0 . 3.56 1373 874 A 55 LEU H A 54 LYS H 1.0 . 3.37 1374 875 A 54 LYS HA A 54 LYS HDx 1.0 . 3.96 1375 875 A 54 LYS HDy A 54 LYS HA 1.0 . 3.96 1376 876 A 54 LYS HA A 54 LYS HEx 1.0 . 5.29 1377 876 A 54 LYS HEy A 54 LYS HA 1.0 . 5.29 1378 877 A 54 LYS HA A 54 LYS HGx 1.0 . 3.34 1379 877 A 54 LYS HGy A 54 LYS HA 1.0 . 3.34 1380 878 A 54 LYS HA A 59 GLN HE2y 1.0 . 5.02 1381 879 A 54 LYS HA A 59 GLN HE2x 1.0 . 5.02 1382 880 A 54 LYS HA A 59 GLN HE2y 1.0 . 4.18 1383 880 A 54 LYS HA A 59 GLN HE2x 1.0 . 4.18 1384 881 A 54 LYS HBx A 54 LYS HDx 1.0 . 2.40 1385 881 A 54 LYS HBy A 54 LYS HDx 1.0 . 2.40 1386 881 A 54 LYS HDy A 54 LYS HBx 1.0 . 2.40 1387 881 A 54 LYS HBy A 54 LYS HDy 1.0 . 2.40 1388 882 A 54 LYS HBy A 54 LYS HEx 1.0 . 2.90 1389 882 A 54 LYS HBx A 54 LYS HEx 1.0 . 2.90 1390 882 A 54 LYS HEy A 54 LYS HBx 1.0 . 2.90 1391 882 A 54 LYS HBy A 54 LYS HEy 1.0 . 2.90 1392 883 A 54 LYS HBy A 54 LYS HGx 1.0 . 2.74 1393 883 A 54 LYS HBx A 54 LYS HGx 1.0 . 2.74 1394 883 A 54 LYS HGy A 54 LYS HBx 1.0 . 2.74 1395 883 A 54 LYS HBy A 54 LYS HGy 1.0 . 2.74 1396 884 A 55 LEU H A 54 LYS HBx 1.0 . 5.04 1397 884 A 55 LEU H A 54 LYS HBy 1.0 . 5.04 1398 885 A 54 LYS HDx A 54 LYS HEx 1.0 . 2.87 1399 885 A 54 LYS HDy A 54 LYS HEx 1.0 . 2.87 1400 885 A 54 LYS HEy A 54 LYS HDx 1.0 . 2.87 1401 885 A 54 LYS HDy A 54 LYS HEy 1.0 . 2.87 1402 886 A 54 LYS HDy A 54 LYS HGx 1.0 . 2.82 1403 886 A 54 LYS HDx A 54 LYS HGx 1.0 . 2.82 1404 886 A 54 LYS HGy A 54 LYS HDx 1.0 . 2.82 1405 886 A 54 LYS HDy A 54 LYS HGy 1.0 . 2.82 1406 887 A 54 LYS HEx A 54 LYS HGx 1.0 . 3.54 1407 887 A 54 LYS HGy A 54 LYS HEx 1.0 . 3.54 1408 887 A 54 LYS HEy A 54 LYS HGy 1.0 . 3.54 1409 887 A 54 LYS HEy A 54 LYS HGx 1.0 . 3.54 1410 888 A 55 LEU H A 55 LEU HG 1.0 . 3.35 1411 889 A 55 LEU H A 55 LEU HBx 1.0 . 3.22 1412 889 A 55 LEU H A 55 LEU HBy 1.0 . 3.22 1413 890 A 55 LEU HDx% A 55 LEU H 1.0 . 4.11 1414 891 A 55 LEU H A 55 LEU HDy% 1.0 . 4.11 1415 892 A 55 LEU H A 55 LEU HDy% 1.0 . 3.19 1416 892 A 55 LEU HDx% A 55 LEU H 1.0 . 3.19 1417 893 A 55 LEU H A 58 ILE HB 1.0 . 5.50 1418 894 A 58 ILE HD1% A 55 LEU H 1.0 . 5.06 1419 895 A 55 LEU H A 58 ILE HG1x 1.0 . 5.34 1420 895 A 58 ILE HG1y A 55 LEU H 1.0 . 5.34 1421 896 A 55 LEU H A 58 ILE HG2% 1.0 . 4.32 1422 897 A 55 LEU HG A 55 LEU HA 1.0 . 3.88 1423 898 A 55 LEU HDx% A 55 LEU HA 1.0 . 4.49 1424 899 A 55 LEU HA A 55 LEU HDy% 1.0 . 4.49 1425 900 A 55 LEU HA A 55 LEU HDy% 1.0 . 2.97 1426 900 A 55 LEU HDx% A 55 LEU HA 1.0 . 2.97 1427 901 A 57 TRP HD1 A 55 LEU HA 1.0 . 4.70 1428 902 A 57 TRP HE1 A 55 LEU HBy 1.0 . 5.50 1429 903 A 55 LEU HBy A 58 ILE H 1.0 . 4.84 1430 904 A 55 LEU HBy A 58 ILE HG2% 1.0 . 4.35 1431 905 A 57 TRP HE1 A 55 LEU HBx 1.0 . 5.50 1432 906 A 58 ILE H A 55 LEU HBx 1.0 . 4.84 1433 907 A 58 ILE HG2% A 55 LEU HBx 1.0 . 4.35 1434 908 A 57 TRP H A 55 LEU HBx 1.0 . 4.45 1435 908 A 55 LEU HBy A 57 TRP H 1.0 . 4.45 1436 909 A 57 TRP HD1 A 55 LEU HBx 1.0 . 3.10 1437 909 A 57 TRP HD1 A 55 LEU HBy 1.0 . 3.10 1438 910 A 58 ILE H A 55 LEU HBx 1.0 . 4.07 1439 910 A 55 LEU HBy A 58 ILE H 1.0 . 4.07 1440 911 A 58 ILE HD1% A 55 LEU HBx 1.0 . 