data_nef_c30679_6um9 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 _nef_nmr_meta_data.program_name . _nef_nmr_meta_data.program_version . _nef_nmr_meta_data.creation_date . _nef_nmr_meta_data.uuid . _nef_nmr_meta_data.coordinate_file_name . loop_ _nef_related_entries.database_name _nef_related_entries.database_accession_code PDB 6UM9 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 19 CYS SG 1 54 CYS SG 1 50 CYS SG 1 109 CYS SG 1 97 CYS SG 1 118 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 SER start . . 2 A 2 LYS middle . . 3 A 3 GLU middle . . 4 A 4 VAL middle . . 5 A 5 MET middle . . 6 A 6 LYS middle . . 7 A 7 GLN middle . . 8 A 8 MET middle . . 9 A 9 THR middle . . 10 A 10 ILE middle . . 11 A 11 ASN middle . . 12 A 12 PHE middle . . 13 A 13 ALA middle . . 14 A 14 LYS middle . . 15 A 15 PRO middle . false 16 A 16 MET middle . . 17 A 17 GLU middle . . 18 A 18 ALA middle . . 19 A 19 CYS middle -HG . 20 A 20 LYS middle . . 21 A 21 GLN middle . . 22 A 22 GLU middle . . 23 A 23 LEU middle . . 24 A 24 ASN middle . . 25 A 25 VAL middle . . 26 A 26 PRO middle . false 27 A 27 ASP middle . . 28 A 28 ALA middle . . 29 A 29 VAL middle . . 30 A 30 MET middle . . 31 A 31 GLN middle . . 32 A 32 ASP middle . . 33 A 33 PHE middle . . 34 A 34 PHE middle . . 35 A 35 ASN middle . . 36 A 36 PHE middle . . 37 A 37 TRP middle . . 38 A 38 LYS middle . . 39 A 39 GLU middle . . 40 A 40 GLY middle . false 41 A 41 TYR middle . . 42 A 42 GLN middle . . 43 A 43 ILE middle . . 44 A 44 THR middle . . 45 A 45 ASN middle . . 46 A 46 ARG middle . . 47 A 47 GLU middle . . 48 A 48 ALA middle . . 49 A 49 GLY middle . false 50 A 50 CYS middle -HG . 51 A 51 VAL middle . . 52 A 52 ILE middle . . 53 A 53 LEU middle . . 54 A 54 CYS middle -HG . 55 A 55 LEU middle . . 56 A 56 ALA middle . . 57 A 57 LYS middle . . 58 A 58 LYS middle . . 59 A 59 LEU middle . . 60 A 60 GLU middle . . 61 A 61 LEU middle . . 62 A 62 LEU middle . . 63 A 63 ASP middle . . 64 A 64 GLN middle . . 65 A 65 ASP middle . . 66 A 66 MET middle . . 67 A 67 ASN middle . . 68 A 68 LEU middle . . 69 A 69 HIS middle . . 70 A 70 HIS middle . . 71 A 71 GLY middle . false 72 A 72 LYS middle . . 73 A 73 ALA middle . . 74 A 74 MET middle . . 75 A 75 GLU middle . . 76 A 76 PHE middle . . 77 A 77 ALA middle . . 78 A 78 MET middle . . 79 A 79 LYS middle . . 80 A 80 HIS middle . . 81 A 81 GLY middle . false 82 A 82 ALA middle . . 83 A 83 ASP middle . . 84 A 84 GLU middle . . 85 A 85 ALA middle . . 86 A 86 MET middle . . 87 A 87 ALA middle . . 88 A 88 LYS middle . . 89 A 89 GLN middle . . 90 A 90 LEU middle . . 91 A 91 LEU middle . . 92 A 92 ASP middle . . 93 A 93 ILE middle . . 94 A 94 LYS middle . . 95 A 95 HIS middle . . 96 A 96 SER middle . . 97 A 97 CYS middle -HG . 98 A 98 GLU middle . . 99 A 99 LYS middle . . 100 A 100 VAL middle . . 101 A 101 ILE middle . . 102 A 102 THR middle . . 103 A 103 ILE middle . . 104 A 104 VAL middle . . 105 A 105 ALA middle . . 106 A 106 ASP middle . . 107 A 107 ASP middle . . 108 A 108 PRO middle . false 109 A 109 CYS middle -HG . 110 A 110 GLN middle . . 111 A 111 THR middle . . 112 A 112 MET middle . . 113 A 113 LEU middle . . 114 A 114 ASN middle . . 115 A 115 LEU middle . . 116 A 116 ALA middle . . 117 A 117 MET middle . . 118 A 118 CYS middle -HG . 119 A 119 PHE middle . . 120 A 120 LYS middle . . 121 A 121 ALA middle . . 122 A 122 GLU middle . . 123 A 123 ILE middle . . 124 A 124 HIS middle . . 125 A 125 LYS middle . . 126 A 126 LEU middle . . 127 A 127 ASP middle . . 128 A 128 TRP middle . . 129 A 129 ALA middle . . 130 A 130 PRO middle . false 131 A 131 THR middle . . 132 A 132 LEU middle . . 133 A 133 ASP middle . . 134 A 134 VAL middle . . 135 A 135 ALA middle . . 136 A 136 VAL middle . . 137 A 137 GLY middle . false 138 A 138 GLU middle . . 139 A 139 LEU middle . . 140 A 140 LEU middle . . 141 A 141 ALA middle . . 142 A 142 ASP middle . . 143 A 143 THR end . . stop_ save_ save_assigned_chemical_shifts_1 _nef_chemical_shift_list.sf_category nef_chemical_shift_list _nef_chemical_shift_list.sf_framecode assigned_chemical_shifts_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 SER H1 H 1 8.267 0.00 A 1 SER HA H 1 4.428 0.00 A 1 SER HBy H 1 3.913 0.00 A 1 SER HBx H 1 3.877 0.00 A 1 SER C C 13 175.098 0.04 A 1 SER CA C 13 58.828 0.02 A 1 SER CB C 13 63.919 0.07 A 1 SER N N 15 115.849 0.07 A 2 LYS H H 1 8.393 0.00 A 2 LYS HA H 1 4.290 0.00 A 2 LYS HBy H 1 1.829 0.00 A 2 LYS HBx H 1 1.796 0.00 A 2 LYS HDx H 1 1.675 0.00 A 2 LYS HDy H 1 1.675 0.00 A 2 LYS HEx H 1 2.988 0.00 A 2 LYS HEy H 1 2.988 0.00 A 2 LYS HGy H 1 1.465 0.00 A 2 LYS HGx H 1 1.422 0.00 A 2 LYS C C 13 177.015 0.04 A 2 LYS CA C 13 57.075 0.03 A 2 LYS CB C 13 32.811 0.08 A 2 LYS CD C 13 29.072 0.00 A 2 LYS CE C 13 42.349 0.00 A 2 LYS CG C 13 24.625 0.00 A 2 LYS N N 15 122.998 0.04 A 3 GLU H H 1 8.277 0.00 A 3 GLU HA H 1 4.295 0.00 A 3 GLU HBy H 1 2.067 0.02 A 3 GLU HBx H 1 1.971 0.00 A 3 GLU HGx H 1 2.315 0.00 A 3 GLU HGy H 1 2.315 0.00 A 3 GLU C C 13 176.933 0.04 A 3 GLU CA C 13 56.987 0.04 A 3 GLU CB C 13 29.700 0.06 A 3 GLU CG C 13 35.592 0.16 A 3 GLU N N 15 121.440 0.18 A 4 VAL H H 1 8.044 0.00 A 4 VAL HA H 1 4.034 0.00 A 4 VAL HB H 1 2.105 0.00 A 4 VAL HGx% H 1 0.988 0.00 A 4 VAL HGy% H 1 0.988 0.00 A 4 VAL C C 13 176.895 0.05 A 4 VAL CA C 13 63.364 0.08 A 4 VAL CB C 13 32.630 0.06 A 4 VAL CGx C 13 21.351 0.01 A 4 VAL CGy C 13 21.351 0.01 A 4 VAL N N 15 120.610 0.21 A 5 MET H H 1 8.336 0.00 A 5 MET HA H 1 4.359 0.00 A 5 MET HBx H 1 2.027 0.00 A 5 MET HBy H 1 2.027 0.00 A 5 MET HGx H 1 2.552 0.01 A 5 MET HGy H 1 2.552 0.01 A 5 MET C C 13 176.899 0.05 A 5 MET CA C 13 56.572 0.01 A 5 MET CB C 13 32.471 0.02 A 5 MET CG C 13 31.092 0.00 A 5 MET N N 15 122.058 0.09 A 6 LYS H H 1 8.156 0.00 A 6 LYS HA H 1 4.172 0.00 A 6 LYS HBx H 1 1.832 0.00 A 6 LYS HBy H 1 1.897 0.00 A 6 LYS HDx H 1 1.707 0.00 A 6 LYS HDy H 1 1.707 0.00 A 6 LYS HEx H 1 2.993 0.00 A 6 LYS HEy H 1 2.993 0.00 A 6 LYS HGx H 1 1.476 0.00 A 6 LYS HGy H 1 1.500 0.00 A 6 LYS C C 13 176.950 0.07 A 6 LYS CA C 13 57.649 0.09 A 6 LYS CB C 13 32.859 0.06 A 6 LYS N N 15 122.499 0.07 A 7 GLN H H 1 8.099 0.00 A 7 GLN HE2x H 1 6.859 0.00 A 7 GLN HE2y H 1 7.471 0.00 A 7 GLN C C 13 176.488 0.00 A 7 GLN CA C 13 56.638 0.00 A 7 GLN CB C 13 29.560 0.01 A 7 GLN CG C 13 33.767 0.00 A 7 GLN N N 15 119.351 0.06 A 7 GLN NE2 N 15 112.113 0.13 A 11 ASN HD2x H 1 7.011 0.00 A 11 ASN HD2y H 1 7.730 0.00 A 11 ASN ND2 N 15 111.375 0.01 A 13 ALA HA H 1 4.089 0.00 A 13 ALA HB% H 1 1.567 0.00 A 13 ALA C C 13 180.136 0.04 A 13 ALA CA C 13 57.443 0.04 A 13 ALA CB C 13 19.089 0.03 A 14 LYS H H 1 9.376 0.00 A 14 LYS HA H 1 4.386 0.00 A 14 LYS HBx H 1 1.986 0.00 A 14 LYS HBy H 1 1.986 0.00 A 14 LYS HDx H 1 1.806 0.00 A 14 LYS HDy H 1 1.806 0.00 A 14 LYS HEx H 1 3.052 0.00 A 14 LYS HEy H 1 3.052 0.00 A 14 LYS HGx H 1 1.618 0.00 A 14 LYS HGy H 1 1.618 0.00 A 14 LYS C C 13 177.716 0.00 A 14 LYS CA C 13 61.208 0.02 A 14 LYS CB C 13 29.494 0.00 A 14 LYS N N 15 115.630 0.05 A 15 PRO HA H 1 4.244 0.00 A 15 PRO HBy H 1 2.305 0.00 A 15 PRO HBx H 1 1.804 0.00 A 15 PRO HDy H 1 3.748 0.00 A 15 PRO HDx H 1 3.262 0.00 A 15 PRO HGy H 1 2.054 0.00 A 15 PRO HGx H 1 1.960 0.00 A 15 PRO C C 13 177.762 0.07 A 15 PRO CA C 13 66.261 0.05 A 15 PRO CB C 13 31.343 0.03 A 15 PRO CD C 13 49.377 0.03 A 15 PRO CG C 13 27.849 0.02 A 16 MET H H 1 8.326 0.00 A 16 MET HA H 1 3.764 0.00 A 16 MET HBy H 1 2.260 0.00 A 16 MET HBx H 1 2.018 0.00 A 16 MET HGy H 1 2.694 0.00 A 16 MET HGx H 1 2.310 0.00 A 16 MET C C 13 177.813 0.04 A 16 MET CA C 13 60.030 0.06 A 16 MET CB C 13 32.406 0.01 A 16 MET CG C 13 34.364 0.00 A 16 MET N N 15 116.311 0.13 A 17 GLU H H 1 8.156 0.00 A 17 GLU HA H 1 4.053 0.00 A 17 GLU HBy H 1 2.211 0.00 A 17 GLU HBx H 1 2.148 0.00 A 17 GLU HGx H 1 2.413 0.00 A 17 GLU HGy H 1 2.413 0.00 A 17 GLU C C 13 178.870 0.04 A 17 GLU CA C 13 59.374 0.04 A 17 GLU CB C 13 28.992 0.04 A 17 GLU CG C 13 35.115 0.00 A 17 GLU N N 15 120.849 0.05 A 18 ALA H H 1 7.673 0.00 A 18 ALA HA H 1 4.196 0.00 A 18 ALA HB% H 1 1.404 0.00 A 18 ALA C C 13 181.315 0.04 A 18 ALA CA C 13 54.908 0.06 A 18 ALA CB C 13 18.300 0.02 A 18 ALA N N 15 120.817 0.06 A 19 CYS H H 1 8.506 0.00 A 19 CYS HA H 1 4.223 0.01 A 19 CYS HBy H 1 2.962 0.00 A 19 CYS HBx H 1 2.545 0.00 A 19 CYS C C 13 175.391 0.03 A 19 CYS CA C 13 60.271 0.07 A 19 CYS CB C 13 41.836 0.02 A 19 CYS N N 15 116.451 0.07 A 20 LYS H H 1 8.783 0.00 A 20 LYS HA H 1 3.975 0.00 A 20 LYS HBy H 1 1.998 0.00 A 20 LYS HBx H 1 1.933 0.00 A 20 LYS HDy H 1 1.741 0.00 A 20 LYS HDx H 1 1.656 0.00 A 20 LYS HEx H 1 2.954 0.00 A 20 LYS HEy H 1 2.954 0.00 A 20 LYS HGx H 1 1.417 0.00 A 20 LYS HGy H 1 1.417 0.00 A 20 LYS C C 13 179.007 0.03 A 20 LYS CA C 13 61.055 0.04 A 20 LYS CB C 13 32.408 0.03 A 20 LYS CD C 13 29.802 0.00 A 20 LYS CE C 13 42.375 0.00 A 20 LYS CG C 13 25.026 0.06 A 20 LYS N N 15 124.292 0.08 A 21 GLN H H 1 7.312 0.00 A 21 GLN HA H 1 4.164 0.00 A 21 GLN HBx H 1 2.161 0.00 A 21 GLN HBy H 1 2.161 0.00 A 21 GLN HE2x H 1 6.770 0.00 A 21 GLN HE2y H 1 7.489 0.00 A 21 GLN HGy H 1 2.547 0.00 A 21 GLN HGx H 1 2.426 0.00 A 21 GLN C C 13 178.230 0.10 A 21 GLN CA C 13 58.144 0.05 A 21 GLN CB C 13 28.606 0.01 A 21 GLN CG C 13 33.892 0.03 A 21 GLN N N 15 115.504 0.05 A 21 GLN NE2 N 15 111.527 0.02 A 22 GLU H H 1 7.946 0.00 A 22 GLU HA H 1 4.021 0.00 A 22 GLU HBy H 1 2.135 0.00 A 22 GLU HBx H 1 2.011 0.00 A 22 GLU HGy H 1 2.370 0.00 A 22 GLU HGx H 1 2.127 0.00 A 22 GLU C C 13 178.348 0.03 A 22 GLU CA C 13 59.358 0.05 A 22 GLU CB C 13 30.820 0.02 A 22 GLU CG C 13 36.204 0.03 A 22 GLU N N 15 119.023 0.04 A 23 LEU H H 1 8.501 0.00 A 23 LEU HA H 1 4.184 0.00 A 23 LEU HBy H 1 1.767 0.00 A 23 LEU HBx H 1 1.419 0.00 A 23 LEU HDx% H 1 0.648 0.00 A 23 LEU HDy% H 1 0.770 0.00 A 23 LEU HG H 1 1.862 0.00 A 23 LEU C C 13 177.210 0.04 A 23 LEU CA C 13 55.382 0.05 A 23 LEU CB C 13 43.222 0.04 A 23 LEU CDy C 13 25.816 0.01 A 23 LEU CDx C 13 22.462 0.00 A 23 LEU CG C 13 27.293 0.07 A 23 LEU N N 15 115.473 0.04 A 24 ASN H H 1 7.881 0.00 A 24 ASN HA H 1 4.416 0.00 A 24 ASN HBy H 1 3.257 0.00 A 24 ASN HBx H 1 2.547 0.00 A 24 ASN HD2x H 1 6.680 0.00 A 24 ASN HD2y H 1 7.446 0.00 A 24 ASN C C 13 174.366 0.03 A 24 ASN CA C 13 54.042 0.04 A 24 ASN CB C 13 37.070 0.04 A 24 ASN N N 15 117.188 0.05 A 24 ASN ND2 N 15 111.273 0.00 A 25 VAL H H 1 7.049 0.00 A 25 VAL HA H 1 4.831 0.00 A 25 VAL HB H 1 2.000 0.00 A 25 VAL HGx% H 1 0.832 0.00 A 25 VAL HGy% H 1 0.707 0.00 A 25 VAL C C 13 173.779 0.00 A 25 VAL CA C 13 57.304 0.01 A 25 VAL CB C 13 32.776 0.00 A 25 VAL CGy C 13 21.897 0.01 A 25 VAL CGx C 13 19.119 0.00 A 25 VAL N N 15 109.350 0.05 A 26 PRO HA H 1 4.640 0.00 A 26 PRO HBy H 1 2.448 0.00 A 26 PRO HBx H 1 2.096 0.01 A 26 PRO HDy H 1 3.860 0.00 A 26 PRO HDx H 1 3.529 0.00 A 26 PRO HGy H 1 2.120 0.00 A 26 PRO HGx H 1 1.949 0.00 A 26 PRO C C 13 177.480 0.03 A 26 PRO CA C 13 61.866 0.05 A 26 PRO CB C 13 32.975 0.06 A 26 PRO CD C 13 50.622 0.01 A 26 PRO CG C 13 27.603 0.04 A 27 ASP H H 1 8.737 0.00 A 27 ASP HA H 1 4.208 0.01 A 27 ASP HBy H 1 2.644 0.00 A 27 ASP HBx H 1 2.579 0.00 A 27 ASP C C 13 178.492 0.04 A 27 ASP CA C 13 58.298 0.08 A 27 ASP CB C 13 40.774 0.03 A 27 ASP N N 15 121.114 0.06 A 28 ALA H H 1 8.573 0.00 A 28 ALA HA H 1 4.026 0.00 A 28 ALA HB% H 1 1.419 0.00 A 28 ALA C C 13 179.898 0.04 A 28 ALA CA C 13 55.429 0.02 A 28 ALA CB C 13 18.701 0.03 A 28 ALA N N 15 118.789 0.07 A 29 VAL H H 1 7.094 0.00 A 29 VAL HA H 1 3.795 0.00 A 29 VAL HB H 1 1.978 0.00 A 29 VAL HGx% H 1 1.022 0.00 A 29 VAL HGy% H 1 0.788 0.00 A 29 VAL C C 13 178.082 0.04 A 29 VAL CA C 13 65.170 0.04 A 29 VAL CB C 13 31.919 0.07 A 29 VAL CGy C 13 23.123 0.01 A 29 VAL CGx C 13 21.408 0.06 A 29 VAL N N 15 116.310 0.04 A 30 MET H H 1 7.156 0.00 A 30 MET HA H 1 4.279 0.00 A 30 MET HBy H 1 2.388 0.00 A 30 MET HBx H 1 2.141 0.00 A 30 MET HGy H 1 2.707 0.00 A 30 MET HGx H 1 2.415 0.00 A 30 MET C C 13 179.130 0.03 A 30 MET CA C 13 56.563 0.06 A 30 MET CB C 13 29.236 0.02 A 30 MET CG C 13 31.594 0.09 A 30 MET N N 15 117.375 0.04 A 31 GLN H H 1 8.040 0.00 A 31 GLN HA H 1 4.188 0.00 A 31 GLN HBy H 1 2.245 0.01 A 31 GLN HBx H 1 2.149 0.00 A 31 GLN HE2x H 1 6.800 0.00 A 31 GLN HE2y H 1 7.531 0.00 A 31 GLN HGx H 1 2.536 0.00 A 31 GLN HGy H 1 2.536 0.00 A 31 GLN C C 13 178.197 0.03 A 31 GLN CA C 13 57.980 0.04 A 31 GLN CB C 13 27.907 0.02 A 31 GLN CG C 13 33.842 0.00 A 31 GLN N N 15 115.617 0.04 A 31 GLN NE2 N 15 112.224 0.00 A 32 ASP H H 1 7.836 0.00 A 32 ASP HA H 1 4.513 0.00 A 32 ASP HBy H 1 3.167 0.00 A 32 ASP HBx H 1 2.627 0.00 A 32 ASP C C 13 177.781 0.04 A 32 ASP CA C 13 57.188 0.03 A 32 ASP CB C 13 39.828 0.04 A 32 ASP N N 15 120.087 0.05 A 33 PHE H H 1 7.773 0.00 A 33 PHE HA H 1 3.952 0.00 A 33 PHE HBy H 1 2.907 0.00 A 33 PHE HBx H 1 2.692 0.00 A 33 PHE HDx H 1 6.263 0.00 A 33 PHE HDy H 1 6.263 0.00 A 33 PHE HEx H 1 6.559 0.00 A 33 PHE HEy H 1 6.559 0.00 A 33 PHE HZ H 1 6.476 0.00 A 33 PHE C C 13 174.930 0.04 A 33 PHE CA C 13 61.631 0.06 A 33 PHE CB C 13 39.080 0.17 A 33 PHE CDx C 13 132.135 0.00 A 33 PHE CDy C 13 132.135 0.00 A 33 PHE CEx C 13 129.913 0.00 A 33 PHE CEy C 13 129.913 0.00 A 33 PHE CZ C 13 128.691 0.00 A 33 PHE N N 15 118.629 0.05 A 34 PHE H H 1 7.035 0.00 A 34 PHE HA H 1 4.150 0.00 A 34 PHE HBy H 1 3.247 0.01 A 34 PHE HBx H 1 3.005 0.00 A 34 PHE HDx H 1 7.356 0.00 A 34 PHE HDy H 1 7.356 0.00 A 34 PHE HEx H 1 7.458 0.00 A 34 PHE HEy H 1 7.458 0.00 A 34 PHE HZ H 1 7.381 0.00 A 34 PHE C C 13 179.102 0.04 A 34 PHE CA C 13 60.752 0.03 A 34 PHE CB C 13 38.873 0.04 A 34 PHE CDx C 13 131.068 0.00 A 34 PHE CDy C 13 131.068 0.00 A 34 PHE CEx C 13 131.752 0.00 A 34 PHE CEy C 13 131.752 0.00 A 34 PHE CZ C 13 130.168 0.00 A 34 PHE N N 15 113.931 0.05 A 35 ASN H H 1 8.143 0.00 A 35 ASN HA H 1 4.096 0.00 A 35 ASN HBy H 1 2.520 0.00 A 35 ASN HBx H 1 2.045 0.00 A 35 ASN HD2x H 1 6.993 0.00 A 35 ASN HD2y H 1 7.818 0.00 A 35 ASN C C 13 175.844 0.04 A 35 ASN CA C 13 55.208 0.03 A 35 ASN CB C 13 37.502 0.04 A 35 ASN N N 15 117.147 0.05 A 35 ASN ND2 N 15 112.483 0.00 A 36 PHE H H 1 7.817 0.00 A 36 PHE HA H 1 3.436 0.00 A 36 PHE HBy H 1 2.906 0.00 A 36 PHE HBx H 1 2.012 0.00 A 36 PHE HDx H 1 5.653 0.00 A 36 PHE HDy H 1 5.653 0.00 A 36 PHE HEx H 1 6.500 0.00 A 36 PHE HEy H 1 6.500 0.00 A 36 PHE HZ H 1 6.604 0.00 A 36 PHE C C 13 174.985 0.04 A 36 PHE CA C 13 61.096 0.06 A 36 PHE CB C 13 39.232 0.10 A 36 PHE CDx C 13 131.223 0.00 A 36 PHE CDy C 13 131.223 0.00 A 36 PHE CEx C 13 130.622 0.00 A 36 PHE CEy C 13 130.622 0.00 A 36 PHE CZ C 13 128.489 0.00 A 36 PHE N N 15 118.435 0.04 A 37 TRP H H 1 6.581 0.00 A 37 TRP HA H 1 4.046 0.01 A 37 TRP HBx H 1 2.827 0.00 A 37 TRP HBy H 1 2.827 0.00 A 37 TRP HD1 H 1 7.212 0.00 A 37 TRP HE3 H 1 7.633 0.00 A 37 TRP HH2 H 1 7.142 0.00 A 37 TRP HZ2 H 1 6.963 0.00 A 37 TRP HZ3 H 1 7.036 0.00 A 37 TRP C C 13 175.905 0.04 A 37 TRP CA C 13 55.906 0.03 A 37 TRP CB C 13 30.486 0.03 A 37 TRP CD1 C 13 129.588 0.00 A 37 TRP CE3 C 13 121.170 0.00 A 37 TRP CH2 C 13 123.671 0.00 A 37 TRP CZ2 C 13 113.414 0.00 A 37 TRP CZ3 C 13 120.652 0.00 A 37 TRP N N 15 114.072 0.06 A 38 LYS H H 1 7.536 0.00 A 38 LYS HA H 1 4.271 0.01 A 38 LYS HBy H 1 1.878 0.00 A 38 LYS HBx H 1 1.817 0.00 A 38 LYS HDy H 1 1.638 0.00 A 38 LYS HDx H 1 1.498 0.00 A 38 LYS HEy H 1 2.941 0.02 A 38 LYS HEx H 1 2.874 0.00 A 38 LYS HGy H 1 1.439 0.00 A 38 LYS C C 13 177.311 0.04 A 38 LYS CA C 13 56.858 0.06 A 38 LYS CB C 13 33.940 0.03 A 38 LYS CD C 13 29.522 0.01 A 38 LYS CG C 13 25.812 0.00 A 38 LYS N N 15 120.289 0.07 A 39 GLU H H 1 8.774 0.00 A 39 GLU HA H 1 4.083 0.00 A 39 GLU HBx H 1 1.968 0.00 A 39 GLU HBy H 1 1.968 0.00 A 39 GLU HGx H 1 2.311 0.00 A 39 GLU HGy H 1 2.311 0.00 A 39 GLU C C 13 177.642 0.03 A 39 GLU CA C 13 57.625 0.06 A 39 GLU CB C 13 29.359 0.03 A 39 GLU CG C 13 35.714 0.01 A 39 GLU N N 15 124.123 0.05 A 40 GLY H H 1 8.706 0.00 A 40 GLY HAy H 1 4.042 0.00 A 40 GLY HAx H 1 3.624 0.01 A 40 GLY C C 13 173.680 0.04 A 40 GLY CA C 13 45.386 0.02 A 40 GLY N N 15 111.342 0.05 A 41 TYR H H 1 7.342 0.00 A 41 TYR HA H 1 4.332 0.00 A 41 TYR HBy H 1 2.838 0.00 A 41 TYR HBx H 1 2.606 0.00 A 41 TYR HDx H 1 6.907 0.00 A 41 TYR HDy H 1 6.907 0.00 A 41 TYR HEx H 1 6.729 0.00 A 41 TYR HEy H 1 6.729 0.00 A 41 TYR C C 13 175.266 0.03 A 41 TYR CA C 13 58.156 0.04 A 41 TYR CB C 13 40.191 0.02 A 41 TYR CDx C 13 133.288 0.00 A 41 TYR CDy C 13 133.288 0.00 A 41 TYR CEx C 13 118.214 0.00 A 41 TYR CEy C 13 118.214 0.00 A 41 TYR N N 15 120.305 0.05 A 42 GLN H H 1 8.401 0.00 A 42 GLN HA H 1 4.353 0.00 A 42 GLN HBy H 1 1.873 0.00 A 42 GLN HBx H 1 1.759 0.01 A 42 GLN HE2x H 1 6.604 0.00 A 42 GLN HE2y H 1 7.245 0.00 A 42 GLN HGx H 1 2.124 0.00 A 42 GLN HGy H 1 2.124 0.00 A 42 GLN C C 13 174.187 0.04 A 42 GLN CA C 13 54.585 0.04 A 42 GLN CB C 13 29.577 0.02 A 42 GLN CG C 13 33.454 0.01 A 42 GLN N N 15 124.596 0.04 A 42 GLN NE2 N 15 111.356 0.00 A 43 ILE H H 1 7.971 0.00 A 43 ILE HA H 1 4.271 0.01 A 43 ILE HB H 1 1.919 0.00 A 43 ILE HD1% H 1 0.839 0.00 A 43 ILE HG1y H 1 1.417 0.00 A 43 ILE HG1x H 1 1.314 0.00 A 43 ILE HG2% H 1 0.965 0.00 A 43 ILE C C 13 175.741 0.03 A 43 ILE CA C 13 60.007 0.09 A 43 ILE CB C 13 37.994 0.03 A 43 ILE CD1 C 13 12.068 0.00 A 43 ILE CG1 C 13 27.167 0.00 A 43 ILE CG2 C 13 17.650 0.00 A 43 ILE N N 15 125.090 0.03 A 44 THR H H 1 8.378 0.00 A 44 THR HA H 1 4.489 0.01 A 44 THR HB H 1 4.419 0.00 A 44 THR HG2% H 1 1.057 0.00 A 44 THR C C 13 174.004 0.03 A 44 THR CA C 13 60.688 0.04 A 44 THR CB C 13 69.831 0.07 A 44 THR CG2 C 13 21.297 0.00 A 44 THR N N 15 115.349 0.05 A 45 ASN H H 1 7.507 0.00 A 45 ASN HA H 1 4.672 0.01 A 45 ASN HBy H 1 2.906 0.00 A 45 ASN HBx H 1 2.883 0.00 A 45 ASN HD2x H 1 7.028 0.00 A 45 ASN HD2y H 1 7.981 0.00 A 45 ASN C C 13 175.960 0.04 A 45 ASN CA C 13 53.244 0.09 A 45 ASN CB C 13 39.455 0.02 A 45 ASN N N 15 120.964 0.04 A 45 ASN ND2 N 15 113.427 0.00 A 46 ARG H H 1 8.891 0.00 A 46 ARG HA H 1 3.872 0.00 A 46 ARG HBy H 1 1.977 0.00 A 46 ARG HBx H 1 1.755 0.00 A 46 ARG HDy H 1 3.418 0.00 A 46 ARG HDx H 1 3.140 0.01 A 46 ARG HGy H 1 1.746 0.00 A 46 ARG HGx H 1 1.504 0.00 A 46 ARG C C 13 177.731 0.03 A 46 ARG CA C 13 59.487 0.03 A 46 ARG CB C 13 29.048 0.02 A 46 ARG CD C 13 42.482 0.04 A 46 ARG CG C 13 25.556 0.00 A 46 ARG N N 15 124.942 0.04 A 47 GLU H H 1 8.705 0.00 A 47 GLU HA H 1 4.106 0.00 A 47 GLU HBy H 1 2.015 0.00 A 47 GLU HBx H 1 1.912 0.01 A 47 GLU HGx H 1 2.444 0.00 A 47 GLU HGy H 1 2.444 0.00 A 47 GLU C C 13 178.820 0.03 A 47 GLU CA C 13 59.047 0.04 A 47 GLU CB C 13 28.306 0.02 A 47 GLU CG C 13 33.904 0.01 A 47 GLU N N 15 120.323 0.06 A 48 ALA H H 1 8.098 0.00 A 48 ALA HA H 1 3.977 0.00 A 48 ALA HB% H 1 1.329 0.00 A 48 ALA C C 13 180.658 0.03 A 48 ALA CA C 13 55.658 0.03 A 48 ALA CB C 13 17.568 0.02 A 48 ALA N N 15 120.620 0.04 A 49 GLY H H 1 7.616 0.00 A 49 GLY HAy H 1 4.403 0.00 A 49 GLY HAx H 1 3.439 0.00 A 49 GLY C C 13 175.560 0.04 A 49 GLY CA C 13 46.897 0.03 A 49 GLY N N 15 103.488 0.04 A 50 CYS H H 1 7.484 0.00 A 50 CYS HA H 1 4.566 0.01 A 50 CYS HBy H 1 3.217 0.01 A 50 CYS HBx H 1 3.153 0.01 A 50 CYS C C 13 178.268 0.05 A 50 CYS CA C 13 55.489 0.09 A 50 CYS CB C 13 34.790 0.03 A 50 CYS N N 15 118.594 0.05 A 51 VAL H H 1 8.092 0.00 A 51 VAL HA H 1 3.234 0.00 A 51 VAL HB H 1 2.216 0.00 A 51 VAL HGx% H 1 0.928 0.00 A 51 VAL HGy% H 1 0.621 0.00 A 51 VAL C C 13 176.644 0.04 A 51 VAL CA C 13 67.786 0.01 A 51 VAL CB C 13 31.285 0.04 A 51 VAL CGy C 13 23.436 0.02 A 51 VAL CGx C 13 21.934 0.00 A 51 VAL N N 15 122.186 0.09 A 52 ILE H H 1 7.481 0.00 A 52 ILE HA H 1 3.218 0.00 A 52 ILE HB H 1 1.770 0.01 A 52 ILE HD1% H 1 0.413 0.00 A 52 ILE HG1y H 1 2.088 0.00 A 52 ILE HG1x H 1 0.875 0.00 A 52 ILE HG2% H 1 0.901 0.00 A 52 ILE C C 13 176.256 0.04 A 52 ILE CA C 13 66.983 0.03 A 52 ILE CB C 13 38.235 0.06 A 52 ILE CD1 C 13 12.715 0.04 A 52 ILE CG1 C 13 30.138 0.05 A 52 ILE CG2 C 13 17.584 0.00 A 52 ILE N N 15 118.452 0.03 A 53 LEU H H 1 7.473 0.00 A 53 LEU HA H 1 3.869 0.00 A 53 LEU HBy H 1 1.727 0.00 A 53 LEU HBx H 1 1.477 0.01 A 53 LEU HDx% H 1 0.827 0.00 A 53 LEU HDy% H 1 0.825 0.00 A 53 LEU HG H 1 1.624 0.00 A 53 LEU C C 13 178.320 0.03 A 53 LEU CA C 13 57.945 0.06 A 53 LEU CB C 13 42.738 0.02 A 53 LEU CDy C 13 25.466 0.00 A 53 LEU CDx C 13 23.785 0.00 A 53 LEU CG C 13 26.723 0.00 A 53 LEU N N 15 115.771 0.07 A 54 CYS H H 1 7.783 0.00 A 54 CYS HA H 1 4.119 0.00 A 54 CYS HBy H 1 3.281 0.00 A 54 CYS HBx H 1 3.002 0.01 A 54 CYS C C 13 176.581 0.03 A 54 CYS CA C 13 60.681 0.05 A 54 CYS CB C 13 43.218 0.03 A 54 CYS N N 15 117.214 0.06 A 55 LEU H H 1 8.515 0.00 A 55 LEU HA H 1 3.602 0.00 A 55 LEU HBy H 1 1.606 0.00 A 55 LEU HBx H 1 0.850 0.00 A 55 LEU HDx% H 1 0.353 0.00 A 55 LEU HDy% H 1 -0.326 0.00 A 55 LEU HG H 1 1.462 0.00 A 55 LEU C C 13 179.232 0.03 A 55 LEU CA C 13 58.336 0.07 A 55 LEU CB C 13 41.984 0.02 A 55 LEU CDx C 13 23.160 0.01 A 55 LEU CDy C 13 25.102 0.01 A 55 LEU CG C 13 26.342 0.00 A 55 LEU N N 15 121.514 0.05 A 56 ALA H H 1 7.754 0.00 A 56 ALA HA H 1 3.815 0.00 A 56 ALA HB% H 1 1.628 0.00 A 56 ALA C C 13 179.488 0.03 A 56 ALA CA C 13 55.110 0.03 A 56 ALA CB C 13 18.692 0.02 A 56 ALA N N 15 117.094 0.06 A 57 LYS H H 1 7.518 0.00 A 57 LYS HA H 1 4.368 0.00 A 57 LYS HBx H 1 2.016 0.00 A 57 LYS HBy H 1 2.016 0.00 A 57 LYS HDx H 1 1.632 0.01 A 57 LYS HDy H 1 1.632 0.01 A 57 LYS HEy H 1 3.025 0.00 A 57 LYS HEx H 1 2.910 0.00 A 57 LYS HGy H 1 1.579 0.00 A 57 LYS HGx H 1 1.520 0.00 A 57 LYS C C 13 177.968 0.03 A 57 LYS CA C 13 57.005 0.03 A 57 LYS CB C 13 33.093 0.07 A 57 LYS CD C 13 29.154 0.00 A 57 LYS CE C 13 42.598 0.00 A 57 LYS CG C 13 24.975 0.00 A 57 LYS N N 15 116.518 0.06 A 58 LYS H H 1 7.733 0.00 A 58 LYS HA H 1 4.752 0.00 A 58 LYS HBy H 1 2.233 0.00 A 58 LYS HBx H 1 1.643 0.00 A 58 LYS HDx H 1 1.636 0.00 A 58 LYS HDy H 1 1.636 0.00 A 58 LYS HEy H 1 2.734 0.00 A 58 LYS HEx H 1 2.669 0.00 A 58 LYS HGx H 1 1.541 0.00 A 58 LYS HGy H 1 1.541 0.00 A 58 LYS C C 13 176.932 0.03 A 58 LYS CA C 13 55.116 0.03 A 58 LYS CB C 13 32.821 0.02 A 58 LYS CD C 13 28.964 0.02 A 58 LYS CE C 13 42.885 0.00 A 58 LYS CG C 13 25.126 0.04 A 58 LYS N N 15 119.966 0.05 A 59 LEU H H 1 7.573 0.00 A 59 LEU HA H 1 3.848 0.00 A 59 LEU HBy H 1 1.904 0.01 A 59 LEU HBx H 1 1.549 0.01 A 59 LEU HDx% H 1 0.666 0.00 A 59 LEU HDy% H 1 0.658 0.00 A 59 LEU HG H 1 2.034 0.00 A 59 LEU C C 13 179.689 0.04 A 59 LEU CA C 13 57.693 0.08 A 59 LEU CB C 13 40.419 0.02 A 59 LEU CDy C 13 25.578 0.02 A 59 LEU CDx C 13 22.473 0.00 A 59 LEU CG C 13 25.826 0.05 A 59 LEU N N 15 118.300 0.06 A 60 GLU H H 1 8.583 0.00 A 60 GLU HA H 1 4.299 0.00 A 60 GLU HBy H 1 2.364 0.01 A 60 GLU HBx H 1 1.911 0.00 A 60 GLU HGy H 1 2.504 0.00 A 60 GLU HGx H 1 2.392 0.00 A 60 GLU C C 13 176.507 0.04 A 60 GLU CA C 13 57.459 0.06 A 60 GLU CB C 13 28.114 0.03 A 60 GLU CG C 13 36.288 0.02 A 60 GLU N N 15 114.947 0.07 A 61 LEU H H 1 7.618 0.00 A 61 LEU HA H 1 4.323 0.00 A 61 LEU HBy H 1 1.713 0.01 A 61 LEU HBx H 1 1.498 0.00 A 61 LEU HDx% H 1 0.841 0.00 A 61 LEU HDy% H 1 0.829 0.00 A 61 LEU HG H 1 1.718 0.00 A 61 LEU C C 13 178.295 0.04 A 61 LEU CA C 13 55.543 0.04 A 61 LEU CB C 13 42.446 0.02 A 61 LEU CDy C 13 25.985 0.08 A 61 LEU CDx C 13 22.805 0.03 A 61 LEU CG C 13 27.431 0.11 A 61 LEU N N 15 116.565 0.05 A 62 LEU H H 1 7.402 0.00 A 62 LEU HA H 1 4.145 0.00 A 62 LEU HBy H 1 1.898 0.01 A 62 LEU HBx H 1 1.340 0.00 A 62 LEU HDx% H 1 0.719 0.00 A 62 LEU HDy% H 1 0.506 0.00 A 62 LEU HG H 1 1.534 0.00 A 62 LEU C C 13 176.675 0.03 A 62 LEU CA C 13 54.585 0.05 A 62 LEU CB C 13 42.892 0.04 A 62 LEU CDy C 13 27.955 0.00 A 62 LEU CDx C 13 24.514 0.02 A 62 LEU CG C 13 27.058 0.03 A 62 LEU N N 15 118.019 0.06 A 63 ASP H H 1 8.304 0.00 A 63 ASP HA H 1 4.463 0.00 A 63 ASP HBy H 1 2.832 0.00 A 63 ASP HBx H 1 2.624 0.01 A 63 ASP C C 13 178.806 0.03 A 63 ASP CA C 13 55.009 0.03 A 63 ASP CB C 13 41.171 0.05 A 63 ASP N N 15 120.382 0.07 A 64 GLN H H 1 9.072 0.00 A 64 GLN HA H 1 4.147 0.00 A 64 GLN HBy H 1 2.258 0.00 A 64 GLN HBx H 1 2.144 0.01 A 64 GLN HE2x H 1 6.891 0.00 A 64 GLN HE2y H 1 7.459 0.00 A 64 GLN HGx H 1 2.552 0.00 A 64 GLN HGy H 1 2.552 0.00 A 64 GLN C C 13 178.398 0.04 A 64 GLN CA C 13 58.409 0.05 A 64 GLN CB C 13 28.469 0.03 A 64 GLN CG C 13 34.141 0.01 A 64 GLN N N 15 125.501 0.04 A 64 GLN NE2 N 15 113.407 0.00 A 65 ASP H H 1 8.897 0.00 A 65 ASP HA H 1 4.460 0.00 A 65 ASP HBy H 1 2.784 0.01 A 65 ASP HBx H 1 2.703 0.01 A 65 ASP C C 13 177.244 0.03 A 65 ASP CA C 13 55.664 0.05 A 65 ASP CB C 13 39.214 0.05 A 65 ASP N N 15 118.934 0.05 A 66 MET H H 1 7.708 0.00 A 66 MET HA H 1 4.546 0.00 A 66 MET HBy H 1 2.775 0.00 A 66 MET HBx H 1 2.573 0.01 A 66 MET HGy H 1 2.332 0.01 A 66 MET HGx H 1 1.919 0.01 A 66 MET C C 13 177.097 0.04 A 66 MET CA C 13 56.282 0.09 A 66 MET CB C 13 32.992 0.06 A 66 MET CG C 13 33.158 0.03 A 66 MET N N 15 116.564 0.07 A 67 ASN H H 1 7.959 0.00 A 67 ASN HA H 1 4.333 0.00 A 67 ASN HBy H 1 3.214 0.00 A 67 ASN HBx H 1 2.719 0.00 A 67 ASN HD2x H 1 7.102 0.00 A 67 ASN HD2y H 1 7.126 0.00 A 67 ASN C C 13 172.710 0.03 A 67 ASN CA C 13 54.594 0.05 A 67 ASN CB C 13 38.390 0.04 A 67 ASN N N 15 115.421 0.05 A 67 ASN ND2 N 15 112.678 0.01 A 68 LEU H H 1 8.380 0.00 A 68 LEU HA H 1 4.358 0.00 A 68 LEU HBy H 1 1.499 0.01 A 68 LEU HBx H 1 0.780 0.01 A 68 LEU HDx% H 1 0.291 0.00 A 68 LEU HDy% H 1 -0.017 0.00 A 68 LEU HG H 1 1.160 0.01 A 68 LEU C C 13 172.364 0.04 A 68 LEU CA C 13 54.176 0.02 A 68 LEU CB C 13 41.242 0.06 A 68 LEU CDy C 13 25.191 0.01 A 68 LEU CDx C 13 21.588 0.01 A 68 LEU CG C 13 26.376 0.03 A 68 LEU N N 15 122.379 0.07 A 69 HIS H H 1 7.960 0.00 A 69 HIS HA H 1 4.763 0.00 A 69 HIS HBy H 1 3.263 0.01 A 69 HIS HBx H 1 2.653 0.01 A 69 HIS HD2 H 1 7.077 0.00 A 69 HIS HE1 H 1 8.785 0.00 A 69 HIS C C 13 173.690 0.04 A 69 HIS CA C 13 52.879 0.04 A 69 HIS CB C 13 32.251 0.01 A 69 HIS CD2 C 13 120.080 0.00 A 69 HIS CE1 C 13 138.049 0.00 A 69 HIS N N 15 119.855 0.07 A 69 HIS ND1 N 15 183.026 0.00 A 69 HIS NE2 N 15 171.918 0.00 A 70 HIS H H 1 9.759 0.00 A 70 HIS HA H 1 4.605 0.00 A 70 HIS HBy H 1 3.400 0.00 A 70 HIS HBx H 1 3.170 0.00 A 70 HIS HD2 H 1 7.281 0.00 A 70 HIS HE1 H 1 8.646 0.00 A 70 HIS C C 13 176.313 0.04 A 70 HIS CA C 13 58.002 0.05 A 70 HIS CB C 13 28.372 0.04 A 70 HIS CD2 C 13 120.212 0.00 A 70 HIS CE1 C 13 137.834 0.00 A 70 HIS N N 15 121.592 0.05 A 70 HIS ND1 N 15 177.988 0.00 A 70 HIS NE2 N 15 172.696 0.00 A 71 GLY H H 1 9.091 0.00 A 71 GLY HAy H 1 4.021 0.01 A 71 GLY HAx H 1 3.739 0.02 A 71 GLY C C 13 174.914 0.04 A 71 GLY CA C 13 45.331 0.06 A 71 GLY N N 15 114.587 0.05 A 72 LYS H H 1 7.542 0.00 A 72 LYS HA H 1 5.078 0.00 A 72 LYS HBy H 1 2.063 0.00 A 72 LYS HBx H 1 1.756 0.00 A 72 LYS HDy H 1 1.685 0.00 A 72 LYS HDx H 1 1.494 0.00 A 72 LYS HEx H 1 2.922 0.00 A 72 LYS HEy H 1 2.922 0.00 A 72 LYS HGy H 1 1.324 0.00 A 72 LYS HGx H 1 1.211 0.00 A 72 LYS C C 13 177.500 0.03 A 72 LYS