data_nef_c25753_2n66 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 25755 PDB 2N66 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 4 CYS SG 1 52 CYS SG 1 16 CYS SG 1 37 CYS SG 1 22 CYS SG 1 47 CYS SG 1 26 CYS SG 1 49 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 GLN start . . 2 A 2 ASP middle . . 3 A 3 LYS middle . . 4 A 4 CYS middle -HG . 5 A 5 LYS middle . . 6 A 6 LYS middle . . 7 A 7 VAL middle . . 8 A 8 TYR middle . . 9 A 9 GLU middle . . 10 A 10 ASN middle . . 11 A 11 TYR middle . . 12 A 12 PRO middle . false 13 A 13 VAL middle . . 14 A 14 SER middle . . 15 A 15 LYS middle . . 16 A 16 CYS middle -HG . 17 A 17 GLN middle . . 18 A 18 LEU middle . . 19 A 19 ALA middle . . 20 A 20 ASN middle . . 21 A 21 GLN middle . . 22 A 22 CYS middle -HG . 23 A 23 ASN middle . . 24 A 24 TYR middle . . 25 A 25 ASP middle . . 26 A 26 CYS middle -HG . 27 A 27 LYS middle . . 28 A 28 LEU middle . . 29 A 29 ASP middle . . 30 A 30 LYS middle . . 31 A 31 HIS middle . . 32 A 32 ALA middle . . 33 A 33 ARG middle . . 34 A 34 SER middle . . 35 A 35 GLY middle . false 36 A 36 GLU middle . . 37 A 37 CYS middle -HG . 38 A 38 PHE middle . . 39 A 39 TYR middle . . 40 A 40 LYS middle . . 41 A 41 GLU middle . . 42 A 42 LYS middle . . 43 A 43 ARG middle . . 44 A 44 ASN middle . . 45 A 45 LEU middle . . 46 A 46 GLN middle . . 47 A 47 CYS middle -HG . 48 A 48 ILE middle . . 49 A 49 CYS middle -HG . 50 A 50 ASP middle . . 51 A 51 TYR middle . . 52 A 52 CYS middle -HG . 53 A 53 GLU middle . . 54 A 54 TYR 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 3 LYS H H 1 8.214 0.002 A 3 LYS HA H 1 4.270 0.001 A 3 LYS HBy H 1 1.845 0.002 A 3 LYS HBx H 1 1.804 0.005 A 3 LYS HDx H 1 1.610 0.002 A 3 LYS HEy H 1 2.934 0.000 A 3 LYS HEx H 1 2.930 0.000 A 3 LYS HGx H 1 1.422 0.013 A 3 LYS CA C 13 57.211 0.000 A 3 LYS CB C 13 32.322 0.102 A 3 LYS CD C 13 28.780 0.000 A 3 LYS CE C 13 41.780 0.000 A 3 LYS CG C 13 24.138 0.000 A 4 CYS H H 1 8.430 0.011 A 4 CYS HA H 1 4.694 0.016 A 4 CYS HBy H 1 3.343 0.003 A 4 CYS HBx H 1 2.998 0.015 A 4 CYS CA C 13 56.772 0.000 A 4 CYS CB C 13 41.600 0.000 A 4 CYS N N 15 116.570 0.000 A 5 LYS H H 1 7.965 0.002 A 5 LYS HA H 1 5.502 0.006 A 5 LYS HBy H 1 1.733 0.002 A 5 LYS HBx H 1 1.453 0.007 A 5 LYS HDx H 1 1.450 0.000 A 5 LYS HDy H 1 1.468 0.000 A 5 LYS HEy H 1 2.867 0.003 A 5 LYS HEx H 1 2.843 0.000 A 5 LYS HGy H 1 1.323 0.000 A 5 LYS HGx H 1 1.299 0.009 A 5 LYS CA C 13 54.566 0.000 A 5 LYS CB C 13 34.300 0.000 A 5 LYS CD C 13 28.946 0.000 A 5 LYS CE C 13 42.045 0.000 A 5 LYS CG C 13 25.267 0.000 A 5 LYS N N 15 118.500 0.000 A 6 LYS H H 1 8.980 0.008 A 6 LYS HA H 1 4.713 0.002 A 6 LYS HBy H 1 1.872 0.001 A 6 LYS HBx H 1 1.775 0.005 A 6 LYS HDx H 1 1.600 0.000 A 6 LYS HEx H 1 2.632 0.000 A 6 LYS HEy H 1 2.742 0.000 A 6 LYS HGy H 1 1.420 0.002 A 6 LYS HGx H 1 1.314 0.001 A 6 LYS CA C 13 55.000 0.000 A 6 LYS CB C 13 36.573 0.000 A 6 LYS CD C 13 28.780 0.000 A 6 LYS CE C 13 41.524 0.000 A 6 LYS CG C 13 24.483 0.000 A 6 LYS N N 15 121.002 0.000 A 7 VAL H H 1 8.756 0.000 A 7 VAL HA H 1 3.913 0.003 A 7 VAL HB H 1 1.992 0.007 A 7 VAL HGx% H 1 0.983 0.004 A 7 VAL HGy% H 1 0.864 0.006 A 7 VAL CA C 13 63.400 0.000 A 7 VAL CB C 13 32.664 0.000 A 7 VAL CGy C 13 22.437 0.000 A 7 VAL CGx C 13 20.611 0.000 A 7 VAL N N 15 127.157 0.000 A 8 TYR H H 1 9.160 0.006 A 8 TYR HA H 1 4.383 0.004 A 8 TYR HBy H 1 3.048 0.004 A 8 TYR HBx H 1 2.701 0.000 A 8 TYR HDx H 1 6.878 0.023 A 8 TYR HDy H 1 6.878 0.023 A 8 TYR HEx H 1 6.842 0.015 A 8 TYR HEy H 1 6.842 0.015 A 8 TYR CA C 13 55.150 0.132 A 8 TYR CB C 13 35.621 0.000 A 8 TYR N N 15 129.707 0.000 A 9 GLU H H 1 8.964 0.003 A 9 GLU HA H 1 4.120 0.006 A 9 GLU HBx H 1 1.957 0.007 A 9 GLU HBy H 1 2.048 0.006 A 9 GLU HGx H 1 2.347 0.011 A 9 GLU HGy H 1 2.357 0.000 A 9 GLU CA C 13 57.898 0.000 A 9 GLU CB C 13 29.013 0.050 A 9 GLU CG C 13 35.775 0.000 A 9 GLU N N 15 130.601 0.000 A 10 ASN H H 1 9.232 0.004 A 10 ASN HA H 1 4.365 0.008 A 10 ASN HBx H 1 2.996 0.004 A 10 ASN HBy H 1 3.059 0.001 A 10 ASN HD2y H 1 7.590 0.008 A 10 ASN HD2x H 1 6.947 0.005 A 10 ASN CA C 13 54.200 0.000 A 10 ASN CB C 13 36.960 0.000 A 10 ASN N N 15 115.766 0.000 A 10 ASN ND2 N 15 113.474 0.000 A 11 TYR H H 1 7.473 0.004 A 11 TYR HA H 1 4.135 0.004 A 11 TYR HBx H 1 2.711 0.004 A 11 TYR HBy H 1 2.792 0.008 A 11 TYR HDx H 1 6.888 0.010 A 11 TYR HDy H 1 6.888 0.010 A 11 TYR HEx H 1 6.253 0.010 A 11 TYR HEy H 1 6.253 0.010 A 11 TYR CA C 13 56.947 0.000 A 11 TYR CB C 13 39.105 0.000 A 11 TYR N N 15 122.267 0.000 A 12 PRO HA H 1 4.432 0.004 A 12 PRO HBy H 1 2.057 0.000 A 12 PRO HBx H 1 1.714 0.006 A 12 PRO HDx H 1 2.116 0.000 A 12 PRO HDy H 1 3.498 0.000 A 12 PRO HGy H 1 1.732 0.009 A 12 PRO HGx H 1 1.586 0.000 A 12 PRO CA C 13 61.847 0.000 A 12 PRO CB C 13 30.250 0.000 A 12 PRO CD C 13 50.070 0.000 A 12 PRO CG C 13 27.275 0.000 A 13 VAL H H 1 8.102 0.002 A 13 VAL HA H 1 3.754 0.009 A 13 VAL HB H 1 2.196 0.005 A 13 VAL HGx% H 1 1.082 0.006 A 13 VAL HGy% H 1 1.095 0.007 A 13 VAL CA C 13 65.500 0.000 A 13 VAL CB C 13 31.111 0.000 A 13 VAL CGx C 13 20.351 0.000 A 13 VAL CGy C 13 21.248 0.000 A 13 VAL N N 15 123.595 0.000 A 14 SER H H 1 8.387 0.006 A 14 SER HA H 1 4.119 0.004 A 14 SER HBx H 1 3.796 0.015 A 14 SER HBy H 1 3.811 0.007 A 14 SER CA C 13 61.050 0.000 A 14 SER CB C 13 61.239 0.000 A 14 SER N N 15 116.945 0.000 A 15 LYS H H 1 7.821 0.152 A 15 LYS HA H 1 4.069 0.009 A 15 LYS HBy H 1 1.901 0.003 A 15 LYS HBx H 1 1.812 0.001 A 15 LYS HDx H 1 1.287 0.001 A 15 LYS HDy H 1 1.436 0.000 A 15 LYS HEy H 1 2.710 0.005 A 15 LYS HEx H 1 2.638 0.009 A 15 LYS HGx H 1 1.254 0.338 A 15 LYS HGy H 1 1.392 0.002 A 15 LYS CA C 13 59.300 0.000 A 15 LYS CB C 13 31.235 0.168 A 15 LYS CD C 13 28.780 0.000 A 15 LYS CE C 13 41.439 0.000 A 15 LYS CG C 13 26.972 0.000 A 15 LYS N N 15 121.073 0.000 A 16 CYS H H 1 7.844 0.006 A 16 CYS HA H 1 4.736 0.005 A 16 CYS HBy H 1 3.208 0.004 A 16 CYS HBx H 1 3.051 0.003 A 16 CYS CA C 13 57.800 0.000 A 16 CYS CB C 13 40.254 0.000 A 16 CYS N N 15 115.469 0.000 A 17 GLN H H 1 7.381 0.000 A 17 GLN HA H 1 4.213 0.008 A 17 GLN HBy H 1 2.242 0.009 A 17 GLN HBx H 1 1.994 0.002 A 17 GLN HE2x H 1 6.701 0.001 A 17 GLN HE2y H 1 7.301 0.000 A 17 GLN HGx H 1 2.375 0.003 A 17 GLN CA C 13 56.100 0.000 A 17 GLN CB C 13 28.600 0.000 A 17 GLN CG C 13 33.720 0.000 A 17 GLN N N 15 115.128 0.000 A 17 GLN NE2 N 15 110.329 0.000 A 18 LEU H H 1 7.286 0.005 A 18 LEU HA H 1 4.506 0.004 A 18 LEU HBy H 1 1.905 0.005 A 18 LEU HBx H 1 1.559 0.004 A 18 LEU HDx% H 1 0.862 0.002 A 18 LEU HDy% H 1 0.908 0.002 A 18 LEU HG H 1 1.657 0.004 A 18 LEU CA C 13 53.300 0.000 A 18 LEU CB C 13 42.094 0.000 A 18 LEU CDx C 13 22.882 0.000 A 18 LEU CDy C 13 25.059 0.000 A 18 LEU CG C 13 26.409 0.000 A 18 LEU N N 15 120.972 0.000 A 19 ALA H H 1 8.556 0.000 A 19 ALA HA H 1 4.115 0.006 A 19 ALA HB% H 1 1.361 0.004 A 19 ALA CA C 13 53.600 0.000 A 19 ALA CB C 13 17.900 0.000 A 19 ALA N N 15 127.694 0.000 A 20 ASN H H 1 9.044 0.001 A 20 ASN HA H 1 4.628 0.008 A 20 ASN HBy H 1 2.949 0.017 A 20 ASN HBx H 1 2.784 0.005 A 20 ASN HD2y H 1 7.584 0.015 A 20 ASN HD2x H 1 7.028 0.010 A 20 ASN CA C 13 54.700 0.000 A 20 ASN CB C 13 38.993 0.000 A 20 ASN N N 15 116.006 0.000 A 20 ASN ND2 N 15 113.774 0.038 A 21 GLN H H 1 7.662 0.003 A 21 GLN HA H 1 3.831 0.003 A 21 GLN HBy H 1 2.413 0.001 A 21 GLN HBx H 1 2.028 0.007 A 21 GLN HE2y H 1 7.983 0.006 A 21 GLN HE2x H 1 6.716 0.000 A 21 GLN HGy H 1 2.632 0.005 A 21 GLN HGx H 1 2.222 0.004 A 21 GLN CA C 13 59.200 0.000 A 21 GLN CB C 13 29.090 0.000 A 21 GLN CG C 13 33.720 0.000 A 21 GLN N N 15 122.731 0.000 A 21 GLN NE2 N 15 116.588 0.000 A 22 CYS H H 1 8.475 0.001 A 22 CYS HA H 1 4.263 0.009 A 22 CYS HBx H 1 2.522 0.010 A 22 CYS HBy H 1 2.857 0.011 A 22 CYS CA C 13 58.100 0.000 A 22 CYS CB C 13 38.500 0.000 A 22 CYS N N 15 118.925 0.000 A 23 ASN H H 1 7.972 0.002 A 23 ASN HA H 1 3.806 0.004 A 23 ASN HBy H 1 3.007 0.011 A 23 ASN HBx H 1 2.699 0.002 A 23 ASN HD2y H 1 7.396 0.004 A 23 ASN HD2x H 1 6.755 0.005 A 23 ASN CA C 13 57.400 0.000 A 23 ASN CB C 13 39.031 0.070 A 23 ASN N N 15 118.714 0.000 A 23 ASN ND2 N 15 112.041 0.000 A 24 TYR H H 1 8.107 0.002 A 24 TYR HA H 1 3.914 0.005 A 24 TYR HBx H 1 3.098 0.006 A 24 TYR HBy H 1 3.185 0.006 A 24 TYR HDx H 1 7.176 0.011 A 24 TYR HDy H 1 7.176 0.011 A 24 TYR HEx H 1 6.825 0.017 A 24 TYR HEy H 1 6.825 0.017 A 24 TYR CA C 13 61.200 0.000 A 24 TYR CB C 13 38.083 0.000 A 24 TYR N N 15 117.828 0.000 A 25 ASP H H 1 9.064 0.012 A 25 ASP HA H 1 4.629 0.009 A 25 ASP HBx H 1 2.790 0.006 A 25 ASP HBy H 1 3.151 0.003 A 25 ASP CA C 13 57.400 0.000 A 25 ASP CB C 13 40.300 0.000 A 25 ASP N N 15 119.620 0.000 A 26 CYS H H 1 9.280 0.003 A 26 CYS HA H 1 4.105 0.007 A 26 CYS HBy H 1 2.878 0.008 A 26 CYS HBx H 1 2.283 0.003 A 26 CYS CA C 13 60.200 0.000 A 26 CYS CB C 13 36.600 0.000 A 26 CYS N N 15 120.031 0.000 A 27 LYS H H 1 7.646 0.006 A 27 LYS HA H 1 4.104 0.008 A 27 LYS HBy H 1 1.684 0.008 A 27 LYS HBx H 1 1.592 0.019 A 27 LYS HDy H 1 1.662 0.023 A 27 LYS HDx H 1 1.645 0.003 A 27 LYS HEy H 1 2.959 0.006 A 27 LYS HEx H 1 2.943 0.000 A 27 LYS HGy H 1 1.384 0.067 A 27 LYS HGx H 1 1.091 0.006 A 27 LYS CA C 13 59.300 0.000 A 27 LYS CB C 13 32.200 0.000 A 27 LYS CD C 13 28.738 0.066 A 27 LYS CE C 13 41.750 0.070 A 27 LYS CG C 13 23.979 0.000 A 27 LYS N N 15 119.838 0.000 A 28 LEU H H 1 8.257 0.005 A 28 LEU HA H 1 4.035 0.002 A 28 LEU HBy H 1 1.630 0.000 A 28 LEU HBx H 1 1.481 0.000 A 28 LEU HDx% H 1 0.807 0.007 A 28 LEU HDy% H 1 0.783 0.001 A 28 LEU HG H 1 1.567 0.008 A 28 LEU CA C 13 57.200 0.000 A 28 LEU CB C 13 41.992 0.000 A 28 LEU CDy C 13 23.887 0.000 A 28 LEU CDx C 13 23.717 0.000 A 28 LEU CG C 13 26.766 0.005 A 28 LEU N N 15 119.791 0.000 A 29 ASP H H 1 8.977 0.006 A 29 ASP HA H 1 4.476 0.007 A 29 ASP HBx H 1 2.779 0.001 A 29 ASP HBy H 1 2.985 0.006 A 29 ASP CA C 13 55.597 0.000 A 29 ASP CB C 13 40.300 0.000 A 29 ASP N N 15 116.737 0.000 A 30 LYS H H 1 6.618 0.013 A 30 LYS HA H 1 4.481 0.000 A 30 LYS HBx H 1 2.209 0.004 A 30 LYS HBy H 1 2.317 0.008 A 30 LYS HDx H 1 1.202 0.000 A 30 LYS HEx H 1 1.497 0.002 A 30 LYS HEy H 1 2.141 0.001 A 30 LYS HGy H 1 1.172 0.012 A 30 LYS HGx H 1 0.815 0.006 A 30 LYS CA C 13 52.979 0.000 A 30 LYS CB C 13 31.484 0.000 A 30 LYS CD C 13 27.398 0.000 A 30 LYS CE C 13 40.924 0.000 A 30 LYS CG C 13 24.304 0.000 A 30 LYS N N 15 