4.00 1441 911 A 58 ILE HD1% A 55 LEU HBy 1.0 . 4.00 1442 912 A 55 LEU HBx A 58 ILE HG1x 1.0 . 4.18 1443 912 A 58 ILE HG1y A 55 LEU HBx 1.0 . 4.18 1444 912 A 58 ILE HG1y A 55 LEU HBy 1.0 . 4.18 1445 912 A 55 LEU HBy A 58 ILE HG1x 1.0 . 4.18 1446 913 A 58 ILE HG2% A 55 LEU HBx 1.0 . 3.73 1447 913 A 55 LEU HBy A 58 ILE HG2% 1.0 . 3.73 1448 914 A 55 LEU HDx% A 57 TRP HD1 1.0 . 4.45 1449 915 A 55 LEU HDx% A 57 TRP HE1 1.0 . 4.07 1450 916 A 55 LEU HDx% A 57 TRP HZ2 1.0 . 5.22 1451 917 A 55 LEU HDx% A 58 ILE HG1y 1.0 . 5.96 1452 918 A 55 LEU HDx% A 58 ILE HG1x 1.0 . 5.96 1453 919 A 57 TRP HD1 A 55 LEU HDy% 1.0 . 4.45 1454 920 A 57 TRP HE1 A 55 LEU HDy% 1.0 . 4.07 1455 921 A 57 TRP HZ2 A 55 LEU HDy% 1.0 . 5.22 1456 922 A 58 ILE HG1y A 55 LEU HDy% 1.0 . 5.96 1457 923 A 55 LEU HDy% A 58 ILE HG1x 1.0 . 5.96 1458 924 A 56 LYS H A 55 LEU HDy% 1.0 . 4.90 1459 924 A 55 LEU HDx% A 56 LYS H 1.0 . 4.90 1460 925 A 57 TRP HD1 A 55 LEU HDy% 1.0 . 3.88 1461 925 A 55 LEU HDx% A 57 TRP HD1 1.0 . 3.88 1462 926 A 57 TRP HE1 A 55 LEU HDy% 1.0 . 3.43 1463 926 A 55 LEU HDx% A 57 TRP HE1 1.0 . 3.43 1464 927 A 57 TRP HZ2 A 55 LEU HDy% 1.0 . 4.07 1465 927 A 55 LEU HDx% A 57 TRP HZ2 1.0 . 4.07 1466 928 A 58 ILE HA A 55 LEU HDy% 1.0 . 5.37 1467 928 A 55 LEU HDx% A 58 ILE HA 1.0 . 5.37 1468 929 A 58 ILE HB A 55 LEU HDy% 1.0 . 4.77 1469 929 A 55 LEU HDx% A 58 ILE HB 1.0 . 4.77 1470 930 A 58 ILE HD1% A 55 LEU HDy% 1.0 . 3.95 1471 930 A 55 LEU HDx% A 58 ILE HD1% 1.0 . 3.95 1472 931 A 55 LEU HDy% A 58 ILE HG1x 1.0 . 3.65 1473 931 A 58 ILE HG1y A 55 LEU HDy% 1.0 . 3.65 1474 931 A 55 LEU HDx% A 58 ILE HG1y 1.0 . 3.65 1475 931 A 55 LEU HDx% A 58 ILE HG1x 1.0 . 3.65 1476 932 A 56 LYS HA A 56 LYS HGy 1.0 . 3.93 1477 933 A 56 LYS HA A 56 LYS HGx 1.0 . 3.93 1478 934 A 56 LYS HA A 56 LYS HDx 1.0 . 4.07 1479 934 A 56 LYS HA A 56 LYS HDy 1.0 . 4.07 1480 935 A 56 LYS HA A 56 LYS HEx 1.0 . 5.50 1481 935 A 56 LYS HA A 56 LYS HEy 1.0 . 5.50 1482 936 A 56 LYS HA A 56 LYS HGy 1.0 . 3.40 1483 936 A 56 LYS HA A 56 LYS HGx 1.0 . 3.40 1484 937 A 56 LYS HA A 59 GLN H 1.0 . 4.62 1485 938 A 56 LYS HA A 59 GLN HBx 1.0 . 3.67 1486 938 A 56 LYS HA A 59 GLN HBy 1.0 . 3.67 1487 939 A 56 LYS HA A 60 GLU H 1.0 . 5.50 1488 940 A 56 LYS HDy A 56 LYS HGy 1.0 . 2.62 1489 940 A 56 LYS HDx A 56 LYS HGy 1.0 . 2.62 1490 941 A 56 LYS HEy A 56 LYS HGy 1.0 . 3.83 1491 941 A 56 LYS HEx A 56 LYS HGy 1.0 . 3.83 1492 942 A 56 LYS HGx A 56 LYS HDx 1.0 . 2.62 1493 942 A 56 LYS HDy A 56 LYS HGx 1.0 . 2.62 1494 943 A 56 LYS HEy A 56 LYS HGx 1.0 . 3.83 1495 943 A 56 LYS HGx A 56 LYS HEx 1.0 . 3.83 1496 944 A 56 LYS HBx A 56 LYS HDx 1.0 . 2.96 1497 944 A 56 LYS HDy A 56 LYS HBx 1.0 . 2.96 1498 944 A 56 LYS HDy A 56 LYS HBy 1.0 . 2.96 1499 944 A 56 LYS HBy A 56 LYS HDx 1.0 . 2.96 1500 945 A 56 LYS HBx A 56 LYS HEx 1.0 . 4.50 1501 945 A 56 LYS HEy A 56 LYS HBx 1.0 . 4.50 1502 945 A 56 LYS HEy A 56 LYS HBy 1.0 . 4.50 1503 945 A 56 LYS HBy A 56 LYS HEx 1.0 . 4.50 1504 946 A 57 TRP H A 56 LYS HBx 1.0 . 4.21 1505 946 A 57 TRP H A 56 LYS HBy 1.0 . 4.21 1506 947 A 57 TRP H A 56 LYS HDx 1.0 . 5.50 1507 947 A 57 TRP H A 56 LYS HDy 1.0 . 