CA C 13 54.124 0.03 A 72 LYS CB C 13 32.034 0.02 A 72 LYS CD C 13 29.196 0.01 A 72 LYS CE C 13 42.524 0.01 A 72 LYS CG C 13 24.281 0.06 A 72 LYS N N 15 120.151 0.09 A 73 ALA H H 1 8.034 0.00 A 73 ALA HA H 1 3.879 0.00 A 73 ALA HB% H 1 1.621 0.00 A 73 ALA C C 13 179.205 0.04 A 73 ALA CA C 13 56.365 0.06 A 73 ALA CB C 13 20.617 0.01 A 73 ALA N N 15 123.927 0.04 A 74 MET H H 1 8.657 0.00 A 74 MET HA H 1 4.080 0.00 A 74 MET HBy H 1 2.099 0.00 A 74 MET HBx H 1 1.979 0.01 A 74 MET HGy H 1 2.663 0.00 A 74 MET HGx H 1 2.410 0.00 A 74 MET C C 13 177.683 0.04 A 74 MET CA C 13 58.479 0.05 A 74 MET CB C 13 30.902 0.03 A 74 MET CG C 13 32.013 0.06 A 74 MET N N 15 116.001 0.06 A 75 GLU H H 1 9.019 0.00 A 75 GLU HA H 1 3.946 0.00 A 75 GLU HBy H 1 2.159 0.00 A 75 GLU HBx H 1 1.992 0.00 A 75 GLU HGy H 1 2.466 0.00 A 75 GLU HGx H 1 2.349 0.01 A 75 GLU C C 13 179.502 0.03 A 75 GLU CA C 13 60.346 0.03 A 75 GLU CB C 13 29.174 0.02 A 75 GLU CG C 13 36.969 0.07 A 75 GLU N N 15 120.153 0.05 A 76 PHE H H 1 7.882 0.00 A 76 PHE HA H 1 4.476 0.00 A 76 PHE HBy H 1 3.785 0.00 A 76 PHE HBx H 1 3.153 0.00 A 76 PHE HDx H 1 7.202 0.00 A 76 PHE HDy H 1 7.202 0.00 A 76 PHE HZ H 1 6.811 0.00 A 76 PHE C C 13 177.558 0.04 A 76 PHE CA C 13 60.796 0.05 A 76 PHE CB C 13 38.515 0.03 A 76 PHE CDx C 13 132.597 0.00 A 76 PHE CDy C 13 132.597 0.00 A 76 PHE CZ C 13 128.984 0.00 A 76 PHE N N 15 117.625 0.06 A 77 ALA H H 1 8.181 0.00 A 77 ALA HA H 1 3.382 0.00 A 77 ALA HB% H 1 1.414 0.00 A 77 ALA C C 13 180.240 0.03 A 77 ALA CA C 13 55.789 0.03 A 77 ALA CB C 13 19.251 0.01 A 77 ALA N N 15 123.430 0.04 A 78 MET H H 1 8.306 0.00 A 78 MET HA H 1 4.767 0.00 A 78 MET HBy H 1 2.198 0.01 A 78 MET HBx H 1 2.006 0.01 A 78 MET HGy H 1 2.633 0.00 A 78 MET HGx H 1 2.385 0.00 A 78 MET C C 13 179.431 0.04 A 78 MET CA C 13 58.039 0.05 A 78 MET CB C 13 32.734 0.01 A 78 MET CG C 13 32.013 0.00 A 78 MET N N 15 116.273 0.04 A 79 LYS H H 1 7.658 0.00 A 79 LYS HA H 1 4.263 0.00 A 79 LYS HBy H 1 1.864 0.00 A 79 LYS HBx H 1 1.811 0.00 A 79 LYS HDx H 1 1.617 0.00 A 79 LYS HDy H 1 1.617 0.00 A 79 LYS HEx H 1 2.951 0.01 A 79 LYS HEy H 1 2.951 0.01 A 79 LYS HGx H 1 1.452 0.01 A 79 LYS HGy H 1 1.452 0.01 A 79 LYS C C 13 176.788 0.04 A 79 LYS CA C 13 56.872 0.04 A 79 LYS CB C 13 32.178 0.02 A 79 LYS CD C 13 28.938 0.00 A 79 LYS CG C 13 25.419 0.01 A 79 LYS N N 15 119.388 0.05 A 80 HIS H H 1 7.484 0.00 A 80 HIS HA H 1 4.523 0.00 A 80 HIS HBy H 1 3.380 0.00 A 80 HIS HBx H 1 2.212 0.00 A 80 HIS HD2 H 1 7.140 0.00 A 80 HIS HE1 H 1 8.727 0.00 A 80 HIS C C 13 174.218 0.04 A 80 HIS CA C 13 55.697 0.06 A 80 HIS CB C 13 28.107 0.01 A 80 HIS CD2 C 13 121.145 0.00 A 80 HIS CE1 C 13 136.018 0.00 A 80 HIS N N 15 116.484 0.05 A 80 HIS ND1 N 15 176.412 0.00 A 80 HIS NE2 N 15 173.746 0.00 A 81 GLY H H 1 7.668 0.00 A 81 GLY HAy H 1 4.230 0.00 A 81 GLY HAx H 1 3.652 0.00 A 81 GLY C C 13 174.146 0.04 A 81 GLY CA C 13 46.050 0.02 A 81 GLY N N 15 105.854 0.04 A 82 ALA H H 1 7.755 0.00 A 82 ALA HA H 1 4.520 0.00 A 82 ALA HB% H 1 1.188 0.00 A 82 ALA C C 13 176.589 0.03 A 82 ALA CA C 13 51.241 0.05 A 82 ALA CB C 13 19.768 0.04 A 82 ALA N N 15 123.069 0.04 A 83 ASP H H 1 7.645 0.00 A 83 ASP HA H 1 4.662 0.00 A 83 ASP HBy H 1 3.057 0.00 A 83 ASP HBx H 1 2.725 0.00 A 83 ASP C C 13 175.516 0.03 A 83 ASP CA C 13 52.371 0.05 A 83 ASP CB C 13 40.737 0.04 A 83 ASP N N 15 120.358 0.04 A 84 GLU H H 1 8.638 0.00 A 84 GLU HA H 1 3.878 0.00 A 84 GLU HBy H 1 2.075 0.02 A 84 GLU HBx H 1 1.987 0.01 A 84 GLU HGy H 1 2.356 0.01 A 84 GLU HGx H 1 2.260 0.01 A 84 GLU C C 13 177.686 0.04 A 84 GLU CA C 13 60.369 0.04 A 84 GLU CB C 13 29.330 0.02 A 84 GLU CG C 13 35.308 0.02 A 84 GLU N N 15 120.538 0.04 A 85 ALA H H 1 8.045 0.00 A 85 ALA HA H 1 4.015 0.00 A 85 ALA HB% H 1 1.378 0.00 A 85 ALA C C 13 181.237 0.04 A 85 ALA CA C 13 55.369 0.03 A 85 ALA CB C 13 17.989 0.01 A 85 ALA N N 15 120.263 0.09 A 86 MET H H 1 8.143 0.00 A 86 MET HA H 1 3.889 0.00 A 86 MET HBy H 1 1.914 0.00 A 86 MET HBx H 1 1.755 0.00 A 86 MET HGy H 1 2.186 0.00 A 86 MET HGx H 1 1.227 0.01 A 86 MET C C 13 177.471 0.04 A 86 MET CA C 13 58.722 0.04 A 86 MET CB C 13 34.250 0.06 A 86 MET CG C 13 31.471 0.01 A 86 MET N N 15 119.985 0.04 A 87 ALA H H 1 8.204 0.00 A 87 ALA HA H 1 4.526 0.00 A 87 ALA HB% H 1 1.407 0.00 A 87 ALA C C 13 182.226 0.03 A 87 ALA CA C 13 53.904 0.05 A 87 ALA CB C 13 19.479 0.02 A 87 ALA N N 15 120.172 0.05 A 88 LYS H H 1 8.562 0.00 A 88 LYS HA H 1 4.063 0.00 A 88 LYS HBy H 1 1.960 0.00 A 88 LYS HBx H 1 1.911 0.00 A 88 LYS HDy H 1 1.777 0.00 A 88 LYS HDx H 1 1.656 0.00 A 88 LYS HEx H 1 3.040 0.00 A 88 LYS HEy H 1 3.040 0.00 A 88 LYS HGy H 1 1.567 0.00 A 88 LYS HGx H 1 1.507 0.00 A 88 LYS C C 13 177.977 0.03 A 88 LYS CA C 13 59.326 0.02 A 88 LYS CB C 13 32.838 0.02 A 88 LYS CD C 13 29.297 0.03 A 88 LYS CE C 13 42.393 0.00 A 88 LYS CG C 13 25.345 0.00 A 88 LYS N N 15 119.348 0.05 A 89 GLN H H 1 8.271 0.00 A 89 GLN HA H 1 4.239 0.00 A 89 GLN HBy H 1 2.458 0.00 A 89 GLN HBx H 1 2.390 0.00 A 89 GLN HE2x H 1 6.980 0.00 A 89 GLN HE2y H 1 7.331 0.00 A 89 GLN HGy H 1 2.667 0.00 A 89 GLN HGx H 1 2.375 0.00 A 89 GLN C C 13 179.052 0.04 A 89 GLN CA C 13 59.568 0.04 A 89 GLN CB C 13 28.555 0.03 A 89 GLN CG C 13 34.307 0.01 A 89 GLN N N 15 120.720 0.18 A 89 GLN NE2 N 15 111.257 0.00 A 90 LEU H H 1 7.853 0.01 A 90 LEU HA H 1 4.136 0.00 A 90 LEU HBy H 1 2.102 0.00 A 90 LEU HBx H 1 1.346 0.01 A 90 LEU HDx% H 1 0.942 0.00 A 90 LEU HDy% H 1 0.708 0.00 A 90 LEU HG H 1 2.137 0.00 A 90 LEU C C 13 179.061 0.03 A 90 LEU CA C 13 58.601 0.05 A 90 LEU CB C 13 41.241 0.05 A 90 LEU CDy C 13 26.302 0.02 A 90 LEU CDx C 13 23.816 0.01 A 90 LEU CG C 13 27.191 0.02 A 90 LEU N N 15 115.907 0.07 A 91 LEU H H 1 7.057 0.00 A 91 LEU HA H 1 3.859 0.00 A 91 LEU HBy H 1 1.916 0.00 A 91 LEU HBx H 1 1.252 0.00 A 91 LEU HDx% H 1 0.885 0.00 A 91 LEU HDy% H 1 0.720 0.00 A 91 LEU HG H 1 1.642 0.01 A 91 LEU C C 13 178.667 0.03 A 91 LEU CA C 13 57.741 0.02 A 91 LEU CB C 13 41.785 0.03 A 91 LEU CDy C 13 25.159 0.12 A 91 LEU CDx C 13 22.712 0.05 A 91 LEU CG C 13 26.658 0.18 A 91 LEU N N 15 119.358 0.05 A 92 ASP H H 1 8.841 0.00 A 92 ASP HA H 1 4.422 0.00 A 92 ASP HBy H 1 2.996 0.01 A 92 ASP HBx H 1 2.776 0.01 A 92 ASP C C 13 180.095 0.03 A 92 ASP CA C 13 57.724 0.03 A 92 ASP CB C 13 39.572 0.05 A 92 ASP N N 15 121.508 0.05 A 93 ILE H H 1 8.421 0.00 A 93 ILE HA H 1 3.850 0.00 A 93 ILE HB H 1 2.089 0.00 A 93 ILE HD1% H 1 0.784 0.00 A 93 ILE HG1y H 1 1.994 0.00 A 93 ILE HG1x H 1 1.223 0.00 A 93 ILE HG2% H 1 0.976 0.00 A 93 ILE C C 13 178.618 0.03 A 93 ILE CA C 13 65.472 0.05 A 93 ILE CB C 13 38.011 0.04 A 93 ILE CD1 C 13 15.132 0.02 A 93 ILE CG1 C 13 29.422 0.04 A 93 ILE CG2 C 13 18.861 0.00 A 93 ILE N N 15 122.235 0.06 A 94 LYS H H 1 8.012 0.00 A 94 LYS HA H 1 3.756 0.00 A 94 LYS HBy H 1 1.999 0.00 A 94 LYS HBx H 1 1.772 0.01 A 94 LYS HDy H 1 1.823 0.00 A 94 LYS HDx H 1 1.369 0.01 A 94 LYS HEy H 1 3.016 0.00 A 94 LYS HEx H 1 2.607 0.01 A 94 LYS HGy H 1 1.713 0.00 A 94 LYS HGx H 1 0.999 0.01 A 94 LYS C C 13 178.002 0.04 A 94 LYS CA C 13 61.541 0.06 A 94 LYS CB C 13 32.612 0.02 A 94 LYS CD C 13 29.703 0.02 A 94 LYS CE C 13 42.690 0.06 A 94 LYS CG C 13 26.069 0.08 A 94 LYS N N 15 121.454 0.06 A 95 HIS H H 1 8.743 0.00 A 95 HIS HA H 1 4.636 0.00 A 95 HIS HBx H 1 3.372 0.00 A 95 HIS HBy H 1 3.372 0.00 A 95 HIS HD2 H 1 7.468 0.00 A 95 HIS HE1 H 1 8.689 0.00 A 95 HIS C C 13 177.759 0.03 A 95 HIS CA C 13 57.371 0.04 A 95 HIS CB C 13 28.250 0.03 A 95 HIS CD2 C 13 119.161 0.00 A 95 HIS CE1 C 13 135.860 0.00 A 95 HIS N N 15 116.503 0.04 A 95 HIS ND1 N 15 177.035 0.00 A 95 HIS NE2 N 15 176.050 0.00 A 96 SER H H 1 8.866 0.00 A 96 SER HA H 1 4.342 0.01 A 96 SER HBy H 1 4.149 0.01 A 96 SER HBx H 1 4.046 0.00 A 96 SER C C 13 178.239 0.04 A 96 SER CA C 13 62.342 0.02 A 96 SER CB C 13 62.574 0.01 A 96 SER N N 15 118.222 0.04 A 97 CYS H H 1 8.552 0.00 A 97 CYS HA H 1 4.539 0.00 A 97 CYS HBy H 1 3.614 0.00 A 97 CYS HBx H 1 2.865 0.00 A 97 CYS C C 13 176.720 0.04 A 97 CYS CA C 13 59.847 0.06 A 97 CYS CB C 13 40.658 0.03 A 97 CYS N N 15 120.682 0.06 A 98 GLU H H 1 8.152 0.00 A 98 GLU HA H 1 3.799 0.00 A 98 GLU HBy H 1 2.373 0.00 A 98 GLU HBx H 1 2.183 0.00 A 98 GLU HGy H 1 2.763 0.00 A 98 GLU HGx H 1 2.373 0.00 A 98 GLU C C 13 177.057 0.03 A 98 GLU CA C 13 60.109 0.04 A 98 GLU CB C 13 29.664 0.05 A 98 GLU CG C 13 37.876 0.04 A 98 GLU N N 15 118.596 0.06 A 99 LYS H H 1 7.214 0.00 A 99 LYS HA H 1 4.373 0.00 A 99 LYS HBy H 1 2.074 0.00 A 99 LYS HBx H 1 2.029 0.00 A 99 LYS HDx H 1 1.724 0.00 A 99 LYS HDy H 1 1.724 0.00 A 99 LYS HEx H 1 3.025 0.00 A 99 LYS HEy H 1 3.025 0.00 A 99 LYS HGy H 1 1.713 0.01 A 99 LYS HGx H 1 1.581 0.01 A 99 LYS C C 13 177.559 0.04 A 99 LYS CA C 13 57.258 0.03 A 99 LYS CB C 13 33.458 0.02 A 99 LYS CD C 13 28.809 0.00 A 99 LYS CE C 13 42.324 0.00 A 99 LYS CG C 13 25.100 0.07 A 99 LYS N N 15 114.175 0.03 A 100 VAL H H 1 7.483 0.00 A 100 VAL HA H 1 4.615 0.00 A 100 VAL HB H 1 2.333 0.00 A 100 VAL HGx% H 1 0.965 0.00 A 100 VAL HGy% H 1 1.071 0.00 A 100 VAL C C 13 177.158 0.03 A 100 VAL CA C 13 61.886 0.10 A 100 VAL CB C 13 33.764 0.06 A 100 VAL CGy C 13 21.311 0.03 A 100 VAL CGx C 13 19.673 0.01 A 100 VAL N N 15 111.534 0.03 A 101 ILE H H 1 7.448 0.00 A 101 ILE HA H 1 4.315 0.00 A 101 ILE HB H 1 1.928 0.00 A 101 ILE HD1% H 1 0.850 0.00 A 101 ILE HG1x H 1 1.331 0.00 A 101 ILE HG1y H 1 1.331 0.00 A 101 ILE HG2% H 1 1.126 0.00 A 101 ILE C C 13 175.821 0.04 A 101 ILE CA C 13 61.653 0.06 A 101 ILE CB C 13 40.814 0.07 A 101 ILE CD1 C 13 15.417 0.04 A 101 ILE CG1 C 13 24.361 0.02 A 101 ILE CG2 C 13 18.829 0.01 A 101 ILE N N 15 115.078 0.04 A 102 THR H H 1 8.507 0.00 A 102 THR HA H 1 4.136 0.00 A 102 THR HB H 1 3.879 0.00 A 102 THR HG2% H 1 1.077 0.00 A 102 THR C C 13 173.395 0.04 A 102 THR CA C 13 63.706 0.07 A 102 THR CB C 13 69.378 0.06 A 102 THR CG2 C 13 21.909 0.10 A 102 THR N N 15 118.342 0.04 A 103 ILE H H 1 8.508 0.00 A 103 ILE HA H 1 4.016 0.00 A 103 ILE HB H 1 1.851 0.00 A 103 ILE HD1% H 1 0.857 0.00 A 103 ILE HG1y H 1 1.590 0.00 A 103 ILE HG1x H 1 1.241 0.00 A 103 ILE HG2% H 1 0.781 0.00 A 103 ILE C C 13 175.999 0.03 A 103 ILE CA C 13 60.386 0.04 A 103 ILE CB C 13 37.647 0.04 A 103 ILE CD1 C 13 12.396 0.02 A 103 ILE CG1 C 13 27.217 0.08 A 103 ILE CG2 C 13 17.006 0.04 A 103 ILE N N 15 129.135 0.04 A 104 VAL H H 1 8.023 0.00 A 104 VAL HA H 1 4.065 0.00 A 104 VAL HB H 1 2.140 0.00 A 104 VAL HGx% H 1 0.978 0.00 A 104 VAL HGy% H 1 0.760 0.00 A 104 VAL C C 13 176.864 0.04 A 104 VAL CA C 13 61.651 0.05 A 104 VAL CB C 13 30.352 0.06 A 104 VAL CGy C 13 22.811 0.02 A 104 VAL CGx C 13 20.533 0.03 A 104 VAL N N 15 130.493 0.05 A 105 ALA H H 1 8.824 0.00 A 105 ALA HA H 1 3.864 0.00 A 105 ALA HB% H 1 1.388 0.00 A 105 ALA C C 13 178.193 0.04 A 105 ALA CA C 13 55.627 0.04 A 105 ALA CB C 13 18.400 0.01 A 105 ALA N N 15 131.922 0.04 A 106 ASP H H 1 8.237 0.00 A 106 ASP HA H 1 4.645 0.00 A 106 ASP HBy H 1 2.859 0.00 A 106 ASP HBx H 1 2.718 0.00 A 106 ASP C C 13 175.535 0.03 A 106 ASP CA C 13 53.085 0.10 A 106 ASP CB C 13 39.895 0.02 A 106 ASP N N 15 112.184 0.04 A 107 ASP H H 1 7.588 0.00 A 107 ASP HA H 1 5.119 0.00 A 107 ASP HBy H 1 2.878 0.00 A 107 ASP HBx H 1 2.427 0.00 A 107 ASP C C 13 173.419 0.00 A 107 ASP CA C 13 51.412 0.02 A 107 ASP CB C 13 41.270 0.01 A 107 ASP N N 15 114.205 0.04 A 108 PRO HA H 1 4.469 0.00 A 108 PRO HBy H 1 2.403 0.00 A 108 PRO HBx H 1 1.842 0.00 A 108 PRO HDy H 1 3.931 0.00 A 108 PRO HDx H 1 3.569 0.00 A 108 PRO HGy H 1 2.041 0.00 A 108 PRO HGx H 1 2.017 0.00 A 108 PRO C C 13 179.801 0.04 A 108 PRO CA C 13 64.346 0.03 A 108 PRO CB C 13 32.473 0.03 A 108 PRO CD C 13 50.635 0.02 A 108 PRO CG C 13 27.190 0.04 A 109 CYS H H 1 7.745 0.00 A 109 CYS HA H 1 4.003 0.02 A 109 CYS HBy H 1 3.717 0.00 A 109 CYS HBx H 1 3.104 0.00 A 109 CYS C C 13 176.088 0.03 A 109 CYS CA C 13 61.168 0.05 A 109 CYS CB C 13 44.504 0.05 A 109 CYS N N 15 115.197 0.04 A 110 GLN H H 1 7.782 0.00 A 110 GLN HA H 1 3.789 0.00 A 110 GLN HBy H 1 2.246 0.01 A 110 GLN HBx H 1 1.811 0.00 A 110 GLN HE2x H 1 6.955 0.00 A 110 GLN HE2y H 1 7.530 0.00 A 110 GLN HGy H 1 2.500 0.00 A 110 GLN HGx H 1 2.229 0.00 A 110 GLN C C 13 177.787 0.04 A 110 GLN CA C 13 58.107 0.05 A 110 GLN CB C 13 28.986 0.03 A 110 GLN CG C 13 34.308 0.01 A 110 GLN N N 15 121.491 0.12 A 110 GLN NE2 N 15 114.306 0.00 A 111 THR H H 1 7.868 0.00 A 111 THR HA H 1 3.855 0.00 A 111 THR HB H 1 4.184 0.00 A 111 THR HG2% H 1 1.337 0.00 A 111 THR C C 13 175.145 0.10 A 111 THR CA C 13 67.896 0.19 A 111 THR CB C 13 68.731 0.09 A 111 THR CG2 C 13 23.169 0.05 A 111 THR N N 15 115.912 0.06 A 112 MET H H 1 7.839 0.01 A 112 MET HA H 1 4.550 0.00 A 112 MET HBy H 1 2.115 0.02 A 112 MET HBx H 1 1.969 0.00 A 112 MET HGx H 1 2.875 0.00 A 112 MET HGy H 1 2.875 0.00 A 112 MET C C 13 177.850 0.03 A 112 MET CA C 13 56.917 0.05 A 112 MET CB C 13 32.500 0.03 A 112 MET CG C 13 33.508 0.02 A 112 MET N N 15 118.923 0.14 A 113 LEU H H 1 8.053 0.00 A 113 LEU HA H 1 3.793 0.00 A 113 LEU HBy H 1 1.999 0.00 A 113 LEU HBx H 1 1.227 0.00 A 113 LEU HDx% H 1 0.704 0.00 A 113 LEU HDy% H 1 0.667 0.00 A 113 LEU HG H 1 1.605 0.00 A 113 LEU C C 13 177.996 0.02 A 113 LEU CA C 13 58.214 0.03 A 113 LEU CB C 13 41.761 0.07 A 113 LEU CDy C 13 25.536 0.14 A 113 LEU CDx C 13 24.039 0.03 A 113 LEU CG C 13 26.774 0.13 A 113 LEU N N 15 122.012 0.06 A 114 ASN H H 1 8.584 0.01 A 114 ASN HA H 1 4.430 0.00 A 114 ASN HBy H 1 3.379 0.00 A 114 ASN HBx H 1 2.916 0.00 A 114 ASN HD2x H 1 7.207 0.00 A 114 ASN HD2y H 1 7.964 0.00 A 114 ASN C C 13 179.311 0.04 A 114 ASN CA C 13 56.013 0.02 A 114 ASN CB C 13 37.189 0.04 A 114 ASN N N 15 119.148 0.15 A 114 ASN ND2 N 15 109.103 0.00 A 115 LEU H H 1 8.552 0.00 A 115 LEU HA H 1 4.151 0.00 A 115 LEU HBy H 1 2.349 0.00 A 115 LEU HBx H 1 1.632 0.00 A 115 LEU HDx% H 1 1.002 0.00 A 115 LEU HDy% H 1 1.072 0.00 A 115 LEU HG H 1 1.522 0.00 A 115 LEU C C 13 178.039 0.04 A 115 LEU CA C 13 59.151 0.03 A 115 LEU CB C 13 41.152 0.03 A 115 LEU CDy C 13 25.935 0.07 A 115 LEU CDx C 13 24.923 0.03 A 115 LEU CG C 13 28.103 0.02 A 115 LEU N N 15 124.044 0.04 A 116 ALA H H 1 9.106 0.00 A 116 ALA HA H 1 4.077 0.00 A 116 ALA HB% H 1 1.256 0.00 A 116 ALA C C 13 179.309 0.04 A 116 ALA CA C 13 55.945 0.07 A 116 ALA CB C 13 18.013 0.03 A 116 ALA N N 15 122.862 0.05 A 117 MET H H 1 8.995 0.00 A 117 MET HA H 1 4.212 0.00 A 117 MET HBy H 1 2.946 0.00 A 117 MET HBx H 1 2.684 0.00 A 117 MET HGy H 1 2.374 0.01 A 117 MET HGx H 1 2.184 0.01 A 117 MET C C 13 178.772 0.03 A 117 MET CA C 13 59.730 0.04 A 117 MET CB C 13 33.003 0.06 A 117 MET CG C 13 32.998 0.03 A 117 MET N N 15 117.316 0.05 A 118 CYS H H 1 7.763 0.00 A 118 CYS HA H 1 4.414 0.00 A 118 CYS HBy H 1 3.323 0.00 A 118 CYS HBx H 1 3.250 0.00 A 118 CYS C C 13 175.008 0.04 A 118 CYS CA C 13 60.175 0.06 A 118 CYS CB C 13 38.651 0.01 A 118 CYS N N 15 121.433 0.05 A 119 PHE H H 1 9.005 0.00 A 119 PHE HA H 1 4.055 0.00 A 119 PHE HBy H 1 3.423 0.00 A 119 PHE HBx H 1 3.054 0.01 A 119 PHE HDx H 1 7.148 0.00 A 119 PHE HDy H 1 7.148 0.00 A 119 PHE HEx H 1 7.361 0.00 A 119 PHE HEy H 1 7.361 0.00 A 119 PHE HZ H 1 7.237 0.00 A 119 PHE C C 13 176.283 0.04 A 119 PHE CA C 13 61.650 0.08 A 119 PHE CB C 13 40.884 0.04 A 119 PHE CDx C 13 131.372 0.00 A 119 PHE CDy C 13 131.372 0.00 A 119 PHE CEx C 13 131.989 0.00 A 119 PHE CEy C 13 131.989 0.00 A 119 PHE CZ C 13 130.098 0.00 A 119 PHE N N 15 122.588 0.06 A 120 LYS H H 1 8.960 0.00 A 120 LYS HA H 1 3.883 0.00 A 120 LYS HBy H 1 2.032 0.00 A 120 LYS HBx H 1 1.945 0.00 A 120 LYS HDy H 1 1.234 0.00 A 120 LYS HDx H 1 1.091 0.00 A 120 LYS HEy H 1 2.577 0.00 A 120 LYS HEx H 1 2.527 0.01 A 120 LYS HGy H 1 1.505 0.00 A 120 LYS HGx H 1 1.277 0.01 A 120 LYS C C 13 178.120 0.03 A 120 LYS CA C 13 60.392 0.05 A 120 LYS CB C 13 33.252 0.02 A 120 LYS CD C 13 29.837 0.07 A 120 LYS CE C 13 41.964 0.01 A 120 LYS CG C 13 25.274 0.06 A 120 LYS N N 15 117.745 0.04 A 121 ALA H H 1 7.860 0.00 A 121 ALA HA H 1 4.113 0.00 A 121 ALA HB% H 1 1.564 0.00 A 121 ALA C C 13 181.434 0.04 A 121 ALA CA C 13 55.267 0.02 A 121 ALA CB C 13 18.325 0.04 A 121 ALA N N 15 120.614 0.05 A 122 GLU H H 1 8.480 0.00 A 122 GLU HA H 1 4.042 0.00 A 122 GLU HBy H 1 2.053 0.01 A 122 GLU HBx H 1 1.966 0.01 A 122 GLU HGy H 1 2.631 0.00 A 122 GLU HGx H 1 2.456 0.00 A 122 GLU C C 13 181.133 0.03 A 122 GLU CA C 13 58.794 0.06 A 122 GLU CB C 13 30.132 0.18 A 122 GLU CG C 13 35.410 0.04 A 122 GLU N N 15 116.884 0.05 A 123 ILE H H 1 8.346 0.00 A 123 ILE HA H 1 3.700 0.00 A 123 ILE HB H 1 1.633 0.00 A 123 ILE HD1% H 1 0.273 0.00 A 123 ILE HG1y H 1 1.127 0.00 A 123 ILE HG1x H 1 1.107 0.00 A 123 ILE HG2% H 1 0.360 0.00 A 123 ILE C C 13 178.047 0.04 A 123 ILE CA C 13 64.917 0.02 A 123 ILE CB C 13 37.377 0.03 A 123 ILE CD1 C 13 13.424 0.10 A 123 ILE CG1 C 13 26.989 0.00 A 123 ILE CG2 C 13 17.136 0.05 A 123 ILE N N 15 117.182 0.05 A 124 HIS H H 1 7.331 0.00 A 124 HIS HA H 1 4.393 0.00 A 124 HIS HBy H 1 3.431 0.00 A 124 HIS HBx H 1 3.258 0.00 A 124 HIS HD2 H 1 7.402 0.00 A 124 HIS HE1 H 1 8.583 0.00 A 124 HIS C C 13 174.716 0.04 A 124 HIS CA C 13 57.787 0.03 A 124 HIS CB C 13 28.421 0.02 A 124 HIS CD2 C 13 120.243 0.00 A 124 HIS CE1 C 13 136.322 0.00 A 124 HIS N N 15 117.050 0.05 A 124 HIS ND1 N 15 176.767 0.00 A 124 HIS NE2 N 15 175.808 0.00 A 125 LYS H H 1 7.208 0.00 A 125 LYS HA H 1 4.278 0.00 A 125 LYS HBy H 1 2.039 0.01 A 125 LYS HBx H 1 1.796 0.00 A 125 LYS HDy H 1 1.646 0.00 A 125 LYS HDx H 1 1.484 0.02 A 125 LYS HEx H 1 2.861 0.01 A 125 LYS HEy H 1 2.861 0.01 A 125 LYS HGy H 1 1.601 0.01 A 125 LYS HGx H 1 1.418 0.01 A 125 LYS C C 13 176.672 0.03 A 125 LYS CA C 13 56.854 0.14 A 125 LYS CB C 13 33.157 0.04 A 125 LYS CD C 13 29.788 0.12 A 125 LYS CE C 13 42.349 0.00 A 125 LYS CG C 13 25.184 0.15 A 125 LYS N N 15 116.638 0.05 A 126 LEU H H 1 6.936 0.00 A 126 LEU HA H 1 4.268 0.00 A 126 LEU HBy H 1 1.606 0.01 A 126 LEU HBx H 1 0.921 0.00 A 126 LEU HDx% H 1 0.334 0.00 A 126 LEU HDy% H 1 0.775 0.00 A 126 LEU HG H 1 1.636 0.00 A 126 LEU C C 13 177.117 0.04 A 126 LEU CA C 13 54.631 0.05 A 126 LEU CB C 13 42.983 0.04 A 126 LEU CDy C 13 25.043 0.03 A 126 LEU CDx C 13 22.317 0.02 A 126 LEU CG C 13 26.199 0.09 A 126 LEU N N 15 118.671 0.04 A 127 ASP H H 1 8.662 0.00 A 127 ASP HA H 1 4.512 0.00 A 127 ASP HBy H 1 2.832 0.00 A 127 ASP HBx H 1 2.772 0.00 A 127 ASP C C 13 175.008 0.04 A 127 ASP CA C 13 54.733 0.09 A 127 ASP CB C 13 39.765 0.02 A 127 ASP N N 15 119.786 0.05 A 128 TRP H H 1 7.289 0.00 A 128 TRP HA H 1 4.732 0.00 A 128 TRP HBy H 1 3.350 0.00 A 128 TRP HBx H 1 3.149 0.00 A 128 TRP HD1 H 1 7.381 0.00 A 128 TRP HE1 H 1 10.334 0.00 A 128 TRP HE3 H 1 7.413 0.00 A 128 TRP HH2 H 1 6.992 0.00 A 128 TRP HZ2 H 1 7.434 0.00 A 128 TRP HZ3 H 1 7.013 0.00 A 128 TRP C C 13 173.612 0.04 A 128 TRP CA C 13 54.586 0.04 A 128 TRP CB C 13 29.518 0.04 A 128 TRP CD1 C 13 127.755 0.00 A 128 TRP CE3 C 13 121.145 0.00 A 128 TRP CH2 C 13 123.757 0.00 A 128 TRP CZ2 C 13 114.769 0.00 A 128 TRP CZ3 C 13 121.570 0.00 A 128 TRP N N 15 117.301 0.04 A 128 TRP NE1 N 15 130.672 0.00 A 129 ALA H H 1 8.176 0.00 A 129 ALA HA H 1 4.579 0.00 A 129 ALA HB% H 1 1.215 0.00 A 129 ALA C C 13 174.469 0.00 A 129 ALA CA C 13 49.450 0.03 A 129 ALA CB C 13 19.276 0.04 A 129 ALA N N 15 122.193 0.05 A 130 PRO HA H 1 4.705 0.00 A 130 PRO HBy H 1 2.103 0.00 A 130 PRO HBx H 1 1.781 0.00 A 130 PRO HDy H 1 3.345 0.00 A 130 PRO HDx H 1 2.862 0.00 A 130 PRO HGy H 1 1.547 0.00 A 130 PRO HGx H 1 1.173 0.00 A 130 PRO C C 13 176.816 0.03 A 130 PRO CA C 13 61.970 0.06 A 130 PRO CB C 13 31.579 0.03 A 130 PRO CD C 13 50.002 0.03 A 130 PRO CG C 13 26.591 0.05 A 131 THR H H 1 8.315 0.00 A 131 THR HA H 1 4.372 0.00 A 131 THR HB H 1 4.750 0.00 A 131 THR HG2% H 1 1.483 0.00 A 131 THR C C 13 176.145 0.04 A 131 THR CA C 13 61.536 0.04 A 131 THR CB C 13 69.722 0.07 A 131 THR CG2 C 13 22.727 0.09 A 131 THR N N 15 112.321 0.07 A 132 LEU H H 1 8.675 0.00 A 132 LEU HA H 1 3.942 0.01 A 132 LEU HBy H 1 1.707 0.00 A 132 LEU HBx H 1 1.350 0.00 A 132 LEU HDx% H 1 0.844 0.00 A 132 LEU HDy% H 1 0.815 0.00 A 132 LEU HG H 1 1.576 0.01 A 132 LEU C C 13 178.449 0.04 A 132 LEU CA C 13 58.155 0.07 A 132 LEU CB C 13 41.948 0.05 A 132 LEU CDy C 13 24.785 0.06 A 132 LEU CDx C 13 24.132 0.04 A 132 LEU CG C 13 27.146 0.09 A 132 LEU N N 15 123.050 0.05 A 133 ASP H H 1 8.568 0.00 A 133 ASP HA H 1 4.267 0.00 A 133 ASP HBy H 1 2.602 0.01 A 133 ASP HBx H 1 2.472 0.00 A 133 ASP C C 13 178.452 0.02 A 133 ASP CA C 13 57.753 0.06 A 133 ASP CB C 13 40.394 0.07 A 133 ASP N N 15 115.551 0.10 A 134 VAL H H 1 7.176 0.00 A 134 VAL HA H 1 3.815 0.00 A 134 VAL HB H 1 2.176 0.00 A 134 VAL HGx% H 1 0.916 0.00 A 134 VAL HGy% H 1 0.969 0.00 A 134 VAL CA C 13 66.654 0.02 A 134 VAL CB C 13 31.827 0.04 A 134 VAL CGy C 13 24.627 0.04 A 134 VAL CGx C 13 21.850 0.01 A 134 VAL N N 15 118.124 0.09 A 135 ALA HA H 1 4.077 0.00 A 135 ALA HB% H 1 1.259 0.00 A 135 ALA C C 13 178.346 0.00 A 135 ALA CA C 13 56.123 0.05 A 135 ALA CB C 13 18.511 0.03 A 136 VAL H H 1 8.669 0.00 A 136 VAL HA H 1 3.180 0.00 A 136 VAL HB H 1 1.800 0.00 A 136 VAL HGx% H 1 -0.182 0.00 A 136 VAL HGy% H 1 0.596 0.00 A 136 VAL C C 13 178.283 0.05 A 136 VAL CA C 13 66.291 0.04 A 136 VAL CB C 13 30.970 0.04 A 136 VAL CGy C 13 21.725 0.00 A 136 VAL CGx C 13 21.111 0.01 A 136 VAL N N 15 115.340 0.27 A 137 GLY H H 1 7.982 0.00 A 137 GLY HAy H 1 3.614 0.00 A 137 GLY HAx H 1 3.277 0.00 A 137 GLY C C 13 175.116 0.04 A 137 GLY CA C 13 47.970 0.02 A 137 GLY N N 15 106.529 0.05 A 138 GLU H H 1 8.347 0.00 A 138 GLU HA H 1 3.887 0.00 A 138 GLU HBy H 1 2.264 0.00 A 138 GLU HBx H 1 2.077 0.01 A 138 GLU HGy H 1 3.101 0.00 A 138 GLU HGx H 1 2.448 0.00 A 138 GLU C C 13 177.117 0.03 A 138 GLU CA C 13 62.174 0.05 A 138 GLU CB C 13 28.634 0.07 A 138 GLU CG C 13 35.944 0.04 A 138 GLU N N 15 117.927 0.05 A 139 LEU H H 1 7.376 0.00 A 139 LEU HA H 1 3.391 0.00 A 139 LEU HBy H 1 1.892 0.01 A 139 LEU HBx H 1 1.004 0.00 A 139 LEU HDx% H 1 0.823 0.00 A 139 LEU HDy% H 1 0.214 0.00 A 139 LEU HG H 1 1.173 0.00 A 139 LEU C C 13 178.789 0.03 A 139 LEU CA C 13 59.107 0.02 A 139 LEU CB C 13 41.091 0.03 A 139 LEU CDy C 13 25.762 0.01 A 139 LEU CDx C 13 22.764 0.03 A 139 LEU CG C 13 26.658 0.01 A 139 LEU N N 15 116.955 0.04 A 140 LEU H H 1 8.363 0.00 A 140 LEU HA H 1 3.848 0.00 A 140 LEU HBy H 1 1.863 0.00 A 140 LEU HBx H 1 1.207 0.00 A 140 LEU HDx% H 1 0.704 0.00 A 140 LEU HDy% H 1 0.767 0.00 A 140 LEU HG H 1 1.990 0.00 A 140 LEU C C 13 179.452 0.04 A 140 LEU CA C 13 57.712 0.04 A 140 LEU CB C 13 42.783 0.06 A 140 LEU CDy C 13 26.991 0.02 A 140 LEU CDx C 13 23.780 0.04 A 140 LEU CG C 13 26.731 0.06 A 140 LEU N N 15 116.229 0.06 A 141 ALA H H 1 8.491 0.00 A 141 ALA HA H 1 3.953 0.00 A 141 ALA HB% H 1 1.259 0.01 A 141 ALA C C 13 177.430 0.03 A 141 ALA CA C 13 54.345 0.05 A 141 ALA CB C 13 17.785 0.01 A 141 ALA N N 15 119.797 0.04 A 142 ASP H H 1 7.488 0.00 A 142 ASP HA H 1 4.923 0.00 A 142 ASP HBy H 1 2.385 0.00 A 142 ASP HBx H 1 2.251 0.00 A 142 ASP C C 13 174.815 0.03 A 142 ASP CA C 13 53.807 0.06 A 142 ASP CB C 13 44.304 0.02 A 142 ASP N N 15 116.276 0.05 A 143 THR H H 1 7.200 0.00 A 143 THR HA H 1 4.124 0.00 A 143 THR HB H 1 4.116 0.00 A 143 THR HG2% H 1 1.128 0.00 A 143 THR C C 13 178.982 0.00 A 143 THR CA C 13 65.995 0.02 A 143 THR CB C 13 70.420 0.02 A 143 THR CG2 C 13 21.830 0.00 A 143 THR N N 15 122.379 0.04 stop_ save_ save_DYANA/DIANA_distance_constraints_3 _nef_distance_restraint_list.sf_category nef_distance_restraint_list _nef_distance_restraint_list.sf_framecode DYANA/DIANA_distance_constraints_3 _nef_distance_restraint_list.restraint_origin undefined _nef_distance_restraint_list.potential_type 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 19 CYS SG A 54 CYS SG 1.0 . 2.0 2 2 A 19 CYS SG A 54 CYS CB 1.0 . 3.0 3 3 A 54 CYS SG A 19 CYS CB 1.0 . 3.0 4 4 A 50 CYS SG A 109 CYS SG 1.0 . 2.0 5 5 A 50 CYS SG A 109 CYS CB 1.0 . 3.0 6 6 A 109 CYS SG A 50 CYS CB 1.0 . 3.0 7 7 A 97 CYS SG A 118 CYS SG 1.0 . 2.0 8 8 A 97 CYS SG A 118 CYS CB 1.0 . 3.0 9 9 A 118 CYS SG A 97 CYS CB 1.0 . 3.0 10 10 A 19 CYS SG A 54 CYS SG 1.0 . 2.1 11 11 A 19 CYS SG A 54 CYS CB 1.0 . 3.1 12 12 A 54 CYS SG A 19 CYS CB 1.0 . 3.1 13 13 A 50 CYS SG A 109 CYS SG 1.0 . 2.1 14 14 A 50 CYS SG A 109 CYS CB 1.0 . 3.1 15 15 A 109 CYS SG A 50 CYS CB 1.0 . 3.1 16 16 A 97 CYS SG A 118 CYS SG 1.0 . 2.1 17 17 A 97 CYS SG A 118 CYS CB 1.0 . 3.1 18 18 A 118 CYS SG A 97 CYS CB 1.0 . 3.1 stop_ save_ save_DYANA/DIANA_distance_constraints_4 _nef_distance_restraint_list.sf_category nef_distance_restraint_list _nef_distance_restraint_list.sf_framecode DYANA/DIANA_distance_constraints_4 _nef_distance_restraint_list.restraint_origin 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 140 LEU HA A 143 THR HA 1.0 . 4.90 2 2 A 143 THR HA A 56 ALA HB% 1.0 . 5.47 3 3 A 143 THR HA A 56 ALA HB% 1.0 . 5.50 4 4 A 143 THR HA A 143 THR HG2% 1.0 . 4.12 5 5 A 143 THR HB A 140 LEU HDy% 1.0 . 5.50 6 6 A 141 ALA HB% A 142 ASP HA 1.0 . 5.04 7 7 A 141 ALA HB% A 142 ASP HA 1.0 . 5.50 8 8 A 142 ASP HBx A 73 ALA HB% 1.0 . 5.50 9 9 A 142 ASP HBx A 91 LEU HG 1.0 . 5.50 10 10 A 142 ASP HBy A 73 ALA HB% 1.0 . 4.34 11 11 A 142 ASP HBy A 73 ALA HB% 1.0 . 4.91 12 12 A 71 GLY H A 141 ALA HA 1.0 . 4.46 13 13 A 56 ALA HB% A 141 ALA HA 1.0 . 5.33 14 14 A 141 ALA HA A 73 ALA HB% 1.0 . 5.50 15 15 A 141 ALA HA A 59 LEU HDx% 1.0 . 3.67 16 16 A 141 ALA HB% A 71 GLY H 1.0 . 3.34 17 17 A 36 PHE HEy A 116 ALA HB% 1.0 . 4.40 18 18 A 119 PHE HDx A 135 ALA HB% 1.0 . 5.34 19 19 A 141 ALA HB% A 138 GLU H 1.0 . 5.30 20 20 A 141 ALA HB% A 140 LEU H 1.0 . 5.50 21 21 A 141 ALA HB% A 73 ALA H 1.0 . 3.69 22 22 A 141 ALA HB% A 142 ASP H 1.0 . 3.90 23 23 A 116 ALA HB% A 119 PHE HDx 1.0 . 4.54 24 24 A 141 ALA HB% A 139 LEU H 1.0 . 5.01 25 25 A 141 ALA HB% A 138 GLU HA 1.0 . 3.16 26 26 A 141 ALA HB% A 70 HIS HBy 1.0 . 5.50 27 27 A 116 ALA HB% A 119 PHE HBx 1.0 . 5.50 28 28 A 141 ALA HB% A 70 HIS HBx 1.0 . 5.50 29 29 A 141 ALA HB% A 76 PHE HBx 1.0 . 5.50 30 30 A 141 ALA HB% A 142 ASP HBy 1.0 . 5.40 31 31 A 141 ALA HB% A 142 ASP HBy 1.0 . 5.50 32 32 A 116 ALA HB% A 117 MET HGy 1.0 . 5.50 33 33 A 141 ALA HB% A 138 GLU HBx 1.0 . 4.68 34 34 A 141 ALA HB% A 59 LEU HDx% 1.0 . 4.61 35 35 A 141 ALA HB% A 59 LEU HDx% 1.0 . 5.14 36 36 A 116 ALA HB% A 52 ILE HG2% 1.0 . 4.31 37 37 A 116 ALA HB% A 52 ILE HG2% 1.0 . 4.49 38 38 A 59 LEU HA A 60 GLU HA 1.0 . 5.02 39 39 A 140 LEU HA A 143 THR HB 1.0 . 3.85 40 40 A 59 LEU HA A 62 LEU HG 1.0 . 3.85 41 41 A 59 LEU HA A 62 LEU HDx% 1.0 . 3.39 42 42 A 59 LEU HA A 62 LEU HDy% 1.0 . 4.65 43 43 A 140 LEU HBx A 141 ALA H 1.0 . 4.80 44 44 A 140 LEU HBy A 140 LEU HDx% 1.0 . 3.87 45 45 A 56 ALA HA A 140 LEU HG 1.0 . 5.11 46 46 A 139 LEU HA A 139 LEU HG 1.0 . 4.10 47 47 A 139 LEU HA A 139 LEU HDx% 1.0 . 5.33 48 48 A 139 LEU HA A 139 LEU HDx% 1.0 . 5.50 49 49 A 139 LEU HA A 139 LEU HDx% 1.0 . 