111.907 0.000 A 31 HIS H H 1 7.013 0.006 A 31 HIS HA H 1 4.542 0.004 A 31 HIS HBx H 1 3.499 0.004 A 31 HIS HBy H 1 3.499 0.019 A 31 HIS CA C 13 55.900 0.000 A 31 HIS CB C 13 25.467 0.000 A 31 HIS N N 15 112.966 0.000 A 32 ALA H H 1 7.644 0.009 A 32 ALA HA H 1 4.055 0.005 A 32 ALA HB% H 1 0.527 0.005 A 32 ALA CA C 13 50.400 0.000 A 32 ALA CB C 13 18.900 0.000 A 32 ALA N N 15 120.001 0.000 A 33 ARG H H 1 8.254 0.014 A 33 ARG HA H 1 4.137 0.006 A 33 ARG HBy H 1 1.473 0.003 A 33 ARG HBx H 1 1.360 0.004 A 33 ARG HDy H 1 2.592 0.015 A 33 ARG HDx H 1 2.400 0.011 A 33 ARG HGy H 1 1.432 0.003 A 33 ARG HGx H 1 1.302 0.007 A 33 ARG CA C 13 57.898 0.000 A 33 ARG CB C 13 30.387 0.000 A 33 ARG CD C 13 42.792 0.000 A 33 ARG CG C 13 27.430 0.000 A 33 ARG N N 15 116.588 0.000 A 34 SER H H 1 7.989 0.005 A 34 SER HA H 1 4.593 0.006 A 34 SER HBy H 1 4.115 0.000 A 34 SER HBx H 1 3.950 0.006 A 34 SER CA C 13 57.500 0.000 A 34 SER CB C 13 64.825 0.000 A 34 SER N N 15 109.178 0.000 A 35 GLY H H 1 8.633 0.003 A 35 GLY HAx H 1 4.016 0.004 A 35 GLY HAy H 1 4.786 0.001 A 35 GLY CA C 13 46.700 0.000 A 35 GLY N N 15 107.345 0.000 A 36 GLU H H 1 8.236 0.003 A 36 GLU HA H 1 4.292 0.012 A 36 GLU HBy H 1 1.990 0.004 A 36 GLU HBx H 1 1.852 0.008 A 36 GLU HGx H 1 2.013 0.013 A 36 GLU HGy H 1 2.016 0.000 A 36 GLU CA C 13 55.200 0.000 A 36 GLU CB C 13 32.664 0.000 A 36 GLU CG C 13 34.674 0.000 A 36 GLU N N 15 118.288 0.000 A 37 CYS H H 1 8.856 0.005 A 37 CYS HA H 1 6.003 0.005 A 37 CYS HBx H 1 2.573 0.002 A 37 CYS HBy H 1 3.640 0.004 A 37 CYS CA C 13 56.200 0.000 A 37 CYS CB C 13 45.700 0.000 A 37 CYS N N 15 120.776 0.000 A 38 PHE H H 1 9.082 0.011 A 38 PHE HA H 1 4.687 0.012 A 38 PHE HBy H 1 3.032 0.003 A 38 PHE HBx H 1 2.719 0.008 A 38 PHE HDx H 1 7.181 0.004 A 38 PHE HDy H 1 7.181 0.004 A 38 PHE HEx H 1 7.275 0.021 A 38 PHE HEy H 1 7.275 0.021 A 38 PHE CA C 13 56.500 0.000 A 38 PHE CB C 13 43.013 0.050 A 38 PHE N N 15 121.520 0.000 A 39 TYR H H 1 8.683 0.006 A 39 TYR HA H 1 4.612 0.001 A 39 TYR HBy H 1 2.793 0.009 A 39 TYR HBx H 1 2.788 0.010 A 39 TYR HDx H 1 6.952 0.012 A 39 TYR HDy H 1 6.952 0.012 A 39 TYR HEx H 1 6.730 0.000 A 39 TYR HEy H 1 6.730 0.000 A 39 TYR CA C 13 57.800 0.000 A 39 TYR CB C 13 38.100 0.000 A 39 TYR N N 15 122.581 0.000 A 40 LYS H H 1 8.319 0.009 A 40 LYS HA H 1 4.319 0.001 A 40 LYS HBy H 1 1.874 0.005 A 40 LYS HBx H 1 1.698 0.005 A 40 LYS HDx H 1 1.649 0.000 A 40 LYS HEx H 1 2.818 0.000 A 40 LYS HEy H 1 2.931 0.000 A 40 LYS HGx H 1 1.429 0.003 A 40 LYS CA C 13 55.700 0.000 A 40 LYS CB C 13 32.800 0.000 A 40 LYS CD C 13 28.780 0.000 A 40 LYS CE C 13 41.684 0.000 A 40 LYS CG C 13 24.314 0.000 A 40 LYS N N 15 126.022 0.000 A 41 GLU H H 1 8.657 0.008 A 41 GLU HA H 1 4.127 0.010 A 41 GLU HBy H 1 2.145 0.001 A 41 GLU HBx H 1 2.042 0.005 A 41 GLU HGx H 1 2.286 0.008 A 41 GLU HGy H 1 2.297 0.000 A 41 GLU CA C 13 56.800 0.000 A 41 GLU CB C 13 29.063 0.000 A 41 GLU CG C 13 36.010 0.000 A 41 GLU N N 15 120.017 0.000 A 42 LYS H H 1 8.468 0.020 A 42 LYS HA H 1 3.792 0.012 A 42 LYS HBx H 1 1.887 0.009 A 42 LYS HBy H 1 1.888 0.010 A 42 LYS HDx H 1 1.629 0.012 A 42 LYS HEx H 1 2.931 0.000 A 42 LYS HGx H 1 1.377 0.003 A 42 LYS CA C 13 57.700 0.000 A 42 LYS CB C 13 30.800 0.000 A 42 LYS CD C 13 28.780 0.000 A 42 LYS CE C 13 41.780 0.000 A 42 LYS CG C 13 25.014 0.000 A 42 LYS N N 15 116.887 0.000 A 43 ARG H H 1 8.165 0.004 A 43 ARG HA H 1 4.226 0.003 A 43 ARG HBy H 1 1.974 0.004 A 43 ARG HBx H 1 1.788 0.005 A 43 ARG HDx H 1 3.130 0.002 A 43 ARG HGx H 1 1.546 0.005 A 43 ARG HGy H 1 1.573 0.002 A 43 ARG CA C 13 56.000 0.000 A 43 ARG CB C 13 29.800 0.000 A 43 ARG CD C 13 42.756 0.000 A 43 ARG CG C 13 26.898 0.000 A 43 ARG N N 15 115.559 0.000 A 44 ASN H H 1 7.983 0.007 A 44 ASN HA H 1 4.881 0.007 A 44 ASN HBy H 1 2.839 0.004 A 44 ASN HBx H 1 2.700 0.011 A 44 ASN HD2y H 1 7.531 0.002 A 44 ASN HD2x H 1 6.819 0.002 A 44 ASN CA C 13 52.400 0.000 A 44 ASN CB C 13 39.200 0.000 A 44 ASN N N 15 117.868 0.000 A 44 ASN ND2 N 15 111.460 0.000 A 45 LEU H H 1 8.193 0.008 A 45 LEU HA H 1 4.306 0.004 A 45 LEU HBx H 1 1.262 0.008 A 45 LEU HBy H 1 1.528 0.002 A 45 LEU HDx% H 1 0.529 0.000 A 45 LEU HDy% H 1 0.369 0.003 A 45 LEU HG H 1 1.308 0.008 A 45 LEU CA C 13 55.100 0.000 A 45 LEU CB C 13 43.067 0.000 A 45 LEU CDy C 13 25.083 0.000 A 45 LEU CDx C 13 23.216 0.000 A 45 LEU CG C 13 26.409 0.000 A 45 LEU N N 15 125.712 0.000 A 46 GLN H H 1 8.425 0.009 A 46 GLN HA H 1 4.665 0.006 A 46 GLN HBy H 1 2.002 0.004 A 46 GLN HBx H 1 1.856 0.002 A 46 GLN HE2x H 1 6.702 0.006 A 46 GLN HE2y H 1 7.438 0.012 A 46 GLN HGx H 1 2.266 0.008 A 46 GLN HGy H 1 2.266 0.008 A 46 GLN CA C 13 54.000 0.000 A 46 GLN CB C 13 32.961 0.000 A 46 GLN CG C 13 33.674 0.000 A 46 GLN N N 15 120.613 0.000 A 46 GLN NE2 N 15 110.329 0.000 A 47 CYS H H 1 9.198 0.003 A 47 CYS HA H 1 4.803 0.016 A 47 CYS HBx H 1 1.692 0.005 A 47 CYS HBy H 1 2.520 0.007 A 47 CYS CA C 13 54.700 0.000 A 47 CYS CB C 13 38.000 0.000 A 47 CYS N N 15 122.193 0.000 A 48 ILE H H 1 8.696 0.015 A 48 ILE HA H 1 4.300 0.008 A 48 ILE HB H 1 2.091 0.005 A 48 ILE HD1% H 1 0.685 0.006 A 48 ILE HG1y H 1 1.554 0.006 A 48 ILE HG1x H 1 1.092 0.006 A 48 ILE HG2% H 1 0.717 0.002 A 48 ILE CA C 13 60.200 0.000 A 48 ILE CB C 13 38.100 0.000 A 48 ILE CD1 C 13 12.074 0.000 A 48 ILE CG1 C 13 27.393 0.000 A 48 ILE CG2 C 13 17.847 0.000 A 48 ILE N N 15 129.093 0.000 A 49 CYS H H 1 8.555 0.005 A 49 CYS HA H 1 5.267 0.007 A 49 CYS HBx H 1 2.597 0.001 A 49 CYS HBy H 1 2.613 0.011 A 49 CYS CA C 13 51.387 0.000 A 49 CYS CB C 13 35.547 0.000 A 49 CYS N N 15 126.279 0.000 A 50 ASP H H 1 8.813 0.006 A 50 ASP HA H 1 5.463 0.003 A 50 ASP HBy H 1 3.054 0.005 A 50 ASP HBx H 1 2.261 0.003 A 50 ASP CA C 13 52.100 0.000 A 50 ASP CB C 13 43.046 0.000 A 50 ASP N N 15 122.491 0.000 A 51 TYR H H 1 9.633 0.004 A 51 TYR HA H 1 4.200 0.005 A 51 TYR HBx H 1 2.866 0.006 A 51 TYR HBy H 1 3.424 0.002 A 51 TYR HDx H 1 7.295 0.007 A 51 TYR HDy H 1 7.295 0.007 A 51 TYR HEx H 1 6.671 0.004 A 51 TYR HEy H 1 6.671 0.004 A 51 TYR CA C 13 59.100 0.000 A 51 TYR CB C 13 38.500 0.000 A 51 TYR N N 15 124.921 0.000 A 52 CYS H H 1 9.550 0.005 A 52 CYS HA H 1 4.414 0.007 A 52 CYS HBx H 1 3.105 0.009 A 52 CYS HBy H 1 3.487 0.002 A 52 CYS CA C 13 54.800 0.000 A 52 CYS CB C 13 44.000 0.000 A 52 CYS N N 15 120.435 0.000 A 53 GLU H H 1 8.335 0.006 A 53 GLU HA H 1 4.247 0.005 A 53 GLU HBy H 1 1.967 0.001 A 53 GLU HBx H 1 1.723 0.004 A 53 GLU HGx H 1 2.122 0.000 A 53 GLU HGy H 1 2.213 0.001 A 53 GLU CA C 13 55.300 0.000 A 53 GLU CB C 13 31.073 0.000 A 53 GLU CG C 13 35.465 0.000 A 53 GLU N N 15 120.972 0.000 A 54 TYR H H 1 7.754 0.003 A 54 TYR HA H 1 4.179 0.008 A 54 TYR HBx H 1 2.711 0.006 A 54 TYR HBy H 1 3.115 0.003 A 54 TYR HDx H 1 7.116 0.005 A 54 TYR HDy H 1 7.116 0.005 A 54 TYR CA C 13 59.165 0.000 A 54 TYR CB C 13 39.160 0.000 A 54 TYR N N 15 125.458 0.000 stop_ save_ save_DYANA/DIANA_distance_constraints_2 _nef_distance_restraint_list.sf_category nef_distance_restraint_list _nef_distance_restraint_list.sf_framecode DYANA/DIANA_distance_constraints_2 _nef_distance_restraint_list.restraint_origin noe _nef_distance_restraint_list.potential_type upper-bound-parabolic loop_ _nef_distance_restraint.index _nef_distance_restraint.restraint_id _nef_distance_restraint.chain_code_1 _nef_distance_restraint.sequence_code_1 _nef_distance_restraint.residue_name_1 _nef_distance_restraint.atom_name_1 _nef_distance_restraint.chain_code_2 _nef_distance_restraint.sequence_code_2 _nef_distance_restraint.residue_name_2 _nef_distance_restraint.atom_name_2 _nef_distance_restraint.weight _nef_distance_restraint.lower_limit _nef_distance_restraint.upper_limit 1 1 A 3 LYS H A 4 CYS H 1.0 . 3.73 2 2 A 4 CYS H A 3 LYS HA 1.0 . 3.43 3 3 A 4 CYS H A 3 LYS HBy 1.0 . 4.53 4 4 A 4 CYS H A 3 LYS HBx 1.0 . 4.53 5 5 A 4 CYS H A 5 LYS H 1.0 . 3.83 6 6 A 5 LYS H A 4 CYS HA 1.0 . 3.45 7 7 A 5 LYS HA A 6 LYS H 1.0 . 2.89 8 8 A 6 LYS H A 5 LYS HBx 1.0 . 4.05 9 9 A 6 LYS HA A 7 VAL H 1.0 . 2.54 10 10 A 7 VAL H A 6 LYS HBx 1.0 . 4.16 11 11 A 7 VAL HB A 8 TYR H 1.0 . 3.98 12 12 A 8 TYR HA A 9 GLU H 1.0 . 2.51 13 13 A 9 GLU H A 8 TYR HBy 1.0 . 5.21 14 14 A 9 GLU H A 8 TYR HD% 1.0 . 3.58 15 15 A 11 TYR H A 10 ASN HBx 1.0 . 4.59 16 16 A 12 PRO HA A 13 VAL H 1.0 . 2.40 17 17 A 13 VAL H A 12 PRO HBx 1.0 . 4.35 18 18 A 13 VAL H A 14 SER H 1.0 . 3.11 19 19 A 14 SER H A 13 VAL HA 1.0 . 3.40 20 20 A 16 CYS H A 17 GLN H 1.0 . 3.51 21 21 A 17 GLN H A 16 CYS HBx 1.0 . 3.75 22 22 A 17 GLN H A 18 LEU H 1.0 . 4.07 23 23 A 18 LEU H A 17 GLN HA 1.0 . 3.46 24 24 A 18 LEU H A 17 GLN HBy 1.0 . 4.62 25 25 A 18 LEU H A 17 GLN HBx 1.0 . 4.52 26 26 A 19 ALA H A 18 LEU HDx% 1.0 . 5.41 27 27 A 19 ALA HB% A 20 ASN H 1.0 . 3.09 28 28 A 20 ASN H A 21 GLN H 1.0 . 4.24 29 29 A 21 GLN H A 20 ASN HA 1.0 . 3.42 30 30 A 21 GLN H A 20 ASN HBy 1.0 . 4.30 31 31 A 21 GLN H A 20 ASN HBx 1.0 . 4.30 32 32 A 22 CYS H A 21 GLN HBy 1.0 . 3.44 33 33 A 22 CYS HA A 23 ASN H 1.0 . 3.40 34 34 A 23 ASN HD2y A 24 TYR H 1.0 . 3.76 35 35 A 24 TYR HA A 25 ASP H 1.0 . 3.53 36 36 A 25 ASP H A 24 TYR HD% 1.0 . 3.67 37 37 A 25 ASP H A 26 CYS H 1.0 . 3.45 38 38 A 26 CYS H A 25 ASP HBx 1.0 . 3.42 39 39 A 27 LYS H A 28 LEU H 1.0 . 3.80 40 40 A 28 LEU H A 29 ASP H 1.0 . 3.40 41 41 A 29 ASP H A 28 LEU HBy 1.0 . 3.75 42 42 A 29 ASP H A 28 LEU HG 1.0 . 3.58 43 43 A 29 ASP H A 28 LEU HDy% 1.0 . 4.70 44 44 A 30 LYS H A 29 ASP HBx 1.0 . 3.78 45 45 A 30 LYS H A 29 ASP HBy 1.0 . 3.78 46 46 A 29 ASP HA A 31 HIS H 1.0 . 4.76 47 47 A 31 HIS H A 30 LYS HBx 1.0 . 4.05 48 48 A 31 HIS H A 30 LYS HGy 1.0 . 4.96 49 49 A 31 HIS H A 32 ALA H 1.0 . 3.87 50 50 A 32 ALA H A 33 ARG H 1.0 . 5.50 51 51 A 33 ARG H A 32 ALA HA 1.0 . 2.78 52 52 A 33 ARG H A 32 ALA HB% 1.0 . 3.75 53 53 A 33 ARG HBx A 34 SER H 1.0 . 3.86 54 54 A 34 SER H A 35 GLY H 1.0 . 4.53 55 55 A 35 GLY H A 34 SER HBx 1.0 . 3.16 56 56 A 36 GLU HA A 37 CYS H 1.0 . 2.54 57 57 A 37 CYS H A 36 GLU HBx 1.0 . 3.76 58 58 A 38 PHE H A 39 TYR H 1.0 . 5.50 59 59 A 39 TYR H A 38 PHE HD% 1.0 . 4.69 60 60 A 39 TYR HBx A 40 LYS H 1.0 . 4.48 61 61 A 40 LYS H A 39 TYR HD% 1.0 . 4.26 62 62 A 40 LYS H A 41 GLU H 1.0 . 4.51 63 63 A 41 GLU H A 42 LYS H 1.0 . 4.66 64 64 A 42 LYS H A 43 ARG H 1.0 . 3.05 65 65 A 43 ARG HBx A 44 ASN H 1.0 . 3.63 66 66 A 44 ASN H A 43 ARG HBy 1.0 . 3.50 67 67 A 45 LEU H A 44 ASN HBy 1.0 . 