5.50 1508 948 A 56 LYS HEx A 56 LYS HGy 1.0 . 3.33 1509 948 A 56 LYS HEy A 56 LYS HGy 1.0 . 3.33 1510 948 A 56 LYS HGx A 56 LYS HEx 1.0 . 3.33 1511 948 A 56 LYS HEy A 56 LYS HGx 1.0 . 3.33 1512 949 A 58 ILE H A 57 TRP H 1.0 . 4.24 1513 950 A 60 GLU H A 57 TRP HA 1.0 . 4.53 1514 951 A 57 TRP HA A 60 GLU HBy 1.0 . 4.66 1515 952 A 57 TRP HA A 60 GLU HBx 1.0 . 4.66 1516 953 A 57 TRP HA A 60 GLU HGy 1.0 . 5.50 1517 954 A 57 TRP HA A 60 GLU HGx 1.0 . 5.50 1518 955 A 57 TRP HA A 60 GLU HBy 1.0 . 4.06 1519 955 A 57 TRP HA A 60 GLU HBx 1.0 . 4.06 1520 956 A 57 TRP HA A 60 GLU HGy 1.0 . 4.69 1521 956 A 57 TRP HA A 60 GLU HGx 1.0 . 4.69 1522 957 A 58 ILE H A 57 TRP HBy 1.0 . 5.50 1523 958 A 57 TRP HBx A 58 ILE H 1.0 . 5.50 1524 959 A 57 TRP HZ3 A 58 ILE HA 1.0 . 4.23 1525 960 A 57 TRP HZ3 A 58 ILE HD1% 1.0 . 4.96 1526 961 A 57 TRP HBx A 60 GLU HBy 1.0 . 5.18 1527 961 A 57 TRP HBy A 60 GLU HBy 1.0 . 5.18 1528 961 A 60 GLU HBx A 57 TRP HBy 1.0 . 5.18 1529 961 A 57 TRP HBx A 60 GLU HBx 1.0 . 5.18 1530 962 A 58 ILE HB A 58 ILE H 1.0 . 3.95 1531 963 A 58 ILE HG1y A 58 ILE H 1.0 . 4.53 1532 964 A 58 ILE H A 58 ILE HG1x 1.0 . 4.53 1533 965 A 58 ILE HD1% A 58 ILE H 1.0 . 4.89 1534 966 A 58 ILE H A 58 ILE HG1x 1.0 . 3.95 1535 966 A 58 ILE HG1y A 58 ILE H 1.0 . 3.95 1536 967 A 58 ILE HG2% A 58 ILE H 1.0 . 3.93 1537 968 A 58 ILE H A 59 GLN H 1.0 . 3.87 1538 969 A 58 ILE H A 60 GLU H 1.0 . 5.03 1539 970 A 58 ILE H A 62 LEU HDy% 1.0 . 5.44 1540 970 A 58 ILE H A 62 LEU HDx% 1.0 . 5.44 1541 971 A 58 ILE HG1y A 58 ILE HA 1.0 . 4.22 1542 972 A 58 ILE HA A 58 ILE HG1x 1.0 . 4.22 1543 973 A 58 ILE HD1% A 58 ILE HA 1.0 . 3.64 1544 974 A 58 ILE HA A 58 ILE HG1x 1.0 . 3.50 1545 974 A 58 ILE HG1y A 58 ILE HA 1.0 . 3.50 1546 975 A 58 ILE HG2% A 58 ILE HA 1.0 . 3.67 1547 976 A 58 ILE HA A 60 GLU H 1.0 . 4.84 1548 977 A 58 ILE HA A 61 TYR H 1.0 . 4.62 1549 978 A 58 ILE HA A 61 TYR HBx 1.0 . 3.62 1550 978 A 61 TYR HBy A 58 ILE HA 1.0 . 3.62 1551 979 A 61 TYR HD% A 58 ILE HA 1.0 . 3.94 1552 980 A 61 TYR HE% A 58 ILE HA 1.0 . 5.50 1553 981 A 58 ILE HA A 62 LEU H 1.0 . 5.18 1554 982 A 58 ILE HD1% A 58 ILE HB 1.0 . 4.08 1555 983 A 58 ILE HB A 59 GLN H 1.0 . 4.76 1556 984 A 61 TYR HBy A 58 ILE HG1y 1.0 . 5.50 1557 984 A 58 ILE HG1y A 61 TYR HBx 1.0 . 5.50 1558 985 A 61 TYR HBy A 58 ILE HG1x 1.0 . 5.50 1559 985 A 58 ILE HG1x A 61 TYR HBx 1.0 . 5.50 1560 986 A 58 ILE HD1% A 59 GLN H 1.0 . 5.50 1561 987 A 58 ILE HD1% A 61 TYR HBx 1.0 . 4.43 1562 987 A 61 TYR HBy A 58 ILE HD1% 1.0 . 4.43 1563 988 A 61 TYR HD% A 58 ILE HD1% 1.0 . 4.41 1564 989 A 61 TYR HE% A 58 ILE HD1% 1.0 . 5.50 1565 990 A 58 ILE HD1% A 62 LEU HDy% 1.0 . 4.01 1566 990 A 58 ILE HD1% A 62 LEU HDx% 1.0 . 4.01 1567 991 A 58 ILE HD1% A 58 ILE HG2% 1.0 . 3.19 1568 992 A 58 ILE HG2% A 58 ILE HG1x 1.0 . 3.38 1569 992 A 58 ILE HG1y A 58 ILE HG2% 1.0 . 3.38 1570 993 A 58 ILE HG2% A 59 GLN H 1.0 . 4.19 1571 994 A 58 ILE HG2% A 60 GLU H 1.0 . 5.15 1572 995 A 58 ILE HG2% A 61 TYR HBx 1.0 . 4.60 1573 995 A 61 TYR HBy A 58 ILE HG2% 1.0 . 4.60 1574 996 A 61 TYR HD% A 58 ILE HG2% 1.0 . 5.19 1575 997 A 61 TYR HE% A 58 ILE HG2% 1.0 . 