5.50 50 50 A 140 LEU H A 139 LEU HBx 1.0 . 4.56 51 51 A 140 LEU H A 139 LEU HBy 1.0 . 4.56 52 52 A 139 LEU H A 139 LEU HG 1.0 . 4.61 53 53 A 138 GLU HA A 138 GLU HGy 1.0 . 4.18 54 54 A 138 GLU HA A 138 GLU HGx 1.0 . 4.18 55 55 A 139 LEU H A 138 GLU HBx 1.0 . 4.65 56 56 A 91 LEU HG A 138 GLU HBy 1.0 . 5.47 57 57 A 138 GLU HBx A 90 LEU HDx% 1.0 . 4.84 58 58 A 110 GLN HBy A 104 VAL HGy% 1.0 . 4.90 59 59 A 90 LEU HDx% A 138 GLU HGy 1.0 . 4.88 60 60 A 76 PHE HZ A 137 GLY HAy 1.0 . 5.01 61 61 A 76 PHE HDy A 137 GLY HAx 1.0 . 4.83 62 62 A 76 PHE HZ A 137 GLY HAx 1.0 . 4.63 63 63 A 137 GLY HAy A 134 VAL HA 1.0 . 5.50 64 64 A 137 GLY HAx A 134 VAL HA 1.0 . 4.47 65 65 A 140 LEU HBy A 137 GLY HAy 1.0 . 4.62 66 66 A 140 LEU HBy A 137 GLY HAx 1.0 . 5.11 67 67 A 140 LEU HBx A 137 GLY HAy 1.0 . 5.11 68 68 A 137 GLY HAy A 140 LEU HDx% 1.0 . 4.54 69 69 A 137 GLY HAy A 140 LEU HDx% 1.0 . 5.10 70 70 A 137 GLY HAy A 68 LEU HDy% 1.0 . 4.72 71 71 A 137 GLY HAx A 68 LEU HDy% 1.0 . 4.89 72 72 A 137 GLY HAx A 68 LEU HDy% 1.0 . 5.50 73 73 A 138 GLU H A 136 VAL HA 1.0 . 5.21 74 74 A 136 VAL HA A 119 PHE HEx 1.0 . 4.42 75 75 A 136 VAL HA A 139 LEU HBy 1.0 . 4.24 76 76 A 135 ALA HB% A 136 VAL HA 1.0 . 4.94 77 77 A 135 ALA HB% A 136 VAL HA 1.0 . 5.50 78 78 A 136 VAL HA A 139 LEU HBx 1.0 . 4.24 79 79 A 136 VAL HA A 136 VAL HGx% 1.0 . 4.08 80 80 A 37 TRP HZ2 A 136 VAL HGy% 1.0 . 5.37 81 81 A 37 TRP HZ2 A 136 VAL HGy% 1.0 . 5.50 82 82 A 37 TRP HZ2 A 136 VAL HGy% 1.0 . 5.50 83 83 A 136 VAL HA A 136 VAL HGy% 1.0 . 4.08 84 84 A 136 VAL HGx% A 137 GLY H 1.0 . 5.50 85 85 A 136 VAL HGx% A 137 GLY H 1.0 . 5.50 86 86 A 136 VAL HGx% A 137 GLY H 1.0 . 5.50 87 87 A 136 VAL HGx% A 37 TRP HH2 1.0 . 5.50 88 88 A 136 VAL HGx% A 37 TRP HH2 1.0 . 5.50 89 89 A 136 VAL HGx% A 37 TRP HH2 1.0 . 5.50 90 90 A 136 VAL HGx% A 37 TRP HZ2 1.0 . 5.20 91 91 A 136 VAL HGx% A 37 TRP HZ2 1.0 . 5.36 92 92 A 138 GLU H A 135 ALA HA 1.0 . 4.47 93 93 A 135 ALA HA A 119 PHE HZ 1.0 . 3.95 94 94 A 119 PHE HEx A 135 ALA HA 1.0 . 4.32 95 95 A 135 ALA HA A 90 LEU HDy% 1.0 . 4.19 96 96 A 115 LEU HDy% A 116 ALA HA 1.0 . 4.80 97 97 A 139 LEU HDx% A 116 ALA HA 1.0 . 3.90 98 98 A 138 GLU HBy A 135 ALA HA 1.0 . 4.61 99 99 A 116 ALA HA A 119 PHE HBy 1.0 . 4.03 100 100 A 135 ALA HB% A 136 VAL H 1.0 . 3.77 101 101 A 135 ALA HB% A 136 VAL H 1.0 . 3.95 102 102 A 135 ALA HB% A 119 PHE HEx 1.0 . 3.58 103 103 A 135 ALA HB% A 119 PHE HZ 1.0 . 3.94 104 104 A 135 ALA HB% A 119 PHE HZ 1.0 . 4.30 105 105 A 135 ALA HB% A 130 PRO HBx 1.0 . 4.41 106 106 A 135 ALA HB% A 132 LEU HA 1.0 . 3.47 107 107 A 135 ALA HB% A 130 PRO HBy 1.0 . 4.41 108 108 A 135 ALA HB% A 136 VAL HGx% 1.0 . 4.21 109 109 A 135 ALA HB% A 136 VAL HGx% 1.0 . 4.74 110 110 A 135 ALA HB% A 136 VAL HGx% 1.0 . 4.80 111 111 A 135 ALA HB% A 123 ILE HD1% 1.0 . 3.33 112 112 A 135 ALA HB% A 90 LEU HDx% 1.0 . 3.45 113 113 A 138 GLU H A 134 VAL HA 1.0 . 4.65 114 114 A 76 PHE HZ A 134 VAL HA 1.0 . 4.39 115 115 A 134 VAL HA A 135 ALA HA 1.0 . 5.12 116 116 A 136 VAL H A 132 LEU HA 1.0 . 4.37 117 117 A 136 VAL HGx% A 132 LEU HA 1.0 . 5.01 118 118 A 136 VAL HGx% A 132 LEU HA 1.0 . 5.50 119 119 A 132 LEU HA A 132 LEU HG 1.0 . 4.05 120 120 A 132 LEU HA A 131 THR HA 1.0 . 4.54 121 121 A 99 LYS HA A 103 ILE HG1x 1.0 . 5.12 122 122 A 136 VAL HGx% A 132 LEU HG 1.0 . 5.50 123 123 A 136 VAL HGx% A 132 LEU HG 1.0 . 5.50 124 124 A 136 VAL HGx% A 132 LEU HG 1.0 . 5.50 125 125 A 13 ALA HA A 14 LYS HA 1.0 . 5.02 126 126 A 131 THR HA A 131 THR HG2% 1.0 . 4.01 127 127 A 131 THR HA A 132 LEU HDy% 1.0 . 5.50 128 128 A 135 ALA HB% A 131 THR HA 1.0 . 5.33 129 129 A 131 THR HG2% A 131 THR H 1.0 . 3.25 130 130 A 131 THR HG2% A 133 ASP H 1.0 . 5.50 131 131 A 131 THR HG2% A 133 ASP H 1.0 . 5.50 132 132 A 128 TRP HE3 A 130 PRO HA 1.0 . 4.44 133 133 A 130 PRO HA A 128 TRP HZ3 1.0 . 3.67 134 134 A 131 THR HA A 130 PRO HA 1.0 . 4.55 135 135 A 131 THR HG2% A 130 PRO HA 1.0 . 5.50 136 136 A 131 THR HG2% A 130 PRO HA 1.0 . 5.50 137 137 A 128 TRP HZ3 A 130 PRO HBx 1.0 . 4.72 138 138 A 128 TRP HZ3 A 130 PRO HBy 1.0 . 4.72 139 139 A 90 LEU HDy% A 130 PRO HBy 1.0 . 4.61 140 140 A 90 LEU HDy% A 130 PRO HBy 1.0 . 5.11 141 141 A 123 ILE HG2% A 130 PRO HGy 1.0 . 4.15 142 142 A 128 TRP HA A 129 ALA HB% 1.0 . 4.34 143 143 A 130 PRO HDy A 129 ALA HB% 1.0 . 3.57 144 144 A 129 ALA HB% A 130 PRO HDx 1.0 . 5.50 145 145 A 129 ALA HB% A 130 PRO HDx 1.0 . 5.50 146 146 A 129 ALA HB% A 130 PRO HDx 1.0 . 5.50 147 147 A 128 TRP HA A 128 TRP HD1 1.0 . 4.26 148 148 A 128 TRP HA A 127 ASP HA 1.0 . 4.75 149 149 A 127 ASP HA A 126 LEU HA 1.0 . 4.49 150 150 A 126 LEU HA A 127 ASP HBy 1.0 . 5.50 151 151 A 126 LEU HA A 127 ASP HBx 1.0 . 5.50 152 152 A 126 LEU HA A 126 LEU HG 1.0 . 4.10 153 153 A 126 LEU HA A 126 LEU HDy% 1.0 . 3.25 154 154 A 126 LEU HA A 126 LEU HDy% 1.0 . 3.73 155 155 A 126 LEU H A 126 LEU HBy 1.0 . 3.96 156 156 A 126 LEU HDx% A 126 LEU HBy 1.0 . 4.05 157 157 A 126 LEU HDx% A 128 TRP HZ2 1.0 . 5.18 158 158 A 126 LEU HDx% A 128 TRP HZ2 1.0 . 5.40 159 159 A 126 LEU HDx% A 89 GLN HE2y 1.0 . 4.69 160 160 A 126 LEU HDx% A 89 GLN HE2y 1.0 . 5.38 161 161 A 126 LEU HDx% A 89 GLN HE2x 1.0 . 4.69 162 162 A 126 LEU HDx% A 89 GLN HE2x 1.0 . 5.38 163 163 A 126 LEU HA A 126 LEU HDx% 1.0 . 5.06 164 164 A 126 LEU HA A 126 LEU HDx% 1.0 . 5.31 165 165 A 130 PRO HDx A 126 LEU HDx% 1.0 . 4.90 166 166 A 126 LEU HDx% A 89 GLN HGx 1.0 . 5.49 167 167 A 126 LEU HDx% A 89 GLN HGx 1.0 . 5.50 168 168 A 126 LEU HDx% A 126 LEU HBx 1.0 . 4.05 169 169 A 126 LEU HDy% A 127 ASP H 1.0 . 3.56 170 170 A 23 LEU H A 23 LEU HDy% 1.0 . 4.12 171 171 A 23 LEU H A 23 LEU HDy% 1.0 . 4.31 172 172 A 126 LEU HDy% A 126 LEU H 1.0 . 4.93 173 173 A 23 LEU HDy% A 19 CYS HA 1.0 . 3.33 174 174 A 23 LEU HDy% A 22 GLU HA 1.0 . 5.50 175 175 A 23 LEU HDy% A 22 GLU HA 1.0 . 5.50 176 176 A 126 LEU HDy% A 89 GLN HGy 1.0 . 5.50 177 177 A 23 LEU HDy% A 22 GLU HGy 1.0 . 5.50 178 178 A 23 LEU HDy% A 22 GLU HBx 1.0 . 3.95 179 179 A 126 LEU HDy% A 126 LEU HDx% 1.0 . 3.05 180 180 A 126 LEU HDy% A 126 LEU HDx% 1.0 . 3.32 181 181 A 79 LYS HA A 80 HIS HA 1.0 . 4.77 182 182 A 29 VAL HA A 30 MET HA 1.0 . 4.90 183 183 A 30 MET HA A 33 PHE HBy 1.0 . 5.17 184 184 A 30 MET HA A 29 VAL HGy% 1.0 . 4.36 185 185 A 30 MET HA A 29 VAL HGy% 1.0 . 4.62 186 186 A 125 LYS HA A 125 LYS HGx 1.0 . 4.14 187 187 A 30 MET HA A 33 PHE HBx 1.0 . 5.06 188 188 A 122 GLU HA A 125 LYS HBx 1.0 . 4.53 189 189 A 123 ILE HG1x A 124 HIS HA 1.0 . 4.93 190 190 A 125 LYS HA A 125 LYS HGy 1.0 . 3.90 191 191 A 126 LEU HA A 125 LYS HGy 1.0 . 4.37 192 192 A 121 ALA HB% A 124 HIS HBy 1.0 . 5.50 193 193 A 121 ALA HB% A 124 HIS HBx 1.0 . 5.50 194 194 A 122 GLU HA A 123 ILE HA 1.0 . 4.92 195 195 A 123 ILE HG1x A 123 ILE HA 1.0 . 4.21 196 196 A 123 ILE HA A 93 ILE HD1% 1.0 . 4.06 197 197 A 126 LEU HDx% A 123 ILE HA 1.0 . 3.44 198 198 A 126 LEU HDx% A 123 ILE HA 1.0 . 3.53 199 199 A 93 ILE HD1% A 123 ILE HB 1.0 . 5.50 200 200 A 93 ILE HD1% A 123 ILE HB 1.0 . 5.50 201 201 A 93 ILE HD1% A 123 ILE HB 1.0 . 5.50 202 202 A 123 ILE H A 123 ILE HD1% 1.0 . 4.20 203 203 A 119 PHE HEx A 123 ILE HD1% 1.0 . 3.83 204 204 A 119 PHE HDx A 123 ILE HD1% 1.0 . 3.99 205 205 A 135 ALA HA A 123 ILE HD1% 1.0 . 5.41 206 206 A 135 ALA HA A 123 ILE HD1% 1.0 . 5.50 207 207 A 123 ILE HD1% A 120 LYS HA 1.0 . 3.70 208 208 A 123 ILE HA A 123 ILE HD1% 1.0 . 4.88 209 209 A 123 ILE HB A 123 ILE HD1% 1.0 . 3.38 210 210 A 90 LEU HDy% A 123 ILE HD1% 1.0 . 3.79 211 211 A 93 ILE HD1% A 123 ILE HG1y 1.0 . 4.69 212 212 A 123 ILE HG2% A 122 GLU H 1.0 . 5.02 213 213 A 123 ILE HG2% A 119 PHE HEy 1.0 . 4.82 214 214 A 123 ILE HG2% A 119 PHE HEy 1.0 . 4.82 215 215 A 119 PHE HZ A 123 ILE HG2% 1.0 . 4.12 216 216 A 123 ILE HG2% A 120 LYS HA 1.0 . 4.64 217 217 A 123 ILE HG2% A 120 LYS HA 1.0 . 4.89 218 218 A 123 ILE HG2% A 119 PHE HA 1.0 . 5.26 219 219 A 123 ILE HG2% A 123 ILE HA 1.0 . 3.35 220 220 A 123 ILE HG2% A 123 ILE HA 1.0 . 3.86 221 221 A 123 ILE HG2% A 130 PRO HDx 1.0 . 5.50 222 222 A 123 ILE HG2% A 130 PRO HDx 1.0 . 5.50 223 223 A 123 ILE HG2% A 93 ILE HB 1.0 . 4.52 224 224 A 123 ILE HG2% A 122 GLU HBx 1.0 . 4.72 225 225 A 123 ILE HG2% A 122 GLU HBy 1.0 . 4.21 226 226 A 123 ILE HG2% A 123 ILE HG1y 1.0 . 3.61 227 227 A 123 ILE HG2% A 123 ILE HG1y 1.0 . 3.72 228 228 A 122 GLU HA A 124 HIS H 1.0 . 4.58 229 229 A 122 GLU HA A 122 GLU HGy 1.0 . 3.85 230 230 A 122 GLU HA A 122 GLU HGx 1.0 . 3.85 231 231 A 122 GLU H A 122 GLU HBx 1.0 . 3.94 232 232 A 123 ILE H A 122 GLU HBx 1.0 . 4.45 233 233 A 93 ILE HD1% A 122 GLU HBy 1.0 . 4.58 234 234 A 93 ILE HD1% A 122 GLU HBy 1.0 . 5.05 235 235 A 122 GLU HBx A 93 ILE HG2% 1.0 . 4.09 236 236 A 122 GLU HBx A 93 ILE HG2% 1.0 . 4.26 237 237 A 123 ILE H A 122 GLU HBy 1.0 . 4.33 238 238 A 122 GLU H A 122 GLU HGx 1.0 . 4.02 239 239 A 118 CYS HA A 121 ALA HA 1.0 . 5.40 240 240 A 120 LYS HA A 121 ALA HA 1.0 . 5.07 241 241 A 121 ALA HA A 124 HIS HBx 1.0 . 4.13 242 242 A 121 ALA HA A 124 HIS HBy 1.0 . 4.13 243 243 A 121 ALA HB% A 119 PHE H 1.0 . 5.12 244 244 A 121 ALA HB% A 118 CYS HA 1.0 . 3.43 245 245 A 121 ALA HB% A 121 ALA HA 1.0 . 2.80 246 246 A 121 ALA HB% A 118 CYS HBy 1.0 . 5.50 247 247 A 123 ILE H A 120 LYS HA 1.0 . 4.38 248 248 A 84 GLU HA A 87 ALA H 1.0 . 4.23 249 249 A 84 GLU HA A 78 MET HGx 1.0 . 4.50 250 250 A 84 GLU HA A 78 MET HGy 1.0 . 4.12 251 251 A 123 ILE HB A 120 LYS HA 1.0 . 4.85 252 252 A 84 GLU HA A 87 ALA HB% 1.0 . 3.44 253 253 A 120 LYS HA A 123 ILE HG1y 1.0 . 3.66 254 254 A 93 ILE HD1% A 120 LYS HA 1.0 . 5.50 255 255 A 122 GLU H A 119 PHE HA 1.0 . 4.37 256 256 A 123 ILE H A 119 PHE HA 1.0 . 4.83 257 257 A 119 PHE HA A 119 PHE HDy 1.0 . 3.70 258 258 A 119 PHE HA A 122 GLU HBy 1.0 . 4.05 259 259 A 119 PHE HBy A 93 ILE HB 1.0 . 5.50 260 260 A 119 PHE HA A 118 CYS HA 1.0 . 4.93 261 261 A 118 CYS HA A 101 ILE HG2% 1.0 . 5.50 262 262 A 118 CYS HA A 101 ILE HG2% 1.0 . 5.50 263 263 A 118 CYS HA A 101 ILE HG2% 1.0 . 5.50 264 264 A 118 CYS HBy A 97 CYS HBy 1.0 . 5.47 265 265 A 118 CYS HBy A 97 CYS HBx 1.0 . 4.20 266 266 A 101 ILE HG2% A 118 CYS HBx 1.0 . 4.31 267 267 A 101 ILE HG2% A 118 CYS HBx 1.0 . 4.09 268 268 A 36 PHE HZ A 117 MET HA 1.0 . 3.56 269 269 A 116 ALA HB% A 117 MET HA 1.0 . 4.28 270 270 A 117 MET HGy A 117 MET HA 1.0 . 3.94 271 271 A 117 MET HBx A 118 CYS H 1.0 . 4.69 272 272 A 36 PHE HZ A 117 MET HBy 1.0 . 4.17 273 273 A 36 PHE HEy A 117 MET HBy 1.0 . 4.39 274 274 A 36 PHE HZ A 117 MET HBx 1.0 . 4.33 275 275 A 36 PHE HEy A 117 MET HBx 1.0 . 4.69 276 276 A 117 MET HBx A 114 ASN HA 1.0 . 4.58 277 277 A 117 MET HBx A 113 LEU HG 1.0 . 5.50 278 278 A 121 ALA HB% A 117 MET HBy 1.0 . 5.50 279 279 A 131 THR H A 134 VAL HB 1.0 . 5.40 280 280 A 78 MET HGy A 78 MET H 1.0 . 4.10 281 281 A 130 PRO HA A 134 VAL HB 1.0 . 5.50 282 282 A 119 PHE HDx A 116 ALA HA 1.0 . 4.21 283 283 A 119 PHE HBx A 116 ALA HA 1.0 . 3.51 284 284 A 141 ALA HB% A 68 LEU HA 1.0 . 5.04 285 285 A 141 ALA HB% A 68 LEU HDy% 1.0 . 3.54 286 286 A 141 ALA HB% A 68 LEU HDy% 1.0 . 3.85 287 287 A 115 LEU HA A 117 MET H 1.0 . 5.32 288 288 A 119 PHE H A 115 LEU HA 1.0 . 5.49 289 289 A 118 CYS HBx A 115 LEU HA 1.0 . 4.10 290 290 A 97 CYS HBx A 115 LEU HA 1.0 . 4.43 291 291 A 115 LEU HA A 101 ILE HD1% 1.0 . 3.80 292 292 A 115 LEU HA A 101 ILE HD1% 1.0 . 4.27 293 293 A 115 LEU HA A 115 LEU HG 1.0 . 4.04 294 294 A 116 ALA HB% A 115 LEU HBx 1.0 . 4.80 295 295 A 115 LEU HBy A 115 LEU HDx% 1.0 . 4.21 296 296 A 101 ILE HD1% A 115 LEU HBy 1.0 . 4.30 297 297 A 101 ILE HD1% A 115 LEU HBx 1.0 . 4.50 298 298 A 115 LEU HG A 115 LEU H 1.0 . 4.73 299 299 A 115 LEU HG A 116 ALA H 1.0 . 5.05 300 300 A 115 LEU HG A 101 ILE HG1x 1.0 . 4.67 301 301 A 115 LEU HG A 139 LEU HDy% 1.0 . 4.82 302 302 A 115 LEU HG A 139 LEU HDy% 1.0 . 5.29 303 303 A 101 ILE HD1% A 115 LEU HG 1.0 . 5.48 304 304 A 101 ILE HD1% A 115 LEU HG 1.0 . 5.50 305 305 A 119 PHE HDy A 115 LEU HDx% 1.0 . 5.50 306 306 A 115 LEU HDx% A 112 MET HA 1.0 . 4.04 307 307 A 115 LEU HA A 115 LEU HDx% 1.0 . 5.24 308 308 A 115 LEU HA A 115 LEU HDx% 1.0 . 5.30 309 309 A 94 LYS HA A 94 LYS HGx 1.0 . 4.23 310 310 A 115 LEU HDx% A 94 LYS HA 1.0 . 4.36 311 311 A 97 CYS HBy A 115 LEU HDx% 1.0 . 5.50 312 312 A 119 PHE HBy A 115 LEU HDx% 1.0 . 4.40 313 313 A 97 CYS HBx A 115 LEU HDx% 1.0 . 5.46 314 314 A 115 LEU HBx A 115 LEU HDx% 1.0 . 3.10 315 315 A 115 LEU HDx% A 139 LEU HDy% 1.0 . 4.46 316 316 A 114 ASN HA A 114 ASN HD2x 1.0 . 4.77 317 317 A 114 ASN HA A 115 LEU HA 1.0 . 4.89 318 318 A 114 ASN HA A 117 MET HGx 1.0 . 3.78 319 319 A 101 ILE HG2% A 114 ASN HA 1.0 . 5.37 320 320 A 101 ILE HG2% A 114 ASN HA 1.0 . 5.50 321 321 A 114 ASN HA A 101 ILE HD1% 1.0 . 5.18 322 322 A 102 THR HB A 114 ASN HBx 1.0 . 4.88 323 323 A 101 ILE HG1x A 114 ASN HBx 1.0 . 5.50 324 324 A 114 ASN HBx A 101 ILE HG1y 1.0 . 5.50 325 325 A 101 ILE HG2% A 114 ASN HBx 1.0 . 4.81 326 326 A 101 ILE HG2% A 114 ASN HBx 1.0 . 5.12 327 327 A 101 ILE HG2% A 114 ASN HBy 1.0 . 4.87 328 328 A 110 GLN HA A 110 GLN HE2x 1.0 . 4.43 329 329 A 110 GLN HA A 49 GLY HAx 1.0 . 4.91 330 330 A 49 GLY HAx A 113 LEU HA 1.0 . 5.21 331 331 A 110 GLN HA A 109 CYS HA 1.0 . 4.97 332 332 A 113 LEU HA A 49 GLY HAy 1.0 . 4.34 333 333 A 110 GLN HA A 110 GLN HGy 1.0 . 4.14 334 334 A 110 GLN HA A 110 GLN HGx 1.0 . 3.46 335 335 A 113 LEU HG A 113 LEU HA 1.0 . 3.79 336 336 A 110 GLN HA A 113 LEU HBx 1.0 . 3.48 337 337 A 113 LEU HA A 52 ILE HD1% 1.0 . 4.53 338 338 A 113 LEU HBx A 114 ASN H 1.0 . 4.02 339 339 A 110 GLN HA A 113 LEU HBy 1.0 . 4.38 340 340 A 46 ARG H A 113 LEU HDx% 1.0 . 5.50 341 341 A 46 ARG H A 113 LEU HDx% 1.0 . 5.50 342 342 A 46 ARG H A 113 LEU HDx% 1.0 . 5.50 343 343 A 114 ASN H A 113 LEU HDx% 1.0 . 5.50 344 344 A 113 LEU HDx% A 44 THR H 1.0 . 5.50 345 345 A 113 LEU HDx% A 44 THR H 1.0 . 5.50 346 346 A 113 LEU HDx% A 48 ALA H 1.0 . 3.97 347 347 A 113 LEU HDx% A 110 GLN H 1.0 . 5.50 348 348 A 59 LEU HDx% A 59 LEU H 1.0 . 4.25 349 349 A 110 GLN HE2x A 113 LEU HDx% 1.0 . 3.66 350 350 A 59 LEU HDx% A 70 HIS H 1.0 . 4.93 351 351 A 59 LEU HDx% A 70 HIS H 1.0 . 5.17 352 352 A 59 LEU HDx% A 69 HIS H 1.0 . 4.92 353 353 A 113 LEU HDx% A 110 GLN HE2y 1.0 . 4.41 354 354 A 59 LEU HDx% A 57 LYS HA 1.0 . 5.42 355 355 A 59 LEU HDx% A 68 LEU HA 1.0 . 5.50 356 356 A 113 LEU HDx% A 46 ARG HA 1.0 . 3.39 357 357 A 59 LEU HDx% A 56 ALA HA 1.0 . 3.73 358 358 A 59 LEU HDx% A 56 ALA HA 1.0 . 4.26 359 359 A 113 LEU HDx% A 45 ASN HBx 1.0 . 4.95 360 360 A 113 LEU HBx A 113 LEU HDx% 1.0 . 3.60 361 361 A 113 LEU HBx A 113 LEU HDx% 1.0 . 3.73 362 362 A 113 LEU HBy A 113 LEU HDx% 1.0 . 3.75 363 363 A 113 LEU HBy A 113 LEU HDx% 1.0 . 3.53 364 364 A 59 LEU HDx% A 68 LEU HG 1.0 . 3.63 365 365 A 59 LEU HDx% A 140 LEU HBx 1.0 . 3.89 366 366 A 59 LEU HDx% A 59 LEU HBx 1.0 . 3.71 367 367 A 59 LEU HDx% A 68 LEU HDx% 1.0 . 4.05 368 368 A 59 LEU HDx% A 68 LEU HDx% 1.0 . 4.40 369 369 A 115 LEU H A 112 MET HA 1.0 . 4.11 370 370 A 115 LEU HBx A 112 MET HA 1.0 . 3.70 371 371 A 115 LEU HBy A 112 MET HA 1.0 . 3.96 372 372 A 112 MET HA A 111 THR HG2% 1.0 . 4.86 373 373 A 112 MET HA A 111 THR HG2% 1.0 . 5.20 374 374 A 112 MET HA A 53 LEU HDx% 1.0 . 5.50 375 375 A 112 MET HBy A 53 LEU HDx% 1.0 . 4.05 376 376 A 114 ASN H A 111 THR HA 1.0 . 5.01 377 377 A 114 ASN HD2x A 111 THR HA 1.0 . 4.68 378 378 A 111 THR HA A 114 ASN HD2y 1.0 . 5.22 379 379 A 114 ASN HBy A 111 THR HA 1.0 . 4.04 380 380 A 114 ASN HBx A 111 THR HA 1.0 . 5.50 381 381 A 111 THR HA A 103 ILE HG2% 1.0 . 4.38 382 382 A 111 THR HA A 104 VAL HGy% 1.0 . 4.98 383 383 A 111 THR H A 111 THR HG2% 1.0 . 5.10 384 384 A 103 ILE HA A 111 THR HG2% 1.0 . 4.24 385 385 A 111 THR HA A 111 THR HG2% 1.0 . 3.07 386 386 A 114 ASN HBy A 111 THR HG2% 1.0 . 5.50 387 387 A 115 LEU HBx A 111 THR HG2% 1.0 . 4.84 388 388 A 112 MET HBy A 111 THR HG2% 1.0 . 5.17 389 389 A 103 ILE HB A 111 THR HG2% 1.0 . 4.79 390 390 A 111 THR HG2% A 103 ILE HD1% 1.0 . 3.26 391 391 A 110 GLN HBy A 104 VAL HGy% 1.0 . 4.73 392 392 A 110 GLN HGx A 110 GLN H 1.0 . 4.39 393 393 A 110 GLN HGx A 104 VAL HGy% 1.0 . 5.50 394 394 A 110 GLN HGx A 104 VAL HGy% 1.0 . 5.50 395 395 A 49 GLY HAx A 109 CYS HA 1.0 . 4.37 396 396 A 109 CYS HA A 112 MET HBy 1.0 . 4.12 397 397 A 50 CYS H A 109 CYS HBx 1.0 . 4.42 398 398 A 108 PRO HA A 111 THR HB 1.0 . 3.43 399 399 A 108 PRO HA A 53 LEU HDx% 1.0 . 5.50 400 400 A 108 PRO HA A 53 LEU HDx% 1.0 . 5.50 401 401 A 108 PRO HA A 53 LEU HDx% 1.0 . 5.50 402 402 A 111 THR HG2% A 108 PRO HA 1.0 . 5.50 403 403 A 111 THR HG2% A 108 PRO HA 1.0 . 5.50 404 404 A 53 LEU HDx% A 108 PRO HBy 1.0 . 3.52 405 405 A 53 LEU HDx% A 108 PRO HBy 1.0 . 3.95 406 406 A 107 ASP HA A 108 PRO HGy 1.0 . 4.54 407 407 A 107 ASP HA A 108 PRO HGx 1.0 . 4.99 408 408 A 53 LEU HDx% A 108 PRO HGy 1.0 . 5.17 409 409 A 53 LEU HDx% A 108 PRO HGy 1.0 . 5.39 410 410 A 107 ASP HA A 104 VAL HGx% 1.0 . 5.50 411 411 A 107 ASP HA A 104 VAL HGx% 1.0 . 5.50 412 412 A 104 VAL HGy% A 107 ASP HBy 1.0 . 5.34 413 413 A 104 VAL HGy% A 107 ASP HBy 1.0 . 5.50 414 414 A 107 ASP HBx A 110 GLN HBx 1.0 . 4.42 415 415 A 107 ASP HBy A 104 VAL HB 1.0 . 4.27 416 416 A 46 ARG HA A 45 ASN HA 1.0 . 4.43 417 417 A 106 ASP HA A 105 ALA HB% 1.0 . 4.40 418 418 A 104 VAL HGx% A 106 ASP HA 1.0 . 4.98 419 419 A 104 VAL HGx% A 106 ASP HA 1.0 . 5.50 420 420 A 106 ASP HA A 105 ALA HA 1.0 . 5.00 421 421 A 105 ALA HA A 104 VAL HA 1.0 . 4.62 422 422 A 105 ALA HA A 103 ILE HG2% 1.0 . 4.26 423 423 A 104 VAL HGx% A 105 ALA HA 1.0 . 5.50 424 424 A 104 VAL HGx% A 105 ALA HA 1.0 . 5.50 425 425 A 105 ALA HA A 105 ALA HB% 1.0 . 2.61 426 426 A 104 VAL HA A 105 ALA HB% 1.0 . 4.49 427 427 A 104 VAL HA A 102 THR HG2% 1.0 . 5.23 428 428 A 104 VAL HA A 102 THR HG2% 1.0 . 5.50 429 429 A 115 LEU HDy% A 119 PHE HA 1.0 . 5.50 430 430 A 19 CYS HA A 22 GLU HBy 1.0 . 3.74 431 431 A 104 VAL HGx% A 105 ALA H 1.0 . 4.97 432 432 A 104 VAL HGx% A 106 ASP H 1.0 . 3.53 433 433 A 104 VAL HGx% A 104 VAL HA 1.0 . 3.87 434 434 A 104 VAL HGx% A 104 VAL HA 1.0 . 4.11 435 435 A 104 VAL HGx% A 107 ASP HBx 1.0 . 3.94 436 436 A 104 VAL HGx% A 107 ASP HBx 1.0 . 3.83 437 437 A 104 VAL HGx% A 107 ASP HBy 1.0 . 3.57 438 438 A 104 VAL HGx% A 107 ASP HBy 1.0 . 3.77 439 439 A 104 VAL HGy% A 103 ILE H 1.0 . 5.50 440 440 A 104 VAL HGy% A 103 ILE H 1.0 . 5.50 441 441 A 104 VAL HGy% A 107 ASP H 1.0 . 4.78 442 442 A 104 VAL HGy% A 107 ASP H 1.0 . 5.50 443 443 A 110 GLN HE2y A 104 VAL HGy% 1.0 . 5.50 444 444 A 104 VAL HGy% A 104 VAL HA 1.0 . 4.16 445 445 A 104 VAL HGy% A 107 ASP HBx 1.0 . 4.27 446 446 A 104 VAL HGy% A 107 ASP HBx 1.0 . 4.60 447 447 A 110 GLN HGy A 104 VAL HGy% 1.0 . 3.52 448 448 A 104 VAL HGy% A 110 GLN HBx 1.0 . 3.88 449 449 A 104 VAL HGy% A 110 GLN HBx 1.0 . 4.33 450 450 A 104 VAL HGy% A 104 VAL HGx% 1.0 . 2.98 451 451 A 104 VAL HGy% A 104 VAL HGx% 1.0 . 3.09 452 452 A 103 ILE HA A 104 VAL HB 1.0 . 5.18 453 453 A 103 ILE HA A 111 THR HG2% 1.0 . 3.60 454 454 A 103 ILE HA A 102 THR HG2% 1.0 . 4.88 455 455 A 103 ILE HA A 102 THR HG2% 1.0 . 5.31 456 456 A 101 ILE HD1% A 103 ILE HA 1.0 . 3.55 457 457 A 103 ILE HB A 104 VAL H 1.0 . 4.70 458 458 A 103 ILE HB A 102 THR HA 1.0 . 4.67 459 459 A 103 ILE HA A 103 ILE HG1y 1.0 . 4.08 460 460 A 103 ILE HG1x A 103 ILE HA 1.0 . 4.01 461 461 A 101 ILE HD1% A 103 ILE HG1y 1.0 . 3.90 462 462 A 103 ILE HA A 102 THR HA 1.0 . 4.64 463 463 A 102 THR HA A 101 ILE HA 1.0 . 4.44 464 464 A 103 ILE HG1x A 102 THR HA 1.0 . 4.74 465 465 A 101 ILE HD1% A 102 THR HA 1.0 . 4.62 466 466 A 102 THR HA A 103 ILE HG1y 1.0 . 5.50 467 467 A 102 THR HB A 101 ILE HB 1.0 . 4.99 468 468 A 102 THR HB A 104 VAL HGy% 1.0 . 5.50 469 469 A 102 THR HG2% A 103 ILE H 1.0 . 3.00 470 470 A 114 ASN HD2y A 102 THR HG2% 1.0 . 4.48 471 471 A 102 THR HG2% A 102 THR HA 1.0 . 2.90 472 472 A 104 VAL HGy% A 102 THR HG2% 1.0 . 2.87 473 473 A 102 THR HB A 101 ILE HA 1.0 . 4.78 474 474 A 114 ASN HBy A 101 ILE HA 1.0 . 5.02 475 475 A 114 ASN HBx A 101 ILE HA 1.0 . 4.45 476 476 A 101 ILE HG1y A 101 ILE HA 1.0 . 3.88 477 477 A 114 ASN HBy A 101 ILE HB 1.0 . 4.39 478 478 A 114 ASN HBx A 101 ILE HB 1.0 . 3.99 479 479 A 115 LEU H A 101 ILE HG1x 1.0 . 4.97 480 480 A 115 LEU HA A 101 ILE HG1x 1.0 . 4.44 481 481 A 101 ILE HG1y A 103 ILE HA 1.0 . 5.25 482 482 A 115 LEU HBx A 101 ILE HG1x 1.0 . 5.50 483 483 A 103 ILE HG1x A 101 ILE HG1y 1.0 . 3.96 484 484 A 115 LEU HDy% A 101 ILE HG1x 1.0 . 3.78 485 485 A 119 PHE H A 101 ILE HG2% 1.0 . 5.50 486 486 A 119 PHE H A 101 ILE HG2% 1.0 . 5.50 487 487 A 101 ILE HG2% A 102 THR H 1.0 . 4.61 488 488 A 101 ILE HG2% A 114 ASN HD2x 1.0 . 5.50 489 489 A 101 ILE HG2% A 114 ASN HD2x 1.0 . 5.50 490 490 A 101 ILE HG2% A 118 CYS H 1.0 . 4.07 491 491 A 101 ILE HG2% A 101 ILE H 1.0 . 3.14 492 492 A 101 ILE HG2% A 99 LYS H 1.0 . 5.50 493 493 A 101 ILE HG2% A 97 CYS HA 1.0 . 3.84 494 494 A 101 ILE HG2% A 101 ILE HA 1.0 . 3.04 495 495 A 101 ILE HG2% A 115 LEU HA 1.0 . 3.10 496 496 A 101 ILE HG2% A 98 GLU HA 1.0 . 4.52 497 497 A 101 ILE HG2% A 98 GLU HA 1.0 . 5.16 498 498 A 101 ILE HG2% A 97 CYS HBy 1.0 . 5.34 499 499 A 101 ILE HG2% A 97 CYS HBy 1.0 . 5.50 500 500 A 118 CYS HBy A 101 ILE HG2% 1.0 . 3.47 501 501 A 118 CYS HBy A 101 ILE HG2% 1.0 . 3.82 502 502 A 101 ILE HG2% A 97 CYS HBx 1.0 . 3.55 503 503 A 101 ILE HG2% A 117 MET HGx 1.0 . 5.29 504 504 A 101 ILE HG2% A 101 ILE HG1x 1.0 . 3.15 505 505 A 101 ILE HG2% A 101 ILE HG1x 1.0 . 3.61 506 506 A 101 ILE HG2% A 101 ILE HD1% 1.0 . 3.39 507 507 A 99 LYS HA A 100 VAL HA 1.0 . 4.91 508 508 A 100 VAL HA A 100 VAL HGx% 1.0 . 3.79 509 509 A 100 VAL HA A 100 VAL HGy% 1.0 . 4.20 510 510 A 44 THR H A 44 THR HG2% 1.0 . 3.46 511 511 A 44 THR HG2% A 44 THR HB 1.0 . 2.95 512 512 A 44 THR HG2% A 43 ILE HA 1.0 . 4.27 513 513 A 44 THR HG2% A 42 GLN HBy 1.0 . 5.50 514 514 A 57 LYS HA A 58 LYS HA 1.0 . 4.72 515 515 A 4 VAL HGx% A 5 MET HA 1.0 . 5.50 516 516 A 4 VAL HGx% A 5 MET HA 1.0 . 5.50 517 517 A 99 LYS HA A 103 ILE HD1% 1.0 . 4.74 518 518 A 99 LYS H A 99 LYS HBy 1.0 . 3.72 519 519 A 100 VAL H A 99 LYS HBy 1.0 . 4.78 520 520 A 99 LYS H A 99 LYS HGy 1.0 . 4.25 521 521 A 57 LYS HA A 57 LYS HGy 1.0 . 3.99 522 522 A 98 GLU HA A 98 GLU HGy 1.0 . 3.86 523 523 A 101 ILE HG1x A 98 GLU HA 1.0 . 3.58 524 524 A 101 ILE HG1y A 98 GLU HA 1.0 . 4.08 525 525 A 98 GLU H A 98 GLU HBy 1.0 . 3.78 526 526 A 99 LYS H A 98 GLU HBx 1.0 . 4.57 527 527 A 115 LEU HDy% A 98 GLU HBy 1.0 . 5.24 528 528 A 115 LEU HDy% A 98 GLU HBy 1.0 . 5.50 529 529 A 97 CYS HA A 100 VAL H 1.0 . 4.10 530 530 A 118 CYS HBx A 97 CYS HA 1.0 . 4.84 531 531 A 97 CYS HA A 100 VAL HB 1.0 . 4.83 532 532 A 97 CYS HA A 100 VAL HGx% 1.0 . 4.30 533 533 A 97 CYS HBx A 94 LYS HA 1.0 . 4.25 534 534 A 97 CYS HBx A 118 CYS HBx 1.0 . 4.04 535 535 A 97 CYS HBy A 118 CYS HBx 1.0 . 4.51 536 536 A 99 LYS H A 96 SER HA 1.0 . 4.70 537 537 A 96 SER HA A 96 SER HBy 1.0 . 2.95 538 538 A 93 ILE HG1y A 96 SER HBx 1.0 . 5.41 539 539 A 96 SER HBx A 99 LYS HDx 1.0 . 5.50 540 540 A 96 SER HBx A 99 LYS HDy 1.0 . 5.50 541 541 A 95 HIS HA A 95 HIS HD2 1.0 . 4.47 542 542 A 95 HIS HA A 98 GLU HGy 1.0 . 4.31 543 543 A 95 HIS HA A 98 GLU HBy 1.0 . 4.24 544 544 A 95 HIS HA A 98 GLU HGx 1.0 . 4.31 545 545 A 95 HIS HA A 98 GLU HBx 1.0 . 4.24 546 546 A 119 PHE HEy A 94 LYS HA 1.0 . 5.50 547 547 A 119 PHE HDy A 94 LYS HA 1.0 . 3.79 548 548 A 119 PHE HA A 94 LYS HA 1.0 . 4.35 549 549 A 97 CYS HBy A 94 LYS HA 1.0 . 3.82 550 550 A 119 PHE HBx A 94 LYS HA 1.0 . 5.01 551 551 A 119 PHE HBy A 94 LYS HA 1.0 . 4.87 552 552 A 94 LYS HA A 94 LYS HGy 1.0 . 4.23 553 553 A 93 ILE HG2% A 94 LYS HA 1.0 . 4.00 554 554 A 25 VAL HB A 29 VAL HGx% 1.0 . 3.88 555 555 A 93 ILE HA A 97 CYS H 1.0 . 4.59 556 556 A 96 SER HBx A 93 ILE HA 1.0 . 3.81 557 557 A 96 SER HBy A 93 ILE HA 1.0 . 3.94 558 558 A 93 ILE HG1y A 93 ILE HA 1.0 . 3.49 559 559 A 93 ILE HA A 93 ILE HG1x 1.0 . 3.48 560 560 A 93 ILE HB A 90 LEU HA 1.0 . 3.94 561 561 A 93 ILE HG1y A 93 ILE H 1.0 . 3.73 562 562 A 93 ILE HG2% A 93 ILE HG1y 1.0 . 3.91 563 563 A 93 ILE HG2% A 93 ILE HG1x 1.0 . 4.18 564 564 A 93 ILE HG2% A 119 PHE H 1.0 . 5.14 565 565 A 93 ILE HG2% A 93 ILE H 1.0 . 4.85 566 566 A 93 ILE HG2% A 93 ILE H 1.0 . 5.19 567 567 A 119 PHE HEy A 93 ILE HG2% 1.0 . 4.35 568 568 A 119 PHE HEy A 93 ILE HG2% 1.0 . 4.73 569 569 A 93 ILE HG2% A 119 PHE HDy 1.0 . 3.33 570 570 A 119 PHE HA A 93 ILE HG2% 1.0 . 3.30 571 571 A 93 ILE HG2% A 93 ILE HA 1.0 . 3.30 572 572 A 119 PHE HBx A 93 ILE HG2% 1.0 . 4.75 573 573 A 119 PHE HBy A 93 ILE HG2% 1.0 . 4.64 574 574 A 93 ILE HG2% A 122 GLU HGy 1.0 . 4.08 575 575 A 93 ILE HG2% A 122 GLU HGx 1.0 . 4.08 576 576 A 122 GLU HBy A 93 ILE HG2% 1.0 . 3.06 577 577 A 123 ILE HG2% A 93 ILE HG2% 1.0 . 3.68 578 578 A 93 ILE HD1% A 93 ILE HG2% 1.0 . 2.77 579 579 A 53 LEU HA A 53 LEU HDy% 1.0 . 3.96 580 580 A 74 MET H A 91 LEU HDx% 1.0 . 4.65 581 581 A 91 LEU HDx% A 92 ASP H 1.0 . 5.50 582 582 A 91 LEU HDx% A 92 ASP H 1.0 . 5.50 583 583 A 91 LEU HDx% A 88 LYS HA 1.0 . 3.85 584 584 A 91 LEU HDx% A 88 LYS HA 1.0 . 4.02 585 585 A 91 LEU HDx% A 91 LEU HA 1.0 . 4.89 586 586 A 138 GLU HBy A 91 LEU HDx% 1.0 . 5.50 587 587 A 138 GLU HBy A 91 LEU HDx% 1.0 . 5.50 588 588 A 138 GLU HBx A 91 LEU HDx% 1.0 . 4.01 589 589 A 138 GLU HBx A 91 LEU HDx% 1.0 . 4.26 590 590 A 91 LEU HDx% A 91 LEU HBy 1.0 . 3.53 591 591 A 91 LEU HDx% A 91 LEU HBy 1.0 . 3.67 592 592 A 91 LEU HDx% A 73 ALA HB% 1.0 . 3.07 593 593 A 92 ASP H A 91 LEU HDy% 1.0 . 5.50 594 594 A 74 MET H A 91 LEU HDy% 1.0 . 4.70 595 595 A 139 LEU H A 91 LEU HDy% 1.0 . 5.50 596 596 A 142 ASP HA A 91 LEU HDy% 1.0 . 5.50 597 597 A 142 ASP HA A 91 LEU HDy% 1.0 . 5.50 598 598 A 142 ASP HA A 91 LEU HDy% 1.0 . 5.50 599 599 A 91 LEU HA A 91 LEU HDy% 1.0 . 3.98 600 600 A 91 LEU HA A 91 LEU HDy% 1.0 . 4.30 601 601 A 142 ASP HBy A 91 LEU HDy% 1.0 . 3.57 602 602 A 142 ASP HBx A 91 LEU HDy% 1.0 . 3.97 603 603 A 142 ASP HBx A 91 LEU HDy% 1.0 . 4.51 604 604 A 138 GLU HBx A 91 LEU HDy% 1.0 . 3.55 605 605 A 91 LEU HBy A 91 LEU HDy% 1.0 . 3.50 606 606 A 91 LEU HDy% A 91 LEU HBx 1.0 . 3.31 607 607 A 91 LEU HDx% A 91 LEU HDy% 1.0 . 3.47 608 608 A 123 ILE HG2% A 90 LEU HA 1.0 . 5.29 609 609 A 123 ILE HG2% A 90 LEU HA 1.0 . 5.50 610 610 A 123 ILE HG2% A 90 LEU HA 1.0 . 5.50 611 611 A 138 GLU H A 90 LEU HDx% 1.0 . 4.49 612 612 A 90 LEU HDx% A 119 PHE HZ 1.0 . 4.44 613 613 A 90 LEU HDx% A 119 PHE HZ 1.0 . 4.73 614 614 A 90 LEU HDx% A 128 TRP HH2 1.0 . 4.59 615 615 A 90 LEU HDx% A 128 TRP HH2 1.0 . 4.76 616 616 A 90 LEU HDx% A 134 VAL HA 1.0 . 5.50 617 617 A 138 GLU HA A 90 LEU HDx% 1.0 . 5.50 618 618 A 90 LEU HDx% A 135 ALA HA 1.0 . 3.67 619 619 A 90 LEU HDx% A 135 ALA HA 1.0 . 3.78 620 620 A 90 LEU HDx% A 138 GLU HGx 1.0 . 4.88 621 621 A 90 LEU HDx% A 123 ILE HG2% 1.0 . 4.83 622 622 A 86 MET HA A 89 GLN HA 1.0 . 4.97 623 623 A 89 GLN HA A 92 ASP HBy 1.0 . 3.77 624 624 A 89 GLN HA A 92 ASP HBx 1.0 . 3.77 625 625 A 89 GLN HGx A 89 GLN HA 1.0 . 3.62 626 626 A 86 MET HA A 89 GLN HBx 1.0 . 4.29 627 627 A 93 ILE HD1% A 89 GLN HBx 1.0 . 