4.13 68 68 A 45 LEU H A 44 ASN HBx 1.0 . 4.13 69 69 A 45 LEU H A 46 GLN H 1.0 . 5.50 70 70 A 46 GLN H A 45 LEU HA 1.0 . 2.94 71 71 A 46 GLN H A 45 LEU HBx 1.0 . 4.59 72 72 A 46 GLN H A 45 LEU HDx% 1.0 . 4.13 73 73 A 46 GLN H A 45 LEU HDy% 1.0 . 4.13 74 74 A 47 CYS H A 46 GLN HGy 1.0 . 4.10 75 75 A 47 CYS H A 46 GLN HGx 1.0 . 4.10 76 76 A 47 CYS H A 48 ILE H 1.0 . 4.70 77 77 A 48 ILE HB A 49 CYS H 1.0 . 4.53 78 78 A 49 CYS H A 48 ILE HG2% 1.0 . 3.78 79 79 A 49 CYS H A 48 ILE HG1y 1.0 . 5.50 80 80 A 49 CYS H A 50 ASP H 1.0 . 4.86 81 81 A 50 ASP H A 49 CYS HBy 1.0 . 3.41 82 82 A 51 TYR H A 4 CYS HBx 1.0 . 4.21 83 83 A 51 TYR HD% A 52 CYS H 1.0 . 5.50 84 84 A 53 GLU H A 54 TYR H 1.0 . 4.17 85 85 A 54 TYR H A 53 GLU HBy 1.0 . 4.01 86 86 A 54 TYR H A 53 GLU HBx 1.0 . 4.01 87 87 A 54 TYR H A 53 GLU HGx 1.0 . 4.67 88 88 A 4 CYS H A 4 CYS HA 1.0 . 2.76 89 89 A 5 LYS H A 5 LYS HBx 1.0 . 3.57 90 90 A 7 VAL H A 7 VAL HGx% 1.0 . 3.69 91 91 A 8 TYR H A 8 TYR HBy 1.0 . 3.04 92 92 A 8 TYR H A 8 TYR HBx 1.0 . 3.04 93 93 A 8 TYR H A 8 TYR HD% 1.0 . 4.36 94 94 A 9 GLU H A 9 GLU HBx 1.0 . 3.65 95 95 A 9 GLU H A 9 GLU HGx 1.0 . 3.42 96 96 A 11 TYR H A 11 TYR HBx 1.0 . 3.79 97 97 A 11 TYR H A 11 TYR HD% 1.0 . 5.14 98 98 A 15 LYS H A 15 LYS HBy 1.0 . 3.50 99 99 A 15 LYS H A 15 LYS HGx 1.0 . 3.80 100 100 A 16 CYS H A 16 CYS HBy 1.0 . 3.58 101 101 A 18 LEU H A 18 LEU HDy% 1.0 . 4.68 102 102 A 20 ASN H A 20 ASN HBx 1.0 . 3.70 103 103 A 21 GLN H A 21 GLN HBx 1.0 . 3.66 104 104 A 21 GLN H A 21 GLN HGy 1.0 . 3.73 105 105 A 21 GLN H A 21 GLN HGx 1.0 . 3.73 106 106 A 24 TYR H A 24 TYR HBy 1.0 . 3.90 107 107 A 24 TYR H A 24 TYR HD% 1.0 . 4.07 108 108 A 26 CYS H A 26 CYS HA 1.0 . 2.94 109 109 A 26 CYS H A 26 CYS HBx 1.0 . 3.67 110 110 A 27 LYS H A 27 LYS HGx 1.0 . 4.39 111 111 A 28 LEU H A 28 LEU HG 1.0 . 5.06 112 112 A 28 LEU H A 28 LEU HDy% 1.0 . 4.45 113 113 A 30 LYS H A 30 LYS HBy 1.0 . 3.59 114 114 A 30 LYS H A 30 LYS HGy 1.0 . 3.70 115 115 A 30 LYS H A 30 LYS HEx 1.0 . 5.50 116 116 A 30 LYS H A 30 LYS HEy 1.0 . 5.50 117 117 A 31 HIS H A 31 HIS HA 1.0 . 2.70 118 118 A 32 ALA H A 32 ALA HB% 1.0 . 3.13 119 119 A 33 ARG H A 33 ARG HBy 1.0 . 2.90 120 120 A 34 SER H A 33 ARG HA 1.0 . 3.45 121 121 A 37 CYS H A 37 CYS HBx 1.0 . 3.66 122 122 A 38 PHE H A 38 PHE HD% 1.0 . 3.97 123 123 A 39 TYR H A 39 TYR HBy 1.0 . 3.40 124 124 A 39 TYR H A 39 TYR HD% 1.0 . 4.00 125 125 A 40 LYS H A 40 LYS HBy 1.0 . 3.49 126 126 A 40 LYS H A 40 LYS HBx 1.0 . 3.49 127 127 A 41 GLU H A 41 GLU HGx 1.0 . 4.71 128 128 A 43 ARG H A 43 ARG HBx 1.0 . 3.67 129 129 A 44 ASN H A 44 ASN HBx 1.0 . 3.20 130 130 A 45 LEU H A 45 LEU HG 1.0 . 4.87 131 131 A 45 LEU H A 45 LEU HBy 1.0 . 3.15 132 132 A 46 GLN H A 46 GLN HBy 1.0 . 3.93 133 133 A 46 GLN H A 46 GLN HBx 1.0 . 3.93 134 134 A 47 CYS H A 47 CYS HBx 1.0 . 3.78 135 135 A 48 ILE H A 48 ILE HB 1.0 . 3.47 136 136 A 48 ILE H A 48 ILE HG2% 1.0 . 3.82 137 137 A 48 ILE H A 48 ILE HG1y 1.0 . 3.43 138 138 A 48 ILE H A 48 ILE HG1x 1.0 . 3.43 139 139 A 50 ASP H A 50 ASP HBx 1.0 . 3.80 140 140 A 51 TYR H A 4 CYS HBy 1.0 . 4.21 141 141 A 51 TYR H A 51 TYR HD% 1.0 . 4.09 142 142 A 53 GLU H A 53 GLU HGx 1.0 . 4.37 143 143 A 54 TYR H A 54 TYR HBy 1.0 . 3.63 144 144 A 20 ASN HA A 20 ASN HD2y 1.0 . 5.28 145 145 A 20 ASN HA A 20 ASN HD2x 1.0 . 5.28 146 146 A 23 ASN HD2x A 23 ASN HBx 1.0 . 4.04 147 147 A 21 GLN HE2y A 21 GLN HGy 1.0 . 4.01 148 148 A 21 GLN HE2x A 21 GLN HGy 1.0 . 4.01 149 149 A 21 GLN HE2x A 21 GLN HGx 1.0 . 4.01 150 150 A 5 LYS H A 6 LYS H 1.0 . 4.56 151 151 A 11 TYR H A 10 ASN H 1.0 . 4.09 152 152 A 14 SER H A 15 LYS H 1.0 . 4.03 153 153 A 16 CYS H A 15 LYS H 1.0 . 3.21 154 154 A 18 LEU H A 19 ALA H 1.0 . 5.50 155 155 A 19 ALA H A 20 ASN H 1.0 . 3.99 156 156 A 21 GLN H A 22 CYS H 1.0 . 3.13 157 157 A 23 ASN H A 24 TYR H 1.0 . 3.89 158 158 A 24 TYR H A 25 ASP H 1.0 . 3.37 159 159 A 26 CYS H A 27 LYS H 1.0 . 3.60 160 160 A 29 ASP H A 30 LYS H 1.0 . 3.16 161 161 A 30 LYS H A 31 HIS H 1.0 . 3.10 162 162 A 33 ARG H A 34 SER H 1.0 . 3.44 163 163 A 35 GLY H A 36 GLU H 1.0 . 4.81 164 164 A 37 CYS H A 36 GLU H 1.0 . 5.41 165 165 A 39 TYR H A 40 LYS H 1.0 . 3.88 166 166 A 43 ARG H A 44 ASN H 1.0 . 2.89 167 167 A 46 GLN H A 47 CYS H 1.0 . 5.50 168 168 A 50 ASP H A 51 TYR H 1.0 . 4.62 169 169 A 52 CYS H A 53 GLU H 1.0 . 4.55 170 170 A 23 ASN H A 22 CYS HBx 1.0 . 3.35 171 171 A 6 LYS H A 48 ILE HG2% 1.0 . 3.62 172 172 A 7 VAL H A 48 ILE HG2% 1.0 . 3.87 173 173 A 8 TYR H A 49 CYS H 1.0 . 4.09 174 174 A 6 LYS H A 51 TYR HD% 1.0 . 4.72 175 175 A 12 PRO HA A 14 SER H 1.0 . 3.98 176 176 A 13 VAL HA A 16 CYS H 1.0 . 3.57 177 177 A 14 SER H A 16 CYS H 1.0 . 4.73 178 178 A 17 GLN H A 18 LEU HG 1.0 . 4.31 179 179 A 18 LEU H A 16 CYS HA 1.0 . 3.68 180 180 A 19 ALA HB% A 20 ASN HD2x 1.0 . 4.41 181 181 A 21 GLN H A 18 LEU HBy 1.0 . 4.01 182 182 A 26 CYS H A 28 LEU H 1.0 . 4.74 183 183 A 27 LYS H A 29 ASP H 1.0 . 4.50 184 184 A 29 ASP H A 31 HIS H 1.0 . 4.74 185 185 A 28 LEU H A 30 LYS H 1.0 . 4.58 186 186 A 25 ASP H A 21 GLN HA 1.0 . 3.65 187 187 A 24 TYR HA A 27 LYS H 1.0 . 4.05 188 188 A 28 LEU H A 25 ASP HA 1.0 . 5.40 189 189 A 30 LYS H A 26 CYS HA 1.0 . 3.35 190 190 A 29 ASP H A 25 ASP HA 1.0 . 5.42 191 191 A 34 SER H A 50 ASP H 1.0 . 3.12 192 192 A 35 GLY H A 23 ASN HA 1.0 . 3.92 193 193 A 34 SER H A 50 ASP HBy 1.0 . 4.01 194 194 A 36 GLU H A 49 CYS HA 1.0 . 3.74 195 195 A 46 GLN HE2x A 7 VAL HGx% 1.0 . 4.40 196 196 A 50 ASP H A 35 GLY HAy 1.0 . 3.88 197 197 A 32 ALA HB% A 50 ASP H 1.0 . 3.31 198 198 A 48 ILE H A 36 GLU H 1.0 . 4.84 199 199 A 6 LYS H A 49 CYS H 1.0 . 3.36 200 200 A 38 PHE H A 48 ILE H 1.0 . 4.87 201 201 A 38 PHE HD% A 48 ILE H 1.0 . 4.79 202 202 A 39 TYR HD% A 44 ASN H 1.0 . 5.50 203 203 A 38 PHE H A 46 GLN H 1.0 . 3.21 204 204 A 8 TYR H A 47 CYS H 1.0 . 4.14 205 205 A 22 CYS HA A 26 CYS H 1.0 . 3.84 206 206 A 54 TYR H A 54 TYR HD% 1.0 . 4.65 207 207 A 11 TYR H A 11 TYR HBy 1.0 . 3.79 208 208 A 24 TYR HD% A 21 GLN HE2x 1.0 . 3.87 209 209 A 24 TYR HD% A 21 GLN HE2y 1.0 . 3.87 210 210 A 24 TYR H A 23 ASN HBy 1.0 . 3.48 211 211 A 6 LYS H A 51 TYR HE% 1.0 . 4.31 212 212 A 6 LYS H A 49 CYS HBx 1.0 . 4.07 213 213 A 6 LYS H A 49 CYS HBy 1.0 . 4.07 214 214 A 22 CYS H A 23 ASN H 1.0 . 3.52 215 215 A 20 ASN HA A 24 TYR H 1.0 . 4.41 216 216 A 20 ASN HA A 23 ASN H 1.0 . 4.41 217 217 A 29 ASP H A 26 CYS HA 1.0 . 3.88 218 218 A 31 HIS H A 31 HIS HBy 1.0 . 4.19 219 219 A 37 CYS H A 36 GLU HGx 1.0 . 3.95 220 220 A 39 TYR H A 39 TYR HBx 1.0 . 3.40 221 221 A 27 LYS H A 27 LYS HGy 1.0 . 4.39 222 222 A 27 LYS H A 27 LYS HBx 1.0 . 3.31 223 223 A 23 ASN HD2y A 34 SER HA 1.0 . 4.59 224 224 A 23 ASN HD2x A 34 SER HA 1.0 . 4.52 225 225 A 18 LEU H A 15 LYS HA 1.0 . 3.80 226 226 A 38 PHE H A 45 LEU HDy% 1.0 . 5.50 227 227 A 17 GLN H A 15 LYS HA 1.0 . 3.86 228 228 A 31 HIS H A 30 LYS HGx 1.0 . 4.76 229 229 A 10 ASN HD2y A 9 GLU HBy 1.0 . 5.32 230 230 A 10 ASN HD2y A 9 GLU HBx 1.0 . 5.32 231 231 A 24 TYR H A 26 CYS H 1.0 . 5.50 232 232 A 23 ASN H A 25 ASP H 1.0 . 4.02 233 233 A 26 CYS H A 8 TYR HE% 1.0 . 4.20 234 234 A 20 ASN H A 22 CYS H 1.0 . 5.33 235 235 A 32 ALA H A 30 LYS HBy 1.0 . 3.71 236 236 A 30 LYS H A 32 ALA H 1.0 . 4.05 237 237 A 5 LYS H A 5 LYS HBy 1.0 . 3.57 238 238 A 5 LYS H A 5 LYS HDx 1.0 . 5.50 239 239 A 5 LYS H A 5 LYS HDy 1.0 . 5.50 240 240 A 6 LYS HEx A 6 LYS HBy 1.0 . 5.38 241 241 A 6 LYS HEx A 6 LYS HBx 1.0 . 5.38 242 242 A 6 LYS HBx A 6 LYS HEy 1.0 . 5.38 243 243 A 6 LYS HA A 6 LYS HEx 1.0 . 5.50 244 244 A 6 LYS HA A 6 LYS HEy 1.0 . 5.50 245 245 A 6 LYS HBy A 6 LYS HEy 1.0 . 5.38 246 246 A 7 VAL H A 7 VAL HB 1.0 . 3.73 247 247 A 7 VAL HA A 7 VAL HGx% 1.0 . 3.07 248 248 A 7 VAL H A 7 VAL HGy% 1.0 . 3.69 249 249 A 9 GLU H A 9 GLU HBy 1.0 . 3.65 250 250 A 9 GLU HA A 9 GLU HGx 1.0 . 4.14 251 251 A 9 GLU H A 9 GLU HGy 1.0 . 3.42 252 252 A 10 ASN HD2y A 10 ASN HBx 1.0 . 3.53 253 253 A 13 VAL H A 13 VAL HB 1.0 . 3.44 254 254 A 13 VAL H A 13 VAL HGx% 1.0 . 3.58 255 255 A 13 VAL HA A 13 VAL HGx% 1.0 . 3.18 256 256 A 13 VAL H A 13 VAL HGy% 1.0 . 3.58 257 257 A 13 VAL HA A 13 VAL HGy% 1.0 . 3.18 258 258 A 15 LYS HBy A 15 LYS HEx 1.0 . 4.66 259 259 A 15 LYS H A 15 LYS HBx 1.0 . 3.50 260 260 A 15 LYS H A 15 LYS HGy 1.0 . 3.80 261 261 A 15 LYS HA A 15 LYS HEy 1.0 . 5.50 262 262 A 15 LYS HEy A 15 LYS HBx 1.0 . 4.66 263 263 A 15 LYS HA A 15 LYS HEx 1.0 . 5.50 264 264 A 16 CYS H A 16 CYS HBx 1.0 . 3.58 265 265 A 17 GLN H A 17 GLN HBx 1.0 . 3.42 266 266 A 17 GLN HA A 17 GLN HBx 1.0 . 2.90 267 267 A 17 GLN H A 17 GLN HBy 1.0 . 3.22 268 268 A 18 LEU HBy A 18 LEU HDx% 1.0 . 3.63 269 269 A 18 LEU HDx% A 18 LEU HBx 1.0 . 3.63 270 270 A 18 LEU H A 18 LEU HG 1.0 . 4.41 271 271 A 18 LEU H A 18 LEU HDx% 1.0 . 4.68 272 272 A 18 LEU HA A 18 LEU HDx% 1.0 . 3.91 273 273 A 18 LEU HA A 18 LEU HDy% 1.0 . 3.91 274 274 A 18 LEU HBy A 18 LEU HDy% 1.0 . 3.63 275 275 A 18 LEU HBx A 18 LEU HDy% 1.0 . 3.63 276 276 A 19 ALA H A 19 ALA HB% 1.0 . 3.77 277 277 A 20 ASN H A 20 ASN HBy 1.0 . 3.70 278 278 A 21 GLN H A 21 GLN HBy 1.0 . 3.66 279 279 A 21 GLN HA A 21 GLN HBx 1.0 . 3.01 280 280 A 21 GLN HE2y A 21 GLN HGx 1.0 . 4.01 281 281 A 23 ASN H A 23 ASN HBy 1.0 . 3.31 282 282 A 23 ASN H A 23 ASN HBx 1.0 . 3.31 283 283 A 24 TYR H A 24 TYR HBx 1.0 . 3.90 284 284 A 25 ASP H A 25 ASP HBx 1.0 . 3.94 285 285 A 25 ASP H A 25 ASP HBy 1.0 . 3.94 286 286 A 26 CYS H A 26 CYS HBy 1.0 . 3.67 287 287 A 28 LEU H A 28 LEU HBy 1.0 . 3.71 288 288 A 28 LEU H A 28 LEU HBx 1.0 . 3.71 289 289 A 28 LEU H A 28 LEU HDx% 1.0 . 4.45 290 290 A 29 ASP H A 29 ASP HBx 1.0 . 3.65 291 291 A 29 ASP H A 29 ASP HBy 1.0 . 3.65 292 292 A 30 LYS H A 30 LYS HBx 1.0 . 3.31 293 293 A 30 LYS HGy A 30 LYS HEy 1.0 . 3.92 294 294 A 30 LYS HGy A 30 LYS HA 1.0 . 2.79 295 295 A 30 LYS HGy A 30 LYS HEx 1.0 . 3.92 296 296 A 31 HIS H A 31 HIS HBx 1.0 . 4.19 297 297 A 33 ARG HBy A 33 ARG HDy 1.0 . 3.95 298 298 A 33 ARG HBx A 33 ARG HDy 1.0 . 3.80 299 299 A 33 ARG HA A 33 ARG HGy 1.0 . 3.18 300 300 A 33 ARG H A 33 ARG HGx 1.0 . 4.07 301 301 A 33 ARG HBy A 33 ARG HDx 1.0 . 3.95 302 302 A 36 GLU H A 36 GLU HBy 1.0 . 3.70 303 303 A 37 CYS H A 37 CYS HBy 1.0 . 3.66 304 304 A 38 PHE H A 38 PHE HBy 1.0 . 3.90 305 305 A 41 GLU H A 41 GLU HGy 1.0 . 4.71 306 306 A 43 ARG HBx A 43 ARG HA 1.0 . 2.92 307 307 A 44 ASN H A 44 ASN HBy 1.0 . 3.20 308 308 A 45 LEU H A 45 LEU HBx 1.0 . 3.15 309 309 A 45 LEU HBx A 45 LEU HDx% 1.0 . 