5.50 1576 998 A 58 ILE HG2% A 62 LEU H 1.0 . 4.66 1577 999 A 58 ILE HG2% A 62 LEU HG 1.0 . 3.73 1578 1000 A 59 GLN H A 59 GLN HGy 1.0 . 4.14 1579 1001 A 59 GLN H A 59 GLN HGx 1.0 . 4.14 1580 1002 A 59 GLN H A 59 GLN HBx 1.0 . 3.55 1581 1002 A 59 GLN H A 59 GLN HBy 1.0 . 3.55 1582 1003 A 59 GLN H A 60 GLU H 1.0 . 3.56 1583 1004 A 59 GLN HA A 59 GLN HGy 1.0 . 3.59 1584 1005 A 59 GLN HA A 59 GLN HGx 1.0 . 3.59 1585 1006 A 62 LEU H A 59 GLN HA 1.0 . 4.18 1586 1007 A 59 GLN HGy A 59 GLN HBx 1.0 . 2.78 1587 1007 A 59 GLN HBy A 59 GLN HGy 1.0 . 2.78 1588 1008 A 59 GLN HBx A 59 GLN HGx 1.0 . 2.78 1589 1008 A 59 GLN HBy A 59 GLN HGx 1.0 . 2.78 1590 1009 A 59 GLN HE2x A 59 GLN HBx 1.0 . 4.14 1591 1009 A 59 GLN HE2x A 59 GLN HBy 1.0 . 4.14 1592 1009 A 59 GLN HE2y A 59 GLN HBy 1.0 . 4.14 1593 1009 A 59 GLN HE2y A 59 GLN HBx 1.0 . 4.14 1594 1010 A 60 GLU H A 59 GLN HBx 1.0 . 3.74 1595 1010 A 59 GLN HBy A 60 GLU H 1.0 . 3.74 1596 1011 A 62 LEU H A 59 GLN HBx 1.0 . 4.81 1597 1011 A 59 GLN HBy A 62 LEU H 1.0 . 4.81 1598 1012 A 59 GLN HE2y A 59 GLN HGx 1.0 . 3.09 1599 1012 A 59 GLN HE2y A 59 GLN HGy 1.0 . 3.09 1600 1012 A 59 GLN HE2x A 59 GLN HGy 1.0 . 3.09 1601 1012 A 59 GLN HE2x A 59 GLN HGx 1.0 . 3.09 1602 1013 A 60 GLU H A 59 GLN HGx 1.0 . 4.77 1603 1013 A 60 GLU H A 59 GLN HGy 1.0 . 4.77 1604 1014 A 60 GLU H A 60 GLU HGy 1.0 . 4.03 1605 1015 A 60 GLU H A 60 GLU HGx 1.0 . 4.03 1606 1016 A 60 GLU H A 60 GLU HBy 1.0 . 2.92 1607 1016 A 60 GLU H A 60 GLU HBx 1.0 . 2.92 1608 1017 A 60 GLU H A 60 GLU HGy 1.0 . 3.29 1609 1017 A 60 GLU H A 60 GLU HGx 1.0 . 3.29 1610 1018 A 60 GLU H A 61 TYR H 1.0 . 3.74 1611 1019 A 60 GLU H A 62 LEU H 1.0 . 5.10 1612 1020 A 60 GLU HA A 60 GLU HGy 1.0 . 3.84 1613 1021 A 60 GLU HGx A 60 GLU HA 1.0 . 3.84 1614 1022 A 60 GLU HA A 63 GLU H 1.0 . 4.24 1615 1023 A 60 GLU HA A 64 LYS H 1.0 . 5.50 1616 1024 A 61 TYR H A 60 GLU HBy 1.0 . 4.06 1617 1025 A 60 GLU HBx A 61 TYR H 1.0 . 4.06 1618 1026 A 60 GLU HBy A 60 GLU HGy 1.0 . 2.36 1619 1026 A 60 GLU HBx A 60 GLU HGy 1.0 . 2.36 1620 1026 A 60 GLU HGx A 60 GLU HBy 1.0 . 2.36 1621 1026 A 60 GLU HBx A 60 GLU HGx 1.0 . 2.36 1622 1027 A 61 TYR H A 60 GLU HBy 1.0 . 3.21 1623 1027 A 60 GLU HBx A 61 TYR H 1.0 . 3.21 1624 1028 A 61 TYR H A 61 TYR HBx 1.0 . 3.69 1625 1028 A 61 TYR HBy A 61 TYR H 1.0 . 3.69 1626 1029 A 61 TYR HD% A 61 TYR H 1.0 . 4.18 1627 1030 A 61 TYR H A 62 LEU H 1.0 . 4.65 1628 1031 A 61 TYR H A 63 GLU HGy 1.0 . 5.34 1629 1031 A 61 TYR H A 63 GLU HGx 1.0 . 5.34 1630 1032 A 61 TYR HD% A 61 TYR HA 1.0 . 3.45 1631 1033 A 61 TYR HE% A 61 TYR HA 1.0 . 5.22 1632 1034 A 64 LYS H A 61 TYR HA 1.0 . 4.79 1633 1035 A 61 TYR HA A 64 LYS HBx 1.0 . 3.94 1634 1035 A 61 TYR HA A 64 LYS HBy 1.0 . 3.94 1635 1036 A 62 LEU H A 61 TYR HBx 1.0 . 3.71 1636 1036 A 61 TYR HBy A 62 LEU H 1.0 . 3.71 1637 1037 A 62 LEU HG A 61 TYR HBx 1.0 . 4.82 1638 1037 A 61 TYR HBy A 62 LEU HG 1.0 . 4.82 1639 1038 A 61 TYR HBx A 62 LEU HDy% 1.0 . 4.46 1640 1038 A 61 TYR HBy A 62 LEU HDy% 1.0 . 4.46 1641 1038 A 62 LEU HDx% A 61 TYR HBx 1.0 . 4.46 1642 1038 A 61 TYR HBy A 62 LEU HDx% 1.0 . 