5.50 628 628 A 89 GLN HGy A 89 GLN H 1.0 . 4.38 629 629 A 89 GLN HGy A 89 GLN HA 1.0 . 3.74 630 630 A 17 GLU HA A 17 GLU HGx 1.0 . 4.15 631 631 A 122 GLU HA A 121 ALA HB% 1.0 . 4.66 632 632 A 122 GLU HA A 125 LYS HGy 1.0 . 5.17 633 633 A 88 LYS HA A 91 LEU HBx 1.0 . 4.65 634 634 A 88 LYS H A 88 LYS HBy 1.0 . 3.71 635 635 A 87 ALA HA A 90 LEU H 1.0 . 4.76 636 636 A 86 MET HA A 87 ALA HA 1.0 . 5.15 637 637 A 87 ALA HA A 90 LEU HG 1.0 . 5.05 638 638 A 87 ALA HA A 82 ALA HB% 1.0 . 4.68 639 639 A 90 LEU HDx% A 87 ALA HA 1.0 . 4.56 640 640 A 87 ALA HB% A 88 LYS H 1.0 . 3.41 641 641 A 79 LYS H A 77 ALA HB% 1.0 . 5.50 642 642 A 87 ALA HB% A 83 ASP H 1.0 . 5.50 643 643 A 76 PHE HDy A 77 ALA HB% 1.0 . 4.39 644 644 A 87 ALA HB% A 83 ASP HA 1.0 . 5.10 645 645 A 73 ALA HA A 77 ALA HB% 1.0 . 3.80 646 646 A 87 ALA HB% A 74 MET HA 1.0 . 3.10 647 647 A 77 ALA HB% A 138 GLU HGy 1.0 . 4.27 648 648 A 78 MET HGx A 87 ALA HB% 1.0 . 3.71 649 649 A 77 ALA HB% A 138 GLU HGx 1.0 . 4.27 650 650 A 138 GLU HBy A 77 ALA HB% 1.0 . 5.48 651 651 A 138 GLU HBy A 77 ALA HB% 1.0 . 5.50 652 652 A 77 ALA HB% A 134 VAL HGy% 1.0 . 3.18 653 653 A 77 ALA HB% A 134 VAL HGy% 1.0 . 3.23 654 654 A 77 ALA HB% A 82 ALA HB% 1.0 . 3.66 655 655 A 87 ALA HB% A 82 ALA HB% 1.0 . 3.86 656 656 A 128 TRP HZ2 A 86 MET HA 1.0 . 4.26 657 657 A 128 TRP HH2 A 86 MET HA 1.0 . 5.36 658 658 A 86 MET HA A 89 GLN HBy 1.0 . 4.29 659 659 A 86 MET HA A 86 MET HGy 1.0 . 3.93 660 660 A 86 MET HA A 85 ALA HB% 1.0 . 4.33 661 661 A 86 MET HA A 86 MET HGx 1.0 . 3.93 662 662 A 86 MET H A 86 MET HGy 1.0 . 3.77 663 663 A 33 PHE H A 48 ALA HB% 1.0 . 4.92 664 664 A 45 ASN HBx A 48 ALA HB% 1.0 . 4.02 665 665 A 48 ALA HB% A 52 ILE HD1% 1.0 . 4.73 666 666 A 113 LEU HDx% A 48 ALA HB% 1.0 . 3.44 667 667 A 48 ALA HB% A 43 ILE HG2% 1.0 . 3.69 668 668 A 84 GLU HBy A 85 ALA H 1.0 . 4.82 669 669 A 84 GLU HA A 84 GLU HGx 1.0 . 3.91 670 670 A 84 GLU HA A 84 GLU HGy 1.0 . 3.91 671 671 A 85 ALA HB% A 84 GLU HGx 1.0 . 4.62 672 672 A 85 ALA HB% A 84 GLU HGy 1.0 . 4.62 673 673 A 78 MET HGy A 83 ASP HA 1.0 . 4.47 674 674 A 83 ASP HA A 84 GLU HBx 1.0 . 4.77 675 675 A 82 ALA HA A 86 MET HBy 1.0 . 4.56 676 676 A 82 ALA HA A 86 MET HBx 1.0 . 4.56 677 677 A 82 ALA HA A 134 VAL HGy% 1.0 . 5.50 678 678 A 82 ALA HA A 134 VAL HGy% 1.0 . 5.50 679 679 A 87 ALA HB% A 82 ALA HA 1.0 . 5.50 680 680 A 88 LYS H A 82 ALA HB% 1.0 . 5.50 681 681 A 83 ASP H A 82 ALA HB% 1.0 . 3.27 682 682 A 82 ALA HB% A 80 HIS H 1.0 . 4.74 683 683 A 128 TRP HH2 A 82 ALA HB% 1.0 . 4.56 684 684 A 82 ALA HB% A 78 MET HA 1.0 . 3.96 685 685 A 83 ASP HA A 82 ALA HB% 1.0 . 4.98 686 686 A 86 MET HA A 82 ALA HB% 1.0 . 5.49 687 687 A 78 MET HGx A 82 ALA HB% 1.0 . 5.04 688 688 A 78 MET HGx A 82 ALA HB% 1.0 . 5.50 689 689 A 78 MET HGy A 82 ALA HB% 1.0 . 4.68 690 690 A 78 MET HGy A 82 ALA HB% 1.0 . 5.12 691 691 A 82 ALA HB% A 86 MET HBy 1.0 . 4.11 692 692 A 82 ALA HB% A 86 MET HBx 1.0 . 4.11 693 693 A 80 HIS HA A 80 HIS HD2 1.0 . 4.69 694 694 A 80 HIS HA A 134 VAL HGx% 1.0 . 5.50 695 695 A 79 LYS H A 79 LYS HBx 1.0 . 3.66 696 696 A 80 HIS HD2 A 79 LYS HBy 1.0 . 4.95 697 697 A 80 HIS HD2 A 79 LYS HBx 1.0 . 4.95 698 698 A 78 MET HGx A 78 MET HA 1.0 . 3.89 699 699 A 78 MET HGy A 78 MET HA 1.0 . 3.60 700 700 A 77 ALA HB% A 78 MET HA 1.0 . 4.92 701 701 A 87 ALA HB% A 78 MET HA 1.0 . 5.14 702 702 A 25 VAL HB A 26 PRO HDx 1.0 . 3.78 703 703 A 91 LEU HDx% A 74 MET HGx 1.0 . 5.11 704 704 A 91 LEU HDx% A 74 MET HGy 1.0 . 5.11 705 705 A 80 HIS H A 77 ALA HA 1.0 . 4.76 706 706 A 76 PHE HDy A 77 ALA HA 1.0 . 4.77 707 707 A 134 VAL HA A 77 ALA HA 1.0 . 4.79 708 708 A 134 VAL HB A 77 ALA HA 1.0 . 5.50 709 709 A 82 ALA HB% A 77 ALA HA 1.0 . 4.70 710 710 A 82 ALA HB% A 77 ALA HA 1.0 . 5.32 711 711 A 87 ALA HB% A 85 ALA H 1.0 . 5.50 712 712 A 87 ALA HB% A 85 ALA H 1.0 . 5.50 713 713 A 77 ALA HB% A 82 ALA H 1.0 . 5.50 714 714 A 77 ALA HB% A 82 ALA H 1.0 . 5.50 715 715 A 87 ALA HB% A 82 ALA H 1.0 . 5.50 716 716 A 76 PHE HA A 76 PHE HDx 1.0 . 3.89 717 717 A 79 LYS H A 76 PHE HA 1.0 . 4.65 718 718 A 76 PHE HA A 67 ASN HBx 1.0 . 4.76 719 719 A 44 THR HG2% A 44 THR HA 1.0 . 3.44 720 720 A 44 THR HG2% A 44 THR HA 1.0 . 3.66 721 721 A 113 LEU HDx% A 44 THR HA 1.0 . 3.49 722 722 A 74 MET H A 75 GLU HA 1.0 . 5.46 723 723 A 75 GLU HA A 75 GLU HGy 1.0 . 4.02 724 724 A 75 GLU HA A 75 GLU HGx 1.0 . 4.02 725 725 A 75 GLU H A 75 GLU HBx 1.0 . 3.91 726 726 A 20 LYS HA A 30 MET HBx 1.0 . 4.31 727 727 A 74 MET HA A 77 ALA H 1.0 . 4.77 728 728 A 74 MET HA A 74 MET HGy 1.0 . 4.09 729 729 A 74 MET HA A 74 MET HGx 1.0 . 4.09 730 730 A 75 GLU H A 74 MET HBx 1.0 . 4.15 731 731 A 87 ALA HB% A 74 MET HBy 1.0 . 5.50 732 732 A 87 ALA HB% A 74 MET HBx 1.0 . 5.26 733 733 A 87 ALA HB% A 74 MET HBx 1.0 . 5.50 734 734 A 73 ALA HA A 76 PHE H 1.0 . 4.58 735 735 A 76 PHE HDy A 73 ALA HA 1.0 . 4.78 736 736 A 76 PHE HBx A 73 ALA HA 1.0 . 3.98 737 737 A 138 GLU HBx A 73 ALA HA 1.0 . 5.50 738 738 A 141 ALA HB% A 73 ALA HA 1.0 . 4.54 739 739 A 141 ALA HB% A 73 ALA HA 1.0 . 5.18 740 740 A 141 ALA HB% A 73 ALA HA 1.0 . 5.05 741 741 A 141 ALA H A 73 ALA HB% 1.0 . 5.50 742 742 A 138 GLU H A 73 ALA HB% 1.0 . 4.54 743 743 A 142 ASP H A 73 ALA HB% 1.0 . 4.29 744 744 A 76 PHE HDy A 73 ALA HB% 1.0 . 5.02 745 745 A 76 PHE HDy A 73 ALA HB% 1.0 . 5.50 746 746 A 142 ASP HA A 73 ALA HB% 1.0 . 5.50 747 747 A 73 ALA HB% A 72 LYS HA 1.0 . 5.50 748 748 A 73 ALA HB% A 72 LYS HA 1.0 . 5.50 749 749 A 74 MET HA A 73 ALA HB% 1.0 . 4.10 750 750 A 138 GLU HA A 73 ALA HB% 1.0 . 3.00 751 751 A 73 ALA HB% A 138 GLU HGy 1.0 . 3.97 752 752 A 73 ALA HB% A 138 GLU HGx 1.0 . 3.97 753 753 A 138 GLU HBy A 73 ALA HB% 1.0 . 4.12 754 754 A 138 GLU HBx A 73 ALA HB% 1.0 . 3.60 755 755 A 74 MET HBy A 73 ALA HB% 1.0 . 5.21 756 756 A 141 ALA HB% A 73 ALA HB% 1.0 . 3.18 757 757 A 141 ALA HB% A 73 ALA HB% 1.0 . 3.44 758 758 A 77 ALA HB% A 73 ALA HB% 1.0 . 3.45 759 759 A 91 LEU HDy% A 73 ALA HB% 1.0 . 3.29 760 760 A 72 LYS H A 72 LYS HBx 1.0 . 4.19 761 761 A 72 LYS HA A 72 LYS HDx 1.0 . 4.66 762 762 A 141 ALA HA A 70 HIS HA 1.0 . 3.81 763 763 A 141 ALA HB% A 70 HIS HA 1.0 . 4.56 764 764 A 141 ALA HB% A 70 HIS HA 1.0 . 5.06 765 765 A 59 LEU HDx% A 70 HIS HA 1.0 . 4.68 766 766 A 59 LEU HDx% A 70 HIS HA 1.0 . 4.61 767 767 A 69 HIS HA A 59 LEU HBy 1.0 . 5.16 768 768 A 69 HIS HA A 59 LEU HBx 1.0 . 5.16 769 769 A 59 LEU HDx% A 69 HIS HA 1.0 . 4.14 770 770 A 68 LEU HDy% A 68 LEU HA 1.0 . 3.85 771 771 A 76 PHE HA A 67 ASN HBy 1.0 . 4.76 772 772 A 67 ASN HBx A 79 LYS HBy 1.0 . 5.50 773 773 A 67 ASN HBx A 79 LYS HBx 1.0 . 5.50 774 774 A 67 ASN HBy A 79 LYS HBy 1.0 . 5.50 775 775 A 79 LYS HBx A 67 ASN HBy 1.0 . 5.50 776 776 A 65 ASP HA A 67 ASN H 1.0 . 4.35 777 777 A 63 ASP HA A 64 GLN HBy 1.0 . 4.97 778 778 A 65 ASP H A 65 ASP HBy 1.0 . 3.71 779 779 A 66 MET HBx A 65 ASP HBy 1.0 . 4.99 780 780 A 66 MET HBx A 65 ASP HBx 1.0 . 4.99 781 781 A 63 ASP HA A 64 GLN HA 1.0 . 4.35 782 782 A 90 LEU HA A 91 LEU HA 1.0 . 4.74 783 783 A 89 GLN HGy A 90 LEU HA 1.0 . 4.48 784 784 A 64 GLN HA A 64 GLN HGy 1.0 . 3.49 785 785 A 64 GLN HGy A 64 GLN H 1.0 . 4.45 786 786 A 65 ASP HA A 64 GLN HGy 1.0 . 4.23 787 787 A 63 ASP HA A 65 ASP H 1.0 . 4.23 788 788 A 63 ASP HA A 64 GLN HBx 1.0 . 4.97 789 789 A 64 GLN H A 63 ASP HBx 1.0 . 4.50 790 790 A 66 MET H A 63 ASP HBx 1.0 . 5.05 791 791 A 66 MET H A 63 ASP HBy 1.0 . 5.05 792 792 A 61 LEU HA A 61 LEU HG 1.0 . 3.99 793 793 A 61 LEU H A 61 LEU HBx 1.0 . 3.87 794 794 A 15 PRO HDy A 61 LEU HBy 1.0 . 4.45 795 795 A 61 LEU HBx A 15 PRO HDy 1.0 . 4.50 796 796 A 53 LEU HDx% A 53 LEU HBy 1.0 . 3.76 797 797 A 61 LEU H A 61 LEU HDx% 1.0 . 5.10 798 798 A 61 LEU H A 61 LEU HDx% 1.0 . 5.38 799 799 A 58 LYS HA A 61 LEU HDx% 1.0 . 4.59 800 800 A 61 LEU HDx% A 15 PRO HA 1.0 . 3.41 801 801 A 61 LEU HDx% A 15 PRO HA 1.0 . 3.63 802 802 A 61 LEU HDx% A 15 PRO HDx 1.0 . 4.75 803 803 A 15 PRO HDy A 61 LEU HDx% 1.0 . 4.46 804 804 A 61 LEU HDx% A 58 LYS HEx 1.0 . 5.34 805 805 A 61 LEU HDx% A 58 LYS HBx 1.0 . 3.38 806 806 A 61 LEU HDx% A 14 LYS HBx 1.0 . 4.33 807 807 A 61 LEU HDx% A 14 LYS HBy 1.0 . 4.33 808 808 A 61 LEU HBx A 61 LEU HDx% 1.0 . 3.04 809 809 A 61 LEU HBy A 61 LEU HDx% 1.0 . 3.06 810 810 A 61 LEU HBy A 61 LEU HDx% 1.0 . 3.43 811 811 A 60 GLU HA A 62 LEU H 1.0 . 4.61 812 812 A 60 GLU HA A 60 GLU HGx 1.0 . 4.17 813 813 A 60 GLU H A 60 GLU HGx 1.0 . 3.92 814 814 A 60 GLU HA A 60 GLU HGy 1.0 . 4.17 815 815 A 56 ALA HA A 59 LEU HG 1.0 . 5.16 816 816 A 58 LYS HA A 61 LEU HDy% 1.0 . 5.50 817 817 A 15 PRO HA A 58 LYS HBy 1.0 . 4.71 818 818 A 15 PRO HA A 58 LYS HBx 1.0 . 4.42 819 819 A 58 LYS HBy A 55 LEU HBx 1.0 . 5.28 820 820 A 61 LEU HDx% A 58 LYS HBy 1.0 . 5.50 821 821 A 58 LYS HBy A 61 LEU HDy% 1.0 . 5.50 822 822 A 58 LYS HBx A 61 LEU HDy% 1.0 . 4.58 823 823 A 78 MET H A 78 MET HBx 1.0 . 3.83 824 824 A 57 LYS HA A 57 LYS HDx 1.0 . 5.50 825 825 A 57 LYS HA A 57 LYS HDy 1.0 . 5.50 826 826 A 72 LYS H A 72 LYS HEx 1.0 . 5.50 827 827 A 72 LYS H A 72 LYS HEy 1.0 . 5.50 828 828 A 57 LYS HA A 57 LYS HGx 1.0 . 3.99 829 829 A 140 LEU HBy A 56 ALA HA 1.0 . 4.21 830 830 A 140 LEU HBx A 56 ALA HA 1.0 . 3.91 831 831 A 56 ALA HA A 140 LEU HDy% 1.0 . 4.63 832 832 A 56 ALA HB% A 55 LEU H 1.0 . 5.50 833 833 A 56 ALA HB% A 55 LEU H 1.0 . 5.50 834 834 A 56 ALA HB% A 56 ALA H 1.0 . 3.06 835 835 A 56 ALA HB% A 56 ALA H 1.0 . 3.35 836 836 A 56 ALA HB% A 143 THR H 1.0 . 4.60 837 837 A 56 ALA HB% A 57 LYS HA 1.0 . 5.30 838 838 A 56 ALA HB% A 57 LYS HA 1.0 . 5.50 839 839 A 56 ALA HB% A 143 THR HB 1.0 . 3.31 840 840 A 140 LEU HA A 56 ALA HB% 1.0 . 3.20 841 841 A 140 LEU HA A 56 ALA HB% 1.0 . 3.10 842 842 A 56 ALA HB% A 140 LEU HG 1.0 . 4.98 843 843 A 56 ALA HB% A 140 LEU HG 1.0 . 4.57 844 844 A 56 ALA HB% A 143 THR HG2% 1.0 . 3.41 845 845 A 56 ALA HB% A 143 THR HG2% 1.0 . 3.61 846 846 A 56 ALA HB% A 140 LEU HDy% 1.0 . 3.33 847 847 A 54 CYS HA A 55 LEU HA 1.0 . 5.08 848 848 A 58 LYS HBx A 55 LEU HA 1.0 . 4.35 849 849 A 55 LEU HA A 15 PRO HBy 1.0 . 4.34 850 850 A 58 LYS HBy A 55 LEU HA 1.0 . 3.57 851 851 A 55 LEU HA A 55 LEU HG 1.0 . 3.95 852 852 A 55 LEU HA A 55 LEU HDy% 1.0 . 5.50 853 853 A 55 LEU HA A 55 LEU HDy% 1.0 . 5.50 854 854 A 55 LEU HA A 55 LEU HDy% 1.0 . 5.50 855 855 A 55 LEU HA A 59 LEU HDy% 1.0 . 5.39 856 856 A 56 ALA H A 55 LEU HBy 1.0 . 4.35 857 857 A 55 LEU HBx A 56 ALA H 1.0 . 4.69 858 858 A 55 LEU HG A 52 ILE HA 1.0 . 4.78 859 859 A 53 LEU HA A 54 CYS HA 1.0 . 5.10 860 860 A 54 CYS HA A 53 LEU HG 1.0 . 5.35 861 861 A 54 CYS HA A 57 LYS HDx 1.0 . 5.50 862 862 A 54 CYS HA A 57 LYS HDy 1.0 . 5.50 863 863 A 54 CYS HA A 23 LEU HDx% 1.0 . 4.80 864 864 A 55 LEU H A 54 CYS HBy 1.0 . 4.36 865 865 A 54 CYS H A 54 CYS HBy 1.0 . 3.64 866 866 A 23 LEU HDy% A 54 CYS HBx 1.0 . 4.88 867 867 A 23 LEU HDy% A 54 CYS HBx 1.0 . 5.44 868 868 A 23 LEU HDy% A 54 CYS HBy 1.0 . 4.88 869 869 A 23 LEU HDy% A 54 CYS HBy 1.0 . 5.44 870 870 A 53 LEU H A 53 LEU HBy 1.0 . 3.83 871 871 A 52 ILE HA A 33 PHE HEy 1.0 . 4.66 872 872 A 52 ILE HA A 33 PHE HDy 1.0 . 4.72 873 873 A 52 ILE HA A 52 ILE HG1x 1.0 . 3.85 874 874 A 55 LEU HBy A 52 ILE HA 1.0 . 4.11 875 875 A 52 ILE HA A 51 VAL HGy% 1.0 . 4.38 876 876 A 52 ILE HA A 52 ILE HG1y 1.0 . 3.72 877 877 A 140 LEU HDy% A 52 ILE HA 1.0 . 4.28 878 878 A 55 LEU HDy% A 52 ILE HA 1.0 . 4.42 879 879 A 55 LEU HDy% A 52 ILE HA 1.0 . 5.08 880 880 A 54 CYS H A 52 ILE HG2% 1.0 . 5.39 881 881 A 56 ALA H A 52 ILE HG2% 1.0 . 5.50 882 882 A 53 LEU H A 52 ILE HG2% 1.0 . 3.45 883 883 A 55 LEU H A 52 ILE HG2% 1.0 . 5.50 884 884 A 55 LEU H A 52 ILE HG2% 1.0 . 5.50 885 885 A 33 PHE HEy A 52 ILE HG2% 1.0 . 5.48 886 886 A 33 PHE HEy A 52 ILE HG2% 1.0 . 5.50 887 887 A 33 PHE HDy A 52 ILE HG2% 1.0 . 5.50 888 888 A 33 PHE HDy A 52 ILE HG2% 1.0 . 5.50 889 889 A 116 ALA HA A 52 ILE HG2% 1.0 . 5.50 890 890 A 53 LEU HA A 52 ILE HG2% 1.0 . 4.41 891 891 A 53 LEU HA A 52 ILE HG2% 1.0 . 4.56 892 892 A 49 GLY HAy A 52 ILE HG2% 1.0 . 4.92 893 893 A 49 GLY HAy A 52 ILE HG2% 1.0 . 5.23 894 894 A 52 ILE HA A 52 ILE HG2% 1.0 . 3.21 895 895 A 52 ILE HG2% A 112 MET HBx 1.0 . 4.26 896 896 A 52 ILE HD1% A 52 ILE HG2% 1.0 . 3.59 897 897 A 52 ILE HD1% A 52 ILE HG2% 1.0 . 4.10 898 898 A 55 LEU H A 51 VAL HA 1.0 . 4.69 899 899 A 51 VAL HA A 23 LEU HG 1.0 . 5.50 900 900 A 23 LEU HDy% A 51 VAL HA 1.0 . 4.27 901 901 A 51 VAL HA A 23 LEU HDx% 1.0 . 3.58 902 902 A 51 VAL HB A 52 ILE H 1.0 . 4.23 903 903 A 51 VAL HB A 48 ALA HA 1.0 . 4.94 904 904 A 51 VAL H A 51 VAL HGy% 1.0 . 4.31 905 905 A 33 PHE H A 51 VAL HGy% 1.0 . 5.50 906 906 A 54 CYS H A 51 VAL HGy% 1.0 . 5.50 907 907 A 55 LEU H A 51 VAL HGy% 1.0 . 4.98 908 908 A 55 LEU H A 51 VAL HGy% 1.0 . 5.50 909 909 A 51 VAL HGy% A 33 PHE HDx 1.0 . 5.50 910 910 A 51 VAL HGy% A 33 PHE HDx 1.0 . 5.24 911 911 A 51 VAL HGy% A 33 PHE HEx 1.0 . 5.50 912 912 A 30 MET HA A 51 VAL HGy% 1.0 . 3.95 913 913 A 51 VAL HA A 51 VAL HGy% 1.0 . 3.30 914 914 A 33 PHE HBy A 51 VAL HGy% 1.0 . 4.05 915 915 A 51 VAL HGy% A 19 CYS HBx 1.0 . 5.50 916 916 A 51 VAL HGy% A 30 MET HBy 1.0 . 4.87 917 917 A 52 ILE HG1x A 51 VAL HGy% 1.0 . 4.54 918 918 A 55 LEU HG A 51 VAL HGy% 1.0 . 4.47 919 919 A 55 LEU HG A 51 VAL HGy% 1.0 . 4.89 920 920 A 55 LEU HDy% A 51 VAL HGy% 1.0 . 4.00 921 921 A 51 VAL H A 50 CYS HBx 1.0 . 4.69 922 922 A 50 CYS HBy A 23 LEU HDx% 1.0 . 4.83 923 923 A 50 CYS HBx A 23 LEU HDx% 1.0 . 4.73 924 924 A 49 GLY HAy A 48 ALA HA 1.0 . 5.32 925 925 A 109 CYS HA A 49 GLY HAy 1.0 . 5.50 926 926 A 49 GLY HAx A 112 MET HBy 1.0 . 4.58 927 927 A 49 GLY HAx A 112 MET HBx 1.0 . 5.06 928 928 A 49 GLY HAx A 113 LEU HBx 1.0 . 5.46 929 929 A 49 GLY HAy A 52 ILE HG1x 1.0 . 5.37 930 930 A 49 GLY HAy A 112 MET HBy 1.0 . 5.50 931 931 A 49 GLY HAy A 112 MET HBx 1.0 . 4.74 932 932 A 49 GLY HAy A 52 ILE HB 1.0 . 4.45 933 933 A 49 GLY HAy A 113 LEU HBy 1.0 . 4.68 934 934 A 49 GLY HAx A 113 LEU HBy 1.0 . 4.71 935 935 A 49 GLY HAy A 113 LEU HDx% 1.0 . 5.50 936 936 A 49 GLY HAy A 113 LEU HDx% 1.0 . 5.50 937 937 A 50 CYS H A 48 ALA HA 1.0 . 4.85 938 938 A 48 ALA HA A 50 CYS HBy 1.0 . 5.50 939 939 A 48 ALA HA A 51 VAL HGy% 1.0 . 5.50 940 940 A 48 ALA HA A 51 VAL HGy% 1.0 . 5.50 941 941 A 47 GLU HA A 49 GLY H 1.0 . 4.55 942 942 A 50 CYS HBy A 47 GLU HA 1.0 . 3.76 943 943 A 47 GLU HA A 46 ARG HBy 1.0 . 4.96 944 944 A 47 GLU HA A 46 ARG HGy 1.0 . 5.32 945 945 A 29 VAL HGy% A 47 GLU HBx 1.0 . 4.02 946 946 A 29 VAL HGy% A 47 GLU HBx 1.0 . 4.40 947 947 A 29 VAL HGy% A 47 GLU HBy 1.0 . 4.38 948 948 A 29 VAL HGy% A 47 GLU HBy 1.0 . 4.66 949 949 A 47 GLU HA A 47 GLU HGx 1.0 . 3.98 950 950 A 47 GLU HA A 47 GLU HGy 1.0 . 3.98 951 951 A 46 ARG HA A 49 GLY H 1.0 . 4.33 952 952 A 46 ARG HA A 46 ARG HGx 1.0 . 4.13 953 953 A 113 LEU HG A 46 ARG HA 1.0 . 5.50 954 954 A 113 LEU HBy A 46 ARG HA 1.0 . 5.18 955 955 A 46 ARG H A 46 ARG HBy 1.0 . 4.04 956 956 A 46 ARG HBy A 47 GLU H 1.0 . 4.81 957 957 A 46 ARG HBy A 46 ARG HDx 1.0 . 4.15 958 958 A 46 ARG HBy A 46 ARG HDy 1.0 . 4.15 959 959 A 46 ARG HA A 46 ARG HGy 1.0 . 4.22 960 960 A 46 ARG H A 45 ASN HBy 1.0 . 4.84 961 961 A 45 ASN HA A 44 THR HB 1.0 . 4.97 962 962 A 113 LEU HDx% A 44 THR HB 1.0 . 5.50 963 963 A 43 ILE HA A 43 ILE HG1y 1.0 . 4.23 964 964 A 43 ILE HA A 43 ILE HG1x 1.0 . 4.23 965 965 A 36 PHE HDy A 43 ILE HB 1.0 . 3.98 966 966 A 43 ILE HB A 36 PHE HA 1.0 . 4.24 967 967 A 43 ILE HG2% A 43 ILE HG1y 1.0 . 3.89 968 968 A 43 ILE HG2% A 43 ILE HG1x 1.0 . 3.89 969 969 A 48 ALA H A 43 ILE HG2% 1.0 . 5.50 970 970 A 48 ALA H A 43 ILE HG2% 1.0 . 5.50 971 971 A 43 ILE HG2% A 43 ILE H 1.0 . 5.50 972 972 A 43 ILE HG2% A 36 PHE H 1.0 . 5.09 973 973 A 36 PHE HEy A 43 ILE HG2% 1.0 . 4.62 974 974 A 43 ILE HG2% A 36 PHE HDy 1.0 . 4.00 975 975 A 43 ILE HG2% A 36 PHE HDy 1.0 . 4.40 976 976 A 43 ILE HG2% A 44 THR HA 1.0 . 5.50 977 977 A 43 ILE HG2% A 44 THR HA 1.0 . 5.50 978 978 A 43 ILE HA A 43 ILE HG2% 1.0 . 3.36 979 979 A 43 ILE HG2% A 33 PHE HA 1.0 . 4.70 980 980 A 43 ILE HG2% A 48 ALA HA 1.0 . 5.38 981 981 A 43 ILE HG2% A 36 PHE HA 1.0 . 5.50 982 982 A 43 ILE HG2% A 45 ASN HBy 1.0 . 4.02 983 983 A 45 ASN HBx A 43 ILE HG2% 1.0 . 4.23 984 984 A 44 THR H A 43 ILE HD1% 1.0 . 4.05 985 985 A 43 ILE HD1% A 45 ASN H 1.0 . 4.78 986 986 A 43 ILE HD1% A 41 TYR HEx 1.0 . 5.24 987 987 A 43 ILE HD1% A 41 TYR HEx 1.0 . 5.40 988 988 A 43 ILE HD1% A 41 TYR HDx 1.0 . 3.94 989 989 A 43 ILE HD1% A 41 TYR HDx 1.0 . 4.36 990 990 A 36 PHE HDy A 43 ILE HD1% 1.0 . 5.50 991 991 A 36 PHE HDy A 43 ILE HD1% 1.0 . 5.50 992 992 A 36 PHE HDy A 43 ILE HD1% 1.0 . 5.50 993 993 A 43 ILE HD1% A 32 ASP HA 1.0 . 3.92 994 994 A 43 ILE HA A 43 ILE HD1% 1.0 . 3.48 995 995 A 36 PHE HA A 43 ILE HD1% 1.0 . 4.35 996 996 A 43 ILE HD1% A 35 ASN HBx 1.0 . 3.94 997 997 A 43 ILE HB A 43 ILE HD1% 1.0 . 3.79 998 998 A 43 ILE HD1% A 35 ASN HBy 1.0 . 3.94 999 999 A 67 ASN HA A 67 ASN HD2x 1.0 . 5.11 1000 1000 A 67 ASN HA A 67 ASN HD2y 1.0 . 5.11 1001 1001 A 43 ILE H A 42 GLN HBy 1.0 . 4.62 1002 1002 A 44 THR HG2% A 42 GLN HBx 1.0 . 5.50 1003 1003 A 43 ILE H A 41 TYR HA 1.0 . 5.50 1004 1004 A 41 TYR HA A 41 TYR HDy 1.0 . 4.06 1005 1005 A 41 TYR HA A 38 LYS HBx 1.0 . 4.88 1006 1006 A 38 LYS HBy A 41 TYR HBx 1.0 . 5.16 1007 1007 A 13 ALA HA A 17 GLU H 1.0 . 4.41 1008 1008 A 4 VAL H A 3 GLU HGx 1.0 . 5.50 1009 1009 A 4 VAL H A 3 GLU HGy 1.0 . 5.50 1010 1010 A 38 LYS HBy A 39 GLU H 1.0 . 4.40 1011 1011 A 38 LYS HBx A 39 GLU H 1.0 . 4.37 1012 1012 A 38 LYS HBx A 38 LYS H 1.0 . 4.01 1013 1013 A 41 TYR HDx A 38 LYS HBy 1.0 . 4.93 1014 1014 A 41 TYR HDx A 38 LYS HBx 1.0 . 4.69 1015 1015 A 38 LYS HBy A 41 TYR HBy 1.0 . 5.16 1016 1016 A 38 LYS H A 38 LYS HGx 1.0 . 4.76 1017 1017 A 37 TRP HA A 37 TRP HE3 1.0 . 3.80 1018 1018 A 37 TRP HA A 36 PHE HDx 1.0 . 4.61 1019 1019 A 36 PHE HA A 36 PHE HDx 1.0 . 4.32 1020 1020 A 36 PHE HDy A 36 PHE HA 1.0 . 4.71 1021 1021 A 36 PHE HA A 43 ILE HG1y 1.0 . 4.43 1022 1022 A 36 PHE HA A 43 ILE HG1x 1.0 . 4.43 1023 1023 A 43 ILE HG2% A 36 PHE HA 1.0 . 4.96 1024 1024 A 36 PHE HA A 43 ILE HD1% 1.0 . 4.55 1025 1025 A 37 TRP H A 36 PHE HBy 1.0 . 4.41 1026 1026 A 35 ASN HA A 37 TRP HBx 1.0 . 5.50 1027 1027 A 38 LYS HBx A 35 ASN HA 1.0 . 4.25 1028 1028 A 38 LYS HBy A 35 ASN HA 1.0 . 4.20 1029 1029 A 34 PHE HA A 34 PHE HDx 1.0 . 4.06 1030 1030 A 34 PHE HA A 37 TRP HD1 1.0 . 3.73 1031 1031 A 35 ASN H A 34 PHE HBy 1.0 . 4.28 1032 1032 A 33 PHE HDy A 33 PHE HA 1.0 . 3.68 1033 1033 A 48 ALA HB% A 33 PHE HA 1.0 . 4.55 1034 1034 A 33 PHE HBy A 52 ILE HB 1.0 . 5.22 1035 1035 A 45 ASN HBx A 46 ARG HGy 1.0 . 5.33 1036 1036 A 33 PHE HBx A 51 VAL HGy% 1.0 . 4.47 1037 1037 A 33 PHE HBx A 51 VAL HGy% 1.0 . 4.73 1038 1038 A 32 ASP HA A 35 ASN HD2x 1.0 . 4.41 1039 1039 A 32 ASP HA A 35 ASN HBy 1.0 . 4.17 1040 1040 A 32 ASP HA A 35 ASN HBx 1.0 . 4.17 1041 1041 A 43 ILE HG2% A 32 ASP HA 1.0 . 4.60 1042 1042 A 31 GLN HA A 34 PHE HDy 1.0 . 3.64 1043 1043 A 21 GLN HA A 21 GLN HGy 1.0 . 4.11 1044 1044 A 31 GLN H A 31 GLN HBy 1.0 . 3.79 1045 1045 A 31 GLN HBx A 32 ASP H 1.0 . 4.21 1046 1046 A 31 GLN HBx A 28 ALA HA 1.0 . 4.37 1047 1047 A 30 MET HBy A 31 GLN H 1.0 . 4.33 1048 1048 A 30 MET HBx A 31 GLN H 1.0 . 4.22 1049 1049 A 30 MET HBy A 30 MET H 1.0 . 3.95 1050 1050 A 29 VAL HA A 28 ALA HA 1.0 . 4.87 1051 1051 A 29 VAL HA A 32 ASP HBy 1.0 . 4.38 1052 1052 A 29 VAL HA A 32 ASP HBx 1.0 . 4.38 1053 1053 A 29 VAL HA A 29 VAL HGx% 1.0 . 3.41 1054 1054 A 29 VAL HA A 29 VAL HGx% 1.0 . 3.61 1055 1055 A 26 PRO HDy A 29 VAL HB 1.0 . 5.23 1056 1056 A 28 ALA HA A 29 VAL HGx% 1.0 . 5.50 1057 1057 A 29 VAL HGx% A 26 PRO HDy 1.0 . 3.23 1058 1058 A 29 VAL HGx% A 26 PRO HGy 1.0 . 3.37 1059 1059 A 29 VAL HGx% A 26 PRO HGx 1.0 . 4.68 1060 1060 A 29 VAL HGy% A 29 VAL HGx% 1.0 . 2.55 1061 1061 A 29 VAL HGy% A 32 ASP H 1.0 . 5.50 1062 1062 A 29 VAL HGy% A 32 ASP H 1.0 . 5.50 1063 1063 A 29 VAL HGy% A 48 ALA H 1.0 . 5.50 1064 1064 A 29 VAL HGy% A 25 VAL HA 1.0 . 5.50 1065 1065 A 29 VAL HGy% A 25 VAL HA 1.0 . 5.50 1066 1066 A 29 VAL HGy% A 48 ALA HA 1.0 . 4.51 1067 1067 A 29 VAL HA A 29 VAL HGy% 1.0 . 3.94 1068 1068 A 29 VAL HGy% A 47 GLU HGx 1.0 . 3.93 1069 1069 A 29 VAL HGy% A 47 GLU HGy 1.0 . 3.93 1070 1070 A 29 VAL HGy% A 25 VAL HB 1.0 . 3.02 1071 1071 A 29 VAL HGy% A 28 ALA HB% 1.0 . 5.35 1072 1072 A 28 ALA HA A 27 ASP H 1.0 . 5.40 1073 1073 A 28 ALA HA A 31 GLN HGx 1.0 . 4.07 1074 1074 A 85 ALA HB% A 85 ALA HA 1.0 . 2.98 1075 1075 A 27 ASP H A 28 ALA HB% 1.0 . 4.54 1076 1076 A 17 GLU H A 18 ALA HB% 1.0 . 4.61 1077 1077 A 28 ALA HB% A 29 VAL H 1.0 . 3.99 1078 1078 A 28 ALA HA A 28 ALA HB% 1.0 . 2.70 1079 1079 A 29 VAL HA A 28 ALA HB% 1.0 . 4.34 1080 1080 A 26 PRO HGy A 28 ALA HB% 1.0 . 4.20 1081 1081 A 26 PRO HGy A 28 ALA HB% 1.0 . 4.45 1082 1082 A 29 VAL HGx% A 28 ALA HB% 1.0 . 3.69 1083 1083 A 30 MET H A 27 ASP HA 1.0 . 3.92 1084 1084 A 27 ASP HA A 20 LYS HDx 1.0 . 4.10 1085 1085 A 27 ASP HA A 20 LYS HDy 1.0 . 5.13 1086 1086 A 27 ASP HA A 25 VAL HGy% 1.0 . 5.12 1087 1087 A 27 ASP H A 27 ASP HBy 1.0 . 3.43 1088 1088 A 26 PRO HBy A 27 ASP HBx 1.0 . 4.94 1089 1089 A 26 PRO HBy A 27 ASP HBy 1.0 . 4.94 1090 1090 A 27 ASP HA A 26 PRO HA 1.0 . 4.36 1091 1091 A 28 ALA HB% A 26 PRO HBx 1.0 . 4.72 1092 1092 A 28 ALA HB% A 26 PRO HBy 1.0 . 4.02 1093 1093 A 29 VAL HGx% A 26 PRO HBx 1.0 . 5.50 1094 1094 A 29 VAL HGx% A 26 PRO HBx 1.0 . 5.50 1095 1095 A 26 PRO HDy A 29 VAL H 1.0 . 4.56 1096 1096 A 26 PRO HDx A 25 VAL H 1.0 . 5.09 1097 1097 A 26 PRO HDy A 25 VAL HA 1.0 . 3.39 1098 1098 A 26 PRO HDx A 25 VAL HA 1.0 . 3.25 1099 1099 A 25 VAL HB A 26 PRO HDy 1.0 . 3.25 1100 1100 A 29 VAL HGy% A 26 PRO HDy 1.0 . 4.50 1101 1101 A 26 PRO HDx A 29 VAL HGx% 1.0 . 5.40 1102 1102 A 26 PRO HDx A 29 VAL HGx% 1.0 . 5.50 1103 1103 A 26 PRO HDx A 25 VAL HGx% 1.0 . 4.29 1104 1104 A 26 PRO HGy A 28 ALA H 1.0 . 4.80 1105 1105 A 26 PRO HGy A 25 VAL HA 1.0 . 4.68 1106 1106 A 29 VAL HGx% A 26 PRO HGy 1.0 . 4.03 1107 1107 A 29 VAL HGx% A 25 VAL HA 1.0 . 4.98 1108 1108 A 24 ASN HA A 25 VAL HGy% 1.0 . 4.75 1109 1109 A 23 LEU HG A 23 LEU HA 1.0 . 3.80 1110 1110 A 23 LEU HDy% A 23 LEU HA 1.0 . 3.82 1111 1111 A 23 LEU HDy% A 23 LEU HA 1.0 . 4.01 1112 1112 A 23 LEU HA A 23 LEU HDx% 1.0 . 4.98 1113 1113 A 23 LEU HA A 23 LEU HDx% 1.0 . 5.25 1114 1114 A 22 GLU HA A 22 GLU HGy 1.0 . 3.68 1115 1115 A 22 GLU HA A 22 GLU HGx 1.0 . 3.68 1116 1116 A 122 GLU HA A 93 ILE HD1% 1.0 . 4.98 1117 1117 A 22 GLU H A 22 GLU HGx 1.0 . 4.78 1118 1118 A 23 LEU HDy% A 22 GLU HGx 1.0 . 5.50 1119 1119 A 21 GLN HA A 24 ASN HA 1.0 . 3.77 1120 1120 A 21 GLN HA A 21 GLN HGx 1.0 . 4.11 1121 1121 A 21 GLN HA A 20 LYS HBx 1.0 . 4.54 1122 1122 A 21 GLN HA A 20 LYS HGx 1.0 . 5.27 1123 1123 A 21 GLN HA A 20 LYS HDy 1.0 . 4.42 1124 1124 A 21 GLN H A 21 GLN HBy 1.0 . 3.27 1125 1125 A 22 GLU H A 21 GLN HBx 1.0 . 3.81 1126 1126 A 23 LEU H A 21 GLN HBx 1.0 . 5.50 1127 1127 A 28 ALA HA A 31 GLN HGy 1.0 . 4.46 1128 1128 A 31 GLN HGx A 28 ALA HB% 1.0 . 4.99 1129 1129 A 28 ALA HB% A 31 GLN HGy 1.0 . 5.11 1130 1130 A 23 LEU H A 20 LYS HA 1.0 . 4.40 1131 1131 A 20 LYS HA A 24 ASN H 1.0 . 5.44 1132 1132 A 20 LYS HA A 25 VAL H 1.0 . 4.21 1133 1133 A 20 LYS HA A 30 MET HBy 1.0 . 5.12 1134 1134 A 20 LYS HA A 20 LYS HDy 1.0 . 3.89 1135 1135 A 20 LYS HA A 20 LYS HGx 1.0 . 3.86 1136 1136 A 20 LYS HA A 20 LYS HDx 1.0 . 4.60 1137 1137 A 20 LYS HA A 23 LEU HBy 1.0 . 4.80 1138 1138 A 20 LYS HBx A 20 LYS H 1.0 . 3.92 1139 1139 A 21 GLN H A 20 LYS HBy 1.0 . 4.10 1140 1140 A 20 LYS HDy A 20 LYS HBy 1.0 . 4.07 1141 1141 A 20 LYS HDy A 20 LYS HBx 1.0 . 3.24 1142 1142 A 20 LYS HDy A 25 VAL HGy% 1.0 . 4.51 1143 1143 A 20 LYS HGx A 20 LYS H 1.0 . 5.10 1144 1144 A 20 LYS H A 20 LYS HGy 1.0 . 5.50 1145 1145 A 20 LYS HGx A 21 GLN H 1.0 . 4.98 1146 1146 A 21 GLN H A 20 LYS HGy 1.0 . 5.50 1147 1147 A 23 LEU H A 19 CYS HA 1.0 . 4.12 1148 1148 A 19 CYS HA A 22 GLU H 1.0 . 3.88 1149 1149 A 19 CYS HA A 22 GLU HBx 1.0 . 3.46 1150 1150 A 19 CYS HA A 23 LEU HG 1.0 . 5.00 1151 1151 A 19 CYS HA A 18 ALA HB% 1.0 . 4.89 1152 1152 A 19 CYS HA A 18 ALA HB% 1.0 . 5.15 1153 1153 A 51 VAL HGy% A 19 CYS HBy 1.0 . 5.50 1154 1154 A 55 LEU HDx% A 19 CYS HBx 1.0 . 5.50 1155 1155 A 55 LEU HDx% A 19 CYS HBy 1.0 . 5.50 1156 1156 A 21 GLN H A 18 ALA HA 1.0 . 4.36 1157 1157 A 17 GLU H A 18 ALA HA 1.0 . 5.16 1158 1158 A 22 GLU HBy A 18 ALA HA 1.0 . 4.34 1159 1159 A 15 PRO HA A 18 ALA HB% 1.0 . 2.94 1160 1160 A 22 GLU HBy A 18 ALA HB% 1.0 . 3.64 1161 1161 A 17 GLU HA A 20 LYS H 1.0 . 3.97 1162 1162 A 17 GLU HA A 21 GLN H 1.0 . 5.20 1163 1163 A 17 GLU H A 17 GLU HBy 1.0 . 3.78 1164 1164 A 17 GLU HBx A 18 ALA H 1.0 . 4.16 1165 1165 A 14 LYS HA A 17 GLU HBx 1.0 . 4.60 1166 1166 A 17 GLU HGy A 21 GLN HE2x 1.0 . 4.57 1167 1167 A 14 LYS HA A 17 GLU HGx 1.0 . 4.16 1168 1168 A 18 ALA HA A 17 GLU HGy 1.0 . 4.13 1169 1169 A 17 GLU HBy A 17 GLU HGy 1.0 . 2.62 1170 1170 A 17 GLU HGx A 13 ALA HB% 1.0 . 4.65 1171 1171 A 18 ALA HB% A 17 GLU HGy 1.0 . 4.53 1172 1172 A 20 LYS H A 16 MET HA 1.0 . 5.09 1173 1173 A 16 MET HA A 16 MET HGy 1.0 . 4.14 1174 1174 A 16 MET HA A 16 MET HGx 1.0 . 4.14 1175 1175 A 16 MET H A 16 MET HGx 1.0 . 4.67 1176 1176 A 16 MET H A 16 MET HGy 1.0 . 4.67 1177 1177 A 15 PRO HA A 18 ALA H 1.0 . 4.18 1178 1178 A 15 PRO HA A 19 CYS H 1.0 . 4.68 1179 1179 A 15 PRO HA A 58 LYS HDx 1.0 . 4.42 1180 1180 A 15 PRO HA A 58 LYS HDy 1.0 . 4.42 1181 1181 A 61 LEU HBy A 15 PRO HA 1.0 . 4.15 1182 1182 A 15 PRO HBy A 55 LEU HDx% 1.0 . 3.87 1183 1183 A 15 PRO HBy A 55 LEU HDx% 1.0 . 4.28 1184 1184 A 61 LEU HA A 15 PRO HGx 1.0 . 5.25 1185 1185 A 61 LEU HBy A 15 PRO HGy 1.0 . 4.18 1186 1186 A 61 LEU HBy A 15 PRO HGx 1.0 . 4.21 1187 1187 A 15 PRO HGy A 62 LEU HDy% 1.0 . 4.72 1188 1188 A 55 LEU HDx% A 15 PRO HGx 1.0 . 5.50 1189 1189 A 55 LEU HDx% A 15 PRO HGx 1.0 . 5.50 1190 1190 A 55 LEU HDx% A 15 PRO HGy 1.0 . 5.37 1191 1191 A 55 LEU HDx% A 15 PRO HGy 1.0 . 5.50 1192 1192 A 55 LEU HDx% A 15 PRO HGy 1.0 . 5.50 1193 1193 A 16 MET H A 13 ALA HB% 1.0 . 5.50 1194 1194 A 16 MET H A 13 ALA HB% 1.0 . 5.50 1195 1195 A 14 LYS HA A 13 ALA HB% 1.0 . 4.98 1196 1196 A 14 LYS HA A 13 ALA HB% 1.0 . 5.38 1197 1197 A 13 ALA HA A 13 ALA HB% 1.0 . 2.98 1198 1198 A 17 GLU HBx A 13 ALA HB% 1.0 . 4.46 1199 1199 A 5 MET HA A 4 VAL HGy% 1.0 . 5.50 1200 1200 A 4 VAL HB A 5 MET H 1.0 . 4.14 1201 1201 A 112 MET HBy A 113 LEU H 1.0 . 4.06 1202 1202 A 2 LYS HA A 4 VAL HGy% 1.0 . 5.50 1203 1203 A 4 VAL HGy% A 3 GLU HA 1.0 . 5.50 1204 1204 A 79 LYS HA A 78 MET HA 1.0 . 5.05 1205 1205 A 3 GLU H A 2 LYS HBx 1.0 . 4.39 1206 1206 A 1 SER H1 A 1 SER HBy 1.0 . 4.15 1207 1207 A 1 SER H1 A 1 SER HBx 1.0 . 4.15 1208 1208 A 4 VAL HB A 1 SER HA 1.0 . 4.23 1209 1209 A 4 VAL HGy% A 1 SER HA 1.0 . 5.35 1210 1210 A 4 VAL HGy% A 1 SER HA 1.0 . 5.50 1211 1211 A 6 LYS H A 6 LYS HBy 1.0 . 3.99 1212 1212 A 47 GLU HA A 46 ARG HGx 1.0 . 4.07 1213 1213 A 85 ALA HA A 88 LYS HDy 1.0 . 4.36 1214 1214 A 90 LEU HDy% A 128 TRP HZ2 1.0 . 4.23 1215 1215 A 119 PHE HZ A 90 LEU HDy% 1.0 . 