3.62 310 310 A 45 LEU HBx A 45 LEU HDy% 1.0 . 3.62 311 311 A 45 LEU H A 45 LEU HDx% 1.0 . 4.42 312 312 A 45 LEU HA A 45 LEU HDx% 1.0 . 3.44 313 313 A 45 LEU HDx% A 45 LEU HBy 1.0 . 3.62 314 314 A 45 LEU HA A 45 LEU HDy% 1.0 . 3.44 315 315 A 47 CYS H A 47 CYS HBy 1.0 . 3.78 316 316 A 48 ILE HG2% A 48 ILE HG1y 1.0 . 3.47 317 317 A 48 ILE HG2% A 48 ILE HG1x 1.0 . 3.47 318 318 A 48 ILE H A 48 ILE HD1% 1.0 . 4.13 319 319 A 48 ILE HD1% A 48 ILE HA 1.0 . 3.69 320 320 A 48 ILE HB A 48 ILE HD1% 1.0 . 3.53 321 321 A 49 CYS H A 49 CYS HBy 1.0 . 3.37 322 322 A 50 ASP H A 50 ASP HBy 1.0 . 3.80 323 323 A 53 GLU H A 53 GLU HBx 1.0 . 4.14 324 324 A 53 GLU HA A 53 GLU HGy 1.0 . 4.19 325 325 A 54 TYR H A 54 TYR HBx 1.0 . 3.63 326 326 A 7 VAL H A 6 LYS HGy 1.0 . 4.28 327 327 A 7 VAL H A 6 LYS HGx 1.0 . 4.28 328 328 A 8 TYR H A 7 VAL HGx% 1.0 . 4.20 329 329 A 8 TYR H A 7 VAL HGy% 1.0 . 4.20 330 330 A 10 ASN H A 9 GLU HBx 1.0 . 3.64 331 331 A 10 ASN H A 9 GLU HBy 1.0 . 3.64 332 332 A 11 TYR H A 10 ASN HBy 1.0 . 4.59 333 333 A 13 VAL H A 12 PRO HBy 1.0 . 4.35 334 334 A 14 SER H A 13 VAL HGx% 1.0 . 4.89 335 335 A 14 SER H A 13 VAL HGy% 1.0 . 4.89 336 336 A 16 CYS H A 15 LYS HGx 1.0 . 5.17 337 337 A 16 CYS H A 15 LYS HGy 1.0 . 5.17 338 338 A 17 GLN H A 16 CYS HBy 1.0 . 3.75 339 339 A 19 ALA H A 18 LEU HG 1.0 . 5.42 340 340 A 19 ALA H A 18 LEU HDy% 1.0 . 5.41 341 341 A 22 CYS H A 21 GLN HBx 1.0 . 3.44 342 342 A 23 ASN H A 22 CYS HBy 1.0 . 3.35 343 343 A 25 ASP H A 24 TYR HBy 1.0 . 3.92 344 344 A 26 CYS H A 25 ASP HBy 1.0 . 3.42 345 345 A 27 LYS H A 26 CYS HBy 1.0 . 4.24 346 346 A 28 LEU H A 27 LYS HBy 1.0 . 4.17 347 347 A 28 LEU H A 27 LYS HBx 1.0 . 4.17 348 348 A 28 LEU H A 27 LYS HGy 1.0 . 5.50 349 349 A 29 ASP H A 28 LEU HBx 1.0 . 3.75 350 350 A 29 ASP H A 28 LEU HDx% 1.0 . 4.70 351 351 A 31 HIS H A 30 LYS HBy 1.0 . 4.24 352 352 A 34 SER H A 33 ARG HBy 1.0 . 3.58 353 353 A 34 SER H A 33 ARG HGy 1.0 . 5.50 354 354 A 34 SER H A 33 ARG HGx 1.0 . 5.50 355 355 A 39 TYR H A 38 PHE HBx 1.0 . 4.07 356 356 A 42 LYS H A 41 GLU HBy 1.0 . 3.98 357 357 A 42 LYS H A 41 GLU HBx 1.0 . 3.98 358 358 A 46 GLN H A 45 LEU HG 1.0 . 5.35 359 359 A 49 CYS H A 48 ILE HG1x 1.0 . 5.50 360 360 A 50 ASP H A 49 CYS HBx 1.0 . 3.41 361 361 A 53 GLU H A 52 CYS HBy 1.0 . 4.05 362 362 A 54 TYR H A 53 GLU HGy 1.0 . 4.67 363 363 A 52 CYS H A 4 CYS HBy 1.0 . 5.42 364 364 A 52 CYS H A 4 CYS HBx 1.0 . 5.42 365 365 A 48 ILE HG2% A 5 LYS HBy 1.0 . 3.56 366 366 A 48 ILE HG2% A 5 LYS HDy 1.0 . 3.85 367 367 A 48 ILE HA A 7 VAL HGx% 1.0 . 5.13 368 368 A 48 ILE HA A 7 VAL HGy% 1.0 . 5.13 369 369 A 46 GLN HE2y A 7 VAL HGy% 1.0 . 4.40 370 370 A 46 GLN HE2x A 7 VAL HGy% 1.0 . 4.40 371 371 A 11 TYR HA A 12 PRO HDy 1.0 . 3.54 372 372 A 16 CYS HBy A 45 LEU HDx% 1.0 . 4.21 373 373 A 16 CYS HBy A 45 LEU HDy% 1.0 . 4.21 374 374 A 19 ALA HB% A 21 GLN H 1.0 . 4.46 375 375 A 19 ALA HB% A 20 ASN HD2y 1.0 . 4.41 376 376 A 32 ALA HB% A 26 CYS HBy 1.0 . 4.70 377 377 A 30 LYS HBx A 32 ALA HB% 1.0 . 3.91 378 378 A 32 ALA HB% A 30 LYS HBy 1.0 . 4.11 379 379 A 32 ALA HB% A 34 SER H 1.0 . 3.22 380 380 A 48 ILE HD1% A 38 PHE HBy 1.0 . 4.17 381 381 A 48 ILE HG2% A 5 LYS HBx 1.0 . 3.56 382 382 A 38 PHE HD% A 48 ILE HB 1.0 . 3.61 383 383 A 38 PHE HD% A 48 ILE HD1% 1.0 . 3.69 384 384 A 8 TYR HBy A 47 CYS HBx 1.0 . 4.15 385 385 A 47 CYS HBx A 8 TYR HBx 1.0 . 4.15 386 386 A 8 TYR HBy A 47 CYS HBy 1.0 . 4.15 387 387 A 37 CYS HBy A 45 LEU HDy% 1.0 . 4.14 388 388 A 45 LEU HDx% A 37 CYS HBy 1.0 . 4.14 389 389 A 45 LEU HDx% A 37 CYS HBx 1.0 . 4.14 390 390 A 37 CYS HBx A 45 LEU HDy% 1.0 . 4.14 391 391 A 32 ALA HB% A 49 CYS HBx 1.0 . 3.59 392 392 A 32 ALA HB% A 49 CYS HBy 1.0 . 3.59 393 393 A 5 LYS HA A 5 LYS HDx 1.0 . 4.26 394 394 A 7 VAL HA A 48 ILE HD1% 1.0 . 3.88 395 395 A 38 PHE HD% A 48 ILE HG2% 1.0 . 4.53 396 396 A 53 GLU H A 52 CYS HBx 1.0 . 4.05 397 397 A 53 GLU HA A 53 GLU HGx 1.0 . 4.19 398 398 A 45 LEU HDx% A 16 CYS HBx 1.0 . 4.21 399 399 A 16 CYS HBx A 45 LEU HDy% 1.0 . 4.21 400 400 A 24 TYR HA A 27 LYS HBy 1.0 . 4.28 401 401 A 7 VAL HB A 48 ILE HA 1.0 . 5.13 402 402 A 48 ILE HD1% A 38 PHE HBx 1.0 . 4.17 403 403 A 9 GLU H A 8 TYR HBx 1.0 . 5.21 404 404 A 10 ASN HD2y A 10 ASN HBy 1.0 . 3.53 405 405 A 24 TYR H A 23 ASN HBx 1.0 . 3.48 406 406 A 23 ASN HD2x A 23 ASN HBy 1.0 . 4.04 407 407 A 32 ALA HB% A 26 CYS HBx 1.0 . 4.70 408 408 A 33 ARG HBx A 33 ARG HDx 1.0 . 3.80 409 409 A 33 ARG HA A 33 ARG HDy 1.0 . 4.18 410 410 A 32 ALA HB% A 51 TYR HA 1.0 . 3.62 411 411 A 32 ALA HB% A 51 TYR HD% 1.0 . 3.93 412 412 A 33 ARG H A 33 ARG HGy 1.0 . 4.07 413 413 A 33 ARG H A 33 ARG HBx 1.0 . 3.80 414 414 A 33 ARG HBx A 51 TYR HA 1.0 . 4.34 415 415 A 51 TYR HA A 33 ARG HGy 1.0 . 4.48 416 416 A 51 TYR HE% A 6 LYS HBy 1.0 . 4.09 417 417 A 7 VAL H A 6 LYS HBy 1.0 . 4.16 418 418 A 6 LYS H A 6 LYS HBy 1.0 . 3.70 419 419 A 6 LYS H A 6 LYS HBx 1.0 . 3.70 420 420 A 5 LYS HA A 5 LYS HDy 1.0 . 4.26 421 421 A 48 ILE HG2% A 5 LYS HDx 1.0 . 3.85 422 422 A 46 GLN HE2y A 7 VAL HGx% 1.0 . 4.40 423 423 A 51 TYR HE% A 49 CYS HBy 1.0 . 3.70 424 424 A 51 TYR HE% A 6 LYS HBx 1.0 . 4.09 425 425 A 51 TYR HE% A 6 LYS HGy 1.0 . 5.23 426 426 A 22 CYS HA A 25 ASP HBy 1.0 . 4.77 427 427 A 22 CYS HA A 25 ASP HBx 1.0 . 4.77 428 428 A 35 GLY HAx A 26 CYS HBy 1.0 . 4.20 429 429 A 30 LYS HBx A 26 CYS HA 1.0 . 4.81 430 430 A 26 CYS HA A 30 LYS HBy 1.0 . 4.69 431 431 A 49 CYS H A 49 CYS HBx 1.0 . 3.37 432 432 A 32 ALA HB% A 51 TYR HE% 1.0 . 3.85 433 433 A 51 TYR HE% A 49 CYS HBx 1.0 . 3.70 434 434 A 49 CYS H A 48 ILE HD1% 1.0 . 5.50 435 435 A 36 GLU H A 36 GLU HBx 1.0 . 3.70 436 436 A 37 CYS H A 36 GLU HBy 1.0 . 3.76 437 437 A 37 CYS H A 36 GLU HGy 1.0 . 3.95 438 438 A 38 PHE H A 38 PHE HBx 1.0 . 3.90 439 439 A 39 TYR H A 38 PHE HBy 1.0 . 4.07 440 440 A 40 LYS H A 39 TYR HBy 1.0 . 4.48 441 441 A 27 LYS H A 27 LYS HBy 1.0 . 3.31 442 442 A 27 LYS H A 26 CYS HBx 1.0 . 4.24 443 443 A 49 CYS HA A 26 CYS HBx 1.0 . 3.94 444 444 A 49 CYS HA A 26 CYS HBy 1.0 . 3.94 445 445 A 26 CYS HA A 49 CYS HBy 1.0 . 5.50 446 446 A 26 CYS HA A 49 CYS HBx 1.0 . 5.50 447 447 A 45 LEU HBy A 45 LEU HDy% 1.0 . 3.62 448 448 A 21 GLN H A 18 LEU HBx 1.0 . 4.01 449 449 A 45 LEU H A 45 LEU HDy% 1.0 . 4.42 450 450 A 46 GLN H A 45 LEU HBy 1.0 . 4.59 451 451 A 43 ARG H A 43 ARG HBy 1.0 . 3.13 452 452 A 39 TYR HD% A 45 LEU HDy% 1.0 . 4.68 453 453 A 39 TYR HE% A 45 LEU HDy% 1.0 . 5.19 454 454 A 39 TYR HE% A 45 LEU HDx% 1.0 . 5.19 455 455 A 53 GLU H A 53 GLU HBy 1.0 . 4.14 456 456 A 7 VAL HA A 7 VAL HGy% 1.0 . 3.07 457 457 A 8 TYR HA A 8 TYR HD% 1.0 . 3.36 458 458 A 18 LEU HG A 18 LEU HA 1.0 . 3.98 459 459 A 21 GLN HA A 21 GLN HBy 1.0 . 3.01 460 460 A 21 GLN HA A 21 GLN HGy 1.0 . 3.55 461 461 A 21 GLN HA A 21 GLN HGx 1.0 . 3.55 462 462 A 24 TYR HA A 24 TYR HD% 1.0 . 3.12 463 463 A 27 LYS HA A 27 LYS HGy 1.0 . 3.34 464 464 A 34 SER HA A 34 SER HBy 1.0 . 2.89 465 465 A 34 SER HA A 34 SER HBx 1.0 . 2.89 466 466 A 43 ARG HA A 43 ARG HGx 1.0 . 3.89 467 467 A 48 ILE HG2% A 48 ILE HA 1.0 . 2.94 468 468 A 48 ILE HA A 48 ILE HG1y 1.0 . 3.82 469 469 A 48 ILE HA A 48 ILE HG1x 1.0 . 3.82 470 470 A 51 TYR HD% A 51 TYR HA 1.0 . 3.32 471 471 A 54 TYR H A 54 TYR HA 1.0 . 2.93 472 472 A 54 TYR HD% A 54 TYR HA 1.0 . 3.30 473 473 A 19 ALA H A 18 LEU HA 1.0 . 2.91 474 474 A 29 ASP H A 28 LEU HA 1.0 . 3.51 475 475 A 32 ALA H A 31 HIS HA 1.0 . 3.09 476 476 A 35 GLY H A 34 SER HA 1.0 . 2.81 477 477 A 39 TYR H A 38 PHE HA 1.0 . 2.80 478 478 A 40 LYS H A 39 TYR HA 1.0 . 2.78 479 479 A 41 GLU H A 40 LYS HA 1.0 . 3.22 480 480 A 42 LYS H A 41 GLU HA 1.0 . 2.98 481 481 A 45 LEU H A 44 ASN HA 1.0 . 3.16 482 482 A 47 CYS H A 46 GLN HA 1.0 . 2.83 483 483 A 48 ILE H A 47 CYS HA 1.0 . 2.69 484 484 A 49 CYS H A 48 ILE HA 1.0 . 3.12 485 485 A 50 ASP H A 49 CYS HA 1.0 . 2.50 486 486 A 51 TYR H A 50 ASP HA 1.0 . 2.58 487 487 A 53 GLU H A 52 CYS HA 1.0 . 2.85 488 488 A 54 TYR H A 53 GLU HA 1.0 . 2.66 489 489 A 5 LYS HA A 48 ILE HG2% 1.0 . 3.52 490 490 A 49 CYS H A 7 VAL HA 1.0 . 3.43 491 491 A 21 GLN H A 19 ALA HA 1.0 . 3.62 492 492 A 35 GLY HAx A 26 CYS HBx 1.0 . 4.20 493 493 A 48 ILE H A 37 CYS HA 1.0 . 3.49 494 494 A 47 CYS HA A 37 CYS HA 1.0 . 4.93 495 495 A 49 CYS HA A 35 GLY HAx 1.0 . 3.51 496 496 A 8 TYR H A 48 ILE HA 1.0 . 3.15 497 497 A 33 ARG HBx A 33 ARG HA 1.0 . 2.75 498 498 A 49 CYS HA A 35 GLY HAy 1.0 . 3.51 499 499 A 5 LYS HA A 51 TYR HD% 1.0 . 4.04 500 500 A 5 LYS HA A 51 TYR H 1.0 . 3.94 501 501 A 7 VAL HA A 48 ILE HA 1.0 . 3.77 502 502 A 48 ILE HG2% A 7 VAL HA 1.0 . 3.87 503 503 A 11 TYR HA A 12 PRO HDx 1.0 . 3.54 504 504 A 32 ALA HB% A 26 CYS HA 1.0 . 4.35 505 505 A 32 ALA HB% A 27 LYS HA 1.0 . 3.51 506 506 A 33 ARG HA A 33 ARG HGx 1.0 . 3.18 507 507 A 51 TYR HD% A 50 ASP HA 1.0 . 3.82 508 508 A 33 ARG H A 51 TYR HA 1.0 . 3.56 509 509 A 33 ARG HBy A 51 TYR HA 1.0 . 4.22 510 510 A 51 TYR HA A 33 ARG HGx 1.0 . 4.48 511 511 A 27 LYS H A 23 ASN HA 1.0 . 4.43 512 512 A 26 CYS H A 23 ASN HA 1.0 . 3.78 513 513 A 24 TYR HA A 28 LEU H 1.0 . 4.67 514 514 A 23 ASN HA A 26 CYS HBx 1.0 . 4.06 515 515 A 23 ASN HA A 26 CYS HBy 1.0 . 4.06 516 516 A 30 LYS HGy A 26 CYS HA 1.0 . 3.92 517 517 A 32 ALA HB% A 49 CYS HA 1.0 . 3.90 518 518 A 32 ALA HA A 51 TYR HD% 1.0 . 3.04 519 519 A 6 LYS H A 50 ASP HA 1.0 . 3.80 520 520 A 33 ARG HA A 33 ARG HDx 1.0 . 4.18 521 521 A 35 GLY H A 34 SER HBy 1.0 . 3.16 522 522 A 26 CYS HBy A 35 GLY HAy 1.0 . 4.20 523 523 A 26 CYS HBx A 35 GLY HAy 1.0 . 4.20 524 524 A 50 ASP H A 35 GLY HAx 1.0 . 3.88 525 525 A 24 TYR H A 21 GLN HA 1.0 . 3.91 526 526 A 27 LYS HA A 27 LYS HGx 1.0 . 3.34 527 527 A 8 TYR HD% A 26 CYS HA 1.0 . 3.86 528 528 A 45 LEU HA A 45 LEU HG 1.0 . 3.88 529 529 A 46 GLN H A 37 CYS HA 1.0 . 5.50 530 530 A 38 PHE H A 47 CYS HA 1.0 . 5.50 531 531 A 43 ARG HA A 43 ARG HGy 1.0 . 3.89 532 532 A 6 LYS H A 5 LYS HBy 1.0 . 4.05 533 533 A 51 TYR HD% A 6 LYS HBx 1.0 . 5.39 534 534 A 51 TYR HD% A 6 LYS HBy 1.0 . 5.39 535 535 A 51 TYR HD% A 6 LYS HGy 1.0 . 5.26 536 536 A 51 TYR HE% A 6 LYS HGx 1.0 . 5.23 537 537 A 51 TYR HD% A 6 LYS HGx 1.0 . 5.26 538 538 A 18 LEU HG A 15 LYS HA 1.0 . 5.50 539 539 A 14 SER H A 13 VAL HB 1.0 . 3.73 540 540 A 46 GLN HE2x A 48 ILE HD1% 1.0 . 5.21 541 541 A 48 ILE HD1% A 46 GLN HE2y 1.0 . 5.21 542 542 A 15 LYS H A 12 PRO HGy 1.0 . 5.10 543 543 A 15 LYS H A 12 PRO HGx 1.0 . 5.10 544 544 A 15 LYS HA A 18 LEU HDy% 1.0 . 