4.46 1643 1039 A 61 TYR HD% A 62 LEU H 1.0 . 4.30 1644 1040 A 61 TYR HD% A 62 LEU HA 1.0 . 4.74 1645 1041 A 61 TYR HD% A 62 LEU HG 1.0 . 4.90 1646 1042 A 61 TYR HD% A 62 LEU HDy% 1.0 . 3.87 1647 1042 A 61 TYR HD% A 62 LEU HDx% 1.0 . 3.87 1648 1043 A 61 TYR HD% A 65 ALA HB% 1.0 . 4.05 1649 1044 A 61 TYR HE% A 62 LEU HDx% 1.0 . 5.50 1650 1045 A 61 TYR HE% A 62 LEU HDy% 1.0 . 5.50 1651 1046 A 61 TYR HE% A 62 LEU HDy% 1.0 . 4.14 1652 1046 A 61 TYR HE% A 62 LEU HDx% 1.0 . 4.14 1653 1047 A 61 TYR HE% A 65 ALA HB% 1.0 . 3.71 1654 1048 A 62 LEU H A 62 LEU HBy 1.0 . 3.83 1655 1049 A 62 LEU H A 62 LEU HBx 1.0 . 3.83 1656 1050 A 62 LEU H A 62 LEU HG 1.0 . 3.17 1657 1051 A 62 LEU HDx% A 62 LEU H 1.0 . 4.67 1658 1052 A 62 LEU H A 62 LEU HDy% 1.0 . 4.67 1659 1053 A 62 LEU H A 62 LEU HDy% 1.0 . 3.53 1660 1053 A 62 LEU HDx% A 62 LEU H 1.0 . 3.53 1661 1054 A 62 LEU H A 63 GLU H 1.0 . 3.52 1662 1055 A 62 LEU HG A 62 LEU HA 1.0 . 4.26 1663 1056 A 62 LEU HDx% A 62 LEU HA 1.0 . 3.86 1664 1057 A 62 LEU HA A 62 LEU HDy% 1.0 . 3.86 1665 1058 A 62 LEU HA A 62 LEU HDy% 1.0 . 2.91 1666 1058 A 62 LEU HDx% A 62 LEU HA 1.0 . 2.91 1667 1059 A 62 LEU HA A 65 ALA H 1.0 . 4.57 1668 1060 A 62 LEU HA A 65 ALA HB% 1.0 . 3.64 1669 1061 A 62 LEU HA A 66 LEU H 1.0 . 5.50 1670 1062 A 62 LEU HA A 66 LEU HBx 1.0 . 4.70 1671 1062 A 62 LEU HA A 66 LEU HBy 1.0 . 4.70 1672 1063 A 63 GLU H A 62 LEU HBy 1.0 . 4.13 1673 1064 A 63 GLU H A 62 LEU HBx 1.0 . 4.13 1674 1065 A 62 LEU HG A 63 GLU H 1.0 . 5.01 1675 1066 A 62 LEU HBx A 62 LEU HDy% 1.0 . 2.67 1676 1066 A 62 LEU HBy A 62 LEU HDy% 1.0 . 2.67 1677 1066 A 62 LEU HDx% A 62 LEU HBx 1.0 . 2.67 1678 1066 A 62 LEU HDx% A 62 LEU HBy 1.0 . 2.67 1679 1067 A 63 GLU H A 62 LEU HBx 1.0 . 3.48 1680 1067 A 63 GLU H A 62 LEU HBy 1.0 . 3.48 1681 1068 A 62 LEU HDx% A 63 GLU H 1.0 . 4.51 1682 1069 A 63 GLU H A 62 LEU HDy% 1.0 . 4.51 1683 1070 A 63 GLU H A 62 LEU HDy% 1.0 . 3.89 1684 1070 A 62 LEU HDx% A 63 GLU H 1.0 . 3.89 1685 1071 A 65 ALA H A 62 LEU HDy% 1.0 . 4.75 1686 1071 A 62 LEU HDx% A 65 ALA H 1.0 . 4.75 1687 1072 A 63 GLU H A 63 GLU HGy 1.0 . 4.19 1688 1073 A 63 GLU H A 63 GLU HGx 1.0 . 4.19 1689 1074 A 63 GLU H A 63 GLU HBy 1.0 . 3.19 1690 1074 A 63 GLU H A 63 GLU HBx 1.0 . 3.19 1691 1075 A 63 GLU H A 63 GLU HGy 1.0 . 3.68 1692 1075 A 63 GLU H A 63 GLU HGx 1.0 . 3.68 1693 1076 A 63 GLU H A 64 LYS H 1.0 . 3.72 1694 1077 A 63 GLU HA A 63 GLU HGy 1.0 . 4.15 1695 1078 A 63 GLU HGx A 63 GLU HA 1.0 . 4.15 1696 1079 A 63 GLU HA A 63 GLU HGy 1.0 . 3.58 1697 1079 A 63 GLU HGx A 63 GLU HA 1.0 . 3.58 1698 1080 A 66 LEU H A 63 GLU HA 1.0 . 5.44 1699 1081 A 63 GLU HA A 66 LEU HBx 1.0 . 4.16 1700 1081 A 66 LEU HBy A 63 GLU HA 1.0 . 4.16 1701 1082 A 63 GLU HA A 67 ASN H 1.0 . 3.69 1702 1083 A 64 LYS H A 63 GLU HBy 1.0 . 4.87 1703 1084 A 64 LYS H A 63 GLU HBx 1.0 . 4.87 1704 1085 A 64 LYS H A 63 GLU HGy 1.0 . 5.50 1705 1086 A 64 LYS H A 63 GLU HGx 1.0 . 5.50 1706 1087 A 63 GLU HBx A 63 GLU HGy 1.0 . 2.34 1707 1087 A 63 GLU HBy A 63 GLU HGy 1.0 . 2.34 1708 1087 A 63 GLU HGx A 63 GLU HBy 1.0 . 2.34 1709 1087 A 63 GLU HGx A 63 GLU HBx 1.0 . 2.34 1710 1088 A 64 LYS H A 63 GLU HBy 1.0 . 