4.08 1216 1216 A 119 PHE HZ A 90 LEU HDy% 1.0 . 4.35 1217 1217 A 90 LEU HDy% A 128 TRP HH2 1.0 . 4.13 1218 1218 A 90 LEU HDy% A 128 TRP HH2 1.0 . 4.26 1219 1219 A 90 LEU HDy% A 90 LEU HA 1.0 . 2.93 1220 1220 A 90 LEU HDy% A 130 PRO HBx 1.0 . 4.61 1221 1221 A 90 LEU HDy% A 130 PRO HBx 1.0 . 5.11 1222 1222 A 135 ALA HB% A 90 LEU HDy% 1.0 . 3.84 1223 1223 A 96 SER HA A 99 LYS HEx 1.0 . 5.24 1224 1224 A 96 SER HA A 99 LYS HEy 1.0 . 5.24 1225 1225 A 4 VAL HGx% A 4 VAL HA 1.0 . 4.21 1226 1226 A 4 VAL HGx% A 4 VAL HA 1.0 . 4.25 1227 1227 A 5 MET H A 4 VAL HGy% 1.0 . 5.08 1228 1228 A 55 LEU HDx% A 15 PRO HBx 1.0 . 4.35 1229 1229 A 55 LEU HDx% A 15 PRO HBx 1.0 . 4.70 1230 1230 A 61 LEU HDx% A 15 PRO HBx 1.0 . 4.64 1231 1231 A 61 LEU HDx% A 15 PRO HBx 1.0 . 4.97 1232 1232 A 61 LEU HDx% A 15 PRO HBy 1.0 . 4.64 1233 1233 A 61 LEU HDx% A 15 PRO HBy 1.0 . 4.89 1234 1234 A 58 LYS HBy A 15 PRO HBx 1.0 . 4.15 1235 1235 A 15 PRO HBx A 58 LYS HDx 1.0 . 4.72 1236 1236 A 15 PRO HBx A 58 LYS HDy 1.0 . 4.72 1237 1237 A 15 PRO HBx A 58 LYS HGx 1.0 . 5.50 1238 1238 A 15 PRO HBx A 58 LYS HGy 1.0 . 5.50 1239 1239 A 58 LYS HBy A 15 PRO HBy 1.0 . 3.79 1240 1240 A 55 LEU HA A 15 PRO HBx 1.0 . 5.40 1241 1241 A 137 GLY HAy A 136 VAL HB 1.0 . 5.16 1242 1242 A 15 PRO HBy A 16 MET HA 1.0 . 4.98 1243 1243 A 61 LEU HBy A 15 PRO HDx 1.0 . 4.19 1244 1244 A 61 LEU HA A 15 PRO HDx 1.0 . 4.85 1245 1245 A 15 PRO HDx A 16 MET H 1.0 . 4.39 1246 1246 A 20 LYS HGy A 20 LYS HEx 1.0 . 3.31 1247 1247 A 20 LYS HGy A 20 LYS HEy 1.0 . 3.31 1248 1248 A 16 MET H A 15 PRO HGx 1.0 . 4.38 1249 1249 A 26 PRO HGy A 25 VAL HGy% 1.0 . 5.50 1250 1250 A 15 PRO HGy A 62 LEU HDx% 1.0 . 5.50 1251 1251 A 29 VAL HGy% A 26 PRO HGy 1.0 . 5.38 1252 1252 A 29 VAL HGy% A 26 PRO HGy 1.0 . 5.50 1253 1253 A 61 LEU HDx% A 15 PRO HGy 1.0 . 5.50 1254 1254 A 61 LEU HDx% A 15 PRO HGx 1.0 . 5.00 1255 1255 A 61 LEU HDx% A 15 PRO HGx 1.0 . 5.50 1256 1256 A 18 ALA HB% A 21 GLN H 1.0 . 5.50 1257 1257 A 19 CYS HA A 20 LYS HA 1.0 . 4.98 1258 1258 A 20 LYS H A 17 GLU HBy 1.0 . 5.50 1259 1259 A 21 GLN HBy A 20 LYS H 1.0 . 5.50 1260 1260 A 18 ALA HA A 21 GLN HGy 1.0 . 3.73 1261 1261 A 18 ALA HA A 21 GLN HGx 1.0 . 3.73 1262 1262 A 22 GLU HBx A 23 LEU HA 1.0 . 4.58 1263 1263 A 24 ASN HA A 23 LEU HA 1.0 . 5.46 1264 1264 A 23 LEU HDy% A 23 LEU HBy 1.0 . 4.22 1265 1265 A 23 LEU H A 23 LEU HDx% 1.0 . 4.42 1266 1266 A 51 VAL H A 23 LEU HDx% 1.0 . 5.50 1267 1267 A 51 VAL H A 23 LEU HDx% 1.0 . 5.50 1268 1268 A 54 CYS H A 23 LEU HDx% 1.0 . 4.18 1269 1269 A 50 CYS H A 23 LEU HDx% 1.0 . 5.50 1270 1270 A 59 LEU HDx% A 142 ASP H 1.0 . 5.50 1271 1271 A 19 CYS HA A 23 LEU HDx% 1.0 . 5.18 1272 1272 A 51 VAL HA A 23 LEU HDx% 1.0 . 3.86 1273 1273 A 59 LEU HDx% A 59 LEU HBy 1.0 . 3.71 1274 1274 A 23 LEU HDx% A 23 LEU HBy 1.0 . 3.36 1275 1275 A 23 LEU HDx% A 23 LEU HBy 1.0 . 3.66 1276 1276 A 23 LEU HDx% A 23 LEU HBx 1.0 . 3.32 1277 1277 A 23 LEU HDy% A 23 LEU HDx% 1.0 . 3.77 1278 1278 A 25 VAL H A 25 VAL HGx% 1.0 . 3.53 1279 1279 A 24 ASN H A 25 VAL HGx% 1.0 . 4.43 1280 1280 A 23 LEU H A 25 VAL HGx% 1.0 . 5.47 1281 1281 A 25 VAL HA A 25 VAL HGx% 1.0 . 3.12 1282 1282 A 24 ASN HA A 25 VAL HGx% 1.0 . 5.06 1283 1283 A 23 LEU HA A 25 VAL HGx% 1.0 . 4.84 1284 1284 A 26 PRO HDy A 25 VAL HGx% 1.0 . 3.58 1285 1285 A 23 LEU HBy A 25 VAL HGx% 1.0 . 3.74 1286 1286 A 25 VAL HB A 25 VAL HGx% 1.0 . 2.98 1287 1287 A 23 LEU HBx A 25 VAL HGx% 1.0 . 3.31 1288 1288 A 23 LEU H A 25 VAL HGy% 1.0 . 4.18 1289 1289 A 25 VAL H A 25 VAL HGy% 1.0 . 3.06 1290 1290 A 25 VAL HA A 25 VAL HGy% 1.0 . 4.03 1291 1291 A 26 PRO HDx A 25 VAL HGy% 1.0 . 5.18 1292 1292 A 21 GLN HA A 25 VAL HGy% 1.0 . 5.50 1293 1293 A 23 LEU HA A 25 VAL HGy% 1.0 . 5.50 1294 1294 A 20 LYS HA A 25 VAL HGy% 1.0 . 3.67 1295 1295 A 20 LYS HA A 25 VAL HGy% 1.0 . 3.45 1296 1296 A 26 PRO HDy A 25 VAL HGy% 1.0 . 4.13 1297 1297 A 30 MET HBx A 25 VAL HGy% 1.0 . 4.30 1298 1298 A 23 LEU HBy A 25 VAL HGy% 1.0 . 3.40 1299 1299 A 20 LYS HGx A 25 VAL HGy% 1.0 . 3.43 1300 1300 A 26 PRO HGx A 28 ALA H 1.0 . 4.87 1301 1301 A 26 PRO HGx A 27 ASP H 1.0 . 5.13 1302 1302 A 26 PRO HGy A 27 ASP H 1.0 . 4.87 1303 1303 A 26 PRO HGx A 25 VAL HA 1.0 . 4.68 1304 1304 A 26 PRO HGx A 29 VAL H 1.0 . 4.96 1305 1305 A 26 PRO HGx A 28 ALA HB% 1.0 . 5.10 1306 1306 A 26 PRO HGx A 28 ALA HB% 1.0 . 5.50 1307 1307 A 29 VAL HGx% A 26 PRO HGx 1.0 . 4.44 1308 1308 A 21 GLN HA A 25 VAL H 1.0 . 4.50 1309 1309 A 31 GLN HA A 34 PHE H 1.0 . 4.98 1310 1310 A 32 ASP H A 31 GLN HGy 1.0 . 4.47 1311 1311 A 30 MET HBy A 20 LYS HBy 1.0 . 4.19 1312 1312 A 33 PHE HEx A 34 PHE HA 1.0 . 5.44 1313 1313 A 37 TRP H A 34 PHE HA 1.0 . 5.50 1314 1314 A 33 PHE HDx A 34 PHE HA 1.0 . 4.85 1315 1315 A 57 LYS H A 57 LYS HDx 1.0 . 5.45 1316 1316 A 57 LYS H A 57 LYS HDy 1.0 . 5.45 1317 1317 A 38 LYS H A 38 LYS HGy 1.0 . 4.76 1318 1318 A 113 LEU HG A 48 ALA HB% 1.0 . 4.55 1319 1319 A 51 VAL H A 51 VAL HGx% 1.0 . 3.27 1320 1320 A 51 VAL H A 51 VAL HGx% 1.0 . 3.47 1321 1321 A 30 MET H A 51 VAL HGx% 1.0 . 5.50 1322 1322 A 30 MET H A 51 VAL HGx% 1.0 . 5.50 1323 1323 A 30 MET HA A 51 VAL HGx% 1.0 . 3.69 1324 1324 A 48 ALA HA A 51 VAL HGx% 1.0 . 3.65 1325 1325 A 48 ALA HA A 51 VAL HGx% 1.0 . 3.76 1326 1326 A 29 VAL HA A 51 VAL HGx% 1.0 . 5.50 1327 1327 A 29 VAL HA A 51 VAL HGx% 1.0 . 5.50 1328 1328 A 47 GLU HA A 51 VAL HGx% 1.0 . 4.99 1329 1329 A 51 VAL HA A 51 VAL HGx% 1.0 . 4.03 1330 1330 A 33 PHE HBx A 51 VAL HGx% 1.0 . 4.30 1331 1331 A 33 PHE HBy A 51 VAL HGx% 1.0 . 4.70 1332 1332 A 33 PHE HBy A 51 VAL HGx% 1.0 . 5.41 1333 1333 A 47 GLU HBx A 51 VAL HGx% 1.0 . 3.99 1334 1334 A 52 ILE HB A 51 VAL HGx% 1.0 . 4.23 1335 1335 A 48 ALA HB% A 51 VAL HGx% 1.0 . 5.50 1336 1336 A 48 ALA HB% A 51 VAL HGx% 1.0 . 5.50 1337 1337 A 51 VAL HGy% A 51 VAL HGx% 1.0 . 3.02 1338 1338 A 51 VAL HGy% A 51 VAL HGx% 1.0 . 3.32 1339 1339 A 33 PHE H A 52 ILE HD1% 1.0 . 5.44 1340 1340 A 52 ILE HD1% A 51 VAL H 1.0 . 5.50 1341 1341 A 52 ILE HD1% A 49 GLY H 1.0 . 5.50 1342 1342 A 52 ILE HD1% A 49 GLY H 1.0 . 5.50 1343 1343 A 37 TRP HH2 A 52 ILE HD1% 1.0 . 5.10 1344 1344 A 52 ILE HD1% A 33 PHE HEy 1.0 . 5.15 1345 1345 A 52 ILE HD1% A 33 PHE HEy 1.0 . 5.34 1346 1346 A 52 ILE HD1% A 33 PHE HDy 1.0 . 4.79 1347 1347 A 52 ILE HD1% A 33 PHE HDy 1.0 . 5.22 1348 1348 A 49 GLY HAx A 52 ILE HD1% 1.0 . 4.75 1349 1349 A 52 ILE HD1% A 33 PHE HA 1.0 . 5.11 1350 1350 A 49 GLY HAy A 52 ILE HD1% 1.0 . 3.97 1351 1351 A 52 ILE HD1% A 52 ILE HA 1.0 . 4.83 1352 1352 A 52 ILE HD1% A 52 ILE HA 1.0 . 5.47 1353 1353 A 33 PHE HBx A 52 ILE HD1% 1.0 . 4.86 1354 1354 A 52 ILE HD1% A 52 ILE HB 1.0 . 3.60 1355 1355 A 113 LEU HG A 52 ILE HD1% 1.0 . 5.50 1356 1356 A 113 LEU HBy A 52 ILE HD1% 1.0 . 3.37 1357 1357 A 52 ILE HD1% A 113 LEU HDy% 1.0 . 3.50 1358 1358 A 52 ILE HG1y A 52 ILE H 1.0 . 4.60 1359 1359 A 33 PHE HEy A 52 ILE HG1y 1.0 . 4.46 1360 1360 A 33 PHE HDy A 52 ILE HG1x 1.0 . 4.66 1361 1361 A 33 PHE HDy A 52 ILE HG1y 1.0 . 4.47 1362 1362 A 33 PHE HEy A 52 ILE HG1x 1.0 . 4.76 1363 1363 A 53 LEU HDx% A 53 LEU H 1.0 . 3.87 1364 1364 A 61 LEU HDx% A 16 MET H 1.0 . 5.50 1365 1365 A 139 LEU HDx% A 116 ALA H 1.0 . 5.50 1366 1366 A 139 LEU HDx% A 119 PHE HEx 1.0 . 4.11 1367 1367 A 119 PHE HDx A 139 LEU HDx% 1.0 . 3.30 1368 1368 A 53 LEU HDx% A 50 CYS HA 1.0 . 3.76 1369 1369 A 109 CYS HA A 53 LEU HDx% 1.0 . 3.66 1370 1370 A 109 CYS HA A 53 LEU HDx% 1.0 . 3.82 1371 1371 A 119 PHE HBx A 139 LEU HDx% 1.0 . 4.41 1372 1372 A 119 PHE HBx A 139 LEU HDx% 1.0 . 4.89 1373 1373 A 139 LEU HDx% A 136 VAL HA 1.0 . 4.40 1374 1374 A 139 LEU HDx% A 136 VAL HA 1.0 . 4.60 1375 1375 A 53 LEU HDx% A 53 LEU HBy 1.0 . 3.67 1376 1376 A 53 LEU HDx% A 53 LEU HBx 1.0 . 3.67 1377 1377 A 53 LEU HDx% A 53 LEU HBx 1.0 . 3.76 1378 1378 A 116 ALA HB% A 139 LEU HDx% 1.0 . 4.72 1379 1379 A 116 ALA HB% A 139 LEU HDx% 1.0 . 5.20 1380 1380 A 51 VAL H A 53 LEU HDy% 1.0 . 5.50 1381 1381 A 53 LEU H A 53 LEU HDy% 1.0 . 4.80 1382 1382 A 50 CYS HA A 53 LEU HDy% 1.0 . 4.75 1383 1383 A 50 CYS HA A 53 LEU HDy% 1.0 . 5.06 1384 1384 A 54 CYS HA A 53 LEU HDy% 1.0 . 4.50 1385 1385 A 54 CYS HA A 53 LEU HDy% 1.0 . 4.64 1386 1386 A 53 LEU HG A 53 LEU H 1.0 . 3.81 1387 1387 A 53 LEU HG A 54 CYS H 1.0 . 4.70 1388 1388 A 91 LEU HG A 91 LEU HA 1.0 . 4.11 1389 1389 A 91 LEU HG A 138 GLU HBx 1.0 . 4.61 1390 1390 A 55 LEU H A 55 LEU HDx% 1.0 . 5.38 1391 1391 A 55 LEU HDx% A 16 MET H 1.0 . 4.87 1392 1392 A 55 LEU HDx% A 16 MET H 1.0 . 5.29 1393 1393 A 55 LEU HDx% A 58 LYS H 1.0 . 5.50 1394 1394 A 55 LEU HDx% A 58 LYS H 1.0 . 5.50 1395 1395 A 15 PRO HA A 55 LEU HDx% 1.0 . 5.50 1396 1396 A 55 LEU HDx% A 16 MET HA 1.0 . 3.86 1397 1397 A 55 LEU HDx% A 16 MET HA 1.0 . 4.10 1398 1398 A 55 LEU HA A 55 LEU HDx% 1.0 . 3.36 1399 1399 A 55 LEU HA A 55 LEU HDx% 1.0 . 3.69 1400 1400 A 55 LEU HDx% A 16 MET HGy 1.0 . 4.52 1401 1401 A 55 LEU HDx% A 16 MET HGx 1.0 . 4.52 1402 1402 A 55 LEU HDx% A 15 PRO HGx 1.0 . 3.96 1403 1403 A 55 LEU HBx A 55 LEU HDx% 1.0 . 3.60 1404 1404 A 55 LEU HDy% A 55 LEU HDx% 1.0 . 3.55 1405 1405 A 140 LEU HDy% A 55 LEU HDy% 1.0 . 5.50 1406 1406 A 58 LYS H A 58 LYS HDx 1.0 . 5.50 1407 1407 A 58 LYS H A 58 LYS HDy 1.0 . 5.50 1408 1408 A 61 LEU HDx% A 58 LYS HEy 1.0 . 5.34 1409 1409 A 22 GLU HBx A 58 LYS HEy 1.0 . 4.95 1410 1410 A 22 GLU HBx A 58 LYS HEx 1.0 . 4.95 1411 1411 A 22 GLU HBy A 58 LYS HEx 1.0 . 5.50 1412 1412 A 22 GLU HGx A 58 LYS HEx 1.0 . 5.50 1413 1413 A 22 GLU HBy A 58 LYS HEy 1.0 . 5.50 1414 1414 A 58 LYS HEy A 22 GLU HGx 1.0 . 5.50 1415 1415 A 58 LYS HEy A 22 GLU HGy 1.0 . 5.50 1416 1416 A 22 GLU HGy A 58 LYS HEx 1.0 . 5.50 1417 1417 A 60 GLU H A 59 LEU HDy% 1.0 . 5.50 1418 1418 A 140 LEU H A 59 LEU HDy% 1.0 . 5.50 1419 1419 A 56 ALA HA A 59 LEU HDy% 1.0 . 3.05 1420 1420 A 55 LEU HA A 59 LEU HDy% 1.0 . 5.42 1421 1421 A 140 LEU HBx A 59 LEU HDy% 1.0 . 3.18 1422 1422 A 62 LEU H A 61 LEU HDy% 1.0 . 5.50 1423 1423 A 62 LEU H A 61 LEU HDy% 1.0 . 5.50 1424 1424 A 61 LEU HA A 61 LEU HDy% 1.0 . 3.31 1425 1425 A 15 PRO HBx A 61 LEU HDy% 1.0 . 5.50 1426 1426 A 61 LEU HBy A 61 LEU HDy% 1.0 . 4.05 1427 1427 A 61 LEU HG A 58 LYS HBx 1.0 . 4.74 1428 1428 A 63 ASP HA A 62 LEU HA 1.0 . 4.56 1429 1429 A 59 LEU HG A 62 LEU HDx% 1.0 . 4.21 1430 1430 A 59 LEU HG A 62 LEU HDx% 1.0 . 4.56 1431 1431 A 68 LEU HG A 62 LEU HDx% 1.0 . 4.10 1432 1432 A 62 LEU HDx% A 62 LEU HDy% 1.0 . 3.43 1433 1433 A 62 LEU HDx% A 68 LEU HDx% 1.0 . 3.47 1434 1434 A 59 LEU HA A 62 LEU HDx% 1.0 . 4.34 1435 1435 A 62 LEU HA A 62 LEU HDx% 1.0 . 5.38 1436 1436 A 62 LEU HA A 62 LEU HDx% 1.0 . 5.50 1437 1437 A 62 LEU HA A 62 LEU HDx% 1.0 . 5.50 1438 1438 A 59 LEU H A 62 LEU HDx% 1.0 . 5.50 1439 1439 A 59 LEU H A 62 LEU HDx% 1.0 . 5.50 1440 1440 A 62 LEU H A 62 LEU HDx% 1.0 . 4.98 1441 1441 A 62 LEU H A 62 LEU HDx% 1.0 . 5.32 1442 1442 A 62 LEU HDx% A 68 LEU H 1.0 . 5.50 1443 1443 A 62 LEU HDy% A 63 ASP H 1.0 . 4.72 1444 1444 A 62 LEU HDy% A 63 ASP H 1.0 . 5.22 1445 1445 A 62 LEU HA A 62 LEU HDy% 1.0 . 3.47 1446 1446 A 15 PRO HDx A 62 LEU HDy% 1.0 . 4.09 1447 1447 A 15 PRO HDy A 62 LEU HDy% 1.0 . 4.18 1448 1448 A 15 PRO HGx A 62 LEU HDy% 1.0 . 3.78 1449 1449 A 15 PRO HGy A 62 LEU HDy% 1.0 . 4.13 1450 1450 A 68 LEU HA A 76 PHE HBy 1.0 . 4.24 1451 1451 A 76 PHE HZ A 68 LEU HDx% 1.0 . 4.10 1452 1452 A 76 PHE HDy A 68 LEU HDx% 1.0 . 5.50 1453 1453 A 137 GLY H A 68 LEU HDx% 1.0 . 5.08 1454 1454 A 68 LEU HA A 68 LEU HDx% 1.0 . 4.89 1455 1455 A 68 LEU HA A 68 LEU HDx% 1.0 . 5.28 1456 1456 A 137 GLY HAx A 68 LEU HDx% 1.0 . 4.42 1457 1457 A 137 GLY HAy A 68 LEU HDx% 1.0 . 4.26 1458 1458 A 140 LEU HBy A 68 LEU HDx% 1.0 . 4.56 1459 1459 A 59 LEU HG A 68 LEU HDx% 1.0 . 4.49 1460 1460 A 68 LEU HDy% A 68 LEU HDx% 1.0 . 3.54 1461 1461 A 76 PHE HDy A 68 LEU HDy% 1.0 . 5.38 1462 1462 A 76 PHE HDy A 68 LEU HDy% 1.0 . 4.96 1463 1463 A 76 PHE HBx A 68 LEU HDy% 1.0 . 5.07 1464 1464 A 59 LEU HDx% A 68 LEU HDy% 1.0 . 4.08 1465 1465 A 72 LYS HA A 72 LYS HDy 1.0 . 4.66 1466 1466 A 72 LYS HA A 72 LYS HEx 1.0 . 5.50 1467 1467 A 72 LYS HA A 72 LYS HEy 1.0 . 5.50 1468 1468 A 68 LEU HDy% A 73 ALA HA 1.0 . 5.50 1469 1469 A 68 LEU HDy% A 73 ALA HA 1.0 . 5.50 1470 1470 A 68 LEU HDy% A 73 ALA HA 1.0 . 5.50 1471 1471 A 68 LEU HDy% A 76 PHE HBy 1.0 . 5.29 1472 1472 A 78 MET HGy A 87 ALA HB% 1.0 . 4.05 1473 1473 A 17 GLU HA A 16 MET HA 1.0 . 4.98 1474 1474 A 85 ALA HA A 88 LYS HDx 1.0 . 4.36 1475 1475 A 93 ILE HD1% A 89 GLN HBy 1.0 . 5.50 1476 1476 A 89 GLN HGx A 89 GLN H 1.0 . 4.69 1477 1477 A 90 LEU HDx% A 90 LEU HA 1.0 . 5.10 1478 1478 A 90 LEU HDx% A 90 LEU HA 1.0 . 5.50 1479 1479 A 90 LEU HDx% A 90 LEU HA 1.0 . 5.50 1480 1480 A 90 LEU HDy% A 123 ILE HG2% 1.0 . 3.30 1481 1481 A 90 LEU HDx% A 90 LEU HDy% 1.0 . 2.67 1482 1482 A 90 LEU HDy% A 130 PRO HDx 1.0 . 5.50 1483 1483 A 90 LEU HDy% A 130 PRO HDx 1.0 . 5.50 1484 1484 A 90 LEU HDy% A 130 PRO HDy 1.0 . 5.50 1485 1485 A 90 LEU HDy% A 130 PRO HDy 1.0 . 5.50 1486 1486 A 90 LEU HDy% A 123 ILE HA 1.0 . 5.50 1487 1487 A 90 LEU HDy% A 123 ILE HA 1.0 . 5.50 1488 1488 A 128 TRP HH2 A 90 LEU HG 1.0 . 4.61 1489 1489 A 88 LYS HA A 91 LEU HBy 1.0 . 4.11 1490 1490 A 93 ILE HD1% A 119 PHE HEy 1.0 . 4.19 1491 1491 A 93 ILE HD1% A 119 PHE HEy 1.0 . 4.77 1492 1492 A 93 ILE HD1% A 90 LEU H 1.0 . 5.06 1493 1493 A 93 ILE HD1% A 119 PHE HDy 1.0 . 4.72 1494 1494 A 93 ILE HD1% A 89 GLN HA 1.0 . 5.33 1495 1495 A 93 ILE HD1% A 90 LEU HA 1.0 . 3.45 1496 1496 A 93 ILE HD1% A 93 ILE HA 1.0 . 5.09 1497 1497 A 93 ILE HD1% A 93 ILE HA 1.0 . 5.50 1498 1498 A 93 ILE HD1% A 93 ILE HA 1.0 . 5.50 1499 1499 A 123 ILE HA A 93 ILE HD1% 1.0 . 4.28 1500 1500 A 89 GLN HGy A 93 ILE HD1% 1.0 . 4.02 1501 1501 A 89 GLN HGx A 93 ILE HD1% 1.0 . 3.58 1502 1502 A 123 ILE HG2% A 93 ILE HD1% 1.0 . 3.35 1503 1503 A 123 ILE HG2% A 93 ILE HD1% 1.0 . 3.47 1504 1504 A 93 ILE HD1% A 93 ILE HB 1.0 . 3.49 1505 1505 A 93 ILE HD1% A 122 GLU HBx 1.0 . 3.82 1506 1506 A 95 HIS HA A 94 LYS HEx 1.0 . 4.81 1507 1507 A 95 HIS HA A 94 LYS HEy 1.0 . 4.81 1508 1508 A 139 LEU HDy% A 94 LYS HEx 1.0 . 5.50 1509 1509 A 139 LEU HDy% A 94 LYS HEy 1.0 . 5.50 1510 1510 A 98 GLU HA A 98 GLU HGx 1.0 . 3.86 1511 1511 A 100 VAL H A 100 VAL HGx% 1.0 . 3.30 1512 1512 A 100 VAL HA A 100 VAL HGx% 1.0 . 3.01 1513 1513 A 100 VAL HB A 100 VAL HGx% 1.0 . 2.95 1514 1514 A 100 VAL HGy% A 100 VAL HB 1.0 . 2.94 1515 1515 A 97 CYS HBx A 100 VAL HGy% 1.0 . 4.60 1516 1516 A 118 CYS HBx A 100 VAL HGy% 1.0 . 5.50 1517 1517 A 118 CYS HBx A 100 VAL HGy% 1.0 . 5.50 1518 1518 A 118 CYS HBx A 100 VAL HGy% 1.0 . 5.50 1519 1519 A 118 CYS HBy A 100 VAL HGy% 1.0 . 5.11 1520 1520 A 118 CYS HBy A 100 VAL HGy% 1.0 . 5.50 1521 1521 A 97 CYS HBy A 100 VAL HGy% 1.0 . 4.77 1522 1522 A 101 ILE HA A 100 VAL HGy% 1.0 . 3.85 1523 1523 A 97 CYS HA A 100 VAL HGy% 1.0 . 2.82 1524 1524 A 99 LYS H A 100 VAL HGy% 1.0 . 3.91 1525 1525 A 100 VAL HGy% A 100 VAL H 1.0 . 2.92 1526 1526 A 100 VAL HGy% A 98 GLU H 1.0 . 4.64 1527 1527 A 100 VAL HGy% A 97 CYS H 1.0 . 4.75 1528 1528 A 101 ILE HD1% A 115 LEU H 1.0 . 3.34 1529 1529 A 101 ILE HD1% A 116 ALA H 1.0 . 5.50 1530 1530 A 101 ILE HD1% A 116 ALA H 1.0 . 5.50 1531 1531 A 101 ILE HD1% A 114 ASN HD2x 1.0 . 4.43 1532 1532 A 101 ILE HD1% A 114 ASN HD2x 1.0 . 4.87 1533 1533 A 101 ILE HD1% A 101 ILE H 1.0 . 5.42 1534 1534 A 101 ILE HD1% A 101 ILE H 1.0 . 5.50 1535 1535 A 101 ILE HD1% A 101 ILE H 1.0 . 5.50 1536 1536 A 101 ILE HD1% A 114 ASN HD2y 1.0 . 5.50 1537 1537 A 101 ILE HD1% A 114 ASN HD2y 1.0 . 5.50 1538 1538 A 101 ILE HD1% A 112 MET HA 1.0 . 5.50 1539 1539 A 101 ILE HD1% A 112 MET HA 1.0 . 5.50 1540 1540 A 101 ILE HD1% A 101 ILE HA 1.0 . 5.13 1541 1541 A 101 ILE HD1% A 101 ILE HA 1.0 . 5.50 1542 1542 A 101 ILE HD1% A 98 GLU HA 1.0 . 3.48 1543 1543 A 101 ILE HD1% A 114 ASN HBy 1.0 . 3.59 1544 1544 A 101 ILE HD1% A 114 ASN HBx 1.0 . 3.85 1545 1545 A 101 ILE HD1% A 115 LEU HBx 1.0 . 4.56 1546 1546 A 101 ILE HD1% A 101 ILE HB 1.0 . 3.30 1547 1547 A 101 ILE HD1% A 115 LEU HBy 1.0 . 3.40 1548 1548 A 101 ILE HD1% A 101 ILE HG1x 1.0 . 2.92 1549 1549 A 101 ILE HD1% A 101 ILE HG1y 1.0 . 2.93 1550 1550 A 115 LEU HDy% A 101 ILE HD1% 1.0 . 4.07 1551 1551 A 103 ILE H A 103 ILE HD1% 1.0 . 4.90 1552 1552 A 103 ILE H A 103 ILE HD1% 1.0 . 5.24 1553 1553 A 103 ILE HB A 103 ILE HD1% 1.0 . 3.35 1554 1554 A 103 ILE HG2% A 104 VAL H 1.0 . 4.06 1555 1555 A 103 ILE HG2% A 104 VAL H 1.0 . 4.29 1556 1556 A 103 ILE HG2% A 103 ILE H 1.0 . 5.19 1557 1557 A 111 THR HB A 103 ILE HG2% 1.0 . 4.41 1558 1558 A 103 ILE HA A 103 ILE HG2% 1.0 . 3.00 1559 1559 A 103 ILE HB A 103 ILE HG2% 1.0 . 2.85 1560 1560 A 103 ILE HG1x A 103 ILE HG2% 1.0 . 4.12 1561 1561 A 111 THR HG2% A 103 ILE HG2% 1.0 . 2.93 1562 1562 A 103 ILE HG2% A 103 ILE HG1y 1.0 . 3.22 1563 1563 A 103 ILE HG2% A 103 ILE HG1y 1.0 . 3.67 1564 1564 A 107 ASP HBx A 104 VAL HB 1.0 . 4.51 1565 1565 A 110 GLN HBy A 107 ASP HBx 1.0 . 4.47 1566 1566 A 110 GLN HBy A 107 ASP HBy 1.0 . 4.36 1567 1567 A 109 CYS H A 108 PRO HDy 1.0 . 4.16 1568 1568 A 107 ASP H A 108 PRO HDy 1.0 . 4.56 1569 1569 A 107 ASP HA A 108 PRO HDx 1.0 . 3.19 1570 1570 A 107 ASP HA A 108 PRO HDy 1.0 . 3.19 1571 1571 A 138 GLU HBy A 90 LEU HDx% 1.0 . 4.77 1572 1572 A 48 ALA HB% A 113 LEU HDy% 1.0 . 3.47 1573 1573 A 48 ALA HB% A 113 LEU HDy% 1.0 . 3.88 1574 1574 A 113 LEU HBy A 113 LEU HDy% 1.0 . 3.88 1575 1575 A 113 LEU HBx A 113 LEU HDy% 1.0 . 4.09 1576 1576 A 117 MET HBy A 113 LEU HDy% 1.0 . 5.50 1577 1577 A 117 MET HBx A 113 LEU HDy% 1.0 . 4.00 1578 1578 A 49 GLY HAy A 113 LEU HDy% 1.0 . 5.04 1579 1579 A 113 LEU HA A 113 LEU HDy% 1.0 . 3.26 1580 1580 A 113 LEU HA A 113 LEU HDy% 1.0 . 3.54 1581 1581 A 114 ASN HA A 113 LEU HDy% 1.0 . 4.11 1582 1582 A 36 PHE HDy A 113 LEU HDy% 1.0 . 4.71 1583 1583 A 36 PHE HDy A 113 LEU HDy% 1.0 . 5.17 1584 1584 A 36 PHE HEy A 113 LEU HDy% 1.0 . 4.57 1585 1585 A 36 PHE HEy A 113 LEU HDy% 1.0 . 5.17 1586 1586 A 114 ASN H A 113 LEU HDy% 1.0 . 4.53 1587 1587 A 114 ASN HA A 113 LEU HBx 1.0 . 4.46 1588 1588 A 115 LEU HDy% A 97 CYS H 1.0 . 4.45 1589 1589 A 115 LEU HDy% A 97 CYS H 1.0 . 4.64 1590 1590 A 115 LEU HDy% A 118 CYS H 1.0 . 5.49 1591 1591 A 115 LEU HDy% A 118 CYS H 1.0 . 5.50 1592 1592 A 115 LEU HDy% A 99 LYS H 1.0 . 5.50 1593 1593 A 115 LEU HDy% A 99 LYS H 1.0 . 5.50 1594 1594 A 115 LEU HDy% A 119 PHE HDy 1.0 . 5.50 1595 1595 A 115 LEU HDy% A 97 CYS HA 1.0 . 5.25 1596 1596 A 115 LEU HDy% A 97 CYS HA 1.0 . 5.50 1597 1597 A 115 LEU HDy% A 97 CYS HA 1.0 . 5.50 1598 1598 A 115 LEU HDy% A 115 LEU HA 1.0 . 3.19 1599 1599 A 115 LEU HDy% A 94 LYS HA 1.0 . 3.74 1600 1600 A 115 LEU HDy% A 98 GLU HA 1.0 . 3.69 1601 1601 A 115 LEU HDy% A 97 CYS HBy 1.0 . 3.53 1602 1602 A 115 LEU HDy% A 97 CYS HBy 1.0 . 4.04 1603 1603 A 115 LEU HDy% A 118 CYS HBx 1.0 . 4.16 1604 1604 A 115 LEU HDy% A 118 CYS HBx 1.0 . 4.57 1605 1605 A 115 LEU HDy% A 119 PHE HBy 1.0 . 4.23 1606 1606 A 115 LEU HDy% A 97 CYS HBx 1.0 . 3.48 1607 1607 A 115 LEU HDy% A 97 CYS HBx 1.0 . 3.77 1608 1608 A 115 LEU HDy% A 98 GLU HGy 1.0 . 3.67 1609 1609 A 115 LEU HDy% A 98 GLU HGx 1.0 . 3.67 1610 1610 A 115 LEU HDy% A 98 GLU HBx 1.0 . 5.24 1611 1611 A 115 LEU HDy% A 98 GLU HBx 1.0 . 5.50 1612 1612 A 115 LEU HDy% A 101 ILE HB 1.0 . 5.21 1613 1613 A 115 LEU HDy% A 115 LEU HBy 1.0 . 3.44 1614 1614 A 115 LEU HDy% A 139 LEU HDy% 1.0 . 5.03 1615 1615 A 115 LEU HDy% A 139 LEU HDy% 1.0 . 5.50 1616 1616 A 135 ALA HA A 123 ILE HG2% 1.0 . 4.81 1617 1617 A 117 MET HGy A 118 CYS H 1.0 . 4.41 1618 1618 A 117 MET HGy A 114 ASN HA 1.0 . 4.61 1619 1619 A 117 MET HA A 117 MET HGx 1.0 . 4.20 1620 1620 A 118 CYS HA A 117 MET HGx 1.0 . 5.01 1621 1621 A 122 GLU HA A 93 ILE HG2% 1.0 . 5.35 1622 1622 A 122 GLU HA A 93 ILE HG2% 1.0 . 5.50 1623 1623 A 122 GLU HA A 93 ILE HD1% 1.0 . 5.50 1624 1624 A 125 LYS H A 124 HIS HBy 1.0 . 4.45 1625 1625 A 30 MET HA A 34 PHE HDy 1.0 . 5.50 1626 1626 A 38 LYS HA A 41 TYR H 1.0 . 5.50 1627 1627 A 126 LEU HA A 125 LYS HGx 1.0 . 4.73 1628 1628 A 125 LYS HBy A 125 LYS HEx 1.0 . 5.50 1629 1629 A 125 LYS HBy A 125 LYS HEy 1.0 . 5.50 1630 1630 A 126 LEU HDx% A 127 ASP H 1.0 . 5.50 1631 1631 A 126 LEU HDx% A 127 ASP H 1.0 . 5.50 1632 1632 A 126 LEU HDx% A 123 ILE H 1.0 . 5.24 1633 1633 A 126 LEU HDx% A 123 ILE H 1.0 . 5.50 1634 1634 A 126 LEU HG A 123 ILE HA 1.0 . 4.08 1635 1635 A 126 LEU HG A 125 LYS H 1.0 . 5.50 1636 1636 A 127 ASP H A 127 ASP HBx 1.0 . 3.84 1637 1637 A 128 TRP HA A 129 ALA HA 1.0 . 4.50 1638 1638 A 130 PRO HDy A 129 ALA H 1.0 . 4.75 1639 1639 A 130 PRO HDy A 129 ALA HA 1.0 . 3.36 1640 1640 A 130 PRO HDx A 129 ALA HA 1.0 . 3.52 1641 1641 A 130 PRO HDx A 126 LEU HDx% 1.0 . 4.02 1642 1642 A 123 ILE HG2% A 130 PRO HGx 1.0 . 4.15 1643 1643 A 136 VAL HGx% A 132 LEU HDx% 1.0 . 4.14 1644 1644 A 136 VAL HGx% A 132 LEU HDx% 1.0 . 4.70 1645 1645 A 136 VAL HGx% A 132 LEU HDx% 1.0 . 4.72 1646 1646 A 132 LEU HDx% A 37 TRP HBy 1.0 . 4.09 1647 1647 A 132 LEU HA A 132 LEU HDx% 1.0 . 4.01 1648 1648 A 132 LEU HA A 132 LEU HDx% 1.0 . 4.21 1649 1649 A 131 THR HA A 132 LEU HDx% 1.0 . 5.39 1650 1650 A 37 TRP HA A 132 LEU HDx% 1.0 . 4.20 1651 1651 A 132 LEU HDx% A 132 LEU H 1.0 . 4.04 1652 1652 A 37 TRP HE3 A 132 LEU HDx% 1.0 . 4.92 1653 1653 A 37 TRP HE3 A 132 LEU HDx% 1.0 . 5.11 1654 1654 A 37 TRP HD1 A 132 LEU HDx% 1.0 . 5.50 1655 1655 A 37 TRP HD1 A 132 LEU HDx% 1.0 . 5.50 1656 1656 A 132 LEU HDy% A 132 LEU H 1.0 . 4.48 1657 1657 A 132 LEU HDy% A 132 LEU H 1.0 . 5.06 1658 1658 A 132 LEU HDy% A 132 LEU H 1.0 . 5.09 1659 1659 A 132 LEU HA A 132 LEU HDy% 1.0 . 4.21 1660 1660 A 132 LEU HA A 132 LEU HDy% 1.0 . 4.64 1661 1661 A 132 LEU HDy% A 37 TRP HBy 1.0 . 3.99 1662 1662 A 134 VAL H A 134 VAL HGx% 1.0 . 3.29 1663 1663 A 133 ASP H A 134 VAL HGx% 1.0 . 4.60 1664 1664 A 80 HIS H A 134 VAL HGx% 1.0 . 5.33 1665 1665 A 130 PRO HA A 134 VAL HGx% 1.0 . 5.50 1666 1666 A 80 HIS HA A 134 VAL HGx% 1.0 . 5.50 1667 1667 A 135 ALA HA A 134 VAL HGx% 1.0 . 4.55 1668 1668 A 134 VAL HA A 134 VAL HGx% 1.0 . 3.99 1669 1669 A 134 VAL HA A 134 VAL HGx% 1.0 . 4.16 1670 1670 A 134 VAL HGx% A 80 HIS HBy 1.0 . 3.39 1671 1671 A 134 VAL HGx% A 133 ASP HBy 1.0 . 4.70 1672 1672 A 134 VAL HGx% A 133 ASP HBx 1.0 . 4.70 1673 1673 A 134 VAL HGx% A 80 HIS HBx 1.0 . 3.39 1674 1674 A 131 THR HG2% A 134 VAL HGx% 1.0 . 3.72 1675 1675 A 134 VAL HGy% A 134 VAL H 1.0 . 5.09 1676 1676 A 134 VAL HGy% A 134 VAL H 1.0 . 5.50 1677 1677 A 134 VAL HGy% A 134 VAL H 1.0 . 5.50 1678 1678 A 128 TRP HZ3 A 134 VAL HGy% 1.0 . 4.89 1679 1679 A 128 TRP HH2 A 134 VAL HGy% 1.0 . 5.17 1680 1680 A 134 VAL HA A 134 VAL HGy% 1.0 . 3.42 1681 1681 A 134 VAL HA A 134 VAL HGy% 1.0 . 3.91 1682 1682 A 134 VAL HGy% A 77 ALA HA 1.0 . 4.20 1683 1683 A 134 VAL HGy% A 77 ALA HA 1.0 . 3.93 1684 1684 A 82 ALA HB% A 134 VAL HGy% 1.0 . 3.45 1685 1685 A 82 ALA HB% A 134 VAL HGy% 1.0 . 3.34 1686 1686 A 140 LEU H A 139 LEU HDy% 1.0 . 5.50 1687 1687 A 140 LEU H A 139 LEU HDy% 1.0 . 5.50 1688 1688 A 119 PHE H A 139 LEU HDy% 1.0 . 5.50 1689 1689 A 116 ALA HA A 139 LEU HDy% 1.0 . 4.13 1690 1690 A 139 LEU HDy% A 94 LYS HA 1.0 . 4.90 1691 1691 A 139 LEU HDy% A 94 LYS HA 1.0 . 5.48 1692 1692 A 140 LEU HA A 139 LEU HDy% 1.0 . 5.50 1693 1693 A 139 LEU HA A 139 LEU HDy% 1.0 . 3.25 1694 1694 A 119 PHE HBy A 139 LEU HDy% 1.0 . 3.69 1695 1695 A 115 LEU HBx A 139 LEU HDy% 1.0 . 5.50 1696 1696 A 115 LEU HBx A 139 LEU HDy% 1.0 . 5.50 1697 1697 A 139 LEU HDx% A 139 LEU HDy% 1.0 . 2.96 1698 1698 A 55 LEU HDy% A 140 LEU HDx% 1.0 . 4.72 1699 1699 A 140 LEU HBx A 140 LEU HDx% 1.0 . 3.67 1700 1700 A 140 LEU HBy A 140 LEU HDx% 1.0 . 3.53 1701 1701 A 55 LEU HBx A 140 LEU HDx% 1.0 . 3.95 1702 1702 A 55 LEU HBx A 140 LEU HDx% 1.0 . 4.29 1703 1703 A 55 LEU HA A 140 LEU HDx% 1.0 . 4.50 1704 1704 A 56 ALA HA A 140 LEU HDx% 1.0 . 4.73 1705 1705 A 56 ALA HA A 140 LEU HDx% 1.0 . 4.88 1706 1706 A 140 LEU H A 140 LEU HDx% 1.0 . 4.84 1707 1707 A 140 LEU H A 140 LEU HDx% 1.0 . 5.25 1708 1708 A 140 LEU HDy% A 56 ALA H 1.0 . 4.24 1709 1709 A 140 LEU HDy% A 56 ALA H 1.0 . 4.84 1710 1710 A 140 LEU HDy% A 33 PHE HEy 1.0 . 4.97 1711 1711 A 140 LEU HA A 140 LEU HDy% 1.0 . 3.28 1712 1712 A 140 LEU HA A 140 LEU HDy% 1.0 . 3.47 1713 1713 A 143 THR HB A 140 LEU HDy% 1.0 . 4.17 1714 1714 A 140 LEU HBy A 140 LEU HDy% 1.0 . 4.15 1715 1715 A 140 LEU HBx A 140 LEU HDy% 1.0 . 4.16 1716 1716 A 141 ALA HA A 68 LEU HDy% 1.0 . 5.39 1717 1717 A 141 ALA HA A 68 LEU HDy% 1.0 . 5.50 1718 1718 A 143 THR H A 143 THR HG2% 1.0 . 4.82 1719 1719 A 143 THR HB A 143 THR HG2% 1.0 . 2.88 1720 1720 A 116 ALA HB% A 36 PHE HZ 1.0 . 5.14 1721 1721 A 37 TRP HH2 A 132 LEU HDx% 1.0 . 5.50 1722 1722 A 37 TRP HZ2 A 132 LEU HDx% 1.0 . 4.17 1723 1723 A 37 TRP HZ2 A 52 ILE HD1% 1.0 . 5.50 1724 1724 A 41 TYR HDy A 42 GLN HE2x 1.0 . 5.50 1725 1725 A 67 ASN HA A 69 HIS HD2 1.0 . 4.92 1726 1726 A 68 LEU HA A 69 HIS HD2 1.0 . 5.50 1727 1727 A 119 PHE HEy A 90 LEU HA 1.0 . 4.28 1728 1728 A 128 TRP HZ2 A 90 LEU HG 1.0 . 5.50 1729 1729 A 105 ALA H A 106 ASP H 1.0 . 3.22 1730 1730 A 105 ALA H A 104 VAL H 1.0 . 4.27 1731 1731 A 105 ALA H A 107 ASP H 1.0 . 4.23 1732 1732 A 104 VAL HA A 105 ALA H 1.0 . 2.46 1733 1733 A 104 VAL HB A 105 ALA H 1.0 . 4.38 1734 1734 A 105 ALA HB% A 105 ALA H 1.0 . 2.53 1735 1735 A 104 VAL HGx% A 105 ALA H 1.0 . 3.12 1736 1736 A 103 ILE HG2% A 105 ALA H 1.0 . 3.80 1737 1737 A 103 ILE HA A 104 VAL H 1.0 . 2.82 1738 1738 A 111 THR HA A 104 VAL H 1.0 . 4.05 1739 1739 A 104 VAL HB A 104 VAL H 1.0 . 3.43 1740 1740 A 110 GLN HBx A 104 VAL H 1.0 . 4.23 1741 1741 A 104 VAL H A 103 ILE HG1y 1.0 . 4.70 1742 1742 A 102 THR HG2% A 104 VAL H 1.0 . 5.01 1743 1743 A 102 THR HG2% A 104 VAL H 1.0 . 5.26 1744 1744 A 104 VAL HGx% A 104 VAL H 1.0 . 5.39 1745 1745 A 104 VAL HGx% A 104 VAL H 1.0 . 5.50 1746 1746 A 104 VAL HGx% A 104 VAL H 1.0 . 5.50 1747 1747 A 104 VAL HGy% A 104 VAL H 1.0 . 3.17 1748 1748 A 104 VAL HGy% A 104 VAL H 1.0 . 3.40 1749 1749 A 103 ILE H A 104 VAL H 1.0 . 4.34 1750 1750 A 103 ILE H A 102 THR HA 1.0 . 2.68 1751 1751 A 102 THR HB A 103 ILE H 1.0 . 4.46 1752 1752 A 103 ILE HB A 103 ILE H 1.0 . 2.97 1753 1753 A 103 ILE HG1x A 103 ILE H 1.0 . 3.44 1754 1754 A 101 ILE HG1y A 103 ILE H 1.0 . 5.09 1755 1755 A 103 ILE H A 103 ILE HG1y 1.0 . 3.96 1756 1756 A 101 ILE HD1% A 103 ILE H 1.0 . 4.71 1757 1757 A 103 ILE HG2% A 103 ILE H 1.0 . 4.47 1758 1758 A 63 ASP HA A 64 GLN H 1.0 . 2.95 1759 1759 A 64 GLN H A 63 ASP HBy 1.0 . 4.50 1760 1760 A 64 GLN H A 64 GLN HBy 1.0 . 3.73 1761 1761 A 64 GLN H A 64 GLN HBx 1.0 . 3.73 1762 1762 A 43 ILE H A 42 GLN H 1.0 . 4.29 1763 1763 A 43 ILE H A 42 GLN HA 1.0 . 2.69 1764 1764 A 36 PHE HA A 43 ILE H 1.0 . 4.55 1765 1765 A 43 ILE HB A 43 ILE H 1.0 . 3.03 1766 1766 A 43 ILE H A 42 GLN HBx 1.0 . 4.62 1767 1767 A 43 ILE H A 43 ILE HG1y 1.0 . 3.70 1768 1768 A 43 ILE H A 43 ILE HG1x 1.0 . 3.70 1769 1769 A 44 THR HG2% A 43 ILE H 1.0 . 4.66 1770 1770 A 43 ILE HG2% A 43 ILE H 1.0 . 4.88 1771 1771 A 43 ILE HG2% A 43 ILE H 1.0 . 5.19 1772 1772 A 43 ILE H A 43 ILE HD1% 1.0 . 