5.50 545 545 A 47 CYS HA A 37 CYS HBx 1.0 . 5.50 546 546 A 47 CYS HA A 37 CYS HBy 1.0 . 5.50 547 547 A 37 CYS HA A 45 LEU HDy% 1.0 . 5.50 548 548 A 37 CYS HA A 45 LEU HDx% 1.0 . 5.50 549 549 A 39 TYR HD% A 45 LEU HDx% 1.0 . 4.68 550 550 A 39 TYR HE% A 45 LEU HBy 1.0 . 5.21 551 551 A 39 TYR HE% A 45 LEU HBx 1.0 . 5.21 552 552 A 39 TYR HD% A 45 LEU HG 1.0 . 5.50 553 553 A 45 LEU HG A 39 TYR HE% 1.0 . 5.36 554 554 A 38 PHE H A 45 LEU HDx% 1.0 . 5.50 555 555 A 13 VAL HA A 16 CYS HBy 1.0 . 4.02 556 556 A 13 VAL HA A 16 CYS HBx 1.0 . 4.02 557 557 A 30 LYS HGx A 30 LYS HEy 1.0 . 4.10 558 558 A 30 LYS HGx A 30 LYS HEx 1.0 . 4.10 559 559 A 12 PRO HDx A 11 TYR HBy 1.0 . 5.50 560 560 A 11 TYR HBx A 12 PRO HDx 1.0 . 5.50 561 561 A 11 TYR HBx A 12 PRO HDy 1.0 . 5.50 562 562 A 11 TYR HBy A 12 PRO HDy 1.0 . 5.50 563 563 A 45 LEU HDx% A 13 VAL HGy% 1.0 . 5.20 564 564 A 13 VAL HGy% A 45 LEU HDy% 1.0 . 5.20 565 565 A 13 VAL HGx% A 45 LEU HDx% 1.0 . 5.20 566 566 A 13 VAL HGx% A 45 LEU HDy% 1.0 . 5.20 567 567 A 44 ASN HA A 13 VAL HGy% 1.0 . 5.50 568 568 A 44 ASN HA A 13 VAL HGx% 1.0 . 5.50 569 569 A 44 ASN HBy A 13 VAL HGy% 1.0 . 5.50 570 570 A 13 VAL HGy% A 44 ASN HBx 1.0 . 5.50 571 571 A 13 VAL HGx% A 44 ASN HBy 1.0 . 5.50 572 572 A 13 VAL HGx% A 44 ASN HBx 1.0 . 5.50 573 573 A 30 LYS HGy A 29 ASP HBx 1.0 . 4.91 574 574 A 30 LYS HGy A 29 ASP HBy 1.0 . 4.91 575 575 A 30 LYS HGx A 29 ASP HBy 1.0 . 4.42 576 576 A 13 VAL HGx% A 16 CYS HBx 1.0 . 5.50 577 577 A 13 VAL HGx% A 16 CYS HBy 1.0 . 5.50 578 578 A 16 CYS HBy A 13 VAL HGy% 1.0 . 5.50 579 579 A 13 VAL HGy% A 16 CYS HBx 1.0 . 5.50 580 580 A 12 PRO HA A 13 VAL HGx% 1.0 . 5.46 581 581 A 12 PRO HA A 13 VAL HGy% 1.0 . 5.46 582 582 A 15 LYS HA A 18 LEU HDx% 1.0 . 5.50 583 583 A 17 GLN HBx A 18 LEU HDy% 1.0 . 5.09 584 584 A 17 GLN HBx A 18 LEU HDx% 1.0 . 5.09 585 585 A 19 ALA HB% A 20 ASN HBx 1.0 . 4.99 586 586 A 19 ALA HB% A 20 ASN HBy 1.0 . 4.99 587 587 A 21 GLN HA A 24 TYR HBy 1.0 . 5.50 588 588 A 21 GLN HA A 24 TYR HBx 1.0 . 5.50 589 589 A 8 TYR HBx A 47 CYS HBy 1.0 . 4.15 590 590 A 30 LYS HGx A 29 ASP HBx 1.0 . 4.42 591 591 A 52 CYS H A 33 ARG HDy 1.0 . 5.50 592 592 A 52 CYS H A 33 ARG HDx 1.0 . 5.50 593 593 A 52 CYS HA A 33 ARG HDy 1.0 . 4.85 594 594 A 52 CYS HA A 33 ARG HDx 1.0 . 4.85 595 595 A 9 GLU HA A 9 GLU HGy 1.0 . 4.14 596 596 A 48 ILE HG2% A 49 CYS HA 1.0 . 5.29 597 597 A 48 ILE HB A 37 CYS HA 1.0 . 5.50 598 598 A 48 ILE HB A 36 GLU H 1.0 . 4.80 599 599 A 34 SER H A 50 ASP HBx 1.0 . 4.01 600 600 A 25 ASP H A 24 TYR HBx 1.0 . 3.92 601 601 A 32 ALA HB% A 50 ASP HA 1.0 . 5.18 602 602 A 53 GLU H A 53 GLU HGy 1.0 . 4.37 603 603 A 8 TYR HD% A 30 LYS HEy 1.0 . 4.43 604 604 A 8 TYR HD% A 30 LYS HEx 1.0 . 4.43 605 605 A 8 TYR HD% A 30 LYS HGx 1.0 . 3.82 606 606 A 28 LEU H A 27 LYS HGx 1.0 . 5.50 607 607 A 24 TYR HD% A 28 LEU HDy% 1.0 . 5.12 608 608 A 24 TYR HD% A 28 LEU HDx% 1.0 . 5.12 609 609 A 24 TYR HE% A 28 LEU HDy% 1.0 . 4.31 610 610 A 24 TYR HE% A 28 LEU HDx% 1.0 . 4.31 611 611 A 30 LYS H A 30 LYS HGx 1.0 . 4.16 612 612 A 8 TYR HD% A 30 LYS HGy 1.0 . 4.59 613 613 A 32 ALA HB% A 51 TYR H 1.0 . 5.50 614 614 A 38 PHE HE% A 36 GLU HBx 1.0 . 4.92 615 615 A 38 PHE HE% A 36 GLU HBy 1.0 . 4.92 616 616 A 48 ILE HB A 38 PHE HE% 1.0 . 4.07 617 617 A 48 ILE HG2% A 38 PHE HE% 1.0 . 4.56 618 618 A 11 TYR HE% A 25 ASP HBy 1.0 . 4.28 619 619 A 11 TYR HE% A 25 ASP HBx 1.0 . 4.28 620 620 A 20 ASN HA A 23 ASN HBy 1.0 . 4.56 621 621 A 20 ASN HA A 23 ASN HBx 1.0 . 4.56 622 622 A 8 TYR HE% A 29 ASP HBy 1.0 . 4.46 623 623 A 8 TYR HE% A 29 ASP HBx 1.0 . 4.46 624 624 A 18 LEU H A 21 GLN HBy 1.0 . 5.38 625 625 A 18 LEU H A 21 GLN HBx 1.0 . 5.38 626 626 A 48 ILE HD1% A 46 GLN HBx 1.0 . 4.67 627 627 A 48 ILE HD1% A 46 GLN HBy 1.0 . 4.67 628 628 A 46 GLN HBx A 48 ILE HG1x 1.0 . 5.29 629 629 A 48 ILE HG1y A 46 GLN HBx 1.0 . 5.29 630 630 A 46 GLN HBy A 48 ILE HG1x 1.0 . 5.29 631 631 A 48 ILE HG1y A 46 GLN HBy 1.0 . 5.29 632 632 A 7 VAL HB A 48 ILE HD1% 1.0 . 3.67 633 633 A 7 VAL HB A 48 ILE HG2% 1.0 . 4.88 634 634 A 17 GLN HBx A 14 SER HA 1.0 . 5.50 635 635 A 17 GLN HBy A 14 SER HA 1.0 . 4.94 636 636 A 15 LYS HA A 21 GLN HBy 1.0 . 5.50 637 637 A 15 LYS HA A 21 GLN HBx 1.0 . 5.50 638 638 A 15 LYS HA A 21 GLN HGy 1.0 . 5.50 639 639 A 15 LYS HA A 21 GLN HGx 1.0 . 5.50 640 640 A 15 LYS HBx A 15 LYS HEx 1.0 . 4.66 641 641 A 15 LYS HBy A 15 LYS HEy 1.0 . 4.66 642 642 A 24 TYR HA A 27 LYS HBx 1.0 . 4.28 643 643 A 30 LYS HBx A 32 ALA H 1.0 . 4.09 644 644 A 13 VAL HA A 45 LEU HBy 1.0 . 5.50 645 645 A 13 VAL HA A 45 LEU HBx 1.0 . 5.50 646 646 A 36 GLU HA A 22 CYS HBx 1.0 . 5.50 647 647 A 36 GLU HA A 22 CYS HBy 1.0 . 5.50 648 648 A 3 LYS HA A 3 LYS HGx 1.0 . 3.59 649 648 A 3 LYS HA A 3 LYS HGy 1.0 . 3.59 650 649 A 4 CYS H A 3 LYS HBx 1.0 . 3.93 651 649 A 4 CYS H A 3 LYS HBy 1.0 . 3.93 652 650 A 4 CYS H A 3 LYS HGx 1.0 . 4.15 653 650 A 4 CYS H A 3 LYS HGy 1.0 . 4.15 654 651 A 4 CYS H A 4 CYS HBx 1.0 . 3.00 655 651 A 4 CYS H A 4 CYS HBy 1.0 . 3.00 656 652 A 4 CYS HA A 51 TYR HBx 1.0 . 4.02 657 652 A 4 CYS HA A 51 TYR HBy 1.0 . 4.02 658 653 A 5 LYS H A 4 CYS HBx 1.0 . 2.79 659 653 A 5 LYS H A 4 CYS HBy 1.0 . 2.79 660 654 A 51 TYR H A 4 CYS HBx 1.0 . 3.62 661 654 A 51 TYR H A 4 CYS HBy 1.0 . 3.62 662 655 A 52 CYS H A 4 CYS HBx 1.0 . 4.74 663 655 A 52 CYS H A 4 CYS HBy 1.0 . 4.74 664 656 A 5 LYS H A 5 LYS HBx 1.0 . 3.12 665 656 A 5 LYS H A 5 LYS HBy 1.0 . 3.12 666 657 A 5 LYS H A 5 LYS HGy 1.0 . 3.52 667 657 A 5 LYS H A 5 LYS HGx 1.0 . 3.52 668 658 A 5 LYS H A 5 LYS HDy 1.0 . 4.83 669 658 A 5 LYS H A 5 LYS HDx 1.0 . 4.83 670 659 A 5 LYS H A 5 LYS HEy 1.0 . 4.52 671 659 A 5 LYS H A 5 LYS HEx 1.0 . 4.52 672 660 A 5 LYS HA A 5 LYS HGy 1.0 . 2.80 673 660 A 5 LYS HA A 5 LYS HGx 1.0 . 2.80 674 661 A 5 LYS HA A 5 LYS HDy 1.0 . 3.73 675 661 A 5 LYS HA A 5 LYS HDx 1.0 . 3.73 676 662 A 5 LYS HA A 5 LYS HEy 1.0 . 5.34 677 662 A 5 LYS HA A 5 LYS HEx 1.0 . 5.34 678 663 A 5 LYS HA A 51 TYR HBx 1.0 . 4.51 679 663 A 5 LYS HA A 51 TYR HBy 1.0 . 4.51 680 664 A 5 LYS HBx A 5 LYS HDy 1.0 . 3.33 681 664 A 5 LYS HBy A 5 LYS HDy 1.0 . 3.33 682 664 A 5 LYS HDx A 5 LYS HBx 1.0 . 3.33 683 664 A 5 LYS HBy A 5 LYS HDx 1.0 . 3.33 684 665 A 5 LYS HBx A 5 LYS HEy 1.0 . 3.11 685 665 A 5 LYS HBy A 5 LYS HEy 1.0 . 3.11 686 665 A 5 LYS HEx A 5 LYS HBx 1.0 . 3.11 687 665 A 5 LYS HBy A 5 LYS HEx 1.0 . 3.11 688 666 A 6 LYS H A 5 LYS HBx 1.0 . 3.38 689 666 A 6 LYS H A 5 LYS HBy 1.0 . 3.38 690 667 A 48 ILE HG2% A 5 LYS HBx 1.0 . 2.85 691 667 A 48 ILE HG2% A 5 LYS HBy 1.0 . 2.85 692 668 A 50 ASP HA A 5 LYS HBx 1.0 . 3.61 693 668 A 50 ASP HA A 5 LYS HBy 1.0 . 3.61 694 669 A 5 LYS HEx A 5 LYS HGy 1.0 . 2.73 695 669 A 5 LYS HEy A 5 LYS HGy 1.0 . 2.73 696 669 A 5 LYS HGx A 5 LYS HEy 1.0 . 2.73 697 669 A 5 LYS HGx A 5 LYS HEx 1.0 . 2.73 698 670 A 6 LYS H A 5 LYS HGy 1.0 . 4.26 699 670 A 6 LYS H A 5 LYS HGx 1.0 . 4.26 700 671 A 48 ILE HG2% A 5 LYS HGy 1.0 . 3.47 701 671 A 48 ILE HG2% A 5 LYS HGx 1.0 . 3.47 702 672 A 50 ASP HA A 5 LYS HGy 1.0 . 3.37 703 672 A 50 ASP HA A 5 LYS HGx 1.0 . 3.37 704 673 A 5 LYS HGy A 50 ASP HBx 1.0 . 3.10 705 673 A 5 LYS HGx A 50 ASP HBx 1.0 . 3.10 706 673 A 50 ASP HBy A 5 LYS HGy 1.0 . 3.10 707 673 A 5 LYS HGx A 50 ASP HBy 1.0 . 3.10 708 674 A 51 TYR H A 5 LYS HGy 1.0 . 4.10 709 674 A 51 TYR H A 5 LYS HGx 1.0 . 4.10 710 675 A 6 LYS H A 5 LYS HDy 1.0 . 5.30 711 675 A 6 LYS H A 5 LYS HDx 1.0 . 5.30 712 676 A 48 ILE HG2% A 5 LYS HDy 1.0 . 3.37 713 676 A 48 ILE HG2% A 5 LYS HDx 1.0 . 3.37 714 677 A 38 PHE HE% A 5 LYS HEy 1.0 . 5.34 715 677 A 38 PHE HE% A 5 LYS HEx 1.0 . 5.34 716 678 A 48 ILE HG2% A 5 LYS HEy 1.0 . 4.35 717 678 A 48 ILE HG2% A 5 LYS HEx 1.0 . 4.35 718 679 A 50 ASP HA A 5 LYS HEy 1.0 . 4.44 719 679 A 50 ASP HA A 5 LYS HEx 1.0 . 4.44 720 680 A 6 LYS H A 6 LYS HGx 1.0 . 4.23 721 680 A 6 LYS H A 6 LYS HGy 1.0 . 4.23 722 681 A 6 LYS H A 49 CYS HBy 1.0 . 3.42 723 681 A 6 LYS H A 49 CYS HBx 1.0 . 3.42 724 682 A 6 LYS HA A 6 LYS HGx 1.0 . 3.31 725 682 A 6 LYS HA A 6 LYS HGy 1.0 . 3.31 726 683 A 6 LYS HA A 6 LYS HDx 1.0 . 4.96 727 683 A 6 LYS HA A 6 LYS HDy 1.0 . 4.96 728 684 A 6 LYS HA A 6 LYS HEy 1.0 . 4.69 729 684 A 6 LYS HA A 6 LYS HEx 1.0 . 4.69 730 685 A 6 LYS HBy A 6 LYS HEy 1.0 . 4.14 731 685 A 6 LYS HBx A 6 LYS HEy 1.0 . 4.14 732 685 A 6 LYS HEx A 6 LYS HBx 1.0 . 4.14 733 685 A 6 LYS HEx A 6 LYS HBy 1.0 . 4.14 734 686 A 7 VAL H A 6 LYS HBx 1.0 . 3.43 735 686 A 7 VAL H A 6 LYS HBy 1.0 . 3.43 736 687 A 51 TYR HD% A 6 LYS HBx 1.0 . 4.74 737 687 A 51 TYR HD% A 6 LYS HBy 1.0 . 4.74 738 688 A 51 TYR HE% A 6 LYS HBx 1.0 . 3.39 739 688 A 51 TYR HE% A 6 LYS HBy 1.0 . 3.39 740 689 A 6 LYS HEx A 6 LYS HGx 1.0 . 3.14 741 689 A 6 LYS HEy A 6 LYS HGx 1.0 . 3.14 742 689 A 6 LYS HGy A 6 LYS HEy 1.0 . 3.14 743 689 A 6 LYS HGy A 6 LYS HEx 1.0 . 3.14 744 690 A 7 VAL H A 6 LYS HGx 1.0 . 3.50 745 690 A 7 VAL H A 6 LYS HGy 1.0 . 3.50 746 691 A 51 TYR HD% A 6 LYS HGx 1.0 . 4.53 747 691 A 51 TYR HD% A 6 LYS HGy 1.0 . 4.53 748 692 A 51 TYR HE% A 6 LYS HGx 1.0 . 4.38 749 692 A 51 TYR HE% A 6 LYS HGy 1.0 . 4.38 750 693 A 7 VAL H A 7 VAL HGy% 1.0 . 2.77 751 693 A 7 VAL H A 7 VAL HGx% 1.0 . 2.77 752 694 A 7 VAL HA A 48 ILE HG1x 1.0 . 3.35 753 694 A 7 VAL HA A 48 ILE HG1y 1.0 . 3.35 754 695 A 7 VAL HB A 46 GLN HE2x 1.0 . 4.18 755 695 A 7 VAL HB A 46 GLN HE2y 1.0 . 4.18 756 696 A 8 TYR H A 7 VAL HGy% 1.0 . 3.15 757 696 A 8 TYR H A 7 VAL HGx% 1.0 . 3.15 758 697 A 8 TYR HA A 7 VAL HGy% 1.0 . 4.20 759 697 A 8 TYR HA A 7 VAL HGx% 1.0 . 4.20 760 698 A 7 VAL HGy% A 8 TYR HBx 1.0 . 4.51 761 698 A 7 VAL HGx% A 8 TYR HBx 1.0 . 4.51 762 698 A 8 TYR HBy A 7 VAL HGy% 1.0 . 4.51 763 698 A 7 VAL HGx% A 8 TYR HBy 1.0 . 4.51 764 699 A 9 GLU H A 7 VAL HGy% 1.0 . 5.02 765 699 A 9 GLU H A 7 VAL HGx% 1.0 . 5.02 766 700 A 9 GLU HA A 7 VAL HGy% 1.0 . 3.97 767 700 A 9 GLU HA A 7 VAL HGx% 1.0 . 3.97 768 701 A 10 ASN H A 7 VAL HGy% 1.0 . 5.44 769 701 A 10 ASN H A 7 VAL HGx% 1.0 . 5.44 770 702 A 11 TYR H A 7 VAL HGy% 1.0 . 5.44 771 702 A 11 TYR H A 7 VAL HGx% 1.0 . 5.44 772 703 A 46 GLN HE2x A 7 VAL HGx% 1.0 . 3.29 773 703 A 46 GLN HE2x A 7 VAL HGy% 1.0 . 3.29 774 703 A 46 GLN HE2y A 7 VAL HGy% 1.0 . 3.29 775 703 A 46 GLN HE2y A 7 VAL HGx% 1.0 . 3.29 776 704 A 47 CYS H A 7 VAL HGy% 1.0 . 3.96 777 704 A 47 CYS H A 7 VAL HGx% 1.0 . 3.96 778 705 A 48 ILE HA A 7 VAL HGy% 1.0 . 4.11 779 705 A 48 ILE HA A 7 VAL HGx% 1.0 . 4.11 780 706 A 48 ILE HD1% A 7 VAL HGy% 1.0 . 