4.07 1711 1088 A 64 LYS H A 63 GLU HBx 1.0 . 4.07 1712 1089 A 64 LYS H A 63 GLU HGy 1.0 . 4.83 1713 1089 A 64 LYS H A 63 GLU HGx 1.0 . 4.83 1714 1090 A 64 LYS H A 64 LYS HGy 1.0 . 4.52 1715 1091 A 64 LYS H A 64 LYS HGx 1.0 . 4.52 1716 1092 A 64 LYS H A 64 LYS HBx 1.0 . 3.63 1717 1092 A 64 LYS H A 64 LYS HBy 1.0 . 3.63 1718 1093 A 64 LYS H A 64 LYS HDx 1.0 . 4.90 1719 1093 A 64 LYS H A 64 LYS HDy 1.0 . 4.90 1720 1094 A 64 LYS H A 64 LYS HEx 1.0 . 5.50 1721 1094 A 64 LYS H A 64 LYS HEy 1.0 . 5.50 1722 1095 A 64 LYS H A 65 ALA H 1.0 . 3.70 1723 1096 A 64 LYS H A 66 LEU H 1.0 . 4.68 1724 1097 A 64 LYS HA A 64 LYS HGy 1.0 . 3.75 1725 1098 A 64 LYS HA A 64 LYS HGx 1.0 . 3.75 1726 1099 A 64 LYS HA A 64 LYS HDx 1.0 . 3.50 1727 1099 A 64 LYS HDy A 64 LYS HA 1.0 . 3.50 1728 1100 A 64 LYS HA A 64 LYS HEx 1.0 . 4.45 1729 1100 A 64 LYS HEy A 64 LYS HA 1.0 . 4.45 1730 1101 A 64 LYS HA A 64 LYS HGy 1.0 . 3.24 1731 1101 A 64 LYS HA A 64 LYS HGx 1.0 . 3.24 1732 1102 A 64 LYS HA A 67 ASN HBy 1.0 . 5.37 1733 1103 A 64 LYS HA A 67 ASN HBx 1.0 . 5.37 1734 1104 A 64 LYS HA A 68 LYS H 1.0 . 5.31 1735 1105 A 64 LYS HDx A 64 LYS HGy 1.0 . 2.41 1736 1105 A 64 LYS HDy A 64 LYS HGy 1.0 . 2.41 1737 1106 A 64 LYS HEy A 64 LYS HGy 1.0 . 3.82 1738 1106 A 64 LYS HEx A 64 LYS HGy 1.0 . 3.82 1739 1107 A 64 LYS HDy A 64 LYS HGx 1.0 . 2.41 1740 1107 A 64 LYS HGx A 64 LYS HDx 1.0 . 2.41 1741 1108 A 64 LYS HGx A 64 LYS HEx 1.0 . 3.82 1742 1108 A 64 LYS HEy A 64 LYS HGx 1.0 . 3.82 1743 1109 A 64 LYS HBx A 64 LYS HDx 1.0 . 3.29 1744 1109 A 64 LYS HBy A 64 LYS HDx 1.0 . 3.29 1745 1109 A 64 LYS HDy A 64 LYS HBx 1.0 . 3.29 1746 1109 A 64 LYS HBy A 64 LYS HDy 1.0 . 3.29 1747 1110 A 64 LYS HBy A 64 LYS HEx 1.0 . 3.93 1748 1110 A 64 LYS HBx A 64 LYS HEx 1.0 . 3.93 1749 1110 A 64 LYS HEy A 64 LYS HBx 1.0 . 3.93 1750 1110 A 64 LYS HBy A 64 LYS HEy 1.0 . 3.93 1751 1111 A 65 ALA H A 64 LYS HBx 1.0 . 3.81 1752 1111 A 64 LYS HBy A 65 ALA H 1.0 . 3.81 1753 1112 A 66 LEU H A 64 LYS HBx 1.0 . 4.95 1754 1112 A 64 LYS HBy A 66 LEU H 1.0 . 4.95 1755 1113 A 65 ALA H A 64 LYS HGy 1.0 . 4.73 1756 1113 A 65 ALA H A 64 LYS HGx 1.0 . 4.73 1757 1114 A 65 ALA HB% A 65 ALA H 1.0 . 3.29 1758 1115 A 65 ALA H A 66 LEU H 1.0 . 3.19 1759 1116 A 65 ALA HA A 68 LYS HBy 1.0 . 4.70 1760 1116 A 65 ALA HA A 68 LYS HBx 1.0 . 4.70 1761 1117 A 65 ALA HB% A 66 LEU H 1.0 . 4.13 1762 1118 A 65 ALA HB% A 66 LEU HA 1.0 . 4.22 1763 1119 A 65 ALA HB% A 66 LEU HDx% 1.0 . 2.95 1764 1119 A 65 ALA HB% A 66 LEU HDy% 1.0 . 2.95 1765 1120 A 66 LEU H A 66 LEU HBy 1.0 . 4.06 1766 1121 A 66 LEU H A 66 LEU HBx 1.0 . 4.06 1767 1122 A 66 LEU H A 66 LEU HG 1.0 . 3.98 1768 1123 A 66 LEU H A 66 LEU HBx 1.0 . 3.31 1769 1123 A 66 LEU H A 66 LEU HBy 1.0 . 3.31 1770 1124 A 66 LEU H A 66 LEU HDx% 1.0 . 4.45 1771 1124 A 66 LEU H A 66 LEU HDy% 1.0 . 4.45 1772 1125 A 66 LEU HA A 66 LEU HG 1.0 . 3.51 1773 1126 A 66 LEU HA A 66 LEU HDx% 1.0 . 3.10 1774 1126 A 66 LEU HA A 66 LEU HDy% 1.0 . 3.10 1775 1127 A 66 LEU HBy A 66 LEU HDy% 1.0 . 3.50 1776 1127 A 66 LEU HBy A 66 LEU HDx% 1.0 . 3.50 1777 1128 A 66 LEU HDy% A 66 LEU HBx 1.0 . 