4.50 1773 1773 A 43 ILE H A 43 ILE HD1% 1.0 . 4.67 1774 1774 A 46 ARG H A 45 ASN H 1.0 . 4.71 1775 1775 A 46 ARG H A 45 ASN HA 1.0 . 2.67 1776 1776 A 46 ARG H A 46 ARG HDy 1.0 . 4.59 1777 1777 A 46 ARG H A 46 ARG HDx 1.0 . 4.59 1778 1778 A 46 ARG H A 45 ASN HBx 1.0 . 4.20 1779 1779 A 46 ARG H A 46 ARG HBx 1.0 . 3.23 1780 1780 A 46 ARG H A 46 ARG HGy 1.0 . 2.99 1781 1781 A 46 ARG H A 46 ARG HGx 1.0 . 3.60 1782 1782 A 42 GLN H A 42 GLN HBy 1.0 . 3.75 1783 1783 A 42 GLN H A 42 GLN HBx 1.0 . 3.75 1784 1784 A 41 TYR HDx A 42 GLN H 1.0 . 5.22 1785 1785 A 41 TYR HDy A 42 GLN H 1.0 . 5.44 1786 1786 A 41 TYR HA A 42 GLN H 1.0 . 2.75 1787 1787 A 42 GLN H A 41 TYR HBy 1.0 . 4.47 1788 1788 A 42 GLN H A 41 TYR HBx 1.0 . 4.47 1789 1789 A 20 LYS H A 25 VAL HGy% 1.0 . 5.50 1790 1790 A 20 LYS H A 25 VAL HGy% 1.0 . 5.50 1791 1791 A 22 GLU H A 20 LYS H 1.0 . 4.32 1792 1792 A 20 LYS H A 18 ALA H 1.0 . 4.28 1793 1793 A 21 GLN H A 20 LYS H 1.0 . 3.17 1794 1794 A 39 GLU H A 38 LYS HA 1.0 . 2.71 1795 1795 A 20 LYS H A 20 LYS HBy 1.0 . 2.76 1796 1796 A 115 LEU H A 113 LEU H 1.0 . 4.57 1797 1797 A 115 LEU H A 111 THR HA 1.0 . 4.85 1798 1798 A 115 LEU H A 113 LEU HA 1.0 . 5.27 1799 1799 A 115 LEU H A 114 ASN HBy 1.0 . 3.81 1800 1800 A 115 LEU H A 114 ASN HBx 1.0 . 4.03 1801 1801 A 115 LEU HBx A 115 LEU H 1.0 . 3.40 1802 1802 A 115 LEU H A 101 ILE HB 1.0 . 4.57 1803 1803 A 115 LEU HBy A 115 LEU H 1.0 . 3.39 1804 1804 A 115 LEU H A 111 THR HG2% 1.0 . 5.50 1805 1805 A 116 ALA HB% A 115 LEU H 1.0 . 4.90 1806 1806 A 101 ILE HG2% A 115 LEU H 1.0 . 4.09 1807 1807 A 115 LEU HDx% A 115 LEU H 1.0 . 4.68 1808 1808 A 73 ALA H A 74 MET H 1.0 . 3.10 1809 1809 A 73 ALA H A 72 LYS H 1.0 . 3.39 1810 1810 A 73 ALA H A 72 LYS HA 1.0 . 3.12 1811 1811 A 73 ALA H A 74 MET HA 1.0 . 5.49 1812 1812 A 142 ASP HBy A 73 ALA H 1.0 . 5.50 1813 1813 A 73 ALA H A 72 LYS HBy 1.0 . 4.54 1814 1814 A 73 ALA H A 72 LYS HBx 1.0 . 4.54 1815 1815 A 73 ALA H A 73 ALA HB% 1.0 . 2.88 1816 1816 A 73 ALA H A 73 ALA HB% 1.0 . 3.24 1817 1817 A 73 ALA H A 91 LEU HDx% 1.0 . 5.31 1818 1818 A 73 ALA H A 91 LEU HDy% 1.0 . 5.39 1819 1819 A 73 ALA H A 91 LEU HDy% 1.0 . 5.50 1820 1820 A 78 MET H A 77 ALA H 1.0 . 3.14 1821 1821 A 77 ALA H A 76 PHE H 1.0 . 3.21 1822 1822 A 79 LYS H A 77 ALA H 1.0 . 4.35 1823 1823 A 76 PHE HDy A 77 ALA H 1.0 . 3.71 1824 1824 A 73 ALA HA A 77 ALA H 1.0 . 3.90 1825 1825 A 77 ALA H A 76 PHE HBy 1.0 . 4.12 1826 1826 A 76 PHE HBx A 77 ALA H 1.0 . 3.29 1827 1827 A 78 MET HGx A 77 ALA H 1.0 . 5.50 1828 1828 A 77 ALA H A 78 MET HBy 1.0 . 5.50 1829 1829 A 77 ALA H A 73 ALA HB% 1.0 . 4.24 1830 1830 A 77 ALA HB% A 77 ALA H 1.0 . 2.77 1831 1831 A 133 ASP H A 132 LEU H 1.0 . 3.41 1832 1832 A 132 LEU H A 132 LEU HBy 1.0 . 3.75 1833 1833 A 132 LEU HG A 132 LEU H 1.0 . 4.10 1834 1834 A 131 THR HG2% A 132 LEU H 1.0 . 4.89 1835 1835 A 132 LEU H A 132 LEU HBx 1.0 . 3.75 1836 1836 A 132 LEU H A 131 THR HB 1.0 . 3.77 1837 1837 A 131 THR HA A 132 LEU H 1.0 . 3.03 1838 1838 A 82 ALA H A 81 GLY H 1.0 . 2.97 1839 1839 A 80 HIS H A 82 ALA H 1.0 . 3.71 1840 1840 A 78 MET HA A 82 ALA H 1.0 . 3.41 1841 1841 A 82 ALA H A 80 HIS HBy 1.0 . 4.30 1842 1842 A 82 ALA H A 80 HIS HBx 1.0 . 4.30 1843 1843 A 82 ALA HB% A 82 ALA H 1.0 . 2.90 1844 1844 A 82 ALA HB% A 82 ALA H 1.0 . 3.22 1845 1845 A 82 ALA H A 134 VAL HGx% 1.0 . 4.81 1846 1846 A 82 ALA H A 134 VAL HGx% 1.0 . 5.50 1847 1847 A 1 SER H1 A 2 LYS H 1.0 . 2.80 1848 1848 A 2 LYS H A 2 LYS HDx 1.0 . 5.30 1849 1849 A 2 LYS H A 2 LYS HDy 1.0 . 5.30 1850 1850 A 4 VAL H A 2 LYS H 1.0 . 4.01 1851 1851 A 68 LEU H A 68 LEU HBy 1.0 . 3.90 1852 1852 A 116 ALA H A 112 MET HA 1.0 . 4.26 1853 1853 A 116 ALA H A 113 LEU HA 1.0 . 3.74 1854 1854 A 115 LEU HBx A 116 ALA H 1.0 . 3.30 1855 1855 A 117 MET HGy A 116 ALA H 1.0 . 4.47 1856 1856 A 116 ALA H A 112 MET HBx 1.0 . 5.50 1857 1857 A 116 ALA H A 113 LEU HBx 1.0 . 5.50 1858 1858 A 115 LEU HBy A 116 ALA H 1.0 . 4.25 1859 1859 A 116 ALA HB% A 116 ALA H 1.0 . 2.78 1860 1860 A 101 ILE HG2% A 116 ALA H 1.0 . 5.11 1861 1861 A 115 LEU HDy% A 116 ALA H 1.0 . 5.18 1862 1862 A 115 LEU HDy% A 116 ALA H 1.0 . 5.50 1863 1863 A 115 LEU HDx% A 116 ALA H 1.0 . 4.37 1864 1864 A 116 ALA H A 113 LEU HDy% 1.0 . 5.50 1865 1865 A 116 ALA H A 113 LEU HDy% 1.0 . 5.50 1866 1866 A 116 ALA H A 114 ASN HBy 1.0 . 5.50 1867 1867 A 119 PHE HBx A 116 ALA H 1.0 . 5.50 1868 1868 A 119 PHE H A 121 ALA H 1.0 . 4.42 1869 1869 A 119 PHE H A 118 CYS H 1.0 . 3.23 1870 1870 A 119 PHE HDx A 119 PHE H 1.0 . 4.71 1871 1871 A 116 ALA HA A 119 PHE H 1.0 . 3.64 1872 1872 A 119 PHE H A 97 CYS HBy 1.0 . 4.59 1873 1873 A 119 PHE HBx A 119 PHE H 1.0 . 3.14 1874 1874 A 119 PHE HBy A 119 PHE H 1.0 . 3.09 1875 1875 A 119 PHE H A 97 CYS HBx 1.0 . 4.42 1876 1876 A 119 PHE H A 115 LEU HG 1.0 . 5.50 1877 1877 A 115 LEU HDy% A 119 PHE H 1.0 . 4.08 1878 1878 A 119 PHE H A 115 LEU HDx% 1.0 . 5.50 1879 1879 A 67 ASN HA A 68 LEU H 1.0 . 3.37 1880 1880 A 68 LEU H A 67 ASN HBy 1.0 . 4.65 1881 1881 A 68 LEU H A 68 LEU HDx% 1.0 . 4.85 1882 1882 A 68 LEU HDy% A 68 LEU H 1.0 . 5.50 1883 1883 A 68 LEU HDy% A 68 LEU H 1.0 . 5.50 1884 1884 A 68 LEU H A 69 HIS HD2 1.0 . 4.86 1885 1885 A 68 LEU H A 66 MET HBy 1.0 . 5.06 1886 1886 A 68 LEU H A 67 ASN HBx 1.0 . 4.65 1887 1887 A 68 LEU HG A 68 LEU H 1.0 . 4.35 1888 1888 A 68 LEU H A 68 LEU HBx 1.0 . 3.90 1889 1889 A 142 ASP H A 143 THR H 1.0 . 3.33 1890 1890 A 143 THR HB A 143 THR H 1.0 . 3.47 1891 1891 A 141 ALA HA A 143 THR H 1.0 . 4.45 1892 1892 A 140 LEU HA A 143 THR H 1.0 . 4.49 1893 1893 A 142 ASP HBy A 143 THR H 1.0 . 4.87 1894 1894 A 142 ASP HBx A 143 THR H 1.0 . 4.59 1895 1895 A 141 ALA HB% A 143 THR H 1.0 . 5.50 1896 1896 A 141 ALA HB% A 143 THR H 1.0 . 5.50 1897 1897 A 96 SER HBy A 93 ILE H 1.0 . 5.16 1898 1898 A 94 LYS HA A 93 ILE H 1.0 . 5.50 1899 1899 A 93 ILE H A 91 LEU H 1.0 . 4.43 1900 1900 A 90 LEU HA A 93 ILE H 1.0 . 3.94 1901 1901 A 93 ILE H A 92 ASP HBy 1.0 . 3.99 1902 1902 A 93 ILE H A 92 ASP HBx 1.0 . 3.99 1903 1903 A 89 GLN HGy A 93 ILE H 1.0 . 5.19 1904 1904 A 89 GLN HGx A 93 ILE H 1.0 . 4.57 1905 1905 A 93 ILE HB A 93 ILE H 1.0 . 3.02 1906 1906 A 93 ILE HG1x A 93 ILE H 1.0 . 3.52 1907 1907 A 93 ILE HD1% A 93 ILE H 1.0 . 3.94 1908 1908 A 128 TRP HE3 A 129 ALA H 1.0 . 4.61 1909 1909 A 129 ALA H A 128 TRP H 1.0 . 4.53 1910 1910 A 128 TRP HA A 129 ALA H 1.0 . 3.15 1911 1911 A 130 PRO HDx A 129 ALA H 1.0 . 4.56 1912 1912 A 129 ALA HB% A 129 ALA H 1.0 . 3.46 1913 1913 A 129 ALA HB% A 129 ALA H 1.0 . 3.60 1914 1914 A 48 ALA HA A 51 VAL H 1.0 . 4.04 1915 1915 A 51 VAL H A 50 CYS HBy 1.0 . 3.61 1916 1916 A 51 VAL HB A 51 VAL H 1.0 . 3.27 1917 1917 A 51 VAL H A 47 GLU HBx 1.0 . 4.89 1918 1918 A 29 VAL HGy% A 51 VAL H 1.0 . 5.50 1919 1919 A 51 VAL H A 23 LEU HDx% 1.0 . 5.05 1920 1920 A 113 LEU H A 112 MET H 1.0 . 3.18 1921 1921 A 49 GLY H A 113 LEU H 1.0 . 5.04 1922 1922 A 49 GLY HAx A 113 LEU H 1.0 . 3.78 1923 1923 A 109 CYS HA A 113 LEU H 1.0 . 4.23 1924 1924 A 49 GLY HAy A 113 LEU H 1.0 . 3.94 1925 1925 A 113 LEU H A 112 MET HGx 1.0 . 5.50 1926 1926 A 113 LEU H A 112 MET HGy 1.0 . 5.50 1927 1927 A 113 LEU HG A 113 LEU H 1.0 . 4.53 1928 1928 A 113 LEU HBy A 113 LEU H 1.0 . 3.07 1929 1929 A 111 THR HB A 113 LEU H 1.0 . 5.41 1930 1930 A 112 MET HBx A 113 LEU H 1.0 . 3.16 1931 1931 A 113 LEU HBx A 113 LEU H 1.0 . 3.45 1932 1932 A 53 LEU HDx% A 113 LEU H 1.0 . 5.17 1933 1933 A 70 HIS H A 70 HIS HBy 1.0 . 4.12 1934 1934 A 70 HIS H A 70 HIS HBx 1.0 . 4.12 1935 1935 A 93 ILE H A 92 ASP H 1.0 . 3.26 1936 1936 A 92 ASP H A 94 LYS H 1.0 . 4.46 1937 1937 A 92 ASP H A 91 LEU H 1.0 . 3.16 1938 1938 A 92 ASP H A 89 GLN HA 1.0 . 3.55 1939 1939 A 92 ASP H A 88 LYS HA 1.0 . 4.46 1940 1940 A 92 ASP H A 92 ASP HBy 1.0 . 3.37 1941 1941 A 92 ASP H A 92 ASP HBx 1.0 . 3.37 1942 1942 A 92 ASP H A 91 LEU HBy 1.0 . 3.49 1943 1943 A 92 ASP H A 91 LEU HBx 1.0 . 3.96 1944 1944 A 92 ASP H A 90 LEU H 1.0 . 4.30 1945 1945 A 89 GLN HGy A 92 ASP H 1.0 . 5.50 1946 1946 A 89 GLN HGx A 92 ASP H 1.0 . 5.37 1947 1947 A 93 ILE HB A 92 ASP H 1.0 . 4.88 1948 1948 A 91 LEU HG A 92 ASP H 1.0 . 5.27 1949 1949 A 55 LEU H A 56 ALA H 1.0 . 3.57 1950 1950 A 55 LEU H A 52 ILE HA 1.0 . 4.53 1951 1951 A 55 LEU H A 54 CYS HBx 1.0 . 4.36 1952 1952 A 55 LEU H A 55 LEU HBy 1.0 . 3.27 1953 1953 A 55 LEU H A 55 LEU HG 1.0 . 3.23 1954 1954 A 55 LEU H A 55 LEU HDx% 1.0 . 5.01 1955 1955 A 55 LEU H A 55 LEU HDy% 1.0 . 4.75 1956 1956 A 55 LEU H A 55 LEU HDy% 1.0 . 5.18 1957 1957 A 55 LEU H A 53 LEU H 1.0 . 4.62 1958 1958 A 55 LEU H A 57 LYS H 1.0 . 4.93 1959 1959 A 53 LEU HA A 55 LEU H 1.0 . 4.61 1960 1960 A 55 LEU HBx A 55 LEU H 1.0 . 3.76 1961 1961 A 4 VAL HGy% A 3 GLU H 1.0 . 4.24 1962 1962 A 4 VAL H A 3 GLU H 1.0 . 3.04 1963 1963 A 3 GLU H A 3 GLU HGx 1.0 . 4.20 1964 1964 A 3 GLU H A 3 GLU HGy 1.0 . 4.20 1965 1965 A 3 GLU H A 3 GLU HBy 1.0 . 3.95 1966 1966 A 3 GLU H A 3 GLU HBx 1.0 . 3.95 1967 1967 A 3 GLU H A 2 LYS HBy 1.0 . 4.39 1968 1968 A 3 GLU H A 2 LYS HDy 1.0 . 5.50 1969 1969 A 97 CYS H A 94 LYS H 1.0 . 4.70 1970 1970 A 95 HIS HD2 A 94 LYS H 1.0 . 5.27 1971 1971 A 94 LYS H A 92 ASP HA 1.0 . 4.55 1972 1972 A 93 ILE HG1x A 94 LYS H 1.0 . 4.54 1973 1973 A 94 LYS H A 96 SER H 1.0 . 4.05 1974 1974 A 93 ILE H A 94 LYS H 1.0 . 3.28 1975 1975 A 119 PHE HEy A 94 LYS H 1.0 . 4.09 1976 1976 A 119 PHE HDy A 94 LYS H 1.0 . 4.10 1977 1977 A 90 LEU HA A 94 LYS H 1.0 . 4.96 1978 1978 A 91 LEU HA A 94 LYS H 1.0 . 3.96 1979 1979 A 93 ILE HB A 94 LYS H 1.0 . 3.21 1980 1980 A 94 LYS H A 94 LYS HBy 1.0 . 3.72 1981 1981 A 94 LYS H A 94 LYS HBx 1.0 . 3.72 1982 1982 A 93 ILE HG2% A 94 LYS H 1.0 . 3.74 1983 1983 A 93 ILE HD1% A 94 LYS H 1.0 . 5.50 1984 1984 A 93 ILE HD1% A 94 LYS H 1.0 . 5.50 1985 1985 A 27 ASP H A 29 VAL H 1.0 . 4.32 1986 1986 A 27 ASP H A 26 PRO HA 1.0 . 2.60 1987 1987 A 27 ASP H A 27 ASP HBx 1.0 . 3.43 1988 1988 A 27 ASP H A 26 PRO HBy 1.0 . 3.16 1989 1989 A 27 ASP H A 20 LYS HGx 1.0 . 5.09 1990 1990 A 27 ASP H A 20 LYS HGy 1.0 . 5.50 1991 1991 A 27 ASP H A 26 PRO HBx 1.0 . 3.60 1992 1992 A 27 ASP H A 20 LYS HDx 1.0 . 4.21 1993 1993 A 44 THR HG2% A 45 ASN H 1.0 . 4.84 1994 1994 A 44 THR H A 45 ASN H 1.0 . 2.94 1995 1995 A 45 ASN H A 45 ASN HD2x 1.0 . 5.12 1996 1996 A 43 ILE HA A 45 ASN H 1.0 . 3.68 1997 1997 A 45 ASN HBy A 45 ASN H 1.0 . 3.05 1998 1998 A 43 ILE HG2% A 45 ASN H 1.0 . 3.36 1999 1999 A 113 LEU HDx% A 45 ASN H 1.0 . 5.38 2000 2000 A 113 LEU HDx% A 45 ASN H 1.0 . 5.50 2001 2001 A 48 ALA HB% A 45 ASN H 1.0 . 4.31 2002 2002 A 38 LYS H A 41 TYR H 1.0 . 5.50 2003 2003 A 17 GLU H A 18 ALA H 1.0 . 2.99 2004 2004 A 17 GLU H A 20 LYS H 1.0 . 5.15 2005 2005 A 17 GLU H A 19 CYS H 1.0 . 4.39 2006 2006 A 17 GLU H A 16 MET H 1.0 . 3.05 2007 2007 A 14 LYS HA A 17 GLU H 1.0 . 3.98 2008 2008 A 15 PRO HA A 17 GLU H 1.0 . 4.73 2009 2009 A 17 GLU HGx A 17 GLU H 1.0 . 3.03 2010 2010 A 17 GLU H A 17 GLU HBx 1.0 . 2.78 2011 2011 A 17 GLU H A 13 ALA HB% 1.0 . 4.38 2012 2012 A 4 VAL H A 1 SER HA 1.0 . 4.50 2013 2013 A 4 VAL H A 3 GLU HA 1.0 . 2.98 2014 2014 A 4 VAL H A 4 VAL HGy% 1.0 . 2.92 2015 2015 A 4 VAL H A 4 VAL HB 1.0 . 3.08 2016 2016 A 86 MET H A 85 ALA H 1.0 . 2.63 2017 2017 A 83 ASP HA A 85 ALA H 1.0 . 4.50 2018 2018 A 18 ALA H A 16 MET H 1.0 . 4.31 2019 2019 A 18 ALA H A 16 MET HA 1.0 . 4.79 2020 2020 A 14 LYS HA A 18 ALA H 1.0 . 4.23 2021 2021 A 17 GLU HGx A 18 ALA H 1.0 . 4.08 2022 2022 A 18 ALA H A 17 GLU HGy 1.0 . 4.37 2023 2023 A 17 GLU HBy A 18 ALA H 1.0 . 4.01 2024 2024 A 20 LYS HBx A 18 ALA H 1.0 . 5.50 2025 2025 A 18 ALA HB% A 18 ALA H 1.0 . 2.96 2026 2026 A 18 ALA HB% A 18 ALA H 1.0 . 3.40 2027 2027 A 83 ASP H A 84 GLU H 1.0 . 4.61 2028 2028 A 97 CYS H A 95 HIS H 1.0 . 4.31 2029 2029 A 100 VAL H A 97 CYS H 1.0 . 5.19 2030 2030 A 96 SER HBx A 97 CYS H 1.0 . 3.35 2031 2031 A 96 SER HBy A 97 CYS H 1.0 . 3.87 2032 2032 A 98 GLU H A 97 CYS H 1.0 . 3.10 2033 2033 A 99 LYS H A 97 CYS H 1.0 . 4.25 2034 2034 A 95 HIS HA A 97 CYS H 1.0 . 4.33 2035 2035 A 94 LYS HA A 97 CYS H 1.0 . 3.64 2036 2036 A 97 CYS HBy A 97 CYS H 1.0 . 3.00 2037 2037 A 97 CYS HBx A 97 CYS H 1.0 . 3.51 2038 2038 A 93 ILE HG2% A 97 CYS H 1.0 . 5.08 2039 2039 A 93 ILE HG2% A 97 CYS H 1.0 . 5.36 2040 2040 A 92 ASP H A 89 GLN H 1.0 . 5.19 2041 2041 A 89 GLN H A 88 LYS H 1.0 . 3.04 2042 2042 A 89 GLN H A 90 LEU H 1.0 . 3.19 2043 2043 A 86 MET HA A 89 GLN H 1.0 . 3.62 2044 2044 A 46 ARG H A 48 ALA H 1.0 . 4.46 2045 2045 A 48 ALA H A 49 GLY H 1.0 . 3.13 2046 2046 A 48 ALA H A 45 ASN HA 1.0 . 4.57 2047 2047 A 48 ALA H A 47 GLU HA 1.0 . 3.51 2048 2048 A 48 ALA H A 45 ASN HBx 1.0 . 3.78 2049 2049 A 48 ALA H A 48 ALA HB% 1.0 . 2.68 2050 2050 A 48 ALA H A 51 VAL HGx% 1.0 . 4.59 2051 2051 A 48 ALA H A 50 CYS H 1.0 . 5.26 2052 2052 A 48 ALA H A 46 ARG HA 1.0 . 4.34 2053 2053 A 48 ALA H A 47 GLU HBy 1.0 . 3.53 2054 2054 A 48 ALA H A 47 GLU HBx 1.0 . 3.63 2055 2055 A 48 ALA H A 46 ARG HGy 1.0 . 4.96 2056 2056 A 121 ALA H A 120 LYS H 1.0 . 3.19 2057 2057 A 122 GLU H A 121 ALA H 1.0 . 3.15 2058 2058 A 118 CYS HA A 121 ALA H 1.0 . 3.90 2059 2059 A 121 ALA HB% A 121 ALA H 1.0 . 2.70 2060 2060 A 121 ALA H A 120 LYS HGy 1.0 . 5.42 2061 2061 A 121 ALA H A 120 LYS HGx 1.0 . 5.42 2062 2062 A 123 ILE HG1y A 121 ALA H 1.0 . 4.66 2063 2063 A 33 PHE HA A 32 ASP H 1.0 . 5.41 2064 2064 A 87 ALA H A 84 GLU H 1.0 . 4.82 2065 2065 A 83 ASP HA A 84 GLU H 1.0 . 2.81 2066 2066 A 85 ALA HA A 84 GLU H 1.0 . 5.41 2067 2067 A 84 GLU H A 83 ASP HBy 1.0 . 3.47 2068 2068 A 84 GLU H A 83 ASP HBx 1.0 . 3.47 2069 2069 A 84 GLU H A 84 GLU HGy 1.0 . 3.70 2070 2070 A 84 GLU H A 84 GLU HGx 1.0 . 3.70 2071 2071 A 84 GLU HBx A 84 GLU H 1.0 . 2.84 2072 2072 A 84 GLU HBy A 84 GLU H 1.0 . 3.72 2073 2073 A 85 ALA HB% A 84 GLU H 1.0 . 4.82 2074 2074 A 62 LEU HA A 63 ASP H 1.0 . 3.15 2075 2075 A 63 ASP H A 63 ASP HBy 1.0 . 3.61 2076 2076 A 63 ASP H A 63 ASP HBx 1.0 . 3.61 2077 2077 A 62 LEU HG A 63 ASP H 1.0 . 5.11 2078 2078 A 62 LEU HDx% A 63 ASP H 1.0 . 5.50 2079 2079 A 62 LEU HDx% A 63 ASP H 1.0 . 5.50 2080 2080 A 83 ASP H A 82 ALA HA 1.0 . 2.90 2081 2081 A 86 MET HA A 83 ASP H 1.0 . 5.43 2082 2082 A 83 ASP H A 83 ASP HBy 1.0 . 3.77 2083 2083 A 83 ASP H A 83 ASP HBx 1.0 . 3.77 2084 2084 A 83 ASP H A 86 MET HBy 1.0 . 3.76 2085 2085 A 83 ASP H A 86 MET HBx 1.0 . 3.76 2086 2086 A 46 ARG H A 47 GLU H 1.0 . 3.24 2087 2087 A 48 ALA H A 47 GLU H 1.0 . 3.01 2088 2088 A 49 GLY H A 47 GLU H 1.0 . 4.59 2089 2089 A 47 GLU H A 45 ASN H 1.0 . 5.50 2090 2090 A 50 CYS H A 47 GLU H 1.0 . 5.50 2091 2091 A 47 GLU H A 45 ASN HD2y 1.0 . 4.53 2092 2092 A 45 ASN HA A 47 GLU H 1.0 . 4.17 2093 2093 A 47 GLU HBy A 47 GLU H 1.0 . 2.90 2094 2094 A 47 GLU HBx A 47 GLU H 1.0 . 3.49 2095 2095 A 46 ARG HGy A 47 GLU H 1.0 . 3.43 2096 2096 A 47 GLU H A 45 ASN HD2x 1.0 . 4.29 2097 2097 A 48 ALA HA A 47 GLU H 1.0 . 5.37 2098 2098 A 47 GLU H A 46 ARG HDy 1.0 . 5.22 2099 2099 A 47 GLU H A 46 ARG HDx 1.0 . 5.22 2100 2100 A 45 ASN HBx A 47 GLU H 1.0 . 3.98 2101 2101 A 46 ARG HGx A 47 GLU H 1.0 . 3.51 2102 2102 A 48 ALA HB% A 47 GLU H 1.0 . 4.94 2103 2103 A 113 LEU HDx% A 47 GLU H 1.0 . 5.50 2104 2104 A 113 LEU HDx% A 47 GLU H 1.0 . 5.50 2105 2105 A 39 GLU H A 38 LYS H 1.0 . 4.74 2106 2106 A 38 LYS H A 35 ASN H 1.0 . 5.47 2107 2107 A 36 PHE H A 38 LYS H 1.0 . 4.26 2108 2108 A 38 LYS H A 37 TRP HD1 1.0 . 5.09 2109 2109 A 41 TYR HDx A 38 LYS H 1.0 . 5.08 2110 2110 A 38 LYS H A 37 TRP H 1.0 . 3.19 2111 2111 A 38 LYS H A 35 ASN HA 1.0 . 3.56 2112 2112 A 36 PHE HA A 38 LYS H 1.0 . 4.39 2113 2113 A 38 LYS HBy A 38 LYS H 1.0 . 3.06 2114 2114 A 72 LYS H A 70 HIS HA 1.0 . 4.26 2115 2115 A 73 ALA HA A 72 LYS H 1.0 . 4.87 2116 2116 A 72 LYS H A 72 LYS HBy 1.0 . 4.19 2117 2117 A 141 ALA HB% A 72 LYS H 1.0 . 3.89 2118 2118 A 41 TYR H A 40 GLY H 1.0 . 3.16 2119 2119 A 41 TYR H A 42 GLN H 1.0 . 4.71 2120 2120 A 41 TYR HDy A 41 TYR H 1.0 . 4.25 2121 2121 A 41 TYR H A 39 GLU HA 1.0 . 3.85 2122 2122 A 41 TYR H A 41 TYR HBy 1.0 . 3.61 2123 2123 A 41 TYR H A 41 TYR HBx 1.0 . 3.61 2124 2124 A 41 TYR H A 39 GLU HBx 1.0 . 5.50 2125 2125 A 41 TYR H A 39 GLU HBy 1.0 . 5.50 2126 2126 A 38 LYS HBx A 41 TYR H 1.0 . 4.29 2127 2127 A 85 ALA H A 84 GLU H 1.0 . 3.02 2128 2128 A 88 LYS H A 85 ALA H 1.0 . 5.13 2129 2129 A 85 ALA H A 83 ASP HBy 1.0 . 4.01 2130 2130 A 85 ALA H A 83 ASP HBx 1.0 . 4.01 2131 2131 A 85 ALA H A 85 ALA HB% 1.0 . 2.48 2132 2132 A 75 GLU H A 77 ALA H 1.0 . 4.44 2133 2133 A 75 GLU H A 72 LYS HA 1.0 . 4.63 2134 2134 A 75 GLU H A 75 GLU HBy 1.0 . 3.91 2135 2135 A 75 GLU H A 74 MET HBy 1.0 . 3.28 2136 2136 A 87 ALA H A 88 LYS H 1.0 . 3.02 2137 2137 A 87 ALA H A 83 ASP HA 1.0 . 5.06 2138 2138 A 87 ALA H A 86 MET HA 1.0 . 3.56 2139 2139 A 87 ALA H A 86 MET HBy 1.0 . 3.78 2140 2140 A 87 ALA H A 86 MET HBx 1.0 . 3.78 2141 2141 A 87 ALA H A 87 ALA HB% 1.0 . 2.93 2142 2142 A 87 ALA H A 87 ALA HB% 1.0 . 3.10 2143 2143 A 87 ALA H A 82 ALA HB% 1.0 . 3.43 2144 2144 A 35 ASN H A 32 ASP H 1.0 . 4.91 2145 2145 A 32 ASP H A 31 GLN HE2y 1.0 . 3.94 2146 2146 A 32 ASP H A 30 MET H 1.0 . 4.08 2147 2147 A 32 ASP H A 32 ASP HBy 1.0 . 3.62 2148 2148 A 32 ASP H A 32 ASP HBx 1.0 . 3.62 2149 2149 A 31 GLN H A 32 ASP H 1.0 . 3.04 2150 2150 A 29 VAL HA A 32 ASP H 1.0 . 3.59 2151 2151 A 33 PHE HBx A 32 ASP H 1.0 . 4.85 2152 2152 A 31 GLN HBy A 32 ASP H 1.0 . 4.29 2153 2153 A 86 MET H A 86 MET HBy 1.0 . 3.60 2154 2154 A 86 MET H A 86 MET HBx 1.0 . 3.60 2155 2155 A 86 MET H A 85 ALA HB% 1.0 . 2.91 2156 2156 A 86 MET H A 86 MET HGx 1.0 . 3.77 2157 2157 A 57 LYS H A 58 LYS H 1.0 . 2.96 2158 2158 A 56 ALA HA A 58 LYS H 1.0 . 4.23 2159 2159 A 55 LEU HA A 58 LYS H 1.0 . 3.95 2160 2160 A 58 LYS HBx A 58 LYS H 1.0 . 3.76 2161 2161 A 58 LYS HBy A 58 LYS H 1.0 . 3.20 2162 2162 A 58 LYS H A 58 LYS HGx 1.0 . 4.15 2163 2163 A 58 LYS H A 58 LYS HGy 1.0 . 4.15 2164 2164 A 55 LEU HBx A 58 LYS H 1.0 . 5.17 2165 2165 A 58 LYS H A 59 LEU HDy% 1.0 . 4.38 2166 2166 A 15 PRO HBy A 58 LYS H 1.0 . 5.32 2167 2167 A 69 HIS H A 72 LYS H 1.0 . 4.57 2168 2168 A 69 HIS H A 69 HIS HD2 1.0 . 4.34 2169 2169 A 68 LEU HA A 69 HIS H 1.0 . 3.07 2170 2170 A 69 HIS H A 76 PHE HBy 1.0 . 4.37 2171 2171 A 69 HIS H A 69 HIS HBy 1.0 . 4.02 2172 2172 A 69 HIS H A 69 HIS HBx 1.0 . 4.02 2173 2173 A 141 ALA HB% A 69 HIS H 1.0 . 4.30 2174 2174 A 68 LEU HDy% A 69 HIS H 1.0 . 3.88 2175 2175 A 68 LEU HDy% A 69 HIS H 1.0 . 3.92 2176 2176 A 69 HIS H A 68 LEU H 1.0 . 4.73 2177 2177 A 69 HIS H A 76 PHE HDx 1.0 . 5.50 2178 2178 A 76 PHE HDy A 69 HIS H 1.0 . 5.50 2179 2179 A 126 LEU H A 127 ASP H 1.0 . 4.65 2180 2180 A 128 TRP HD1 A 127 ASP H 1.0 . 3.91 2181 2181 A 126 LEU HA A 127 ASP H 1.0 . 2.81 2182 2182 A 127 ASP H A 127 ASP HBy 1.0 . 3.84 2183 2183 A 127 ASP H A 126 LEU HBy 1.0 . 3.85 2184 2184 A 127 ASP H A 126 LEU HBx 1.0 . 3.85 2185 2185 A 138 GLU HA A 141 ALA H 1.0 . 4.19 2186 2186 A 140 LEU H A 141 ALA H 1.0 . 3.48 2187 2187 A 141 ALA H A 140 LEU HG 1.0 . 5.44 2188 2188 A 141 ALA H A 140 LEU HBy 1.0 . 3.89 2189 2189 A 56 ALA HB% A 141 ALA H 1.0 . 5.50 2190 2190 A 141 ALA H A 73 ALA HB% 1.0 . 5.50 2191 2191 A 141 ALA HB% A 141 ALA H 1.0 . 3.25 2192 2192 A 59 LEU HDx% A 141 ALA H 1.0 . 4.18 2193 2193 A 141 ALA H A 68 LEU HDy% 1.0 . 4.62 2194 2194 A 141 ALA H A 68 LEU HDy% 1.0 . 5.17 2195 2195 A 79 LYS H A 76 PHE H 1.0 . 4.94 2196 2196 A 78 MET HGx A 79 LYS H 1.0 . 4.91 2197 2197 A 79 LYS H A 78 MET HBy 1.0 . 3.96 2198 2198 A 79 LYS H A 78 MET HBx 1.0 . 3.80 2199 2199 A 79 LYS H A 79 LYS HDx 1.0 . 5.50 2200 2200 A 79 LYS H A 79 LYS HDy 1.0 . 5.50 2201 2201 A 79 LYS H A 80 HIS HD2 1.0 . 5.39 2202 2202 A 79 LYS H A 75 GLU HA 1.0 . 4.87 2203 2203 A 79 LYS H A 77 ALA HA 1.0 . 4.68 2204 2204 A 79 LYS H A 79 LYS HBy 1.0 . 3.66 2205 2205 A 79 LYS H A 79 LYS HGx 1.0 . 4.06 2206 2206 A 79 LYS H A 79 LYS HGy 1.0 . 4.06 2207 2207 A 88 LYS HA A 91 LEU H 1.0 . 3.99 2208 2208 A 91 LEU HBy A 91 LEU H 1.0 . 3.40 2209 2209 A 91 LEU HG A 91 LEU H 1.0 . 3.80 2210 2210 A 91 LEU HBx A 91 LEU H 1.0 . 3.73 2211 2211 A 91 LEU HDx% A 91 LEU H 1.0 . 4.40 2212 2212 A 91 LEU HDx% A 91 LEU H 1.0 . 4.81 2213 2213 A 91 LEU HDy% A 91 LEU H 1.0 . 5.39 2214 2214 A 91 LEU HDy% A 91 LEU H 1.0 . 5.50 2215 2215 A 88 LYS H A 88 LYS HBx 1.0 . 2.88 2216 2216 A 114 ASN H A 110 GLN HBx 1.0 . 5.24 2217 2217 A 110 GLN HE2x A 114 ASN H 1.0 . 5.25 2218 2218 A 110 GLN HGx A 114 ASN H 1.0 . 4.46 2219 2219 A 88 LYS H A 88 LYS HGy 1.0 . 4.39 2220 2220 A 88 LYS H A 88 LYS HGx 1.0 . 4.39 2221 2221 A 116 ALA H A 114 ASN H 1.0 . 4.66 2222 2222 A 114 ASN H A 113 LEU H 1.0 . 3.09 2223 2223 A 114 ASN HD2x A 114 ASN H 1.0 . 4.22 2224 2224 A 110 GLN HA A 114 ASN H 1.0 . 3.61 2225 2225 A 114 ASN HBy A 114 ASN H 1.0 . 3.28 2226 2226 A 114 ASN HBx A 114 ASN H 1.0 . 3.69 2227 2227 A 114 ASN H A 113 LEU HBy 1.0 . 3.77 2228 2228 A 101 ILE HD1% A 114 ASN H 1.0 . 4.61 2229 2229 A 114 ASN H A 113 LEU HDx% 1.0 . 4.91 2230 2230 A 101 ILE HG2% A 114 ASN H 1.0 . 5.50 2231 2231 A 26 PRO HA A 28 ALA H 1.0 . 4.36 2232 2232 A 27 ASP HA A 28 ALA H 1.0 . 3.55 2233 2233 A 26 PRO HBx A 28 ALA H 1.0 . 4.14 2234 2234 A 26 PRO HBy A 28 ALA H 1.0 . 3.08 2235 2235 A 28 ALA HB% A 28 ALA H 1.0 . 2.48 2236 2236 A 29 VAL HGx% A 28 ALA H 1.0 . 4.73 2237 2237 A 29 VAL HGx% A 28 ALA H 1.0 . 5.32 2238 2238 A 22 GLU H A 24 ASN H 1.0 . 3.88 2239 2239 A 18 ALA HB% A 22 GLU H 1.0 . 4.87 2240 2240 A 23 LEU H A 22 GLU H 1.0 . 3.12 2241 2241 A 22 GLU H A 21 GLN H 1.0 . 3.13 2242 2242 A 22 GLU H A 18 ALA HA 1.0 . 4.24 2243 2243 A 22 GLU H A 22 GLU HGy 1.0 . 4.78 2244 2244 A 22 GLU HBy A 22 GLU H 1.0 . 2.75 2245 2245 A 22 GLU HBx A 22 GLU H 1.0 . 3.11 2246 2246 A 114 ASN H A 112 MET H 1.0 . 4.84 2247 2247 A 115 LEU H A 112 MET H 1.0 . 5.29 2248 2248 A 111 THR HB A 112 MET H 1.0 . 3.36 2249 2249 A 109 CYS HA A 112 MET H 1.0 . 3.86 2250 2250 A 112 MET HBy A 112 MET H 1.0 . 3.10 2251 2251 A 112 MET HBx A 112 MET H 1.0 . 3.33 2252 2252 A 111 THR HG2% A 112 MET H 1.0 . 4.66 2253 2253 A 111 THR HG2% A 112 MET H 1.0 . 5.04 2254 2254 A 113 LEU HBy A 112 MET H 1.0 . 5.35 2255 2255 A 53 LEU HDx% A 112 MET H 1.0 . 4.38 2256 2256 A 65 ASP H A 64 GLN H 1.0 . 3.33 2257 2257 A 67 ASN H A 65 ASP H 1.0 . 4.21 2258 2258 A 65 ASP H A 66 MET H 1.0 . 3.29 2259 2259 A 65 ASP H A 65 ASP HBx 1.0 . 3.71 2260 2260 A 65 ASP H A 64 GLN HGy 1.0 . 4.07 2261 2261 A 65 ASP H A 64 GLN HBy 1.0 . 4.24 2262 2262 A 65 ASP H A 64 GLN HBx 1.0 . 4.24 2263 2263 A 29 VAL H A 28 ALA H 1.0 . 3.12 2264 2264 A 126 LEU H A 125 LYS H 1.0 . 3.00 2265 2265 A 126 LEU H A 124 HIS HA 1.0 . 4.40 2266 2266 A 126 LEU H A 123 ILE HA 1.0 . 3.97 2267 2267 A 126 LEU H A 125 LYS HBy 1.0 . 4.32 2268 2268 A 126 LEU H A 125 LYS HBx 1.0 . 3.98 2269 2269 A 126 LEU HG A 126 LEU H 1.0 . 3.80 2270 2270 A 126 LEU H A 126 LEU HBx 1.0 . 3.96 2271 2271 A 126 LEU H A 126 LEU HDx% 1.0 . 3.80 2272 2272 A 99 LYS H A 98 GLU H 1.0 . 3.20 2273 2273 A 98 GLU H A 95 HIS HA 1.0 . 3.70 2274 2274 A 97 CYS HBy A 98 GLU H 1.0 . 3.56 2275 2275 A 98 GLU H A 95 HIS HBx 1.0 . 5.50 2276 2276 A 98 GLU H A 95 HIS HBy 1.0 . 5.50 2277 2277 A 97 CYS HBx A 98 GLU H 1.0 . 3.71 2278 2278 A 101 ILE HG1x A 98 GLU H 1.0 . 4.55 2279 2279 A 115 LEU HDy% A 98 GLU H 1.0 . 3.80 2280 2280 A 115 LEU HDy% A 98 GLU H 1.0 . 3.94 2281 2281 A 101 ILE HD1% A 98 GLU H 1.0 . 5.50 2282 2282 A 33 PHE H A 35 ASN H 1.0 . 4.39 2283 2283 A 33 PHE H A 34 PHE HDy 1.0 . 4.53 2284 2284 A 33 PHE H A 30 MET H 1.0 . 5.50 2285 2285 A 33 PHE H A 34 PHE H 1.0 . 3.14 2286 2286 A 30 MET HA A 33 PHE H 1.0 . 4.15 2287 2287 A 33 PHE H A 31 GLN HA 1.0 . 4.47 2288 2288 A 33 PHE HBx A 33 PHE H 1.0 . 2.99 2289 2289 A 33 PHE HBy A 33 PHE H 1.0 . 2.96 2290 2290 A 50 CYS H A 51 VAL H 1.0 . 3.27 2291 2291 A 52 ILE H A 51 VAL H 1.0 . 3.47 2292 2292 A 54 CYS H A 52 ILE H 1.0 . 4.13 2293 2293 A 50 CYS H A 49 GLY H 1.0 . 3.00 2294 2294 A 50 CYS H A 47 GLU HA 1.0 . 3.49 2295 2295 A 52 ILE H A 48 ALA HA 1.0 . 4.45 2296 2296 A 109 CYS HA A 50 CYS H 1.0 . 4.62 2297 2297 A 50 CYS H A 109 CYS HBy 1.0 . 4.42 2298 2298 A 49 GLY HAy A 52 ILE H 1.0 . 4.29 2299 2299 A 50 CYS H A 50 CYS HBy 1.0 . 3.18 2300 2300 A 50 CYS H A 47 GLU HGx 1.0 . 5.50 2301 2301 A 50 CYS H A 47 GLU HGy 1.0 . 5.50 2302 2302 A 46 ARG HA A 50 CYS H 1.0 . 5.50 2303 2303 A 53 LEU HA A 52 ILE H 1.0 . 5.50 2304 2304 A 52 ILE HG1x A 52 ILE H 1.0 . 3.69 2305 2305 A 50 CYS H A 47 GLU HBx 1.0 . 4.86 2306 2306 A 52 ILE H A 52 ILE HB 1.0 . 3.34 2307 2307 A 53 LEU HG A 52 ILE H 1.0 . 4.19 2308 2308 A 52 ILE H A 51 VAL HGx% 1.0 . 3.25 2309 2309 A 52 ILE H A 51 VAL HGy% 1.0 . 3.69 2310 2310 A 36 PHE H A 34 PHE H 1.0 . 4.23 2311 2311 A 36 PHE H A 37 TRP H 1.0 . 3.40 2312 2312 A 36 PHE H A 36 PHE HBy 1.0 . 3.01 2313 2313 A 36 PHE H A 36 PHE HBx 1.0 . 3.01 2314 2314 A 36 PHE H A 43 ILE HG1y 1.0 . 4.83 2315 2315 A 114 ASN HD2x A 102 THR H 1.0 . 4.01 2316 2316 A 101 ILE HA A 102 THR H 1.0 . 2.84 2317 2317 A 102 THR HB A 102 THR H 1.0 . 3.04 2318 2318 A 114 ASN HBy A 102 THR H 1.0 . 4.52 2319 2319 A 114 ASN HBx A 102 THR H 1.0 . 4.00 2320 2320 A 101 ILE HB A 102 THR H 1.0 . 3.08 2321 2321 A 101 ILE HG1y A 102 THR H 1.0 . 4.34 2322 2322 A 101 ILE HD1% A 102 THR H 1.0 . 4.78 2323 2323 A 101 ILE HD1% A 102 THR H 1.0 . 5.03 2324 2324 A 59 LEU H A 58 LYS H 1.0 . 3.27 2325 2325 A 59 LEU H A 62 LEU H 1.0 . 5.23 2326 2326 A 59 LEU H A 57 LYS HA 1.0 . 4.42 2327 2327 A 59 LEU H A 58 LYS HBx 1.0 . 4.47 2328 2328 A 59 LEU H A 59 LEU HG 1.0 . 3.14 2329 2329 A 59 LEU H A 59 LEU HBy 1.0 . 3.76 2330 2330 A 59 LEU H A 59 LEU HBx 1.0 . 3.76 2331 2331 A 59 LEU H A 59 LEU HDy% 1.0 . 3.32 2332 2332 A 96 SER H A 95 HIS H 1.0 . 2.97 2333 2333 A 97 CYS H A 96 SER H 1.0 . 3.00 2334 2334 A 93 ILE H A 96 SER H 1.0 . 5.00 2335 2335 A 96 SER HBx A 96 SER H 1.0 . 3.02 2336 2336 A 96 SER HBy A 96 SER H 1.0 . 3.18 2337 2337 A 93 ILE HA A 96 SER H 1.0 . 3.86 2338 2338 A 97 CYS HBy A 96 SER H 1.0 . 4.47 2339 2339 A 93 ILE HG2% A 96 SER H 1.0 . 5.50 2340 2340 A 93 ILE HG2% A 96 SER H 1.0 . 5.50 2341 2341 A 62 LEU H A 60 GLU H 1.0 . 4.47 2342 2342 A 61 LEU H A 62 LEU H 1.0 . 3.04 2343 2343 A 61 LEU HA A 62 LEU H 1.0 . 3.57 2344 2344 A 59 LEU HA A 62 LEU H 1.0 . 4.13 2345 2345 A 62 LEU H A 62 LEU HBy 1.0 . 3.67 2346 2346 A 61 LEU HBx A 62 LEU H 1.0 . 3.96 2347 2347 A 61 LEU HBy A 62 LEU H 1.0 . 3.39 2348 2348 A 62 LEU HG A 62 LEU H 1.0 . 3.62 2349 2349 A 62 LEU H A 62 LEU HBx 1.0 . 3.67 2350 2350 A 62 LEU H A 63 ASP H 1.0 . 4.68 2351 2351 A 138 GLU H A 137 GLY H 1.0 . 3.27 2352 2352 A 138 GLU H A 138 GLU HGy 1.0 . 3.77 2353 2353 A 138 GLU H A 138 GLU HBy 1.0 . 3.31 2354 2354 A 138 GLU H A 136 VAL H 1.0 . 4.97 2355 2355 A 138 GLU H A 138 GLU HGx 1.0 . 3.77 2356 2356 A 138 GLU H A 138 GLU HBx 1.0 . 3.68 2357 2357 A 138 GLU H A 77 ALA HB% 1.0 . 5.50 2358 2358 A 138 GLU H A 77 ALA HB% 1.0 . 5.50 2359 2359 A 138 GLU H A 76 PHE HDy 1.0 . 4.91 2360 2360 A 123 ILE H A 121 ALA H 1.0 . 4.82 2361 2361 A 138 GLU H A 77 ALA HA 1.0 . 5.50 2362 2362 A 122 GLU H A 120 LYS H 1.0 . 