3.41 781 706 A 48 ILE HD1% A 7 VAL HGx% 1.0 . 3.41 782 707 A 10 ASN H A 8 TYR HBx 1.0 . 3.73 783 707 A 10 ASN H A 8 TYR HBy 1.0 . 3.73 784 708 A 8 TYR HBy A 47 CYS HBy 1.0 . 3.00 785 708 A 47 CYS HBx A 8 TYR HBx 1.0 . 3.00 786 708 A 8 TYR HBy A 47 CYS HBx 1.0 . 3.00 787 708 A 8 TYR HBx A 47 CYS HBy 1.0 . 3.00 788 709 A 8 TYR HD% A 30 LYS HDx 1.0 . 4.59 789 709 A 8 TYR HD% A 30 LYS HDy 1.0 . 4.59 790 710 A 8 TYR HD% A 47 CYS HBy 1.0 . 5.08 791 710 A 8 TYR HD% A 47 CYS HBx 1.0 . 5.08 792 711 A 8 TYR HE% A 29 ASP HBy 1.0 . 3.89 793 711 A 8 TYR HE% A 29 ASP HBx 1.0 . 3.89 794 712 A 9 GLU H A 9 GLU HGx 1.0 . 2.94 795 712 A 9 GLU H A 9 GLU HGy 1.0 . 2.94 796 713 A 9 GLU HA A 9 GLU HGx 1.0 . 3.27 797 713 A 9 GLU HA A 9 GLU HGy 1.0 . 3.27 798 714 A 9 GLU HBy A 9 GLU HGx 1.0 . 2.36 799 714 A 9 GLU HBx A 9 GLU HGx 1.0 . 2.36 800 714 A 9 GLU HGy A 9 GLU HBy 1.0 . 2.36 801 714 A 9 GLU HGy A 9 GLU HBx 1.0 . 2.36 802 715 A 10 ASN HD2y A 9 GLU HBy 1.0 . 4.45 803 715 A 10 ASN HD2y A 9 GLU HBx 1.0 . 4.45 804 716 A 10 ASN HD2x A 9 GLU HBy 1.0 . 4.46 805 716 A 9 GLU HBx A 10 ASN HD2x 1.0 . 4.46 806 717 A 10 ASN H A 9 GLU HGx 1.0 . 4.48 807 717 A 10 ASN H A 9 GLU HGy 1.0 . 4.48 808 718 A 10 ASN HD2y A 9 GLU HGx 1.0 . 5.34 809 718 A 10 ASN HD2y A 9 GLU HGy 1.0 . 5.34 810 719 A 10 ASN HD2x A 9 GLU HGx 1.0 . 5.34 811 719 A 9 GLU HGy A 10 ASN HD2x 1.0 . 5.34 812 720 A 10 ASN HA A 10 ASN HBy 1.0 . 2.63 813 720 A 10 ASN HA A 10 ASN HBx 1.0 . 2.63 814 721 A 10 ASN HD2y A 10 ASN HBy 1.0 . 3.04 815 721 A 10 ASN HD2y A 10 ASN HBx 1.0 . 3.04 816 722 A 11 TYR H A 10 ASN HBy 1.0 . 4.00 817 722 A 11 TYR H A 10 ASN HBx 1.0 . 4.00 818 723 A 11 TYR HA A 12 PRO HGx 1.0 . 5.02 819 723 A 11 TYR HA A 12 PRO HGy 1.0 . 5.02 820 724 A 11 TYR HBy A 12 PRO HGx 1.0 . 4.15 821 724 A 11 TYR HBx A 12 PRO HGx 1.0 . 4.15 822 724 A 12 PRO HGy A 11 TYR HBy 1.0 . 4.15 823 724 A 12 PRO HGy A 11 TYR HBx 1.0 . 4.15 824 725 A 11 TYR HBx A 12 PRO HDy 1.0 . 4.25 825 725 A 11 TYR HBy A 12 PRO HDy 1.0 . 4.25 826 725 A 12 PRO HDx A 11 TYR HBy 1.0 . 4.25 827 725 A 11 TYR HBx A 12 PRO HDx 1.0 . 4.25 828 726 A 11 TYR HBx A 47 CYS HBy 1.0 . 3.98 829 726 A 11 TYR HBy A 47 CYS HBy 1.0 . 3.98 830 726 A 47 CYS HBx A 11 TYR HBy 1.0 . 3.98 831 726 A 47 CYS HBx A 11 TYR HBx 1.0 . 3.98 832 727 A 11 TYR HE% A 25 ASP HBy 1.0 . 3.63 833 727 A 11 TYR HE% A 25 ASP HBx 1.0 . 3.63 834 728 A 12 PRO HA A 13 VAL HGy% 1.0 . 3.94 835 728 A 12 PRO HA A 13 VAL HGx% 1.0 . 3.94 836 729 A 13 VAL H A 12 PRO HBx 1.0 . 3.68 837 729 A 13 VAL H A 12 PRO HBy 1.0 . 3.68 838 730 A 14 SER H A 12 PRO HBx 1.0 . 3.57 839 730 A 14 SER H A 12 PRO HBy 1.0 . 3.57 840 731 A 15 LYS H A 12 PRO HBx 1.0 . 4.22 841 731 A 15 LYS H A 12 PRO HBy 1.0 . 4.22 842 732 A 13 VAL H A 12 PRO HGx 1.0 . 5.03 843 732 A 13 VAL H A 12 PRO HGy 1.0 . 5.03 844 733 A 12 PRO HGy A 15 LYS HBx 1.0 . 3.98 845 733 A 12 PRO HGx A 15 LYS HBx 1.0 . 3.98 846 733 A 15 LYS HBy A 12 PRO HGx 1.0 . 3.98 847 733 A 12 PRO HGy A 15 LYS HBy 1.0 . 3.98 848 734 A 13 VAL H A 13 VAL HGy% 1.0 . 3.06 849 734 A 13 VAL H A 13 VAL HGx% 1.0 . 3.06 850 735 A 13 VAL HA A 13 VAL HGy% 1.0 . 2.74 851 735 A 13 VAL HA A 13 VAL HGx% 1.0 . 2.74 852 736 A 14 SER H A 13 VAL HGy% 1.0 . 3.36 853 736 A 14 SER H A 13 VAL HGx% 1.0 . 3.36 854 737 A 13 VAL HGx% A 16 CYS HBx 1.0 . 4.19 855 737 A 16 CYS HBy A 13 VAL HGy% 1.0 . 4.19 856 737 A 13 VAL HGx% A 16 CYS HBy 1.0 . 4.19 857 737 A 13 VAL HGy% A 16 CYS HBx 1.0 . 4.19 858 738 A 13 VAL HGx% A 44 ASN HBx 1.0 . 4.10 859 738 A 13 VAL HGy% A 44 ASN HBx 1.0 . 4.10 860 738 A 44 ASN HBy A 13 VAL HGy% 1.0 . 4.10 861 738 A 13 VAL HGx% A 44 ASN HBy 1.0 . 4.10 862 739 A 45 LEU H A 13 VAL HGy% 1.0 . 4.33 863 739 A 45 LEU H A 13 VAL HGx% 1.0 . 4.33 864 740 A 13 VAL HGx% A 45 LEU HBy 1.0 . 3.92 865 740 A 13 VAL HGy% A 45 LEU HBy 1.0 . 3.92 866 740 A 45 LEU HBx A 13 VAL HGy% 1.0 . 3.92 867 740 A 13 VAL HGx% A 45 LEU HBx 1.0 . 3.92 868 741 A 13 VAL HGy% A 45 LEU HDy% 1.0 . 3.73 869 741 A 45 LEU HDx% A 13 VAL HGy% 1.0 . 3.73 870 741 A 13 VAL HGx% A 45 LEU HDx% 1.0 . 3.73 871 741 A 13 VAL HGx% A 45 LEU HDy% 1.0 . 3.73 872 742 A 14 SER H A 14 SER HBx 1.0 . 2.93 873 742 A 14 SER H A 14 SER HBy 1.0 . 2.93 874 743 A 14 SER HA A 17 GLN HGx 1.0 . 5.00 875 743 A 14 SER HA A 17 GLN HGy 1.0 . 5.00 876 744 A 15 LYS H A 14 SER HBx 1.0 . 4.11 877 744 A 15 LYS H A 14 SER HBy 1.0 . 4.11 878 745 A 15 LYS H A 15 LYS HBx 1.0 . 2.99 879 745 A 15 LYS H A 15 LYS HBy 1.0 . 2.99 880 746 A 15 LYS H A 15 LYS HGy 1.0 . 3.27 881 746 A 15 LYS H A 15 LYS HGx 1.0 . 3.27 882 747 A 15 LYS H A 15 LYS HDx 1.0 . 5.34 883 747 A 15 LYS H A 15 LYS HDy 1.0 . 5.34 884 748 A 15 LYS HA A 15 LYS HBx 1.0 . 2.61 885 748 A 15 LYS HA A 15 LYS HBy 1.0 . 2.61 886 749 A 15 LYS HA A 15 LYS HGy 1.0 . 2.97 887 749 A 15 LYS HA A 15 LYS HGx 1.0 . 2.97 888 750 A 15 LYS HA A 15 LYS HDx 1.0 . 5.33 889 750 A 15 LYS HA A 15 LYS HDy 1.0 . 5.33 890 751 A 15 LYS HA A 18 LEU HBx 1.0 . 4.13 891 751 A 15 LYS HA A 18 LEU HBy 1.0 . 4.13 892 752 A 15 LYS HA A 18 LEU HDy% 1.0 . 4.35 893 752 A 15 LYS HA A 18 LEU HDx% 1.0 . 4.35 894 753 A 15 LYS HBy A 15 LYS HEx 1.0 . 3.63 895 753 A 15 LYS HBx A 15 LYS HEx 1.0 . 3.63 896 753 A 15 LYS HEy A 15 LYS HBx 1.0 . 3.63 897 753 A 15 LYS HBy A 15 LYS HEy 1.0 . 3.63 898 754 A 16 CYS H A 15 LYS HBx 1.0 . 3.55 899 754 A 16 CYS H A 15 LYS HBy 1.0 . 3.55 900 755 A 15 LYS HEy A 15 LYS HGy 1.0 . 3.20 901 755 A 15 LYS HEx A 15 LYS HGy 1.0 . 3.20 902 755 A 15 LYS HGx A 15 LYS HEx 1.0 . 3.20 903 755 A 15 LYS HGx A 15 LYS HEy 1.0 . 3.20 904 756 A 16 CYS H A 15 LYS HGy 1.0 . 4.47 905 756 A 16 CYS H A 15 LYS HGx 1.0 . 4.47 906 757 A 15 LYS HGy A 21 GLN HBy 1.0 . 4.41 907 757 A 15 LYS HGx A 21 GLN HBy 1.0 . 4.41 908 757 A 21 GLN HBx A 15 LYS HGy 1.0 . 4.41 909 757 A 15 LYS HGx A 21 GLN HBx 1.0 . 4.41 910 758 A 15 LYS HGy A 21 GLN HGx 1.0 . 4.76 911 758 A 15 LYS HGx A 21 GLN HGx 1.0 . 4.76 912 758 A 21 GLN HGy A 15 LYS HGy 1.0 . 4.76 913 758 A 15 LYS HGx A 21 GLN HGy 1.0 . 4.76 914 759 A 17 GLN H A 16 CYS HBx 1.0 . 3.27 915 759 A 17 GLN H A 16 CYS HBy 1.0 . 3.27 916 760 A 16 CYS HBx A 45 LEU HBy 1.0 . 3.98 917 760 A 16 CYS HBy A 45 LEU HBy 1.0 . 3.98 918 760 A 45 LEU HBx A 16 CYS HBx 1.0 . 3.98 919 760 A 16 CYS HBy A 45 LEU HBx 1.0 . 3.98 920 761 A 16 CYS HBy A 45 LEU HDy% 1.0 . 3.23 921 761 A 16 CYS HBx A 45 LEU HDy% 1.0 . 3.23 922 761 A 45 LEU HDx% A 16 CYS HBx 1.0 . 3.23 923 761 A 16 CYS HBy A 45 LEU HDx% 1.0 . 3.23 924 762 A 17 GLN H A 17 GLN HGx 1.0 . 3.32 925 762 A 17 GLN H A 17 GLN HGy 1.0 . 3.32 926 763 A 17 GLN HA A 17 GLN HGx 1.0 . 3.00 927 763 A 17 GLN HA A 17 GLN HGy 1.0 . 3.00 928 764 A 17 GLN HBx A 17 GLN HGx 1.0 . 2.60 929 764 A 17 GLN HBx A 17 GLN HGy 1.0 . 2.60 930 765 A 17 GLN HBx A 17 GLN HE2y 1.0 . 3.82 931 765 A 17 GLN HBx A 17 GLN HE2x 1.0 . 3.82 932 766 A 17 GLN HBx A 18 LEU HDy% 1.0 . 3.95 933 766 A 17 GLN HBx A 18 LEU HDx% 1.0 . 3.95 934 767 A 18 LEU H A 17 GLN HGx 1.0 . 4.41 935 767 A 18 LEU H A 17 GLN HGy 1.0 . 4.41 936 768 A 17 GLN HGx A 18 LEU HDy% 1.0 . 4.66 937 768 A 17 GLN HGy A 18 LEU HDy% 1.0 . 4.66 938 768 A 18 LEU HDx% A 17 GLN HGx 1.0 . 4.66 939 768 A 17 GLN HGy A 18 LEU HDx% 1.0 . 4.66 940 769 A 18 LEU H A 18 LEU HDy% 1.0 . 4.08 941 769 A 18 LEU H A 18 LEU HDx% 1.0 . 4.08 942 770 A 18 LEU H A 21 GLN HBy 1.0 . 4.66 943 770 A 18 LEU H A 21 GLN HBx 1.0 . 4.66 944 771 A 18 LEU HA A 18 LEU HDy% 1.0 . 3.40 945 771 A 18 LEU HA A 18 LEU HDx% 1.0 . 3.40 946 772 A 18 LEU HBx A 18 LEU HDy% 1.0 . 2.80 947 772 A 18 LEU HBy A 18 LEU HDy% 1.0 . 2.80 948 772 A 18 LEU HDx% A 18 LEU HBx 1.0 . 2.80 949 772 A 18 LEU HBy A 18 LEU HDx% 1.0 . 2.80 950 773 A 19 ALA H A 18 LEU HBx 1.0 . 3.38 951 773 A 19 ALA H A 18 LEU HBy 1.0 . 3.38 952 774 A 21 GLN H A 18 LEU HBx 1.0 . 3.34 953 774 A 21 GLN H A 18 LEU HBy 1.0 . 3.34 954 775 A 19 ALA H A 18 LEU HDy% 1.0 . 4.74 955 775 A 19 ALA H A 18 LEU HDx% 1.0 . 4.74 956 776 A 21 GLN H A 18 LEU HDy% 1.0 . 5.41 957 776 A 21 GLN H A 18 LEU HDx% 1.0 . 5.41 958 777 A 18 LEU HDx% A 21 GLN HBy 1.0 . 3.87 959 777 A 18 LEU HDy% A 21 GLN HBy 1.0 . 3.87 960 777 A 21 GLN HBx A 18 LEU HDy% 1.0 . 3.87 961 777 A 18 LEU HDx% A 21 GLN HBx 1.0 . 3.87 962 778 A 18 LEU HDx% A 21 GLN HGx 1.0 . 3.15 963 778 A 21 GLN HGy A 18 LEU HDy% 1.0 . 3.15 964 778 A 18 LEU HDx% A 21 GLN HGy 1.0 . 3.15 965 778 A 18 LEU HDy% A 21 GLN HGx 1.0 . 3.15 966 779 A 19 ALA HA A 22 CYS HBy 1.0 . 3.94 967 779 A 19 ALA HA A 22 CYS HBx 1.0 . 3.94 968 780 A 19 ALA HB% A 20 ASN HD2y 1.0 . 3.77 969 780 A 19 ALA HB% A 20 ASN HD2x 1.0 . 3.77 970 781 A 20 ASN H A 20 ASN HBx 1.0 . 3.10 971 781 A 20 ASN H A 20 ASN HBy 1.0 . 3.10 972 782 A 20 ASN HA A 20 ASN HD2x 1.0 . 4.59 973 782 A 20 ASN HA A 20 ASN HD2y 1.0 . 4.59 974 783 A 20 ASN HA A 23 ASN HBx 1.0 . 3.91 975 783 A 20 ASN HA A 23 ASN HBy 1.0 . 3.91 976 784 A 20 ASN HD2y A 20 ASN HBy 1.0 . 2.95 977 784 A 20 ASN HD2y A 20 ASN HBx 1.0 . 2.95 978 784 A 20 ASN HD2x A 20 ASN HBx 1.0 . 2.95 979 784 A 20 ASN HD2x A 20 ASN HBy 1.0 . 2.95 980 785 A 21 GLN H A 20 ASN HBx 1.0 . 3.60 981 785 A 21 GLN H A 20 ASN HBy 1.0 . 3.60 982 786 A 21 GLN H A 21 GLN HBy 1.0 . 3.18 983 786 A 21 GLN H A 21 GLN HBx 1.0 . 3.18 984 787 A 21 GLN H A 21 GLN HGx 1.0 . 3.24 985 787 A 21 GLN H A 21 GLN HGy 1.0 . 3.24 986 788 A 21 GLN HA A 21 GLN HBy 1.0 . 2.55 987 788 A 21 GLN HA A 21 GLN HBx 1.0 . 2.55 988 789 A 21 GLN HA A 21 GLN HGx 1.0 . 3.04 989 789 A 21 GLN HA A 21 GLN HGy 1.0 . 3.04 990 790 A 21 GLN HE2y A 21 GLN HA 1.0 . 3.71 991 790 A 21 GLN HE2x A 21 GLN HA 1.0 . 3.71 992 791 A 21 GLN HBy A 21 GLN HGx 1.0 . 2.24 993 791 A 21 GLN HBx A 21 GLN HGx 1.0 . 2.24 994 791 A 21 GLN HGy A 21 GLN HBy 1.0 . 2.24 995 791 A 21 GLN HBx A 21 GLN HGy 1.0 . 2.24 996 792 A 21 GLN HE2y A 21 GLN HBx 1.0 . 3.88 997 792 A 21 GLN HE2x A 21 GLN HBy 1.0 . 3.88 998 792 A 21 GLN HE2y A 21 GLN HBy 1.0 . 3.88 999 792 A 21 GLN HE2x A 21 GLN HBx 1.0 . 3.88 1000 793 A 22 CYS H A 21 GLN HBy 1.0 . 2.81 1001 793 A 22 CYS H A 21 GLN HBx 1.0 . 2.81 1002 794 A 21 GLN HE2y A 21 GLN HGy 1.0 . 2.41 1003 794 A 21 GLN HE2x A 21 GLN HGx 1.0 . 2.41 1004 794 A 21 GLN HE2x A 21 GLN HGy 1.0 . 2.41 1005 794 A 21 GLN HE2y A 21 GLN HGx 1.0 . 2.41 1006 795 A 22 CYS H A 21 GLN HGx 1.0 . 4.86 1007 795 A 22 CYS H A 21 GLN HGy 1.0 . 4.86 1008 796 A 21 GLN HE2x A 25 ASP HBy 1.0 . 3.39 1009 796 A 21 GLN HE2y A 25 ASP HBx 1.0 . 3.39 1010 796 A 21 GLN HE2x A 25 ASP HBx 1.0 . 