3.50 1778 1128 A 66 LEU HBx A 66 LEU HDx% 1.0 . 3.50 1779 1129 A 68 LYS H A 68 LYS HDx 1.0 . 5.02 1780 1129 A 68 LYS H A 68 LYS HDy 1.0 . 5.02 1781 1130 A 68 LYS H A 68 LYS HEx 1.0 . 5.50 1782 1130 A 68 LYS H A 68 LYS HEy 1.0 . 5.50 1783 1131 A 68 LYS H A 68 LYS HGx 1.0 . 4.41 1784 1131 A 68 LYS H A 68 LYS HGy 1.0 . 4.41 1785 1132 A 68 LYS HA A 68 LYS HDx 1.0 . 4.19 1786 1132 A 68 LYS HDy A 68 LYS HA 1.0 . 4.19 1787 1133 A 68 LYS HA A 68 LYS HEx 1.0 . 5.50 1788 1133 A 68 LYS HEy A 68 LYS HA 1.0 . 5.50 1789 1134 A 68 LYS HA A 68 LYS HGx 1.0 . 4.23 1790 1134 A 68 LYS HGy A 68 LYS HA 1.0 . 4.23 1791 1135 A 68 LYS HEy A 68 LYS HBy 1.0 . 3.93 1792 1135 A 68 LYS HBy A 68 LYS HEx 1.0 . 3.93 1793 1136 A 68 LYS HBx A 68 LYS HEy 1.0 . 3.93 1794 1136 A 68 LYS HBx A 68 LYS HEx 1.0 . 3.93 1795 1137 A 68 LYS HBy A 68 LYS HDx 1.0 . 2.51 1796 1137 A 68 LYS HBx A 68 LYS HDx 1.0 . 2.51 1797 1137 A 68 LYS HDy A 68 LYS HBy 1.0 . 2.51 1798 1137 A 68 LYS HBx A 68 LYS HDy 1.0 . 2.51 1799 1138 A 68 LYS HBx A 68 LYS HEx 1.0 . 3.35 1800 1138 A 68 LYS HBy A 68 LYS HEx 1.0 . 3.35 1801 1138 A 68 LYS HEy A 68 LYS HBy 1.0 . 3.35 1802 1138 A 68 LYS HBx A 68 LYS HEy 1.0 . 3.35 1803 1139 A 68 LYS HDy A 68 LYS HGx 1.0 . 2.69 1804 1139 A 68 LYS HDx A 68 LYS HGx 1.0 . 2.69 1805 1139 A 68 LYS HGy A 68 LYS HDx 1.0 . 2.69 1806 1139 A 68 LYS HDy A 68 LYS HGy 1.0 . 2.69 1807 1140 A 68 LYS HEx A 68 LYS HGx 1.0 . 3.62 1808 1140 A 68 LYS HEy A 68 LYS HGx 1.0 . 3.62 1809 1140 A 68 LYS HGy A 68 LYS HEx 1.0 . 3.62 1810 1140 A 68 LYS HEy A 68 LYS HGy 1.0 . 3.62 stop_ save_ save_DYANA/DIANA_dihedral_2 _nef_dihedral_restraint_list.sf_category nef_dihedral_restraint_list _nef_dihedral_restraint_list.sf_framecode DYANA/DIANA_dihedral_2 _nef_dihedral_restraint_list.potential_type square-well-parabolic _nef_dihedral_restraint_list.restraint_origin . loop_ _nef_dihedral_restraint.index _nef_dihedral_restraint.restraint_id _nef_dihedral_restraint.chain_code_1 _nef_dihedral_restraint.sequence_code_1 _nef_dihedral_restraint.residue_name_1 _nef_dihedral_restraint.atom_name_1 _nef_dihedral_restraint.chain_code_2 _nef_dihedral_restraint.sequence_code_2 _nef_dihedral_restraint.residue_name_2 _nef_dihedral_restraint.atom_name_2 _nef_dihedral_restraint.chain_code_3 _nef_dihedral_restraint.sequence_code_3 _nef_dihedral_restraint.residue_name_3 _nef_dihedral_restraint.atom_name_3 _nef_dihedral_restraint.chain_code_4 _nef_dihedral_restraint.sequence_code_4 _nef_dihedral_restraint.residue_name_4 _nef_dihedral_restraint.atom_name_4 _nef_dihedral_restraint.weight _nef_dihedral_restraint.lower_limit _nef_dihedral_restraint.upper_limit _nef_dihedral_restraint.name 1 1 A 2 PRO C A 3 VAL N A 3 VAL CA A 3 VAL C 1.0 -109.0 -79.0 PHI 2 2 A 3 VAL N A 3 VAL CA A 3 VAL C A 4 SER N 1.0 102.0 160.0 PSI 3 3 A 13 PHE C A 14 PHE N A 14 PHE CA A 14 PHE C 1.0 -121.3 -94.0 PHI 4 4 A 14 PHE N A 14 PHE CA A 14 PHE C A 15 GLU N 1.0 106.8 146.2 PSI 5 5 A 17 HIS C A 18 VAL N A 18 VAL CA A 18 VAL C 1.0 -125.0 -95.0 PHI 6 6 A 18 VAL N A 18 VAL CA A 18 VAL C A 19 ALA N 1.0 99.0 139.0 PSI 7 7 A 18 VAL C A 19 ALA N A 19 ALA CA A 19 ALA C 