4.49 2363 2363 A 120 LYS H A 120 LYS HBy 1.0 . 3.72 2364 2364 A 119 PHE HDx A 120 LYS H 1.0 . 3.85 2365 2365 A 36 PHE HZ A 120 LYS H 1.0 . 5.50 2366 2366 A 117 MET HA A 120 LYS H 1.0 . 4.47 2367 2367 A 119 PHE HBx A 120 LYS H 1.0 . 3.37 2368 2368 A 119 PHE HBy A 120 LYS H 1.0 . 4.10 2369 2369 A 120 LYS H A 120 LYS HBx 1.0 . 3.72 2370 2370 A 121 ALA HB% A 120 LYS H 1.0 . 4.67 2371 2371 A 123 ILE HG1y A 120 LYS H 1.0 . 5.35 2372 2372 A 75 GLU H A 76 PHE H 1.0 . 3.37 2373 2373 A 76 PHE H A 76 PHE HBy 1.0 . 3.32 2374 2374 A 76 PHE HBx A 76 PHE H 1.0 . 3.14 2375 2375 A 78 MET H A 76 PHE H 1.0 . 4.42 2376 2376 A 76 PHE HDx A 76 PHE H 1.0 . 5.33 2377 2377 A 76 PHE HDy A 76 PHE H 1.0 . 5.50 2378 2378 A 76 PHE H A 75 GLU HBy 1.0 . 3.51 2379 2379 A 76 PHE H A 75 GLU HBx 1.0 . 3.51 2380 2380 A 73 ALA H A 76 PHE H 1.0 . 4.93 2381 2381 A 21 GLN H A 24 ASN H 1.0 . 4.99 2382 2382 A 24 ASN H A 23 LEU HBx 1.0 . 4.33 2383 2383 A 74 MET H A 76 PHE H 1.0 . 4.82 2384 2384 A 24 ASN H A 24 ASN HD2x 1.0 . 4.56 2385 2385 A 24 ASN H A 24 ASN HBy 1.0 . 4.00 2386 2386 A 24 ASN H A 23 LEU HBy 1.0 . 3.67 2387 2387 A 30 MET H A 30 MET HGy 1.0 . 3.50 2388 2388 A 30 MET H A 31 GLN HGy 1.0 . 4.30 2389 2389 A 30 MET H A 30 MET HGx 1.0 . 3.50 2390 2390 A 31 GLN HBx A 30 MET H 1.0 . 5.16 2391 2391 A 30 MET HBx A 30 MET H 1.0 . 3.30 2392 2392 A 30 MET H A 29 VAL HB 1.0 . 4.15 2393 2393 A 30 MET H A 29 VAL HGx% 1.0 . 4.81 2394 2394 A 30 MET H A 29 VAL HGx% 1.0 . 5.23 2395 2395 A 29 VAL HGy% A 30 MET H 1.0 . 3.77 2396 2396 A 30 MET H A 25 VAL HGy% 1.0 . 4.46 2397 2397 A 28 ALA HA A 30 MET H 1.0 . 5.28 2398 2398 A 30 MET H A 20 LYS HDx 1.0 . 5.50 2399 2399 A 30 MET H A 20 LYS HGx 1.0 . 4.52 2400 2400 A 30 MET H A 20 LYS HGy 1.0 . 4.93 2401 2401 A 117 MET H A 115 LEU H 1.0 . 4.58 2402 2402 A 36 PHE HZ A 117 MET H 1.0 . 4.54 2403 2403 A 114 ASN HA A 117 MET H 1.0 . 4.02 2404 2404 A 117 MET H A 113 LEU HA 1.0 . 4.40 2405 2405 A 117 MET HBx A 117 MET H 1.0 . 3.32 2406 2406 A 117 MET HBy A 117 MET H 1.0 . 3.80 2407 2407 A 117 MET H A 117 MET HGx 1.0 . 3.52 2408 2408 A 117 MET HGy A 117 MET H 1.0 . 3.44 2409 2409 A 116 ALA HB% A 117 MET H 1.0 . 3.28 2410 2410 A 117 MET H A 113 LEU HDy% 1.0 . 4.46 2411 2411 A 127 ASP H A 128 TRP H 1.0 . 3.16 2412 2412 A 128 TRP HD1 A 128 TRP H 1.0 . 2.98 2413 2413 A 127 ASP HA A 128 TRP H 1.0 . 3.52 2414 2414 A 126 LEU HA A 128 TRP H 1.0 . 4.12 2415 2415 A 128 TRP H A 128 TRP HBy 1.0 . 3.95 2416 2416 A 128 TRP H A 128 TRP HBx 1.0 . 3.95 2417 2417 A 128 TRP H A 126 LEU HBy 1.0 . 3.48 2418 2418 A 128 TRP H A 126 LEU HBx 1.0 . 3.48 2419 2419 A 126 LEU HDy% A 128 TRP H 1.0 . 4.88 2420 2420 A 126 LEU HDy% A 128 TRP H 1.0 . 5.49 2421 2421 A 126 LEU H A 128 TRP H 1.0 . 5.15 2422 2422 A 55 LEU H A 54 CYS H 1.0 . 3.08 2423 2423 A 54 CYS H A 51 VAL HA 1.0 . 3.86 2424 2424 A 54 CYS H A 54 CYS HBx 1.0 . 3.64 2425 2425 A 54 CYS H A 53 LEU HBy 1.0 . 4.26 2426 2426 A 54 CYS H A 51 VAL H 1.0 . 4.99 2427 2427 A 54 CYS H A 53 LEU H 1.0 . 3.23 2428 2428 A 54 CYS H A 50 CYS HA 1.0 . 4.79 2429 2429 A 53 LEU HA A 56 ALA H 1.0 . 4.25 2430 2430 A 123 ILE HB A 123 ILE H 1.0 . 3.79 2431 2431 A 123 ILE H A 123 ILE HG1y 1.0 . 3.05 2432 2432 A 93 ILE HD1% A 123 ILE H 1.0 . 4.19 2433 2433 A 93 ILE HD1% A 123 ILE H 1.0 . 4.67 2434 2434 A 23 LEU H A 24 ASN H 1.0 . 2.96 2435 2435 A 25 VAL H A 24 ASN H 1.0 . 3.17 2436 2436 A 24 ASN HA A 24 ASN H 1.0 . 2.63 2437 2437 A 21 GLN HA A 24 ASN H 1.0 . 3.63 2438 2438 A 24 ASN H A 24 ASN HBx 1.0 . 4.00 2439 2439 A 23 LEU HDy% A 24 ASN H 1.0 . 5.03 2440 2440 A 24 ASN H A 25 VAL HGy% 1.0 . 4.07 2441 2441 A 36 PHE H A 35 ASN H 1.0 . 3.08 2442 2442 A 35 ASN H A 31 GLN HE2y 1.0 . 5.50 2443 2443 A 35 ASN H A 34 PHE HDy 1.0 . 4.71 2444 2444 A 35 ASN H A 34 PHE H 1.0 . 3.03 2445 2445 A 32 ASP HA A 35 ASN H 1.0 . 3.52 2446 2446 A 33 PHE HA A 35 ASN H 1.0 . 4.57 2447 2447 A 35 ASN H A 34 PHE HBx 1.0 . 4.28 2448 2448 A 35 ASN H A 35 ASN HBy 1.0 . 3.55 2449 2449 A 35 ASN H A 35 ASN HBx 1.0 . 3.55 2450 2450 A 43 ILE HD1% A 35 ASN H 1.0 . 4.43 2451 2451 A 54 CYS H A 53 LEU HBx 1.0 . 4.26 2452 2452 A 56 ALA H A 143 THR HG2% 1.0 . 5.50 2453 2453 A 56 ALA H A 143 THR HG2% 1.0 . 5.50 2454 2454 A 54 CYS H A 53 LEU HDy% 1.0 . 3.71 2455 2455 A 56 ALA H A 140 LEU HDx% 1.0 . 4.97 2456 2456 A 56 ALA H A 140 LEU HDx% 1.0 . 5.08 2457 2457 A 140 LEU HG A 56 ALA H 1.0 . 5.50 2458 2458 A 140 LEU HBy A 56 ALA H 1.0 . 5.50 2459 2459 A 56 ALA H A 55 LEU HDx% 1.0 . 5.50 2460 2460 A 56 ALA H A 55 LEU HDx% 1.0 . 5.50 2461 2461 A 122 GLU H A 124 HIS H 1.0 . 4.10 2462 2462 A 123 ILE H A 124 HIS H 1.0 . 3.12 2463 2463 A 124 HIS H A 121 ALA H 1.0 . 4.85 2464 2464 A 126 LEU H A 124 HIS H 1.0 . 4.27 2465 2465 A 124 HIS H A 121 ALA HA 1.0 . 3.93 2466 2466 A 120 LYS HA A 124 HIS H 1.0 . 4.49 2467 2467 A 124 HIS H A 124 HIS HBy 1.0 . 3.14 2468 2468 A 124 HIS H A 124 HIS HBx 1.0 . 3.14 2469 2469 A 122 GLU HBy A 124 HIS H 1.0 . 5.19 2470 2470 A 125 LYS HBx A 124 HIS H 1.0 . 4.66 2471 2471 A 123 ILE HB A 124 HIS H 1.0 . 4.19 2472 2472 A 123 ILE HG1x A 124 HIS H 1.0 . 3.64 2473 2473 A 123 ILE HG1y A 124 HIS H 1.0 . 4.12 2474 2474 A 123 ILE HD1% A 124 HIS H 1.0 . 5.50 2475 2475 A 123 ILE HD1% A 124 HIS H 1.0 . 5.50 2476 2476 A 139 LEU H A 135 ALA HA 1.0 . 5.26 2477 2477 A 139 LEU H A 141 ALA H 1.0 . 4.29 2478 2478 A 138 GLU H A 139 LEU H 1.0 . 3.13 2479 2479 A 140 LEU H A 139 LEU H 1.0 . 3.39 2480 2480 A 139 LEU H A 137 GLY H 1.0 . 4.44 2481 2481 A 139 LEU H A 136 VAL HA 1.0 . 3.70 2482 2482 A 139 LEU H A 138 GLU HBy 1.0 . 3.63 2483 2483 A 139 LEU H A 139 LEU HBy 1.0 . 3.56 2484 2484 A 139 LEU H A 139 LEU HBx 1.0 . 3.56 2485 2485 A 139 LEU H A 139 LEU HDx% 1.0 . 5.29 2486 2486 A 139 LEU H A 139 LEU HDx% 1.0 . 5.50 2487 2487 A 139 LEU H A 139 LEU HDy% 1.0 . 4.76 2488 2488 A 123 ILE H A 122 GLU H 1.0 . 3.07 2489 2489 A 122 GLU H A 118 CYS HA 1.0 . 4.97 2490 2490 A 122 GLU H A 122 GLU HGy 1.0 . 4.02 2491 2491 A 122 GLU H A 122 GLU HBy 1.0 . 3.20 2492 2492 A 121 ALA HB% A 122 GLU H 1.0 . 3.09 2493 2493 A 123 ILE HG1y A 122 GLU H 1.0 . 4.47 2494 2494 A 122 GLU H A 93 ILE HG2% 1.0 . 3.90 2495 2495 A 123 ILE H A 125 LYS H 1.0 . 4.40 2496 2496 A 124 HIS H A 125 LYS H 1.0 . 3.02 2497 2497 A 122 GLU HA A 125 LYS H 1.0 . 3.86 2498 2498 A 123 ILE HA A 125 LYS H 1.0 . 4.17 2499 2499 A 125 LYS H A 124 HIS HBx 1.0 . 4.45 2500 2500 A 125 LYS H A 125 LYS HBy 1.0 . 3.85 2501 2501 A 125 LYS HBx A 125 LYS H 1.0 . 3.19 2502 2502 A 125 LYS HGy A 125 LYS H 1.0 . 3.68 2503 2503 A 126 LEU HDx% A 125 LYS H 1.0 . 5.44 2504 2504 A 66 MET H A 68 LEU H 1.0 . 4.68 2505 2505 A 66 MET H A 67 ASN HA 1.0 . 4.98 2506 2506 A 64 GLN HA A 66 MET H 1.0 . 4.27 2507 2507 A 66 MET H A 65 ASP HBy 1.0 . 3.95 2508 2508 A 66 MET H A 66 MET HBy 1.0 . 4.11 2509 2509 A 66 MET H A 65 ASP HBx 1.0 . 3.95 2510 2510 A 66 MET HBx A 66 MET H 1.0 . 3.41 2511 2511 A 61 LEU H A 60 GLU H 1.0 . 3.30 2512 2512 A 58 LYS HA A 61 LEU H 1.0 . 4.35 2513 2513 A 61 LEU H A 62 LEU HA 1.0 . 5.31 2514 2514 A 59 LEU HA A 61 LEU H 1.0 . 4.12 2515 2515 A 61 LEU H A 60 GLU HBy 1.0 . 4.22 2516 2516 A 61 LEU H A 60 GLU HGx 1.0 . 4.72 2517 2517 A 61 LEU H A 60 GLU HBx 1.0 . 4.22 2518 2518 A 61 LEU HG A 61 LEU H 1.0 . 3.67 2519 2519 A 61 LEU H A 61 LEU HBy 1.0 . 3.29 2520 2520 A 61 LEU H A 61 LEU HDy% 1.0 . 3.73 2521 2521 A 61 LEU H A 61 LEU HDy% 1.0 . 3.82 2522 2522 A 56 ALA H A 57 LYS H 1.0 . 3.16 2523 2523 A 54 CYS HA A 57 LYS H 1.0 . 3.78 2524 2524 A 55 LEU HA A 57 LYS H 1.0 . 4.35 2525 2525 A 80 HIS H A 79 LYS HBy 1.0 . 4.13 2526 2526 A 56 ALA HB% A 57 LYS H 1.0 . 3.76 2527 2527 A 56 ALA HB% A 57 LYS H 1.0 . 3.88 2528 2528 A 57 LYS H A 59 LEU HDy% 1.0 . 5.28 2529 2529 A 57 LYS H A 59 LEU HDy% 1.0 . 5.50 2530 2530 A 57 LYS H A 53 LEU HDy% 1.0 . 5.50 2531 2531 A 55 LEU HBx A 57 LYS H 1.0 . 5.50 2532 2532 A 93 ILE H A 95 HIS H 1.0 . 4.80 2533 2533 A 98 GLU H A 95 HIS H 1.0 . 4.91 2534 2534 A 94 LYS H A 95 HIS H 1.0 . 3.22 2535 2535 A 95 HIS HD2 A 95 HIS H 1.0 . 3.95 2536 2536 A 92 ASP HA A 95 HIS H 1.0 . 3.95 2537 2537 A 96 SER HBx A 95 HIS H 1.0 . 5.50 2538 2538 A 95 HIS H A 94 LYS HBy 1.0 . 4.01 2539 2539 A 95 HIS H A 94 LYS HBx 1.0 . 4.01 2540 2540 A 79 LYS H A 80 HIS H 1.0 . 3.10 2541 2541 A 80 HIS H A 78 MET HA 1.0 . 4.30 2542 2542 A 142 ASP HBx A 142 ASP H 1.0 . 3.18 2543 2543 A 142 ASP H A 141 ALA H 1.0 . 3.50 2544 2544 A 142 ASP HBy A 142 ASP H 1.0 . 3.39 2545 2545 A 80 HIS H A 79 LYS HBx 1.0 . 4.13 2546 2546 A 141 ALA HB% A 142 ASP H 1.0 . 3.93 2547 2547 A 142 ASP H A 91 LEU HDy% 1.0 . 4.25 2548 2548 A 20 LYS H A 19 CYS H 1.0 . 3.09 2549 2549 A 18 ALA H A 19 CYS H 1.0 . 3.12 2550 2550 A 16 MET HA A 19 CYS H 1.0 . 4.10 2551 2551 A 19 CYS H A 19 CYS HBy 1.0 . 3.67 2552 2552 A 19 CYS H A 19 CYS HBx 1.0 . 3.67 2553 2553 A 18 ALA HB% A 19 CYS H 1.0 . 3.00 2554 2554 A 78 MET H A 79 LYS H 1.0 . 3.29 2555 2555 A 13 ALA HA A 16 MET H 1.0 . 3.98 2556 2556 A 78 MET H A 75 GLU HA 1.0 . 3.86 2557 2557 A 78 MET HGx A 78 MET H 1.0 . 3.25 2558 2558 A 17 GLU HGx A 16 MET H 1.0 . 4.37 2559 2559 A 78 MET H A 78 MET HBy 1.0 . 3.32 2560 2560 A 16 MET H A 15 PRO HGy 1.0 . 3.28 2561 2561 A 16 MET H A 16 MET HBx 1.0 . 3.60 2562 2562 A 78 MET H A 77 ALA HB% 1.0 . 3.12 2563 2563 A 78 MET H A 80 HIS H 1.0 . 4.33 2564 2564 A 53 LEU H A 53 LEU HBx 1.0 . 3.83 2565 2565 A 53 LEU H A 52 ILE HB 1.0 . 3.74 2566 2566 A 31 GLN H A 29 VAL H 1.0 . 4.05 2567 2567 A 29 VAL H A 27 ASP HA 1.0 . 4.15 2568 2568 A 29 VAL H A 26 PRO HBy 1.0 . 3.93 2569 2569 A 26 PRO HGy A 29 VAL H 1.0 . 3.42 2570 2570 A 29 VAL HB A 29 VAL H 1.0 . 3.69 2571 2571 A 28 ALA HB% A 29 VAL H 1.0 . 3.44 2572 2572 A 29 VAL HGx% A 29 VAL H 1.0 . 3.03 2573 2573 A 29 VAL HGx% A 29 VAL H 1.0 . 3.49 2574 2574 A 29 VAL HGy% A 29 VAL H 1.0 . 4.59 2575 2575 A 140 LEU H A 140 LEU HG 1.0 . 3.30 2576 2576 A 140 LEU H A 140 LEU HBy 1.0 . 3.41 2577 2577 A 140 LEU H A 140 LEU HDy% 1.0 . 4.47 2578 2578 A 74 MET H A 75 GLU H 1.0 . 3.12 2579 2579 A 74 MET H A 77 ALA H 1.0 . 5.11 2580 2580 A 74 MET H A 72 LYS HA 1.0 . 4.03 2581 2581 A 74 MET H A 74 MET HGy 1.0 . 3.53 2582 2582 A 74 MET H A 74 MET HGx 1.0 . 3.53 2583 2583 A 74 MET H A 74 MET HBx 1.0 . 3.70 2584 2584 A 74 MET H A 74 MET HBy 1.0 . 3.19 2585 2585 A 74 MET H A 73 ALA HB% 1.0 . 3.09 2586 2586 A 74 MET H A 77 ALA HB% 1.0 . 5.42 2587 2587 A 87 ALA HB% A 74 MET H 1.0 . 5.50 2588 2588 A 74 MET H A 91 LEU HDx% 1.0 . 4.89 2589 2589 A 88 LYS H A 90 LEU H 1.0 . 4.47 2590 2590 A 90 LEU H A 91 LEU H 1.0 . 3.34 2591 2591 A 111 THR H A 111 THR HB 1.0 . 3.15 2592 2592 A 89 GLN HGy A 90 LEU H 1.0 . 4.20 2593 2593 A 110 GLN HBy A 111 THR H 1.0 . 3.48 2594 2594 A 90 LEU H A 90 LEU HBy 1.0 . 3.41 2595 2595 A 90 LEU H A 90 LEU HG 1.0 . 3.29 2596 2596 A 91 LEU HBy A 90 LEU H 1.0 . 4.84 2597 2597 A 111 THR H A 110 GLN HBx 1.0 . 3.46 2598 2598 A 90 LEU H A 90 LEU HBx 1.0 . 3.41 2599 2599 A 90 LEU HDx% A 90 LEU H 1.0 . 5.04 2600 2600 A 90 LEU HDx% A 90 LEU H 1.0 . 5.30 2601 2601 A 104 VAL HGy% A 111 THR H 1.0 . 3.89 2602 2602 A 104 VAL HGy% A 111 THR H 1.0 . 4.40 2603 2603 A 90 LEU HDy% A 90 LEU H 1.0 . 4.63 2604 2604 A 90 LEU HDy% A 90 LEU H 1.0 . 4.93 2605 2605 A 111 THR H A 104 VAL H 1.0 . 3.97 2606 2606 A 128 TRP HZ2 A 90 LEU H 1.0 . 5.50 2607 2607 A 111 THR H A 108 PRO HA 1.0 . 4.01 2608 2608 A 109 CYS HA A 111 THR H 1.0 . 4.90 2609 2609 A 111 THR H A 107 ASP HBx 1.0 . 4.37 2610 2610 A 4 VAL H A 1 SER H1 1.0 . 3.95 2611 2611 A 2 LYS HA A 1 SER H1 1.0 . 4.80 2612 2612 A 53 LEU H A 51 VAL HA 1.0 . 5.00 2613 2613 A 53 LEU H A 53 LEU HDy% 1.0 . 4.31 2614 2614 A 16 MET H A 14 LYS H 1.0 . 4.62 2615 2615 A 15 PRO HDx A 14 LYS H 1.0 . 3.27 2616 2616 A 15 PRO HDy A 14 LYS H 1.0 . 3.57 2617 2617 A 13 ALA HB% A 14 LYS H 1.0 . 3.21 2618 2618 A 34 PHE HDy A 31 GLN H 1.0 . 5.14 2619 2619 A 31 GLN H A 30 MET H 1.0 . 3.05 2620 2620 A 31 GLN H A 28 ALA HA 1.0 . 3.98 2621 2621 A 29 VAL HA A 31 GLN H 1.0 . 4.48 2622 2622 A 31 GLN H A 31 GLN HGy 1.0 . 3.07 2623 2623 A 31 GLN H A 31 GLN HBx 1.0 . 3.27 2624 2624 A 133 ASP H A 134 VAL H 1.0 . 3.75 2625 2625 A 133 ASP H A 132 LEU HBx 1.0 . 4.17 2626 2626 A 131 THR HA A 133 ASP H 1.0 . 4.38 2627 2627 A 133 ASP H A 132 LEU HBy 1.0 . 4.17 2628 2628 A 58 LYS HA A 60 GLU H 1.0 . 4.47 2629 2629 A 133 ASP H A 131 THR HB 1.0 . 4.64 2630 2630 A 21 GLN H A 19 CYS H 1.0 . 4.71 2631 2631 A 23 LEU H A 21 GLN H 1.0 . 4.93 2632 2632 A 21 GLN H A 21 GLN HGy 1.0 . 3.65 2633 2633 A 21 GLN H A 21 GLN HGx 1.0 . 3.65 2634 2634 A 20 LYS HBx A 21 GLN H 1.0 . 3.26 2635 2635 A 20 LYS HDx A 21 GLN H 1.0 . 5.47 2636 2636 A 21 GLN H A 23 LEU HBy 1.0 . 5.50 2637 2637 A 20 LYS HDy A 21 GLN H 1.0 . 4.19 2638 2638 A 23 LEU H A 24 ASN HA 1.0 . 4.96 2639 2639 A 23 LEU H A 22 GLU HBy 1.0 . 3.81 2640 2640 A 23 LEU H A 22 GLU HBx 1.0 . 3.51 2641 2641 A 23 LEU H A 23 LEU HG 1.0 . 3.20 2642 2642 A 23 LEU H A 23 LEU HBy 1.0 . 3.30 2643 2643 A 23 LEU H A 23 LEU HDx% 1.0 . 5.23 2644 2644 A 67 ASN H A 68 LEU H 1.0 . 3.30 2645 2645 A 67 ASN H A 66 MET H 1.0 . 3.07 2646 2646 A 67 ASN H A 67 ASN HD2x 1.0 . 4.85 2647 2647 A 67 ASN H A 67 ASN HD2y 1.0 . 4.85 2648 2648 A 67 ASN H A 67 ASN HA 1.0 . 2.81 2649 2649 A 67 ASN H A 64 GLN HA 1.0 . 3.95 2650 2650 A 67 ASN H A 64 GLN HGy 1.0 . 4.84 2651 2651 A 67 ASN H A 66 MET HBx 1.0 . 5.05 2652 2652 A 67 ASN H A 66 MET HGy 1.0 . 4.23 2653 2653 A 67 ASN H A 66 MET HGx 1.0 . 4.23 2654 2654 A 44 THR H A 44 THR HB 1.0 . 3.95 2655 2655 A 44 THR H A 43 ILE HA 1.0 . 2.74 2656 2656 A 44 THR H A 45 ASN HBy 1.0 . 4.10 2657 2657 A 44 THR H A 43 ILE HG2% 1.0 . 3.59 2658 2658 A 136 VAL H A 136 VAL HB 1.0 . 3.72 2659 2659 A 136 VAL HGx% A 136 VAL H 1.0 . 3.96 2660 2660 A 136 VAL HGx% A 136 VAL H 1.0 . 4.52 2661 2661 A 109 CYS H A 109 CYS HBy 1.0 . 3.84 2662 2662 A 109 CYS H A 108 PRO HDx 1.0 . 4.16 2663 2663 A 109 CYS H A 109 CYS HBx 1.0 . 3.84 2664 2664 A 109 CYS H A 108 PRO HBx 1.0 . 4.61 2665 2665 A 110 GLN HBy A 109 CYS H 1.0 . 4.43 2666 2666 A 108 PRO HGy A 109 CYS H 1.0 . 3.62 2667 2667 A 108 PRO HBy A 109 CYS H 1.0 . 3.95 2668 2668 A 53 LEU HDx% A 109 CYS H 1.0 . 5.50 2669 2669 A 53 LEU HDx% A 109 CYS H 1.0 . 5.32 2670 2670 A 107 ASP H A 109 CYS H 1.0 . 5.50 2671 2671 A 102 THR H A 101 ILE H 1.0 . 4.70 2672 2672 A 101 ILE H A 99 LYS H 1.0 . 3.98 2673 2673 A 101 ILE H A 98 GLU HA 1.0 . 4.06 2674 2674 A 101 ILE H A 100 VAL HB 1.0 . 4.19 2675 2675 A 101 ILE HB A 101 ILE H 1.0 . 3.88 2676 2676 A 101 ILE HG1y A 101 ILE H 1.0 . 2.82 2677 2677 A 101 ILE H A 100 VAL HGy% 1.0 . 3.32 2678 2678 A 101 ILE H A 100 VAL HGx% 1.0 . 4.31 2679 2679 A 60 GLU H A 58 LYS H 1.0 . 5.11 2680 2680 A 59 LEU H A 60 GLU H 1.0 . 3.43 2681 2681 A 60 GLU H A 60 GLU HBy 1.0 . 3.80 2682 2682 A 60 GLU H A 59 LEU HBy 1.0 . 4.06 2683 2683 A 60 GLU H A 60 GLU HBx 1.0 . 3.80 2684 2684 A 60 GLU H A 59 LEU HBx 1.0 . 4.06 2685 2685 A 59 LEU HDx% A 60 GLU H 1.0 . 5.50 2686 2686 A 60 GLU H A 59 LEU HDy% 1.0 . 5.50 2687 2687 A 71 GLY H A 72 LYS H 1.0 . 3.58 2688 2688 A 71 GLY H A 70 HIS HA 1.0 . 3.17 2689 2689 A 71 GLY H A 70 HIS HBy 1.0 . 4.74 2690 2690 A 106 ASP H A 107 ASP H 1.0 . 3.16 2691 2691 A 111 THR H A 107 ASP H 1.0 . 5.50 2692 2692 A 105 ALA HA A 107 ASP H 1.0 . 4.29 2693 2693 A 107 ASP H A 106 ASP HBy 1.0 . 4.44 2694 2694 A 107 ASP HBx A 107 ASP H 1.0 . 4.19 2695 2695 A 107 ASP H A 106 ASP HBx 1.0 . 4.44 2696 2696 A 107 ASP HBy A 107 ASP H 1.0 . 3.64 2697 2697 A 104 VAL HB A 107 ASP H 1.0 . 4.48 2698 2698 A 105 ALA HB% A 107 ASP H 1.0 . 5.50 2699 2699 A 105 ALA HB% A 107 ASP H 1.0 . 5.50 2700 2700 A 104 VAL HGx% A 107 ASP H 1.0 . 3.31 2701 2701 A 104 VAL HGx% A 107 ASP H 1.0 . 3.73 2702 2702 A 99 LYS H A 100 VAL H 1.0 . 2.90 2703 2703 A 99 LYS H A 100 VAL HA 1.0 . 4.97 2704 2704 A 99 LYS H A 97 CYS HA 1.0 . 4.38 2705 2705 A 99 LYS H A 98 GLU HBy 1.0 . 4.57 2706 2706 A 99 LYS H A 99 LYS HBx 1.0 . 3.72 2707 2707 A 99 LYS H A 99 LYS HGx 1.0 . 4.25 2708 2708 A 99 LYS H A 100 VAL HGx% 1.0 . 3.99 2709 2709 A 37 TRP H A 37 TRP HD1 1.0 . 3.86 2710 2710 A 37 TRP H A 37 TRP HBx 1.0 . 3.56 2711 2711 A 37 TRP H A 36 PHE HBx 1.0 . 4.41 2712 2712 A 34 PHE HDy A 34 PHE H 1.0 . 3.76 2713 2713 A 34 PHE H A 34 PHE HBy 1.0 . 3.68 2714 2714 A 34 PHE H A 34 PHE HBx 1.0 . 3.68 2715 2715 A 33 PHE HBy A 34 PHE H 1.0 . 4.23 2716 2716 A 34 PHE H A 34 PHE HEy 1.0 . 4.95 2717 2717 A 33 PHE HBx A 34 PHE H 1.0 . 3.46 2718 2718 A 45 ASN HD2y A 47 GLU HGx 1.0 . 5.50 2719 2719 A 45 ASN HD2y A 47 GLU HGy 1.0 . 5.50 2720 2720 A 32 ASP H A 34 PHE H 1.0 . 4.59 2721 2721 A 47 GLU HBy A 45 ASN HD2y 1.0 . 4.19 2722 2722 A 47 GLU HBx A 45 ASN HD2y 1.0 . 4.75 2723 2723 A 29 VAL HGx% A 45 ASN HD2y 1.0 . 4.18 2724 2724 A 29 VAL HGy% A 45 ASN HD2y 1.0 . 5.50 2725 2725 A 29 VAL HGy% A 45 ASN HD2y 1.0 . 5.50 2726 2726 A 131 THR H A 130 PRO HA 1.0 . 3.09 2727 2727 A 131 THR H A 130 PRO HBy 1.0 . 4.25 2728 2728 A 131 THR H A 130 PRO HBx 1.0 . 4.25 2729 2729 A 131 THR H A 134 VAL HGx% 1.0 . 4.67 2730 2730 A 131 THR H A 134 VAL HGx% 1.0 . 4.34 2731 2731 A 104 VAL HA A 106 ASP H 1.0 . 4.41 2732 2732 A 106 ASP H A 106 ASP HBy 1.0 . 3.72 2733 2733 A 106 ASP H A 106 ASP HBx 1.0 . 3.72 2734 2734 A 105 ALA HB% A 106 ASP H 1.0 . 3.64 2735 2735 A 105 ALA HB% A 106 ASP H 1.0 . 3.87 2736 2736 A 100 VAL H A 98 GLU H 1.0 . 4.22 2737 2737 A 22 GLU H A 21 GLN HE2x 1.0 . 4.55 2738 2738 A 18 ALA H A 21 GLN HE2x 1.0 . 4.04 2739 2739 A 100 VAL H A 100 VAL HB 1.0 . 3.69 2740 2740 A 20 LYS HBx A 21 GLN HE2x 1.0 . 4.62 2741 2741 A 100 VAL H A 99 LYS HBx 1.0 . 4.78 2742 2742 A 100 VAL H A 99 LYS HGy 1.0 . 5.10 2743 2743 A 101 ILE HG1x A 100 VAL H 1.0 . 4.78 2744 2744 A 101 ILE HG1y A 100 VAL H 1.0 . 5.00 2745 2745 A 40 GLY H A 39 GLU HA 1.0 . 2.78 2746 2746 A 23 LEU H A 25 VAL H 1.0 . 4.60 2747 2747 A 25 VAL H A 24 ASN HA 1.0 . 3.14 2748 2748 A 25 VAL H A 24 ASN HBx 1.0 . 4.70 2749 2749 A 20 LYS HDx A 25 VAL H 1.0 . 5.04 2750 2750 A 25 VAL H A 23 LEU HBy 1.0 . 5.20 2751 2751 A 20 LYS HDy A 25 VAL H 1.0 . 4.38 2752 2752 A 25 VAL H A 20 LYS HGx 1.0 . 4.94 2753 2753 A 25 VAL H A 23 LEU HBx 1.0 . 5.45 2754 2754 A 137 GLY H A 136 VAL H 1.0 . 3.35 2755 2755 A 76 PHE HZ A 137 GLY H 1.0 . 5.42 2756 2756 A 137 GLY H A 133 ASP HA 1.0 . 4.47 2757 2757 A 134 VAL HA A 137 GLY H 1.0 . 4.06 2758 2758 A 137 GLY H A 136 VAL HB 1.0 . 4.21 2759 2759 A 135 ALA HB% A 137 GLY H 1.0 . 5.50 2760 2760 A 135 ALA HB% A 137 GLY H 1.0 . 5.50 2761 2761 A 137 GLY H A 134 VAL H 1.0 . 4.57 2762 2762 A 113 LEU HBy A 49 GLY H 1.0 . 4.56 2763 2763 A 118 CYS H A 116 ALA H 1.0 . 3.99 2764 2764 A 118 CYS H A 117 MET H 1.0 . 3.09 2765 2765 A 118 CYS H A 115 LEU H 1.0 . 5.05 2766 2766 A 110 GLN H A 113 LEU H 1.0 . 4.79 2767 2767 A 110 GLN HE2x A 110 GLN H 1.0 . 4.37 2768 2768 A 118 CYS H A 115 LEU HA 1.0 . 3.96 2769 2769 A 118 CYS HBx A 118 CYS H 1.0 . 3.04 2770 2770 A 118 CYS HBy A 118 CYS H 1.0 . 3.03 2771 2771 A 118 CYS H A 117 MET HBy 1.0 . 4.33 2772 2772 A 118 CYS H A 117 MET HGx 1.0 . 3.40 2773 2773 A 113 LEU HBy A 110 GLN H 1.0 . 5.50 2774 2774 A 116 ALA HB% A 118 CYS H 1.0 . 5.50 2775 2775 A 110 GLN H A 104 VAL HGy% 1.0 . 5.15 2776 2776 A 110 GLN H A 104 VAL HGy% 1.0 . 5.50 2777 2777 A 121 ALA HB% A 118 CYS H 1.0 . 5.04 2778 2778 A 110 GLN H A 107 ASP HBx 1.0 . 4.00 2779 2779 A 110 GLN HGy A 110 GLN H 1.0 . 4.58 2780 2780 A 110 GLN HBy A 110 GLN H 1.0 . 3.29 2781 2781 A 110 GLN H A 110 GLN HBx 1.0 . 3.50 2782 2782 A 114 ASN HD2y A 102 THR H 1.0 . 5.07 2783 2783 A 102 THR HB A 114 ASN HD2y 1.0 . 3.75 2784 2784 A 110 GLN HGx A 114 ASN HD2y 1.0 . 4.36 2785 2785 A 114 ASN HD2y A 104 VAL HGy% 1.0 . 5.10 2786 2786 A 114 ASN HD2y A 104 VAL HGy% 1.0 . 5.50 2787 2787 A 114 ASN HD2y A 104 VAL HGy% 1.0 . 5.50 2788 2788 A 114 ASN HD2x A 102 THR HB 1.0 . 3.82 2789 2789 A 114 ASN HD2x A 102 THR HG2% 1.0 . 4.25 2790 2790 A 114 ASN HD2x A 104 VAL HGy% 1.0 . 5.50 2791 2791 A 114 ASN HD2x A 104 VAL HGy% 1.0 . 5.50 2792 2792 A 69 HIS HD2 A 64 GLN HE2y 1.0 . 3.93 2793 2793 A 67 ASN HA A 64 GLN HE2y 1.0 . 4.38 2794 2794 A 64 GLN HA A 64 GLN HE2y 1.0 . 4.52 2795 2795 A 64 GLN HGy A 64 GLN HE2y 1.0 . 3.69 2796 2796 A 110 GLN HBy A 110 GLN HE2y 1.0 . 4.06 2797 2797 A 110 GLN HE2x A 114 ASN HD2y 1.0 . 5.19 2798 2798 A 110 GLN HBy A 110 GLN HE2x 1.0 . 4.10 2799 2799 A 64 GLN HA A 64 GLN HE2x 1.0 . 4.49 2800 2800 A 64 GLN HGy A 64 GLN HE2x 1.0 . 3.24 2801 2801 A 48 ALA H A 45 ASN HD2x 1.0 . 3.58 2802 2802 A 45 ASN HA A 45 ASN HD2x 1.0 . 4.58 2803 2803 A 45 ASN HBx A 45 ASN HD2x 1.0 . 3.46 2804 2804 A 29 VAL HGx% A 45 ASN HD2x 1.0 . 4.39 2805 2805 A 33 PHE H A 31 GLN HE2x 1.0 . 5.48 2806 2806 A 31 GLN HE2y A 35 ASN HD2y 1.0 . 4.11 2807 2807 A 35 ASN HD2x A 31 GLN HE2y 1.0 . 4.11 2808 2808 A 31 GLN H A 31 GLN HE2y 1.0 . 5.32 2809 2809 A 31 GLN HGy A 31 GLN HE2y 1.0 . 3.45 2810 2810 A 128 TRP HZ2 A 89 GLN HE2y 1.0 . 3.63 2811 2811 A 89 GLN HE2y A 89 GLN HGy 1.0 . 3.73 2812 2812 A 128 TRP HZ2 A 89 GLN HE2x 1.0 . 3.63 2813 2813 A 89 GLN HE2x A 89 GLN HGy 1.0 . 3.73 2814 2814 A 17 GLU HGy A 21 GLN HE2y 1.0 . 4.23 2815 2815 A 6 LYS H A 5 MET HBx 1.0 . 5.10 2816 2816 A 6 LYS H A 5 MET HBy 1.0 . 5.10 2817 2817 A 6 LYS H A 6 LYS HDx 1.0 . 5.50 2818 2818 A 6 LYS H A 6 LYS HDy 1.0 . 5.50 2819 2819 A 6 LYS H A 6 LYS HGx 1.0 . 5.31 2820 2820 A 6 LYS H A 6 LYS HGy 1.0 . 5.31 2821 2821 A 5 MET HA A 6 LYS H 1.0 . 3.56 2822 2822 A 6 LYS H A 5 MET HGx 1.0 . 5.50 2823 2823 A 6 LYS H A 5 MET HGy 1.0 . 5.50 2824 2824 A 6 LYS H A 6 LYS HBx 1.0 . 3.99 2825 2825 A 5 MET H A 6 LYS H 1.0 . 3.31 2826 2826 A 5 MET H A 6 LYS HA 1.0 . 5.36 2827 2827 A 4 VAL H A 5 MET H 1.0 . 3.26 2828 2828 A 5 MET H A 4 VAL HGy% 1.0 . 5.05 2829 2829 A 6 LYS HA A 7 GLN H 1.0 . 2.79 2830 2830 A 7 GLN H A 6 LYS HDx 1.0 . 4.73 2831 2831 A 7 GLN H A 6 LYS HDy 1.0 . 4.73 2832 2832 A 135 ALA HB% A 134 VAL H 1.0 . 4.60 2833 2833 A 134 VAL HB A 134 VAL H 1.0 . 3.33 2834 2834 A 93 ILE H A 89 GLN HA 1.0 . 4.53 2835 2835 A 3 GLU H A 2 LYS HDx 1.0 . 5.50 2836 2836 A 14 LYS HA A 16 MET H 1.0 . 4.67 2837 2837 A 15 PRO HDy A 16 MET H 1.0 . 4.47 2838 2838 A 16 MET H A 16 MET HBy 1.0 . 3.60 2839 2839 A 15 PRO HBy A 16 MET H 1.0 . 3.71 2840 2840 A 78 MET H A 82 ALA HB% 1.0 . 4.33 2841 2841 A 17 GLU H A 21 GLN HE2x 1.0 . 5.50 2842 2842 A 21 GLN H A 21 GLN HE2x 1.0 . 3.88 2843 2843 A 22 GLU H A 23 LEU HBy 1.0 . 5.12 2844 2844 A 20 LYS HDy A 22 GLU H 1.0 . 5.50 2845 2845 A 25 VAL H A 21 GLN H 1.0 . 5.23 2846 2846 A 25 VAL H A 24 ASN HBy 1.0 . 4.70 2847 2847 A 26 PRO HDx A 27 ASP H 1.0 . 5.50 2848 2848 A 32 ASP H A 29 VAL H 1.0 . 4.97 2849 2849 A 29 VAL H A 31 GLN HGy 1.0 . 4.64 2850 2850 A 29 VAL HGy% A 31 GLN H 1.0 . 5.50 2851 2851 A 29 VAL HGy% A 31 GLN H 1.0 . 5.50 2852 2852 A 34 PHE HDy A 32 ASP H 1.0 . 5.05 2853 2853 A 33 PHE H A 31 GLN H 1.0 . 4.36 2854 2854 A 36 PHE H A 43 ILE HG1x 1.0 . 4.83 2855 2855 A 33 PHE H A 51 VAL HGx% 1.0 . 4.26 2856 2856 A 29 VAL HA A 33 PHE H 1.0 . 5.22 2857 2857 A 33 PHE H A 30 MET HBy 1.0 . 5.50 2858 2858 A 32 ASP HA A 34 PHE H 1.0 . 4.97 2859 2859 A 45 ASN HA A 45 ASN HD2y 1.0 . 4.66 2860 2860 A 37 TRP H A 35 ASN H 1.0 . 4.71 2861 2861 A 36 PHE HA A 35 ASN H 1.0 . 5.40 2862 2862 A 36 PHE H A 33 PHE HA 1.0 . 4.07 2863 2863 A 36 PHE H A 43 ILE HD1% 1.0 . 3.72 2864 2864 A 38 LYS HBx A 37 TRP H 1.0 . 5.00 2865 2865 A 74 MET H A 72 LYS H 1.0 . 5.50 2866 2866 A 44 THR H A 43 ILE H 1.0 . 4.69 2867 2867 A 44 THR H A 45 ASN HA 1.0 . 4.54 2868 2868 A 44 THR H A 48 ALA HB% 1.0 . 5.50 2869 2869 A 48 ALA H A 45 ASN H 1.0 . 5.01 2870 2870 A 47 GLU H A 29 VAL HGx% 1.0 . 5.29 2871 2871 A 49 GLY HAx A 48 ALA H 1.0 . 5.21 2872 2872 A 49 GLY HAy A 48 ALA H 1.0 . 5.50 2873 2873 A 48 ALA HB% A 49 GLY H 1.0 . 3.87 2874 2874 A 113 LEU HDx% A 49 GLY H 1.0 . 4.27 2875 2875 A 113 LEU HDx% A 49 GLY H 1.0 . 4.70 2876 2876 A 51 VAL H A 49 GLY H 1.0 . 4.17 2877 2877 A 51 VAL H A 47 GLU HA 1.0 . 4.69 2878 2878 A 115 LEU HA A 101 ILE H 1.0 . 5.17 2879 2879 A 56 ALA H A 55 LEU HDy% 1.0 . 5.50 2880 2880 A 56 ALA H A 55 LEU HDy% 1.0 . 5.50 2881 2881 A 57 LYS HA A 56 ALA H 1.0 . 5.50 2882 2882 A 73 ALA H A 142 ASP H 1.0 . 5.50 2883 2883 A 143 THR HG2% A 57 LYS H 1.0 . 5.25 2884 2884 A 55 LEU H A 58 LYS H 1.0 . 5.11 2885 2885 A 54 CYS HA A 58 LYS H 1.0 . 5.26 2886 2886 A 59 LEU H A 61 LEU HDy% 1.0 . 4.54 2887 2887 A 60 GLU H A 60 GLU HGy 1.0 . 3.92 2888 2888 A 60 GLU H A 61 LEU HDy% 1.0 . 5.50 2889 2889 A 60 GLU H A 61 LEU HDy% 1.0 . 5.50 2890 2890 A 132 LEU HDy% A 133 ASP H 1.0 . 5.50 2891 2891 A 61 LEU H A 60 GLU HGy 1.0 . 4.72 2892 2892 A 61 LEU H A 15 PRO HGx 1.0 . 4.89 2893 2893 A 89 GLN H A 88 LYS HBx 1.0 . 4.94 2894 2894 A 64 GLN H A 63 ASP H 1.0 . 4.73 2895 2895 A 66 MET H A 63 ASP H 1.0 . 5.25 2896 2896 A 64 GLN H A 66 MET H 1.0 . 4.75 2897 2897 A 64 GLN HA A 68 LEU H 1.0 . 4.63 2898 2898 A 142 ASP HA A 71 GLY H 1.0 . 4.72 2899 2899 A 71 GLY H A 70 HIS HBx 1.0 . 4.74 2900 2900 A 71 GLY H A 59 LEU HDx% 1.0 . 5.50 2901 2901 A 71 GLY H A 59 LEU HDx% 1.0 . 5.50 2902 2902 A 71 GLY H A 59 LEU HDx% 1.0 . 5.50 2903 2903 A 136 VAL H A 133 ASP HA 1.0 . 4.97 2904 2904 A 75 GLU H A 73 ALA HB% 1.0 . 5.50 2905 2905 A 75 GLU H A 73 ALA HB% 1.0 . 5.50 2906 2906 A 77 ALA HA A 76 PHE H 1.0 . 5.50 2907 2907 A 82 ALA HB% A 77 ALA H 1.0 . 5.50 2908 2908 A 78 MET HGy A 79 LYS H 1.0 . 5.30 2909 2909 A 80 HIS H A 81 GLY H 1.0 . 3.15 2910 2910 A 78 MET HA A 81 GLY H 1.0 . 4.13 2911 2911 A 80 HIS HA A 81 GLY H 1.0 . 3.50 2912 2912 A 81 GLY H A 80 HIS HBy 1.0 . 4.40 2913 2913 A 81 GLY H A 80 HIS HBx 1.0 . 4.40 2914 2914 A 82 ALA HB% A 81 GLY H 1.0 . 4.61 2915 2915 A 78 MET H A 82 ALA H 1.0 . 5.50 2916 2916 A 78 MET HGy A 82 ALA H 1.0 . 5.22 2917 2917 A 86 MET H A 84 GLU H 1.0 . 4.40 2918 2918 A 88 LYS H A 86 MET H 1.0 . 4.72 2919 2919 A 83 ASP HA A 86 MET H 1.0 . 4.87 2920 2920 A 86 MET H A 82 ALA HA 1.0 . 5.50 2921 2921 A 87 ALA HA A 86 MET H 1.0 . 5.50 2922 2922 A 87 ALA H A 85 ALA HA 1.0 . 4.91 2923 2923 A 87 ALA H A 78 MET HGy 1.0 . 4.70 2924 2924 A 87 ALA H A 89 GLN H 1.0 . 4.09 2925 2925 A 87 ALA H A 85 ALA H 1.0 . 4.17 2926 2926 A 87 ALA H A 90 LEU H 1.0 . 5.23 2927 2927 A 87 ALA H A 83 ASP H 1.0 . 3.96 2928 2928 A 87 ALA H A 78 MET HGx 1.0 . 4.82 2929 2929 A 89 GLN H A 91 LEU H 1.0 . 4.42 2930 2930 A 89 GLN H A 88 LYS HEx 1.0 . 5.50 2931 2931 A 89 GLN H A 88 LYS HEy 1.0 . 5.50 2932 2932 A 110 GLN HE2x A 111 THR H 1.0 . 4.97 2933 2933 A 91 LEU HG A 90 LEU H 1.0 . 5.50 2934 2934 A 119 PHE HEy A 91 LEU H 1.0 . 5.38 2935 2935 A 89 GLN HA A 91 LEU H 1.0 . 4.78 2936 2936 A 93 ILE H A 90 LEU H 1.0 . 5.22 2937 2937 A 119 PHE HEy A 93 ILE H 1.0 . 4.78 2938 2938 A 91 LEU H A 94 LYS H 1.0 . 5.34 2939 2939 A 96 SER HBy A 95 HIS H 1.0 . 4.92 2940 2940 A 95 HIS H A 98 GLU HGy 1.0 . 5.50 2941 2941 A 95 HIS H A 98 GLU HGx 1.0 . 5.50 2942 2942 A 98 GLU H A 96 SER H 1.0 . 4.12 2943 2943 A 115 LEU HDy% A 96 SER H 1.0 . 5.50 2944 2944 A 98 GLU H A 96 SER HA 1.0 . 4.29 2945 2945 A 98 GLU H A 98 GLU HBx 1.0 . 3.78 2946 2946 A 101 ILE HG1x A 99 LYS H 1.0 . 