3.39 1011 796 A 21 GLN HE2y A 25 ASP HBy 1.0 . 3.39 1012 797 A 22 CYS H A 22 CYS HBy 1.0 . 2.79 1013 797 A 22 CYS H A 22 CYS HBx 1.0 . 2.79 1014 798 A 22 CYS HA A 22 CYS HBy 1.0 . 2.43 1015 798 A 22 CYS HA A 22 CYS HBx 1.0 . 2.43 1016 799 A 22 CYS HA A 25 ASP HBy 1.0 . 4.19 1017 799 A 22 CYS HA A 25 ASP HBx 1.0 . 4.19 1018 800 A 23 ASN H A 22 CYS HBy 1.0 . 2.90 1019 800 A 23 ASN H A 22 CYS HBx 1.0 . 2.90 1020 801 A 22 CYS HBy A 23 ASN HBx 1.0 . 3.73 1021 801 A 22 CYS HBx A 23 ASN HBx 1.0 . 3.73 1022 801 A 23 ASN HBy A 22 CYS HBy 1.0 . 3.73 1023 801 A 22 CYS HBx A 23 ASN HBy 1.0 . 3.73 1024 802 A 23 ASN H A 35 GLY HAy 1.0 . 4.88 1025 802 A 23 ASN H A 35 GLY HAx 1.0 . 4.88 1026 803 A 23 ASN HA A 23 ASN HBx 1.0 . 2.64 1027 803 A 23 ASN HA A 23 ASN HBy 1.0 . 2.64 1028 804 A 23 ASN HA A 26 CYS HBx 1.0 . 3.25 1029 804 A 23 ASN HA A 26 CYS HBy 1.0 . 3.25 1030 805 A 23 ASN HA A 35 GLY HAy 1.0 . 4.72 1031 805 A 23 ASN HA A 35 GLY HAx 1.0 . 4.72 1032 806 A 23 ASN HD2y A 23 ASN HBx 1.0 . 2.94 1033 806 A 23 ASN HD2y A 23 ASN HBy 1.0 . 2.94 1034 807 A 23 ASN HD2x A 23 ASN HBx 1.0 . 3.52 1035 807 A 23 ASN HD2x A 23 ASN HBy 1.0 . 3.52 1036 808 A 35 GLY H A 23 ASN HBx 1.0 . 3.32 1037 808 A 35 GLY H A 23 ASN HBy 1.0 . 3.32 1038 809 A 23 ASN HD2y A 34 SER HBx 1.0 . 5.34 1039 809 A 23 ASN HD2y A 34 SER HBy 1.0 . 5.34 1040 810 A 23 ASN HD2x A 34 SER HBx 1.0 . 5.07 1041 810 A 23 ASN HD2x A 34 SER HBy 1.0 . 5.07 1042 811 A 24 TYR H A 24 TYR HBy 1.0 . 3.32 1043 811 A 24 TYR H A 24 TYR HBx 1.0 . 3.32 1044 812 A 25 ASP H A 24 TYR HBy 1.0 . 3.35 1045 812 A 25 ASP H A 24 TYR HBx 1.0 . 3.35 1046 813 A 24 TYR HBx A 25 ASP HBy 1.0 . 3.63 1047 813 A 24 TYR HBy A 25 ASP HBy 1.0 . 3.63 1048 813 A 25 ASP HBx A 24 TYR HBy 1.0 . 3.63 1049 813 A 25 ASP HBx A 24 TYR HBx 1.0 . 3.63 1050 814 A 24 TYR HE% A 28 LEU HDy% 1.0 . 3.66 1051 814 A 24 TYR HE% A 28 LEU HDx% 1.0 . 3.66 1052 815 A 25 ASP H A 25 ASP HBy 1.0 . 3.40 1053 815 A 25 ASP H A 25 ASP HBx 1.0 . 3.40 1054 816 A 25 ASP HA A 28 LEU HBx 1.0 . 3.09 1055 816 A 25 ASP HA A 28 LEU HBy 1.0 . 3.09 1056 817 A 25 ASP HA A 28 LEU HDy% 1.0 . 5.44 1057 817 A 25 ASP HA A 28 LEU HDx% 1.0 . 5.44 1058 818 A 26 CYS H A 25 ASP HBy 1.0 . 2.93 1059 818 A 26 CYS H A 25 ASP HBx 1.0 . 2.93 1060 819 A 26 CYS H A 26 CYS HBx 1.0 . 2.94 1061 819 A 26 CYS H A 26 CYS HBy 1.0 . 2.94 1062 820 A 26 CYS HA A 26 CYS HBx 1.0 . 2.39 1063 820 A 26 CYS HA A 26 CYS HBy 1.0 . 2.39 1064 821 A 26 CYS HA A 29 ASP HBy 1.0 . 3.88 1065 821 A 26 CYS HA A 29 ASP HBx 1.0 . 3.88 1066 822 A 27 LYS H A 26 CYS HBx 1.0 . 3.68 1067 822 A 27 LYS H A 26 CYS HBy 1.0 . 3.68 1068 823 A 32 ALA HB% A 26 CYS HBx 1.0 . 4.04 1069 823 A 32 ALA HB% A 26 CYS HBy 1.0 . 4.04 1070 824 A 35 GLY H A 26 CYS HBx 1.0 . 4.24 1071 824 A 35 GLY H A 26 CYS HBy 1.0 . 4.24 1072 825 A 26 CYS HBx A 35 GLY HAy 1.0 . 2.85 1073 825 A 26 CYS HBy A 35 GLY HAy 1.0 . 2.85 1074 825 A 35 GLY HAx A 26 CYS HBx 1.0 . 2.85 1075 825 A 35 GLY HAx A 26 CYS HBy 1.0 . 2.85 1076 826 A 49 CYS HA A 26 CYS HBx 1.0 . 3.22 1077 826 A 49 CYS HA A 26 CYS HBy 1.0 . 3.22 1078 827 A 27 LYS H A 27 LYS HBx 1.0 . 2.88 1079 827 A 27 LYS H A 27 LYS HBy 1.0 . 2.88 1080 828 A 27 LYS HA A 27 LYS HGx 1.0 . 2.88 1081 828 A 27 LYS HA A 27 LYS HGy 1.0 . 2.88 1082 829 A 27 LYS HBy A 27 LYS HGx 1.0 . 2.36 1083 829 A 27 LYS HBx A 27 LYS HGx 1.0 . 2.36 1084 829 A 27 LYS HGy A 27 LYS HBx 1.0 . 2.36 1085 829 A 27 LYS HBy A 27 LYS HGy 1.0 . 2.36 1086 830 A 27 LYS HBx A 27 LYS HEy 1.0 . 3.29 1087 830 A 27 LYS HEx A 27 LYS HBx 1.0 . 3.29 1088 830 A 27 LYS HBy A 27 LYS HEx 1.0 . 3.29 1089 830 A 27 LYS HBy A 27 LYS HEy 1.0 . 3.29 1090 831 A 28 LEU H A 27 LYS HBx 1.0 . 3.61 1091 831 A 28 LEU H A 27 LYS HBy 1.0 . 3.61 1092 832 A 27 LYS HEy A 27 LYS HGx 1.0 . 3.34 1093 832 A 27 LYS HEx A 27 LYS HGx 1.0 . 3.34 1094 832 A 27 LYS HGy A 27 LYS HEy 1.0 . 3.34 1095 832 A 27 LYS HGy A 27 LYS HEx 1.0 . 3.34 1096 833 A 28 LEU H A 27 LYS HGx 1.0 . 4.75 1097 833 A 28 LEU H A 27 LYS HGy 1.0 . 4.75 1098 834 A 28 LEU H A 27 LYS HEy 1.0 . 4.84 1099 834 A 28 LEU H A 27 LYS HEx 1.0 . 4.84 1100 835 A 28 LEU H A 28 LEU HDy% 1.0 . 3.89 1101 835 A 28 LEU H A 28 LEU HDx% 1.0 . 3.89 1102 836 A 28 LEU HA A 28 LEU HDy% 1.0 . 2.92 1103 836 A 28 LEU HA A 28 LEU HDx% 1.0 . 2.92 1104 837 A 29 ASP H A 28 LEU HBx 1.0 . 3.18 1105 837 A 29 ASP H A 28 LEU HBy 1.0 . 3.18 1106 838 A 29 ASP H A 28 LEU HDy% 1.0 . 4.01 1107 838 A 29 ASP H A 28 LEU HDx% 1.0 . 4.01 1108 839 A 29 ASP HA A 29 ASP HBy 1.0 . 2.59 1109 839 A 29 ASP HA A 29 ASP HBx 1.0 . 2.59 1110 840 A 30 LYS H A 29 ASP HBy 1.0 . 3.02 1111 840 A 30 LYS H A 29 ASP HBx 1.0 . 3.02 1112 841 A 30 LYS HGy A 29 ASP HBy 1.0 . 4.29 1113 841 A 30 LYS HGy A 29 ASP HBx 1.0 . 4.29 1114 842 A 29 ASP HBy A 30 LYS HEy 1.0 . 5.18 1115 842 A 29 ASP HBx A 30 LYS HEy 1.0 . 5.18 1116 842 A 30 LYS HEx A 29 ASP HBy 1.0 . 5.18 1117 842 A 29 ASP HBx A 30 LYS HEx 1.0 . 5.18 1118 843 A 30 LYS H A 30 LYS HDx 1.0 . 4.53 1119 843 A 30 LYS H A 30 LYS HDy 1.0 . 4.53 1120 844 A 30 LYS H A 30 LYS HEy 1.0 . 4.63 1121 844 A 30 LYS H A 30 LYS HEx 1.0 . 4.63 1122 845 A 30 LYS HA A 30 LYS HDx 1.0 . 3.17 1123 845 A 30 LYS HA A 30 LYS HDy 1.0 . 3.17 1124 846 A 30 LYS HA A 30 LYS HEy 1.0 . 4.32 1125 846 A 30 LYS HA A 30 LYS HEx 1.0 . 4.32 1126 847 A 30 LYS HBx A 30 LYS HDx 1.0 . 3.54 1127 847 A 30 LYS HBx A 30 LYS HDy 1.0 . 3.54 1128 848 A 30 LYS HBx A 30 LYS HEy 1.0 . 4.81 1129 848 A 30 LYS HBx A 30 LYS HEx 1.0 . 4.81 1130 849 A 30 LYS HBy A 30 LYS HDx 1.0 . 3.50 1131 849 A 30 LYS HBy A 30 LYS HDy 1.0 . 3.50 1132 850 A 30 LYS HBy A 30 LYS HEy 1.0 . 5.34 1133 850 A 30 LYS HBy A 30 LYS HEx 1.0 . 5.34 1134 851 A 30 LYS HGy A 30 LYS HEy 1.0 . 3.29 1135 851 A 30 LYS HGy A 30 LYS HEx 1.0 . 3.29 1136 852 A 30 LYS HGx A 30 LYS HEy 1.0 . 3.44 1137 852 A 30 LYS HGx A 30 LYS HEx 1.0 . 3.44 1138 853 A 31 HIS H A 30 LYS HDx 1.0 . 5.34 1139 853 A 31 HIS H A 30 LYS HDy 1.0 . 5.34 1140 854 A 31 HIS H A 31 HIS HBy 1.0 . 3.54 1141 854 A 31 HIS H A 31 HIS HBx 1.0 . 3.54 1142 855 A 33 ARG H A 33 ARG HDy 1.0 . 4.32 1143 855 A 33 ARG H A 33 ARG HDx 1.0 . 4.32 1144 856 A 33 ARG HA A 33 ARG HGx 1.0 . 2.69 1145 856 A 33 ARG HA A 33 ARG HGy 1.0 . 2.69 1146 857 A 33 ARG HBy A 33 ARG HDy 1.0 . 3.47 1147 857 A 33 ARG HBy A 33 ARG HDx 1.0 . 3.47 1148 858 A 33 ARG HBx A 33 ARG HDy 1.0 . 3.29 1149 858 A 33 ARG HBx A 33 ARG HDx 1.0 . 3.29 1150 859 A 51 TYR HA A 33 ARG HGx 1.0 . 3.93 1151 859 A 51 TYR HA A 33 ARG HGy 1.0 . 3.93 1152 860 A 34 SER H A 33 ARG HDy 1.0 . 4.88 1153 860 A 34 SER H A 33 ARG HDx 1.0 . 4.88 1154 861 A 52 CYS HA A 33 ARG HDy 1.0 . 4.16 1155 861 A 52 CYS HA A 33 ARG HDx 1.0 . 4.16 1156 862 A 34 SER H A 34 SER HBx 1.0 . 3.41 1157 862 A 34 SER H A 34 SER HBy 1.0 . 3.41 1158 863 A 34 SER H A 50 ASP HBx 1.0 . 3.22 1159 863 A 34 SER H A 50 ASP HBy 1.0 . 3.22 1160 864 A 34 SER HA A 34 SER HBx 1.0 . 2.52 1161 864 A 34 SER HA A 34 SER HBy 1.0 . 2.52 1162 865 A 35 GLY H A 34 SER HBx 1.0 . 2.60 1163 865 A 35 GLY H A 34 SER HBy 1.0 . 2.60 1164 866 A 50 ASP H A 35 GLY HAy 1.0 . 3.16 1165 866 A 50 ASP H A 35 GLY HAx 1.0 . 3.16 1166 867 A 36 GLU H A 36 GLU HBx 1.0 . 3.22 1167 867 A 36 GLU H A 36 GLU HBy 1.0 . 3.22 1168 868 A 36 GLU H A 36 GLU HGx 1.0 . 3.87 1169 868 A 36 GLU H A 36 GLU HGy 1.0 . 3.87 1170 869 A 36 GLU HA A 36 GLU HGx 1.0 . 3.53 1171 869 A 36 GLU HA A 36 GLU HGy 1.0 . 3.53 1172 870 A 37 CYS H A 36 GLU HBx 1.0 . 3.24 1173 870 A 37 CYS H A 36 GLU HBy 1.0 . 3.24 1174 871 A 38 PHE HE% A 36 GLU HBx 1.0 . 4.22 1175 871 A 38 PHE HE% A 36 GLU HBy 1.0 . 4.22 1176 872 A 37 CYS H A 36 GLU HGx 1.0 . 3.28 1177 872 A 37 CYS H A 36 GLU HGy 1.0 . 3.28 1178 873 A 38 PHE HE% A 36 GLU HGx 1.0 . 4.60 1179 873 A 38 PHE HE% A 36 GLU HGy 1.0 . 4.60 1180 874 A 37 CYS HA A 37 CYS HBy 1.0 . 2.60 1181 874 A 37 CYS HA A 37 CYS HBx 1.0 . 2.60 1182 875 A 38 PHE H A 37 CYS HBy 1.0 . 3.20 1183 875 A 38 PHE H A 37 CYS HBx 1.0 . 3.20 1184 876 A 37 CYS HBy A 45 LEU HBy 1.0 . 4.76 1185 876 A 37 CYS HBx A 45 LEU HBy 1.0 . 4.76 1186 876 A 45 LEU HBx A 37 CYS HBy 1.0 . 4.76 1187 876 A 45 LEU HBx A 37 CYS HBx 1.0 . 4.76 1188 877 A 37 CYS HBx A 45 LEU HDy% 1.0 . 2.90 1189 877 A 37 CYS HBy A 45 LEU HDy% 1.0 . 2.90 1190 877 A 45 LEU HDx% A 37 CYS HBy 1.0 . 2.90 1191 877 A 45 LEU HDx% A 37 CYS HBx 1.0 . 2.90 1192 878 A 46 GLN H A 37 CYS HBy 1.0 . 5.34 1193 878 A 46 GLN H A 37 CYS HBx 1.0 . 5.34 1194 879 A 38 PHE H A 38 PHE HBx 1.0 . 3.26 1195 879 A 38 PHE H A 38 PHE HBy 1.0 . 3.26 1196 880 A 38 PHE H A 45 LEU HDy% 1.0 . 3.97 1197 880 A 38 PHE H A 45 LEU HDx% 1.0 . 3.97 1198 881 A 39 TYR H A 38 PHE HBx 1.0 . 3.47 1199 881 A 39 TYR H A 38 PHE HBy 1.0 . 3.47 1200 882 A 48 ILE HD1% A 38 PHE HBx 1.0 . 3.48 1201 882 A 48 ILE HD1% A 38 PHE HBy 1.0 . 3.48 1202 883 A 38 PHE HD% A 48 ILE HG1x 1.0 . 4.57 1203 883 A 38 PHE HD% A 48 ILE HG1y 1.0 . 4.57 1204 884 A 39 TYR HD% A 45 LEU HBy 1.0 . 4.55 1205 884 A 39 TYR HD% A 45 LEU HBx 1.0 . 4.55 1206 885 A 39 TYR HD% A 45 LEU HDy% 1.0 . 4.10 1207 885 A 39 TYR HD% A 45 LEU HDx% 1.0 . 4.10 1208 886 A 39 TYR HE% A 45 LEU HBy 1.0 . 4.36 1209 886 A 39 TYR HE% A 45 LEU HBx 1.0 . 4.36 1210 887 A 39 TYR HE% A 45 LEU HDy% 1.0 . 4.23 1211 887 A 39 TYR HE% A 45 LEU HDx% 1.0 . 4.23 1212 888 A 40 LYS H A 40 LYS HBx 1.0 . 2.86 1213 888 A 40 LYS H A 40 LYS HBy 1.0 . 2.86 1214 889 A 40 LYS H A 40 LYS HGx 1.0 . 3.78 1215 889 A 40 LYS H A 40 LYS HGy 1.0 . 3.78 1216 890 A 40 LYS HA A 40 LYS HDx 1.0 . 4.55 1217 890 A 40 LYS HA A 40 LYS HDy 1.0 . 4.55 1218 891 A 41 GLU H A 40 LYS HBx 1.0 . 3.75 1219 891 A 41 GLU H A 40 LYS HBy 1.0 . 3.75 1220 892 A 41 GLU H A 40 LYS HGx 1.0 . 4.63 1221 892 A 41 GLU H A 40 LYS HGy 1.0 . 4.63 1222 893 A 41 GLU H A 41 GLU HBx 1.0 . 3.25 1223 893 A 41 GLU H A 41 GLU HBy 1.0 . 3.25 1224 894 A 41 GLU H A 41 GLU HGx 1.0 . 3.97 1225 894 A 41 GLU H A 41 GLU HGy 1.0 . 3.97 1226 895 A 41 GLU HA A 41 GLU HGx 1.0 . 3.36 1227 895 A 41 GLU HA A 41 GLU HGy 1.0 . 3.36 1228 896 A 42 LYS H A 41 GLU HBx 1.0 . 3.29 1229 896 A 42 LYS H A 41 GLU HBy 1.0 . 3.29 1230 897 A 42 LYS H A 41 GLU HGx 1.0 . 3.99 1231 897 A 42 LYS H A 41 GLU HGy 1.0 . 3.99 1232 898 A 41 GLU HGx A 44 ASN HD2x 1.0 . 4.38 1233 898 A 41 GLU HGy A 44 ASN HD2x 1.0 . 4.38 1234 898 A 44 ASN HD2y A 41 GLU HGx 1.0 . 4.38 1235 898 A 41 GLU HGy A 44 ASN HD2y 1.0 . 4.38 1236 899 A 42 LYS H A 42 LYS HBx 1.0 . 3.41 1237 899 A 42 LYS H A 42 LYS HBy 1.0 . 3.41 1238 900 A 42 LYS H A 42 LYS HGx 1.0 . 