1.0 -116.0 -60.0 PHI 8 8 A 19 ALA N A 19 ALA CA A 19 ALA C A 20 ARG N 1.0 107.0 173.0 PSI 9 9 A 22 ASN C A 23 VAL N A 23 VAL CA A 23 VAL C 1.0 -117.0 -81.0 PHI 10 10 A 23 VAL N A 23 VAL CA A 23 VAL C A 24 LYS N 1.0 113.0 153.0 PSI 11 11 A 24 LYS C A 25 HIS N A 25 HIS CA A 25 HIS C 1.0 -162.0 -96.0 PHI 12 12 A 25 HIS N A 25 HIS CA A 25 HIS C A 26 LEU N 1.0 129.0 149.0 PSI 13 13 A 25 HIS C A 26 LEU N A 26 LEU CA A 26 LEU C 1.0 -139.0 -89.0 PHI 14 14 A 26 LEU N A 26 LEU CA A 26 LEU C A 27 LYS N 1.0 110.0 142.0 PSI 15 15 A 27 LYS C A 28 ILE N A 28 ILE CA A 28 ILE C 1.0 -111.0 -91.0 PHI 16 16 A 28 ILE N A 28 ILE CA A 28 ILE C A 29 LEU N 1.0 103.0 137.0 PSI 17 17 A 28 ILE C A 29 LEU N A 29 LEU CA A 29 LEU C 1.0 -117.0 -85.0 PHI 18 18 A 29 LEU N A 29 LEU CA A 29 LEU C A 30 ASN N 1.0 116.0 144.0 PSI 19 19 A 29 LEU C A 30 ASN N A 30 ASN CA A 30 ASN C 1.0 -128.0 -86.0 PHI 20 20 A 30 ASN N A 30 ASN CA A 30 ASN C A 31 THR N 1.0 106.0 146.0 PSI 21 21 A 37 GLN C A 38 ILE N A 38 ILE CA A 38 ILE C 1.0 -119.0 -97.0 PHI 22 22 A 38 ILE N A 38 ILE CA A 38 ILE C A 39 VAL N 1.0 121.0 143.0 PSI 23 23 A 38 ILE C A 39 VAL N A 39 VAL CA A 39 VAL C 1.0 -120.0 -100.0 PHI 24 24 A 39 VAL N A 39 VAL CA A 39 VAL C A 40 ALA N 1.0 129.0 149.0 PSI 25 25 A 39 VAL C A 40 ALA N A 40 ALA CA A 40 ALA C 1.0 -151.0 -109.0 PHI 26 26 A 40 ALA N A 40 ALA CA A 40 ALA C A 41 ARG N 1.0 125.0 171.0 PSI 27 27 A 40 ALA C A 41 ARG N A 41 ARG CA A 41 ARG C 1.0 -113.0 -93.0 PHI 28 28 A 41 ARG N A 41 ARG CA A 41 ARG C A 42 LEU N 1.0 112.0 132.0 PSI 29 29 A 42 LEU C A 43 LYS N A 43 LYS CA A 43 LYS C 1.0 -85.0 -55.0 PHI 30 30 A 43 LYS N A 43 LYS CA A 43 LYS C A 44 ASN N 1.0 -39.0 -9.0 PSI 31 31 A 43 LYS C A 44 ASN N A 44 ASN CA A 44 ASN C 1.0 -81.0 -51.0 PHI 32 32 A 44 ASN N A 44 ASN CA A 44 ASN C A 45 ASN N 1.0 -44.0 -12.0 PSI 33 33 A 44 ASN C A 45 ASN N A 45 ASN CA A 45 ASN C 1.0 -109.0 -89.0 PHI 34 34 A 45 ASN N A 45 ASN CA A 45 ASN C A 46 ASN N 1.0 -29.0 13.0 PSI 35 35 A 50 CYS C A 51 ILE N A 51 ILE CA A 51 ILE C 1.0 -123.0 -87.0 PHI 36 36 A 51 ILE N A 51 ILE CA A 51 ILE C A 52 ASP N 1.0 117.0 167.0 PSI 37 37 A 55 LEU C A 56 LYS N A 56 LYS CA A 56 LYS C 1.0 -78.0 -54.0 PHI 38 38 A 56 LYS N A 56 LYS CA A 56 LYS C A 57 TRP N 1.0 -47.0 -27.0 PSI 39 39 A 56 LYS C A 57 TRP N A 57 TRP CA A 57 TRP C 1.0 -97.0 -61.0 PHI 40 40 A 57 TRP N A 57 TRP CA A 57 TRP C A 58 ILE N 1.0 -43.0 5.0 PSI 41 41 A 57 TRP C A 58 ILE N A 58 ILE CA A 58 ILE C 1.0 -80.0 -58.0 PHI 42 42 A 58 ILE N A 58 ILE CA A 58 ILE C A 59 GLN N 1.0 -48.0 -26.0 PSI 43 43 A 58 ILE C A 59 GLN N A 59 GLN CA A 59 GLN C 1.0 -71.0 -51.0 PHI 44 44 A 59 GLN N A 59 GLN CA A 59 GLN C A 60 GLU N 1.0 -49.0 -29.0 PSI 45 45 A 59 GLN C A 60 GLU N A 60 GLU CA A 60 GLU C 1.0 -76.0 -56.0 PHI 46 46 A 60 GLU N A 60 GLU CA A 60 GLU C A 61 TYR N 1.0 -54.0 -34.0 PSI 47 47 A 60 GLU C A 61 TYR N A 61 TYR CA A 61 TYR C 1.0 -75.0 -55.0 PHI 48 48 A 61 TYR N A 61 TYR CA A 61 TYR C A 62 LEU N 1.0 -51.0 -31.0 PSI 49 49 A 61 TYR C A 62 LEU N A 62 LEU CA A 62 LEU C 1.0 -71.4 -51.4 PHI 50 50 A 62 LEU N A 62 LEU CA A 62 LEU C A 63 GLU N 1.0 -53.4 -33.3 PSI stop_ save_