3.72 1239 900 A 42 LYS H A 42 LYS HGy 1.0 . 3.72 1240 901 A 42 LYS HA A 42 LYS HGx 1.0 . 3.05 1241 901 A 42 LYS HGy A 42 LYS HA 1.0 . 3.05 1242 902 A 42 LYS HA A 42 LYS HDx 1.0 . 5.03 1243 902 A 42 LYS HA A 42 LYS HDy 1.0 . 5.03 1244 903 A 43 ARG H A 42 LYS HBx 1.0 . 3.32 1245 903 A 43 ARG H A 42 LYS HBy 1.0 . 3.32 1246 904 A 43 ARG H A 43 ARG HGy 1.0 . 3.62 1247 904 A 43 ARG H A 43 ARG HGx 1.0 . 3.62 1248 905 A 43 ARG HA A 43 ARG HGy 1.0 . 3.17 1249 905 A 43 ARG HA A 43 ARG HGx 1.0 . 3.17 1250 906 A 43 ARG HA A 43 ARG HDx 1.0 . 3.72 1251 906 A 43 ARG HA A 43 ARG HDy 1.0 . 3.72 1252 907 A 43 ARG HBy A 43 ARG HGy 1.0 . 2.58 1253 907 A 43 ARG HBy A 43 ARG HGx 1.0 . 2.58 1254 908 A 44 ASN H A 43 ARG HGy 1.0 . 3.91 1255 908 A 44 ASN H A 43 ARG HGx 1.0 . 3.91 1256 909 A 44 ASN HBy A 44 ASN HD2x 1.0 . 3.02 1257 909 A 44 ASN HBx A 44 ASN HD2x 1.0 . 3.02 1258 909 A 44 ASN HD2y A 44 ASN HBx 1.0 . 3.02 1259 909 A 44 ASN HBy A 44 ASN HD2y 1.0 . 3.02 1260 910 A 45 LEU H A 44 ASN HBx 1.0 . 3.58 1261 910 A 45 LEU H A 44 ASN HBy 1.0 . 3.58 1262 911 A 45 LEU H A 45 LEU HDy% 1.0 . 3.87 1263 911 A 45 LEU H A 45 LEU HDx% 1.0 . 3.87 1264 912 A 45 LEU HA A 45 LEU HDy% 1.0 . 2.90 1265 912 A 45 LEU HA A 45 LEU HDx% 1.0 . 2.90 1266 913 A 45 LEU HBy A 45 LEU HDy% 1.0 . 2.54 1267 913 A 45 LEU HBx A 45 LEU HDy% 1.0 . 2.54 1268 913 A 45 LEU HDx% A 45 LEU HBy 1.0 . 2.54 1269 913 A 45 LEU HBx A 45 LEU HDx% 1.0 . 2.54 1270 914 A 46 GLN H A 45 LEU HBy 1.0 . 4.04 1271 914 A 46 GLN H A 45 LEU HBx 1.0 . 4.04 1272 915 A 46 GLN H A 45 LEU HDy% 1.0 . 3.39 1273 915 A 46 GLN H A 45 LEU HDx% 1.0 . 3.39 1274 916 A 46 GLN H A 46 GLN HGy 1.0 . 3.69 1275 916 A 46 GLN H A 46 GLN HGx 1.0 . 3.69 1276 917 A 46 GLN HA A 46 GLN HGy 1.0 . 3.57 1277 917 A 46 GLN HA A 46 GLN HGx 1.0 . 3.57 1278 918 A 46 GLN HE2x A 46 GLN HBy 1.0 . 4.60 1279 918 A 46 GLN HE2y A 46 GLN HBy 1.0 . 4.60 1280 918 A 46 GLN HE2y A 46 GLN HBx 1.0 . 4.60 1281 918 A 46 GLN HE2x A 46 GLN HBx 1.0 . 4.60 1282 919 A 47 CYS H A 46 GLN HBy 1.0 . 3.49 1283 919 A 47 CYS H A 46 GLN HBx 1.0 . 3.49 1284 920 A 46 GLN HBy A 48 ILE HG1x 1.0 . 3.71 1285 920 A 46 GLN HBx A 48 ILE HG1x 1.0 . 3.71 1286 920 A 48 ILE HG1y A 46 GLN HBy 1.0 . 3.71 1287 920 A 48 ILE HG1y A 46 GLN HBx 1.0 . 3.71 1288 921 A 48 ILE HD1% A 46 GLN HBy 1.0 . 3.87 1289 921 A 48 ILE HD1% A 46 GLN HBx 1.0 . 3.87 1290 922 A 46 GLN HE2x A 46 GLN HGx 1.0 . 2.98 1291 922 A 46 GLN HE2y A 46 GLN HGy 1.0 . 2.98 1292 922 A 46 GLN HE2y A 46 GLN HGx 1.0 . 2.98 1293 922 A 46 GLN HE2x A 46 GLN HGy 1.0 . 2.98 1294 923 A 47 CYS H A 46 GLN HGy 1.0 . 3.60 1295 923 A 47 CYS H A 46 GLN HGx 1.0 . 3.60 1296 924 A 46 GLN HE2x A 48 ILE HD1% 1.0 . 4.50 1297 924 A 48 ILE HD1% A 46 GLN HE2y 1.0 . 4.50 1298 925 A 47 CYS H A 47 CYS HBy 1.0 . 3.22 1299 925 A 47 CYS H A 47 CYS HBx 1.0 . 3.22 1300 926 A 48 ILE H A 47 CYS HBy 1.0 . 3.66 1301 926 A 48 ILE H A 47 CYS HBx 1.0 . 3.66 1302 927 A 48 ILE HA A 48 ILE HG1x 1.0 . 3.32 1303 927 A 48 ILE HA A 48 ILE HG1y 1.0 . 3.32 1304 928 A 48 ILE HG2% A 48 ILE HG1x 1.0 . 2.80 1305 928 A 48 ILE HG2% A 48 ILE HG1y 1.0 . 2.80 1306 929 A 50 ASP H A 49 CYS HBy 1.0 . 2.96 1307 929 A 50 ASP H A 49 CYS HBx 1.0 . 2.96 1308 930 A 51 TYR HD% A 49 CYS HBy 1.0 . 5.18 1309 930 A 51 TYR HD% A 49 CYS HBx 1.0 . 5.18 1310 931 A 51 TYR HE% A 49 CYS HBy 1.0 . 3.21 1311 931 A 51 TYR HE% A 49 CYS HBx 1.0 . 3.21 1312 932 A 50 ASP H A 50 ASP HBx 1.0 . 3.30 1313 932 A 50 ASP H A 50 ASP HBy 1.0 . 3.30 1314 933 A 51 TYR H A 50 ASP HBx 1.0 . 4.08 1315 933 A 51 TYR H A 50 ASP HBy 1.0 . 4.08 1316 934 A 51 TYR H A 51 TYR HBx 1.0 . 3.23 1317 934 A 51 TYR H A 51 TYR HBy 1.0 . 3.23 1318 935 A 51 TYR HA A 51 TYR HBx 1.0 . 2.64 1319 935 A 51 TYR HA A 51 TYR HBy 1.0 . 2.64 1320 936 A 52 CYS H A 51 TYR HBx 1.0 . 4.19 1321 936 A 52 CYS H A 51 TYR HBy 1.0 . 4.19 1322 937 A 52 CYS H A 52 CYS HBy 1.0 . 3.57 1323 937 A 52 CYS H A 52 CYS HBx 1.0 . 3.57 1324 938 A 52 CYS HA A 52 CYS HBy 1.0 . 2.64 1325 938 A 52 CYS HA A 52 CYS HBx 1.0 . 2.64 1326 939 A 53 GLU H A 52 CYS HBy 1.0 . 3.52 1327 939 A 53 GLU H A 52 CYS HBx 1.0 . 3.52 1328 940 A 53 GLU H A 53 GLU HBx 1.0 . 3.57 1329 940 A 53 GLU H A 53 GLU HBy 1.0 . 3.57 1330 941 A 53 GLU H A 53 GLU HGx 1.0 . 3.67 1331 941 A 53 GLU H A 53 GLU HGy 1.0 . 3.67 1332 942 A 53 GLU HBx A 53 GLU HGx 1.0 . 2.32 1333 942 A 53 GLU HBy A 53 GLU HGx 1.0 . 2.32 1334 942 A 53 GLU HGy A 53 GLU HBx 1.0 . 2.32 1335 942 A 53 GLU HBy A 53 GLU HGy 1.0 . 2.32 1336 943 A 54 TYR H A 53 GLU HBx 1.0 . 3.40 1337 943 A 54 TYR H A 53 GLU HBy 1.0 . 3.40 1338 944 A 54 TYR H A 53 GLU HGx 1.0 . 4.07 1339 944 A 54 TYR H A 53 GLU HGy 1.0 . 4.07 1340 945 A 54 TYR H A 54 TYR HBy 1.0 . 3.14 1341 945 A 54 TYR H A 54 TYR HBx 1.0 . 3.14 stop_ save_ save_DYANA/DIANA_dihedral_3 _nef_dihedral_restraint_list.sf_category nef_dihedral_restraint_list _nef_dihedral_restraint_list.sf_framecode DYANA/DIANA_dihedral_3 _nef_dihedral_restraint_list.potential_type square-well-parabolic _nef_dihedral_restraint_list.restraint_origin . loop_ _nef_dihedral_restraint.index _nef_dihedral_restraint.restraint_id _nef_dihedral_restraint.chain_code_1 _nef_dihedral_restraint.sequence_code_1 _nef_dihedral_restraint.residue_name_1 _nef_dihedral_restraint.atom_name_1 _nef_dihedral_restraint.chain_code_2 _nef_dihedral_restraint.sequence_code_2 _nef_dihedral_restraint.residue_name_2 _nef_dihedral_restraint.atom_name_2 _nef_dihedral_restraint.chain_code_3 _nef_dihedral_restraint.sequence_code_3 _nef_dihedral_restraint.residue_name_3 _nef_dihedral_restraint.atom_name_3 _nef_dihedral_restraint.chain_code_4 _nef_dihedral_restraint.sequence_code_4 _nef_dihedral_restraint.residue_name_4 _nef_dihedral_restraint.atom_name_4 _nef_dihedral_restraint.weight _nef_dihedral_restraint.lower_limit _nef_dihedral_restraint.upper_limit _nef_dihedral_restraint.name 1 1 A 4 CYS C A 5 LYS N A 5 LYS CA A 5 LYS C 1.0 -169.9 -92.6 PHI 2 2 A 5 LYS N A 5 LYS CA A 5 LYS C A 6 LYS N 1.0 116.3 174.3 PSI 3 3 A 5 LYS C A 6 LYS N A 6 LYS CA A 6 LYS C 1.0 -161.9 -88.1 PHI 4 4 A 6 LYS N A 6 LYS CA A 6 LYS C A 7 VAL N 1.0 110.4 157.2 PSI 5 5 A 6 LYS C A 7 VAL N A 7 VAL CA A 7 VAL C 1.0 -121.7 -61.1 PHI 6 6 A 7 VAL N A 7 VAL CA A 7 VAL C A 8 TYR N 1.0 92.5 146.6 PSI 7 7 A 7 VAL C A 8 TYR N A 8 TYR CA A 8 TYR C 1.0 -112.7 -63.6 PHI 8 8 A 8 TYR N A 8 TYR CA A 8 TYR C A 9 GLU N 1.0 73.4 137.5 PSI 9 9 A 8 TYR C A 9 GLU N A 9 GLU CA A 9 GLU C 1.0 -69.2 -46.1 PHI 10 10 A 9 GLU N A 9 GLU CA A 9 GLU C A 10 ASN N 1.0 -53.4 -8.5 PSI 11 11 A 10 ASN C A 11 TYR N A 11 TYR CA A 11 TYR C 1.0 -134.9 -34.1 PHI 12 12 A 11 TYR N A 11 TYR CA A 11 TYR C A 12 PRO N 1.0 59.6 171.7 PSI 13 13 A 12 PRO C A 13 VAL N A 13 VAL CA A 13 VAL C 1.0 -65.4 -45.4 PHI 14 14 A 13 VAL N A 13 VAL CA A 13 VAL C A 14 SER N 1.0 -54.8 -18.6 PSI 15 15 A 13 VAL C A 14 SER N A 14 SER CA A 14 SER C 1.0 -76.4 -53.4 PHI 16 16 A 14 SER N A 14 SER CA A 14 SER C A 15 LYS N 1.0 -51.3 -31.3 PSI 17 17 A 14 SER C A 15 LYS N A 15 LYS CA A 15 LYS C 1.0 -96.3 -53.7 PHI 18 18 A 15 LYS N A 15 LYS CA A 15 LYS C A 16 CYS N 1.0 -63.0 5.3 PSI 19 19 A 18 LEU C A 19 ALA N A 19 ALA CA A 19 ALA C 1.0 -79.1 -43.3 PHI 20 20 A 19 ALA N A 19 ALA CA A 19 ALA C A 20 ASN N 1.0 -47.3 -3.7 PSI 21 21 A 19 ALA C A 20 ASN N A 20 ASN CA A 20 ASN C 1.0 -79.6 -53.1 PHI 22 22 A 20 ASN N A 20 ASN CA A 20 ASN C A 21 GLN N 1.0 -52.7 -24.7 PSI 23 23 A 20 ASN C A 21 GLN N A 21 GLN CA A 21 GLN C 1.0 -105.5 -50.3 PHI 24 24 A 21 GLN N A 21 GLN CA A 21 GLN C A 22 CYS N 1.0 -62.1 -0.1 PSI 25 25 A 23 ASN C A 24 TYR N A 24 TYR CA A 24 TYR C 1.0 -69.5 -49.5 PHI 26 26 A 24 TYR N A 24 TYR CA A 24 TYR C A 25 ASP N 1.0 -54.6 -32.4 PSI 27 27 A 24 TYR C A 25 ASP N A 25 ASP CA A 25 ASP C 1.0 -78.8 -55.1 PHI 28 28 A 25 ASP N A 25 ASP CA A 25 ASP C A 26 CYS N 1.0 -56.6 -21.7 PSI 29 29 A 25 ASP C A 26 CYS N A 26 CYS CA A 26 CYS C 1.0 -70.7 -50.7 PHI 30 30 A 26 CYS N A 26 CYS CA A 26 CYS C A 27 LYS N 1.0 -57.3 -37.3 PSI 31 31 A 28 LEU C A 29 ASP N A 29 ASP CA A 29 ASP C 1.0 -84.1 -50.5 PHI 32 32 A 29 ASP N A 29 ASP CA A 29 ASP C A 30 LYS N 1.0 -46.3 -8.7 PSI 33 33 A 29 ASP C A 30 LYS N A 30 LYS CA A 30 LYS C 1.0 -112.8 -87.9 PHI 34 34 A 30 LYS N A 30 LYS CA A 30 LYS C A 31 HIS N 1.0 -26.6 37.9 PSI 35 35 A 30 LYS C A 31 HIS N A 31 HIS CA A 31 HIS C 1.0 35.9 74.9 PHI 36 36 A 31 HIS N A 31 HIS CA A 31 HIS C A 32 ALA N 1.0 26.7 57.6 PSI 37 37 A 32 ALA C A 33 ARG N A 33 ARG CA A 33 ARG C 1.0 -82.8 -42.7 PHI 38 38 A 33 ARG N A 33 ARG CA A 33 ARG C A 34 SER N 1.0 -51.1 3.1 PSI 39 39 A 35 GLY C A 36 GLU N A 36 GLU CA A 36 GLU C 1.0 -151.6 -88.7 PHI 40 40 A 36 GLU N A 36 GLU CA A 36 GLU C A 37 CYS N 1.0 113.4 169.3 PSI 41 41 A 36 GLU C A 37 CYS N A 37 CYS CA A 37 CYS C 1.0 -162.2 -111.2 PHI 42 42 A 37 CYS N A 37 CYS CA A 37 CYS C A 38 PHE N 1.0 131.6 183.6 PSI 43 43 A 37 CYS C A 38 PHE N A 38 PHE CA A 38 PHE C 1.0 -170.7 -89.6 PHI 44 44 A 38 PHE N A 38 PHE CA A 38 PHE C A 39 TYR N 1.0 115.9 168.6 PSI 45 45 A 38 PHE C A 39 TYR N A 39 TYR CA A 39 TYR C 1.0 -134.0 -54.2 PHI 46 46 A 39 TYR N A 39 TYR CA A 39 TYR C A 40 LYS N 1.0 96.4 154.8 PSI 47 47 A 39 TYR C A 40 LYS N A 40 LYS CA A 40 LYS C 1.0 -138.5 -41.1 PHI 48 48 A 40 LYS N A 40 LYS CA A 40 LYS C A 41 GLU N 1.0 104.7 171.2 PSI 49 49 A 41 GLU C A 42 LYS N A 42 LYS CA A 42 LYS C 1.0 -83.1 -53.5 PHI 50 50 A 42 LYS N A 42 LYS CA A 42 LYS C A 43 ARG N 1.0 -44.1 7.0 PSI 51 51 A 42 LYS C A 43 ARG N A 43 ARG CA A 43 ARG C 1.0 -121.9 -50.6 PHI 52 52 A 43 ARG N A 43 ARG CA A 43 ARG C A 44 ASN N 1.0 -57.7 30.9 PSI 53 53 A 43 ARG C A 44 ASN N A 44 ASN CA A 44 ASN C 1.0 -116.9 -54.4 PHI 54 54 A 44 ASN N A 44 ASN CA A 44 ASN C A 45 LEU N 1.0 105.8 170.7 PSI 55 55 A 44 ASN C A 45 LEU N A 45 LEU CA A 45 LEU C 1.0 -135.2 -44.5 PHI 56 56 A 45 LEU N A 45 LEU CA A 45 LEU C A 46 GLN N 1.0 103.6 154.7 PSI 57 57 A 45 LEU C A 46 GLN N A 46 GLN CA A 46 GLN C 1.0 -154.7 -99.3 PHI 58 58 A 46 GLN N A 46 GLN CA A 46 GLN C A 47 CYS N 1.0 124.9 169.4 PSI 59 59 A 47 CYS C A 48 ILE N A 48 ILE CA A 48 ILE C 1.0 -123.6 -86.6 PHI 60 60 A 48 ILE N A 48 ILE CA A 48 ILE C A 49 CYS N 1.0 114.3 142.5 PSI 61 61 A 48 ILE C A 49 CYS N A 49 CYS CA A 49 CYS C 1.0 -156.5 -94.6 PHI 62 62 A 49 CYS N A 49 CYS CA A 49 CYS C A 50 ASP N 1.0 125.9 177.7 PSI 63 63 A 49 CYS C A 50 ASP N A 50 ASP CA A 50 ASP C 1.0 -143.8 -82.8 PHI 64 64 A 50 ASP N A 50 ASP CA A 50 ASP C A 51 TYR N 1.0 110.3 168.9 PSI stop_ save_