5.13 2947 2947 A 101 ILE HG1y A 99 LYS H 1.0 . 5.44 2948 2948 A 21 GLN HE2x A 19 CYS H 1.0 . 5.31 2949 2949 A 98 GLU HA A 100 VAL H 1.0 . 4.64 2950 2950 A 100 VAL H A 99 LYS HGx 1.0 . 5.10 2951 2951 A 103 ILE HG1x A 104 VAL H 1.0 . 5.34 2952 2952 A 103 ILE HB A 105 ALA H 1.0 . 5.50 2953 2953 A 110 GLN HBy A 107 ASP H 1.0 . 5.37 2954 2954 A 107 ASP H A 104 VAL H 1.0 . 4.70 2955 2955 A 104 VAL HA A 107 ASP H 1.0 . 4.69 2956 2956 A 115 LEU HBx A 112 MET H 1.0 . 5.02 2957 2957 A 115 LEU HBy A 112 MET H 1.0 . 5.50 2958 2958 A 115 LEU HBx A 113 LEU H 1.0 . 5.34 2959 2959 A 117 MET HBx A 116 ALA H 1.0 . 5.50 2960 2960 A 118 CYS HBy A 117 MET H 1.0 . 5.38 2961 2961 A 101 ILE HG2% A 117 MET H 1.0 . 5.50 2962 2962 A 119 PHE H A 94 LYS HA 1.0 . 5.39 2963 2963 A 122 GLU HBy A 119 PHE H 1.0 . 5.50 2964 2964 A 123 ILE HD1% A 120 LYS H 1.0 . 4.64 2965 2965 A 119 PHE HBx A 121 ALA H 1.0 . 5.20 2966 2966 A 119 PHE HBy A 121 ALA H 1.0 . 5.50 2967 2967 A 125 LYS HBx A 122 GLU H 1.0 . 5.50 2968 2968 A 93 ILE HD1% A 122 GLU H 1.0 . 5.50 2969 2969 A 93 ILE HD1% A 122 GLU H 1.0 . 5.50 2970 2970 A 120 LYS HA A 122 GLU H 1.0 . 4.80 2971 2971 A 124 HIS HA A 123 ILE H 1.0 . 5.50 2972 2972 A 125 LYS HA A 124 HIS H 1.0 . 5.39 2973 2973 A 122 GLU HBx A 124 HIS H 1.0 . 5.50 2974 2974 A 125 LYS HGy A 124 HIS H 1.0 . 5.50 2975 2975 A 126 LEU H A 125 LYS HGy 1.0 . 5.26 2976 2976 A 131 THR H A 132 LEU H 1.0 . 4.71 2977 2977 A 131 THR H A 128 TRP HZ3 1.0 . 5.04 2978 2978 A 137 GLY H A 133 ASP H 1.0 . 5.50 2979 2979 A 90 LEU HDx% A 137 GLY H 1.0 . 5.50 2980 2980 A 137 GLY H A 134 VAL HGx% 1.0 . 5.50 2981 2981 A 137 GLY H A 134 VAL HGy% 1.0 . 5.50 2982 2982 A 123 ILE H A 93 ILE HG2% 1.0 . 3.67 2983 2983 A 140 LEU H A 137 GLY HAy 1.0 . 4.50 2984 2984 A 140 LEU H A 139 LEU HG 1.0 . 4.19 2985 2985 A 140 LEU H A 136 VAL HA 1.0 . 4.64 2986 2986 A 140 LEU H A 139 LEU HDx% 1.0 . 5.38 2987 2987 A 140 LEU H A 139 LEU HDx% 1.0 . 5.50 2988 2988 A 62 LEU HDy% A 14 LYS H 1.0 . 5.50 2989 2989 A 55 LEU HDx% A 19 CYS H 1.0 . 5.50 2990 2990 A 52 ILE HD1% A 52 ILE H 1.0 . 4.25 2991 2991 A 52 ILE HD1% A 52 ILE H 1.0 . 4.60 2992 2992 A 62 LEU H A 62 LEU HDy% 1.0 . 4.02 2993 2993 A 62 LEU H A 62 LEU HDy% 1.0 . 4.39 2994 2994 A 71 GLY H A 73 ALA H 1.0 . 4.65 2995 2995 A 73 ALA H A 75 GLU H 1.0 . 5.12 2996 2996 A 107 ASP H A 108 PRO HDx 1.0 . 4.56 2997 2997 A 52 ILE HD1% A 113 LEU H 1.0 . 5.50 2998 2998 A 123 ILE HG2% A 123 ILE H 1.0 . 3.15 2999 2999 A 123 ILE HG2% A 124 HIS H 1.0 . 4.91 3000 3000 A 126 LEU HDx% A 124 HIS H 1.0 . 5.49 3001 3001 A 136 VAL HGy% A 136 VAL H 1.0 . 5.34 3002 3002 A 136 VAL HGy% A 136 VAL H 1.0 . 5.50 3003 3003 A 136 VAL HGy% A 136 VAL H 1.0 . 5.50 3004 3004 A 136 VAL HGy% A 137 GLY H 1.0 . 4.42 3005 3005 A 136 VAL HGy% A 137 GLY H 1.0 . 5.09 3006 3006 A 136 VAL HGy% A 137 GLY H 1.0 . 4.81 3007 3007 A 140 LEU H A 136 VAL HGy% 1.0 . 5.50 3008 3008 A 140 LEU H A 136 VAL HGy% 1.0 . 5.50 3009 3009 A 140 LEU H A 136 VAL HGy% 1.0 . 5.50 3010 3010 A 115 LEU H A 116 ALA H 1.0 . 3.23 3011 3011 A 127 ASP H A 128 TRP HE1 1.0 . 5.50 3012 3012 A 126 LEU HA A 128 TRP HE1 1.0 . 5.50 3013 3013 A 86 MET HA A 128 TRP HE1 1.0 . 5.16 3014 3014 A 89 GLN HGy A 128 TRP HE1 1.0 . 5.20 3015 3015 A 128 TRP HE1 A 126 LEU HBy 1.0 . 4.24 3016 3016 A 126 LEU HG A 128 TRP HE1 1.0 . 4.73 3017 3017 A 128 TRP HE1 A 126 LEU HBx 1.0 . 4.24 3018 3018 A 126 LEU HDy% A 128 TRP HE1 1.0 . 4.11 3019 3019 A 126 LEU HDy% A 128 TRP HE1 1.0 . 4.24 3020 3020 A 126 LEU HDx% A 128 TRP HE1 1.0 . 4.46 3021 3021 A 126 LEU HDx% A 128 TRP HE1 1.0 . 4.70 3022 3022 A 128 TRP H A 128 TRP HE1 1.0 . 4.45 3023 3023 A 119 PHE H A 118 CYS HBy 1.0 . 4.03 3024 3024 A 119 PHE H A 118 CYS HBx 1.0 . 3.43 3025 3025 A 69 HIS H A 68 LEU HBy 1.0 . 4.64 3026 3026 A 3 GLU H A 2 LYS HGy 1.0 . 5.50 3027 3027 A 3 GLU H A 2 LYS HGx 1.0 . 5.50 3028 3028 A 35 ASN HD2x A 31 GLN HBx 1.0 . 5.50 3029 3029 A 31 GLN HBx A 35 ASN HD2y 1.0 . 5.50 3030 3030 A 32 ASP HA A 35 ASN HD2y 1.0 . 4.41 3031 3031 A 38 LYS H A 37 TRP HBx 1.0 . 3.67 3032 3032 A 66 MET HBx A 68 LEU H 1.0 . 4.77 3033 3033 A 22 GLU H A 21 GLN HE2y 1.0 . 5.50 3034 3034 A 17 GLU HBy A 21 GLN HE2y 1.0 . 5.19 3035 3035 A 24 ASN H A 24 ASN HD2y 1.0 . 5.50 3036 3036 A 25 VAL H A 24 ASN HD2x 1.0 . 4.73 3037 3037 A 25 VAL HB A 25 VAL H 1.0 . 4.07 3038 3038 A 27 ASP H A 28 ALA H 1.0 . 3.01 3039 3039 A 31 GLN H A 31 GLN HE2x 1.0 . 4.69 3040 3040 A 32 ASP H A 31 GLN HE2x 1.0 . 4.65 3041 3041 A 31 GLN HA A 31 GLN HE2y 1.0 . 5.50 3042 3042 A 35 ASN H A 35 ASN HD2x 1.0 . 5.03 3043 3043 A 35 ASN H A 35 ASN HD2y 1.0 . 5.03 3044 3044 A 43 ILE H A 42 GLN HE2x 1.0 . 5.50 3045 3045 A 47 GLU HBy A 45 ASN HD2x 1.0 . 4.75 3046 3046 A 29 VAL HGy% A 45 ASN HD2x 1.0 . 5.50 3047 3047 A 29 VAL HGy% A 45 ASN HD2x 1.0 . 5.50 3048 3048 A 51 VAL H A 52 ILE HB 1.0 . 4.44 3049 3049 A 64 GLN HE2y A 69 HIS HE1 1.0 . 5.50 3050 3050 A 66 MET H A 64 GLN HE2x 1.0 . 5.39 3051 3051 A 67 ASN HA A 64 GLN HE2x 1.0 . 4.65 3052 3052 A 93 ILE HB A 96 SER H 1.0 . 5.50 3053 3053 A 69 HIS H A 73 ALA HA 1.0 . 5.31 3054 3054 A 76 PHE HBx A 69 HIS H 1.0 . 4.61 3055 3055 A 69 HIS H A 68 LEU HG 1.0 . 4.68 3056 3056 A 69 HIS H A 68 LEU HBx 1.0 . 4.64 3057 3057 A 117 MET H A 114 ASN H 1.0 . 5.31 3058 3058 A 110 GLN H A 110 GLN HE2y 1.0 . 4.70 3059 3059 A 110 GLN HE2y A 109 CYS H 1.0 . 5.50 3060 3060 A 110 GLN HA A 110 GLN HE2y 1.0 . 4.71 3061 3061 A 110 GLN HE2y A 46 ARG HBx 1.0 . 4.63 3062 3062 A 110 GLN HE2x A 109 CYS H 1.0 . 4.94 3063 3063 A 110 GLN HE2x A 46 ARG HBx 1.0 . 5.07 3064 3064 A 110 GLN HE2x A 113 LEU HBx 1.0 . 5.43 3065 3065 A 110 GLN HBy A 114 ASN HD2x 1.0 . 5.42 3066 3066 A 114 ASN HD2x A 110 GLN HGx 1.0 . 5.50 3067 3067 A 117 MET H A 116 ALA H 1.0 . 2.98 3068 3068 A 33 PHE H A 33 PHE HDx 1.0 . 4.60 3069 3069 A 33 PHE HDx A 34 PHE H 1.0 . 4.21 3070 3070 A 36 PHE HDy A 36 PHE H 1.0 . 4.71 3071 3071 A 36 PHE HDx A 37 TRP H 1.0 . 4.65 3072 3072 A 36 PHE HDy A 43 ILE H 1.0 . 4.60 3073 3073 A 107 ASP HA A 109 CYS H 1.0 . 3.86 3074 3074 A 123 ILE H A 123 ILE HD1% 1.0 . 5.00 3075 3075 A 132 LEU H A 134 VAL H 1.0 . 5.09 3076 3076 A 136 VAL H A 134 VAL H 1.0 . 5.38 3077 3077 A 2 LYS H A 1 SER HBx 1.0 . 3.64 3078 3077 A 2 LYS H A 1 SER HBy 1.0 . 3.64 3079 3078 A 2 LYS HA A 1 SER HBx 1.0 . 4.10 3080 3078 A 2 LYS HA A 1 SER HBy 1.0 . 4.10 3081 3079 A 2 LYS H A 2 LYS HBy 1.0 . 3.01 3082 3079 A 2 LYS H A 2 LYS HBx 1.0 . 3.01 3083 3080 A 2 LYS H A 2 LYS HGx 1.0 . 3.43 3084 3080 A 2 LYS H A 2 LYS HGy 1.0 . 3.43 3085 3081 A 2 LYS H A 2 LYS HDx 1.0 . 4.48 3086 3081 A 2 LYS H A 2 LYS HDy 1.0 . 4.48 3087 3082 A 3 GLU H A 2 LYS HBy 1.0 . 3.65 3088 3082 A 3 GLU H A 2 LYS HBx 1.0 . 3.65 3089 3083 A 4 VAL H A 2 LYS HBy 1.0 . 4.94 3090 3083 A 4 VAL H A 2 LYS HBx 1.0 . 4.94 3091 3084 A 2 LYS HEy A 2 LYS HGx 1.0 . 3.33 3092 3084 A 2 LYS HGy A 2 LYS HEx 1.0 . 3.33 3093 3084 A 2 LYS HGy A 2 LYS HEy 1.0 . 3.33 3094 3084 A 2 LYS HEx A 2 LYS HGx 1.0 . 3.33 3095 3085 A 3 GLU H A 2 LYS HGx 1.0 . 4.73 3096 3085 A 3 GLU H A 2 LYS HGy 1.0 . 4.73 3097 3086 A 3 GLU H A 2 LYS HDx 1.0 . 4.83 3098 3086 A 3 GLU H A 2 LYS HDy 1.0 . 4.83 3099 3087 A 3 GLU H A 3 GLU HBx 1.0 . 3.22 3100 3087 A 3 GLU H A 3 GLU HBy 1.0 . 3.22 3101 3088 A 3 GLU H A 3 GLU HGx 1.0 . 3.52 3102 3088 A 3 GLU H A 3 GLU HGy 1.0 . 3.52 3103 3089 A 3 GLU HA A 3 GLU HGx 1.0 . 3.61 3104 3089 A 3 GLU HA A 3 GLU HGy 1.0 . 3.61 3105 3090 A 4 VAL H A 5 MET HGy 1.0 . 4.52 3106 3090 A 4 VAL H A 5 MET HGx 1.0 . 4.52 3107 3091 A 5 MET H A 5 MET HBy 1.0 . 3.67 3108 3091 A 5 MET H A 5 MET HBx 1.0 . 3.67 3109 3092 A 5 MET H A 5 MET HGy 1.0 . 3.83 3110 3092 A 5 MET H A 5 MET HGx 1.0 . 3.83 3111 3093 A 5 MET H A 6 LYS HBx 1.0 . 5.01 3112 3093 A 5 MET H A 6 LYS HBy 1.0 . 5.01 3113 3094 A 5 MET HA A 5 MET HGy 1.0 . 3.70 3114 3094 A 5 MET HA A 5 MET HGx 1.0 . 3.70 3115 3095 A 6 LYS H A 5 MET HBy 1.0 . 4.27 3116 3095 A 6 LYS H A 5 MET HBx 1.0 . 4.27 3117 3096 A 6 LYS H A 6 LYS HBx 1.0 . 3.22 3118 3096 A 6 LYS H A 6 LYS HBy 1.0 . 3.22 3119 3097 A 6 LYS H A 6 LYS HGy 1.0 . 4.54 3120 3097 A 6 LYS H A 6 LYS HGx 1.0 . 4.54 3121 3098 A 7 GLN H A 6 LYS HBx 1.0 . 3.91 3122 3098 A 7 GLN H A 6 LYS HBy 1.0 . 3.91 3123 3099 A 7 GLN H A 6 LYS HGy 1.0 . 3.78 3124 3099 A 7 GLN H A 6 LYS HGx 1.0 . 3.78 3125 3100 A 7 GLN H A 6 LYS HDx 1.0 . 4.03 3126 3100 A 7 GLN H A 6 LYS HDy 1.0 . 4.03 3127 3101 A 7 GLN H A 7 GLN HE2x 1.0 . 4.47 3128 3101 A 7 GLN H A 7 GLN HE2y 1.0 . 4.47 3129 3102 A 13 ALA HA A 14 LYS HDx 1.0 . 5.34 3130 3102 A 13 ALA HA A 14 LYS HDy 1.0 . 5.34 3131 3103 A 13 ALA HA A 16 MET HBx 1.0 . 4.02 3132 3103 A 13 ALA HA A 16 MET HBy 1.0 . 4.02 3133 3104 A 14 LYS H A 14 LYS HBx 1.0 . 3.18 3134 3104 A 14 LYS H A 14 LYS HBy 1.0 . 3.18 3135 3105 A 14 LYS H A 14 LYS HDx 1.0 . 3.48 3136 3105 A 14 LYS H A 14 LYS HDy 1.0 . 3.48 3137 3106 A 14 LYS HA A 14 LYS HGx 1.0 . 3.70 3138 3106 A 14 LYS HA A 14 LYS HGy 1.0 . 3.70 3139 3107 A 14 LYS HA A 14 LYS HDx 1.0 . 3.26 3140 3107 A 14 LYS HA A 14 LYS HDy 1.0 . 3.26 3141 3108 A 14 LYS HBx A 14 LYS HEx 1.0 . 4.94 3142 3108 A 14 LYS HBy A 14 LYS HEx 1.0 . 4.94 3143 3108 A 14 LYS HEy A 14 LYS HBx 1.0 . 4.94 3144 3108 A 14 LYS HBy A 14 LYS HEy 1.0 . 4.94 3145 3109 A 15 PRO HDy A 14 LYS HBx 1.0 . 3.75 3146 3109 A 15 PRO HDy A 14 LYS HBy 1.0 . 3.75 3147 3110 A 15 PRO HDx A 14 LYS HBx 1.0 . 3.48 3148 3110 A 15 PRO HDx A 14 LYS HBy 1.0 . 3.48 3149 3111 A 18 ALA H A 14 LYS HBx 1.0 . 5.34 3150 3111 A 18 ALA H A 14 LYS HBy 1.0 . 5.34 3151 3112 A 61 LEU HBy A 14 LYS HBx 1.0 . 4.58 3152 3112 A 61 LEU HBy A 14 LYS HBy 1.0 . 4.58 3153 3113 A 61 LEU HBx A 14 LYS HBx 1.0 . 4.22 3154 3113 A 61 LEU HBx A 14 LYS HBy 1.0 . 4.22 3155 3114 A 61 LEU HDx% A 14 LYS HBx 1.0 . 3.74 3156 3114 A 61 LEU HDx% A 14 LYS HBy 1.0 . 3.74 3157 3115 A 15 PRO HA A 58 LYS HDx 1.0 . 3.75 3158 3115 A 15 PRO HA A 58 LYS HDy 1.0 . 3.75 3159 3116 A 15 PRO HA A 58 LYS HEx 1.0 . 5.34 3160 3116 A 15 PRO HA A 58 LYS HEy 1.0 . 5.34 3161 3117 A 15 PRO HBx A 58 LYS HGy 1.0 . 4.81 3162 3117 A 15 PRO HBx A 58 LYS HGx 1.0 . 4.81 3163 3118 A 16 MET H A 16 MET HGx 1.0 . 4.10 3164 3118 A 16 MET H A 16 MET HGy 1.0 . 4.10 3165 3119 A 16 MET HA A 19 CYS HBy 1.0 . 3.81 3166 3119 A 16 MET HA A 19 CYS HBx 1.0 . 3.81 3167 3120 A 17 GLU H A 16 MET HBx 1.0 . 3.20 3168 3120 A 17 GLU H A 16 MET HBy 1.0 . 3.20 3169 3121 A 18 ALA H A 16 MET HBx 1.0 . 5.34 3170 3121 A 18 ALA H A 16 MET HBy 1.0 . 5.34 3171 3122 A 55 LEU HDx% A 16 MET HBx 1.0 . 3.92 3172 3122 A 55 LEU HDx% A 16 MET HBy 1.0 . 3.92 3173 3123 A 17 GLU H A 16 MET HGx 1.0 . 5.12 3174 3123 A 17 GLU H A 16 MET HGy 1.0 . 5.12 3175 3124 A 55 LEU HDx% A 16 MET HGy 1.0 . 3.85 3176 3124 A 55 LEU HDx% A 16 MET HGx 1.0 . 3.85 3177 3125 A 17 GLU H A 19 CYS HBy 1.0 . 5.34 3178 3125 A 17 GLU H A 19 CYS HBx 1.0 . 5.34 3179 3126 A 17 GLU HA A 20 LYS HEy 1.0 . 4.18 3180 3126 A 17 GLU HA A 20 LYS HEx 1.0 . 4.18 3181 3127 A 18 ALA H A 19 CYS HBy 1.0 . 4.79 3182 3127 A 18 ALA H A 19 CYS HBx 1.0 . 4.79 3183 3128 A 18 ALA HA A 21 GLN HGx 1.0 . 3.16 3184 3128 A 18 ALA HA A 21 GLN HGy 1.0 . 3.16 3185 3129 A 18 ALA HB% A 58 LYS HEx 1.0 . 4.66 3186 3129 A 18 ALA HB% A 58 LYS HEy 1.0 . 4.66 3187 3130 A 18 ALA HB% A 21 GLN HGy 1.0 . 4.84 3188 3130 A 18 ALA HB% A 21 GLN HGx 1.0 . 4.84 3189 3131 A 18 ALA HB% A 58 LYS HEy 1.0 . 3.58 3190 3131 A 18 ALA HB% A 58 LYS HEx 1.0 . 3.58 3191 3132 A 18 ALA HB% A 21 GLN HGy 1.0 . 5.33 3192 3132 A 18 ALA HB% A 21 GLN HGx 1.0 . 5.33 3193 3133 A 19 CYS H A 19 CYS HBy 1.0 . 2.88 3194 3133 A 19 CYS H A 19 CYS HBx 1.0 . 2.88 3195 3134 A 19 CYS H A 21 GLN HGx 1.0 . 5.11 3196 3134 A 19 CYS H A 21 GLN HGy 1.0 . 5.11 3197 3135 A 19 CYS H A 58 LYS HDx 1.0 . 4.20 3198 3135 A 19 CYS H A 58 LYS HDy 1.0 . 4.20 3199 3136 A 19 CYS HA A 22 GLU HGy 1.0 . 4.48 3200 3136 A 19 CYS HA A 22 GLU HGx 1.0 . 4.48 3201 3137 A 19 CYS HA A 58 LYS HEx 1.0 . 4.27 3202 3137 A 19 CYS HA A 58 LYS HEy 1.0 . 4.27 3203 3138 A 20 LYS H A 19 CYS HBy 1.0 . 3.38 3204 3138 A 20 LYS H A 19 CYS HBx 1.0 . 3.38 3205 3139 A 22 GLU HBx A 19 CYS HBy 1.0 . 5.25 3206 3139 A 22 GLU HBx A 19 CYS HBx 1.0 . 5.25 3207 3140 A 23 LEU HG A 19 CYS HBy 1.0 . 4.52 3208 3140 A 23 LEU HG A 19 CYS HBx 1.0 . 4.52 3209 3141 A 23 LEU HDx% A 19 CYS HBy 1.0 . 3.71 3210 3141 A 23 LEU HDx% A 19 CYS HBx 1.0 . 3.71 3211 3142 A 23 LEU HDx% A 19 CYS HBy 1.0 . 5.34 3212 3142 A 23 LEU HDx% A 19 CYS HBx 1.0 . 5.34 3213 3143 A 51 VAL HA A 19 CYS HBy 1.0 . 4.80 3214 3143 A 51 VAL HA A 19 CYS HBx 1.0 . 4.80 3215 3144 A 54 CYS H A 19 CYS HBy 1.0 . 5.34 3216 3144 A 54 CYS H A 19 CYS HBx 1.0 . 5.34 3217 3145 A 19 CYS HBy A 54 CYS HBy 1.0 . 4.56 3218 3145 A 19 CYS HBx A 54 CYS HBy 1.0 . 4.56 3219 3145 A 54 CYS HBx A 19 CYS HBy 1.0 . 4.56 3220 3145 A 19 CYS HBx A 54 CYS HBx 1.0 . 4.56 3221 3146 A 55 LEU HDx% A 19 CYS HBy 1.0 . 4.72 3222 3146 A 55 LEU HDx% A 19 CYS HBx 1.0 . 4.72 3223 3147 A 55 LEU HDx% A 19 CYS HBx 1.0 . 5.34 3224 3147 A 55 LEU HDx% A 19 CYS HBy 1.0 . 5.34 3225 3148 A 20 LYS H A 21 GLN HGx 1.0 . 4.31 3226 3148 A 20 LYS H A 21 GLN HGy 1.0 . 4.31 3227 3149 A 20 LYS HBy A 20 LYS HEy 1.0 . 3.58 3228 3149 A 20 LYS HBy A 20 LYS HEx 1.0 . 3.58 3229 3150 A 20 LYS HBy A 30 MET HGx 1.0 . 3.62 3230 3150 A 20 LYS HBy A 30 MET HGy 1.0 . 3.62 3231 3151 A 20 LYS HBx A 20 LYS HEy 1.0 . 3.32 3232 3151 A 20 LYS HBx A 20 LYS HEx 1.0 . 3.32 3233 3152 A 20 LYS HGy A 20 LYS HEy 1.0 . 2.89 3234 3152 A 20 LYS HGy A 20 LYS HEx 1.0 . 2.89 3235 3153 A 20 LYS HGy A 27 ASP HBx 1.0 . 4.30 3236 3153 A 20 LYS HGy A 27 ASP HBy 1.0 . 4.30 3237 3154 A 20 LYS HDy A 21 GLN HGx 1.0 . 5.01 3238 3154 A 20 LYS HDy A 21 GLN HGy 1.0 . 5.01 3239 3155 A 20 LYS HDy A 30 MET HGx 1.0 . 5.00 3240 3155 A 20 LYS HDy A 30 MET HGy 1.0 . 5.00 3241 3156 A 20 LYS HDx A 30 MET HGx 1.0 . 4.35 3242 3156 A 20 LYS HDx A 30 MET HGy 1.0 . 4.35 3243 3157 A 21 GLN H A 20 LYS HEy 1.0 . 4.82 3244 3157 A 21 GLN H A 20 LYS HEx 1.0 . 4.82 3245 3158 A 26 PRO HA A 20 LYS HEy 1.0 . 4.73 3246 3158 A 26 PRO HA A 20 LYS HEx 1.0 . 4.73 3247 3159 A 27 ASP H A 20 LYS HEy 1.0 . 4.61 3248 3159 A 27 ASP H A 20 LYS HEx 1.0 . 4.61 3249 3160 A 27 ASP HA A 20 LYS HEy 1.0 . 4.47 3250 3160 A 27 ASP HA A 20 LYS HEx 1.0 . 4.47 3251 3161 A 20 LYS HEy A 27 ASP HBx 1.0 . 4.09 3252 3161 A 27 ASP HBy A 20 LYS HEy 1.0 . 4.09 3253 3161 A 20 LYS HEx A 27 ASP HBy 1.0 . 4.09 3254 3161 A 20 LYS HEx A 27 ASP HBx 1.0 . 4.09 3255 3162 A 21 GLN H A 21 GLN HGx 1.0 . 3.20 3256 3162 A 21 GLN H A 21 GLN HGy 1.0 . 3.20 3257 3163 A 21 GLN HA A 21 GLN HGx 1.0 . 3.61 3258 3163 A 21 GLN HA A 21 GLN HGy 1.0 . 3.61 3259 3164 A 22 GLU H A 21 GLN HGx 1.0 . 4.08 3260 3164 A 22 GLU H A 21 GLN HGy 1.0 . 4.08 3261 3165 A 22 GLU HA A 21 GLN HGx 1.0 . 4.27 3262 3165 A 22 GLU HA A 21 GLN HGy 1.0 . 4.27 3263 3166 A 23 LEU H A 21 GLN HGx 1.0 . 5.34 3264 3166 A 23 LEU H A 21 GLN HGy 1.0 . 5.34 3265 3167 A 22 GLU H A 22 GLU HGy 1.0 . 4.16 3266 3167 A 22 GLU H A 22 GLU HGx 1.0 . 4.16 3267 3168 A 22 GLU HA A 22 GLU HGy 1.0 . 3.18 3268 3168 A 22 GLU HA A 22 GLU HGx 1.0 . 3.18 3269 3169 A 22 GLU HBy A 58 LYS HEx 1.0 . 4.77 3270 3169 A 22 GLU HBy A 58 LYS HEy 1.0 . 4.77 3271 3170 A 22 GLU HBx A 58 LYS HEx 1.0 . 4.13 3272 3170 A 22 GLU HBx A 58 LYS HEy 1.0 . 4.13 3273 3171 A 23 LEU H A 22 GLU HGy 1.0 . 4.86 3274 3171 A 23 LEU H A 22 GLU HGx 1.0 . 4.86 3275 3172 A 23 LEU HA A 22 GLU HGy 1.0 . 4.74 3276 3172 A 23 LEU HA A 22 GLU HGx 1.0 . 4.74 3277 3173 A 23 LEU HDy% A 22 GLU HGy 1.0 . 4.78 3278 3173 A 23 LEU HDy% A 22 GLU HGx 1.0 . 4.78 3279 3174 A 23 LEU HDy% A 22 GLU HGy 1.0 . 3.69 3280 3174 A 23 LEU HDy% A 22 GLU HGx 1.0 . 3.69 3281 3175 A 22 GLU HGx A 58 LYS HEx 1.0 . 4.21 3282 3175 A 22 GLU HGy A 58 LYS HEx 1.0 . 4.21 3283 3175 A 58 LYS HEy A 22 GLU HGy 1.0 . 4.21 3284 3175 A 58 LYS HEy A 22 GLU HGx 1.0 . 4.21 3285 3176 A 23 LEU HDx% A 54 CYS HBy 1.0 . 3.76 3286 3176 A 23 LEU HDx% A 54 CYS HBx 1.0 . 3.76 3287 3177 A 23 LEU HDx% A 54 CYS HBx 1.0 . 3.91 3288 3177 A 23 LEU HDx% A 54 CYS HBy 1.0 . 3.91 3289 3178 A 23 LEU HDy% A 54 CYS HBy 1.0 . 4.25 3290 3178 A 23 LEU HDy% A 54 CYS HBx 1.0 . 4.25 3291 3179 A 23 LEU HDy% A 58 LYS HEx 1.0 . 5.34 3292 3179 A 23 LEU HDy% A 58 LYS HEy 1.0 . 5.34 3293 3180 A 23 LEU HDy% A 54 CYS HBx 1.0 . 4.73 3294 3180 A 23 LEU HDy% A 54 CYS HBy 1.0 . 4.73 3295 3181 A 23 LEU HDy% A 58 LYS HEy 1.0 . 5.34 3296 3181 A 23 LEU HDy% A 58 LYS HEx 1.0 . 5.34 3297 3182 A 24 ASN H A 24 ASN HBy 1.0 . 3.22 3298 3182 A 24 ASN H A 24 ASN HBx 1.0 . 3.22 3299 3183 A 25 VAL HGx% A 24 ASN HBy 1.0 . 4.70 3300 3183 A 25 VAL HGx% A 24 ASN HBx 1.0 . 4.70 3301 3184 A 25 VAL HGx% A 24 ASN HBx 1.0 . 5.33 3302 3184 A 25 VAL HGx% A 24 ASN HBy 1.0 . 5.33 3303 3185 A 25 VAL HGy% A 24 ASN HBy 1.0 . 5.34 3304 3185 A 24 ASN HBx A 25 VAL HGy% 1.0 . 5.34 3305 3186 A 25 VAL HGx% A 47 GLU HGy 1.0 . 3.39 3306 3186 A 25 VAL HGx% A 47 GLU HGx 1.0 . 3.39 3307 3187 A 25 VAL HGy% A 47 GLU HGx 1.0 . 4.36 3308 3187 A 47 GLU HGy A 25 VAL HGy% 1.0 . 4.36 3309 3188 A 30 MET HGy A 25 VAL HGy% 1.0 . 5.34 3310 3188 A 25 VAL HGy% A 30 MET HGx 1.0 . 5.34 3311 3189 A 26 PRO HA A 27 ASP HBx 1.0 . 4.37 3312 3189 A 26 PRO HA A 27 ASP HBy 1.0 . 4.37 3313 3190 A 26 PRO HBy A 27 ASP HBx 1.0 . 4.32 3314 3190 A 26 PRO HBy A 27 ASP HBy 1.0 . 4.32 3315 3191 A 26 PRO HDy A 47 GLU HGx 1.0 . 4.90 3316 3191 A 26 PRO HDy A 47 GLU HGy 1.0 . 4.90 3317 3192 A 27 ASP H A 27 ASP HBx 1.0 . 2.70 3318 3192 A 27 ASP H A 27 ASP HBy 1.0 . 2.70 3319 3193 A 27 ASP HA A 30 MET HGx 1.0 . 3.24 3320 3193 A 27 ASP HA A 30 MET HGy 1.0 . 3.24 3321 3194 A 28 ALA H A 27 ASP HBx 1.0 . 3.17 3322 3194 A 28 ALA H A 27 ASP HBy 1.0 . 3.17 3323 3195 A 28 ALA HB% A 27 ASP HBx 1.0 . 4.67 3324 3195 A 28 ALA HB% A 27 ASP HBy 1.0 . 4.67 3325 3196 A 29 VAL H A 30 MET HGx 1.0 . 4.29 3326 3196 A 29 VAL H A 30 MET HGy 1.0 . 4.29 3327 3197 A 29 VAL HA A 30 MET HGx 1.0 . 5.34 3328 3197 A 29 VAL HA A 30 MET HGy 1.0 . 5.34 3329 3198 A 29 VAL HA A 32 ASP HBx 1.0 . 3.75 3330 3198 A 29 VAL HA A 32 ASP HBy 1.0 . 3.75 3331 3199 A 29 VAL HGx% A 47 GLU HGx 1.0 . 4.89 3332 3199 A 29 VAL HGx% A 47 GLU HGy 1.0 . 4.89 3333 3200 A 29 VAL HGx% A 47 GLU HGy 1.0 . 4.88 3334 3200 A 29 VAL HGx% A 47 GLU HGx 1.0 . 4.88 3335 3201 A 29 VAL HGy% A 32 ASP HBx 1.0 . 5.34 3336 3201 A 29 VAL HGy% A 32 ASP HBy 1.0 . 5.34 3337 3202 A 29 VAL HGy% A 47 GLU HGy 1.0 . 3.21 3338 3202 A 29 VAL HGy% A 47 GLU HGx 1.0 . 3.21 3339 3203 A 30 MET H A 30 MET HGx 1.0 . 2.75 3340 3203 A 30 MET H A 30 MET HGy 1.0 . 2.75 3341 3204 A 31 GLN H A 30 MET HGx 1.0 . 3.20 3342 3204 A 31 GLN H A 30 MET HGy 1.0 . 3.20 3343 3205 A 31 GLN HA A 30 MET HGx 1.0 . 4.25 3344 3205 A 31 GLN HA A 30 MET HGy 1.0 . 4.25 3345 3206 A 31 GLN HBx A 30 MET HGx 1.0 . 4.72 3346 3206 A 31 GLN HBx A 30 MET HGy 1.0 . 4.72 3347 3207 A 32 ASP H A 30 MET HGx 1.0 . 4.53 3348 3207 A 32 ASP H A 30 MET HGy 1.0 . 4.53 3349 3208 A 31 GLN HA A 34 PHE HBx 1.0 . 4.41 3350 3208 A 31 GLN HA A 34 PHE HBy 1.0 . 4.41 3351 3209 A 35 ASN HD2x A 31 GLN HBy 1.0 . 4.66 3352 3209 A 31 GLN HBy A 35 ASN HD2y 1.0 . 4.66 3353 3210 A 35 ASN HD2x A 31 GLN HGx 1.0 . 5.08 3354 3210 A 31 GLN HGx A 35 ASN HD2y 1.0 . 5.08 3355 3211 A 35 ASN HD2x A 31 GLN HGy 1.0 . 5.34 3356 3211 A 31 GLN HGy A 35 ASN HD2y 1.0 . 5.34 3357 3212 A 35 ASN HD2x A 31 GLN HE2x 1.0 . 4.14 3358 3212 A 31 GLN HE2x A 35 ASN HD2y 1.0 . 4.14 3359 3213 A 32 ASP H A 32 ASP HBx 1.0 . 2.85 3360 3213 A 32 ASP H A 32 ASP HBy 1.0 . 2.85 3361 3214 A 32 ASP HA A 35 ASN HBy 1.0 . 3.30 3362 3214 A 32 ASP HA A 35 ASN HBx 1.0 . 3.30 3363 3215 A 32 ASP HA A 35 ASN HD2x 1.0 . 3.82 3364 3215 A 32 ASP HA A 35 ASN HD2y 1.0 . 3.82 3365 3216 A 33 PHE H A 32 ASP HBx 1.0 . 3.61 3366 3216 A 33 PHE H A 32 ASP HBy 1.0 . 3.61 3367 3217 A 43 ILE HG2% A 32 ASP HBy 1.0 . 5.23 3368 3217 A 43 ILE HG2% A 32 ASP HBx 1.0 . 5.23 3369 3218 A 43 ILE HG2% A 32 ASP HBy 1.0 . 3.67 3370 3218 A 43 ILE HG2% A 32 ASP HBx 1.0 . 3.67 3371 3219 A 32 ASP HBy A 43 ILE HG1x 1.0 . 4.76 3372 3219 A 43 ILE HG1y A 32 ASP HBx 1.0 . 4.76 3373 3219 A 32 ASP HBy A 43 ILE HG1y 1.0 . 4.76 3374 3219 A 32 ASP HBx A 43 ILE HG1x 1.0 . 4.76 3375 3220 A 43 ILE HD1% A 32 ASP HBx 1.0 . 4.23 3376 3220 A 43 ILE HD1% A 32 ASP HBy 1.0 . 4.23 3377 3221 A 43 ILE HD1% A 32 ASP HBy 1.0 . 5.34 3378 3221 A 43 ILE HD1% A 32 ASP HBx 1.0 . 5.34 3379 3222 A 48 ALA H A 32 ASP HBx 1.0 . 5.34 3380 3222 A 48 ALA H A 32 ASP HBy 1.0 . 5.34 3381 3223 A 48 ALA HB% A 32 ASP HBx 1.0 . 4.06 3382 3223 A 48 ALA HB% A 32 ASP HBy 1.0 . 4.06 3383 3224 A 48 ALA HB% A 32 ASP HBy 1.0 . 4.46 3384 3224 A 48 ALA HB% A 32 ASP HBx 1.0 . 4.46 3385 3225 A 33 PHE HA A 36 PHE HBx 1.0 . 3.94 3386 3225 A 33 PHE HA A 36 PHE HBy 1.0 . 3.94 3387 3226 A 34 PHE H A 34 PHE HBx 1.0 . 3.14 3388 3226 A 34 PHE H A 34 PHE HBy 1.0 . 3.14 3389 3227 A 34 PHE H A 35 ASN HBy 1.0 . 4.40 3390 3227 A 34 PHE H A 35 ASN HBx 1.0 . 4.40 3391 3228 A 35 ASN H A 34 PHE HBx 1.0 . 3.48 3392 3228 A 35 ASN H A 34 PHE HBy 1.0 . 3.48 3393 3229 A 35 ASN H A 35 ASN HBy 1.0 . 3.03 3394 3229 A 35 ASN H A 35 ASN HBx 1.0 . 3.03 3395 3230 A 35 ASN H A 35 ASN HD2x 1.0 . 4.28 3396 3230 A 35 ASN H A 35 ASN HD2y 1.0 . 4.28 3397 3231 A 35 ASN HA A 38 LYS HEy 1.0 . 5.34 3398 3231 A 35 ASN HA A 38 LYS HEx 1.0 . 5.34 3399 3232 A 35 ASN HA A 41 TYR HBx 1.0 . 5.34 3400 3232 A 35 ASN HA A 41 TYR HBy 1.0 . 5.34 3401 3233 A 35 ASN HD2y A 35 ASN HBy 1.0 . 3.04 3402 3233 A 35 ASN HD2y A 35 ASN HBx 1.0 . 3.04 3403 3233 A 35 ASN HD2x A 35 ASN HBy 1.0 . 3.04 3404 3233 A 35 ASN HD2x A 35 ASN HBx 1.0 . 3.04 3405 3234 A 36 PHE H A 35 ASN HBy 1.0 . 3.59 3406 3234 A 36 PHE H A 35 ASN HBx 1.0 . 3.59 3407 3235 A 35 ASN HBy A 41 TYR HBx 1.0 . 4.00 3408 3235 A 35 ASN HBx A 41 TYR HBx 1.0 . 4.00 3409 3235 A 41 TYR HBy A 35 ASN HBy 1.0 . 4.00 3410 3235 A 35 ASN HBx A 41 TYR HBy 1.0 . 4.00 3411 3236 A 43 ILE HD1% A 35 ASN HBy 1.0 . 4.18 3412 3236 A 43 ILE HD1% A 35 ASN HBx 1.0 . 4.18 3413 3237 A 36 PHE H A 43 ILE HG1x 1.0 . 3.98 3414 3237 A 36 PHE H A 43 ILE HG1y 1.0 . 3.98 3415 3238 A 36 PHE HA A 41 TYR HBx 1.0 . 4.72 3416 3238 A 36 PHE HA A 41 TYR HBy 1.0 . 4.72 3417 3239 A 36 PHE HA A 43 ILE HG1x 1.0 . 3.88 3418 3239 A 36 PHE HA A 43 ILE HG1y 1.0 . 3.88 3419 3240 A 37 TRP H A 36 PHE HBx 1.0 . 3.65 3420 3240 A 37 TRP H A 36 PHE HBy 1.0 . 3.65 3421 3241 A 36 PHE HBx A 43 ILE HG1x 1.0 . 4.19 3422 3241 A 36 PHE HBy A 43 ILE HG1x 1.0 . 4.19 3423 3241 A 43 ILE HG1y A 36 PHE HBx 1.0 . 4.19 3424 3241 A 43 ILE HG1y A 36 PHE HBy 1.0 . 4.19 3425 3242 A 43 ILE HD1% A 36 PHE HBx 1.0 . 4.42 3426 3242 A 43 ILE HD1% A 36 PHE HBy 1.0 . 4.42 3427 3243 A 38 LYS H A 38 LYS HGy 1.0 . 4.17 3428 3243 A 38 LYS H A 38 LYS HGx 1.0 . 4.17 3429 3244 A 38 LYS H A 38 LYS HDy 1.0 . 4.73 3430 3244 A 38 LYS H A 38 LYS HDx 1.0 . 4.73 3431 3245 A 38 LYS H A 41 TYR HBx 1.0 . 4.39 3432 3245 A 38 LYS H A 41 TYR HBy 1.0 . 4.39 3433 3246 A 38 LYS HA A 38 LYS HDy 1.0 . 4.13 3434 3246 A 38 LYS HA A 38 LYS HDx 1.0 . 4.13 3435 3247 A 38 LYS HBy A 38 LYS HEy 1.0 . 4.88 3436 3247 A 38 LYS HBy A 38 LYS HEx 1.0 . 4.88 3437 3248 A 38 LYS HBy A 41 TYR HBx 1.0 . 4.35 3438 3248 A 38 LYS HBy A 41 TYR HBy 1.0 . 4.35 3439 3249 A 38 LYS HBx A 41 TYR HBx 1.0 . 4.15 3440 3249 A 38 LYS HBx A 41 TYR HBy 1.0 . 4.15 3441 3250 A 39 GLU H A 38 LYS HGy 1.0 . 3.57 3442 3250 A 39 GLU H A 38 LYS HGx 1.0 . 3.57 3443 3251 A 39 GLU HA A 38 LYS HGy 1.0 . 4.67 3444 3251 A 39 GLU HA A 38 LYS HGx 1.0 . 4.67 3445 3252 A 38 LYS HGx A 41 TYR HBx 1.0 . 4.63 3446 3252 A 38 LYS HGy A 41 TYR HBx 1.0 . 4.63 3447 3252 A 41 TYR HBy A 38 LYS HGy 1.0 . 4.63 3448 3252 A 41 TYR HBy A 38 LYS HGx 1.0 . 4.63 3449 3253 A 39 GLU H A 38 LYS HDy 1.0 . 3.93 3450 3253 A 39 GLU H A 38 LYS HDx 1.0 . 3.93 3451 3254 A 39 GLU HA A 38 LYS HDy 1.0 . 4.99 3452 3254 A 39 GLU HA A 38 LYS HDx 1.0 . 4.99 3453 3255 A 39 GLU H A 39 GLU HBy 1.0 . 2.93 3454 3255 A 39 GLU H A 39 GLU HBx 1.0 . 2.93 3455 3256 A 39 GLU H A 39 GLU HGx 1.0 . 3.17 3456 3256 A 39 GLU H A 39 GLU HGy 1.0 . 3.17 3457 3257 A 39 GLU HA A 39 GLU HGx 1.0 . 3.70 3458 3257 A 39 GLU HA A 39 GLU HGy 1.0 . 3.70 3459 3258 A 39 GLU HA A 40 GLY HAy 1.0 . 4.38 3460 3258 A 39 GLU HA A 40 GLY HAx 1.0 . 4.38 3461 3259 A 40 GLY H A 39 GLU HBy 1.0 . 3.37 3462 3259 A 40 GLY H A 39 GLU HBx 1.0 . 3.37 3463 3260 A 41 TYR HA A 40 GLY HAy 1.0 . 4.73 3464 3260 A 41 TYR HA A 40 GLY HAx 1.0 . 4.73 3465 3261 A 41 TYR H A 41 TYR HBx 1.0 . 2.85 3466 3261 A 41 TYR H A 41 TYR HBy 1.0 . 2.85 3467 3262 A 41 TYR HA A 42 GLN HBx 1.0 . 4.79 3468 3262 A 41 TYR HA A 42 GLN HBy 1.0 . 4.79 3469 3263 A 41 TYR HA A 42 GLN HGx 1.0 . 5.34 3470 3263 A 41 TYR HA A 42 GLN HGy 1.0 . 5.34 3471 3264 A 41 TYR HEx A 41 TYR HBx 1.0 . 4.48 3472 3264 A 41 TYR HEx A 41 TYR HBy 1.0 . 4.48 3473 3265 A 42 GLN H A 41 TYR HBx 1.0 . 3.67 3474 3265 A 42 GLN H A 41 TYR HBy 1.0 . 3.67 3475 3266 A 43 ILE H A 41 TYR HBx 1.0 . 4.64 3476 3266 A 43 ILE H A 41 TYR HBy 1.0 . 4.64 3477 3267 A 41 TYR HBx A 43 ILE HG1x 1.0 . 4.66 3478 3267 A 41 TYR HBy A 43 ILE HG1x 1.0 . 4.66 3479 3267 A 43 ILE HG1y A 41 TYR HBx 1.0 . 4.66 3480 3267 A 43 ILE HG1y A 41 TYR HBy 1.0 . 4.66 3481 3268 A 43 ILE HD1% A 41 TYR HBy 1.0 . 4.50 3482 3268 A 43 ILE HD1% A 41 TYR HBx 1.0 . 4.50 3483 3269 A 43 ILE HD1% A 41 TYR HBx 1.0 . 5.34 3484 3269 A 43 ILE HD1% A 41 TYR HBy 1.0 . 5.34 3485 3270 A 42 GLN H A 42 GLN HBx 1.0 . 3.23 3486 3270 A 42 GLN H A 42 GLN HBy 1.0 . 3.23 3487 3271 A 42 GLN H A 42 GLN HGx 1.0 . 4.09 3488 3271 A 42 GLN H A 42 GLN HGy 1.0 . 4.09 3489 3272 A 42 GLN HA A 42 GLN HGx 1.0 . 3.46 3490 3272 A 42 GLN HA A 42 GLN HGy 1.0 . 3.46 3491 3273 A 43 ILE H A 42 GLN HBx 1.0 . 4.04 3492 3273 A 43 ILE H A 42 GLN HBy 1.0 . 4.04 3493 3274 A 44 THR HG2% A 42 GLN HBx 1.0 . 4.24 3494 3274 A 44 THR HG2% A 42 GLN HBy 1.0 . 4.24 3495 3275 A 44 THR HG2% A 42 GLN HBx 1.0 . 4.69 3496 3275 A 44 THR HG2% A 42 GLN HBy 1.0 . 4.69 3497 3276 A 42 GLN HE2y A 42 GLN HGx 1.0 . 3.60 3498 3276 A 42 GLN HGy A 42 GLN HE2y 1.0 . 3.60 3499 3277 A 43 ILE H A 42 GLN HGx 1.0 . 4.46 3500 3277 A 43 ILE H A 42 GLN HGy 1.0 . 4.46 3501 3278 A 44 THR HG2% A 42 GLN HGx 1.0 . 5.01 3502 3278 A 44 THR HG2% A 42 GLN HGy 1.0 . 5.01 3503 3279 A 44 THR HG2% A 42 GLN HGx 1.0 . 5.34 3504 3279 A 44 THR HG2% A 42 GLN HGy 1.0 . 5.34 3505 3280 A 43 ILE HA A 43 ILE HG1x 1.0 . 3.67 3506 3280 A 43 ILE HA A 43 ILE HG1y 1.0 . 3.67 3507 3281 A 44 THR H A 43 ILE HG1x 1.0 . 5.34 3508 3281 A 44 THR H A 43 ILE HG1y 1.0 . 5.34 3509 3282 A 46 ARG H A 46 ARG HDx 1.0 . 4.01 3510 3282 A 46 ARG H A 46 ARG HDy 1.0 . 4.01 3511 3283 A 46 ARG HA A 46 ARG HDx 1.0 . 4.44 3512 3283 A 46 ARG HA A 46 ARG HDy 1.0 . 4.44 3513 3284 A 46 ARG HA A 109 CYS HBy 1.0 . 5.34 3514 3284 A 46 ARG HA A 109 CYS HBx 1.0 . 5.34 3515 3285 A 46 ARG HBx A 46 ARG HDx 1.0 . 3.67 3516 3285 A 46 ARG HBx A 46 ARG HDy 1.0 . 3.67 3517 3286 A 46 ARG HGx A 47 GLU HGx 1.0 . 4.56 3518 3286 A 46 ARG HGx A 47 GLU HGy 1.0 . 4.56 3519 3287 A 47 GLU H A 46 ARG HDx 1.0 . 4.45 3520 3287 A 47 GLU H A 46 ARG HDy 1.0 . 4.45 3521 3288 A 47 GLU H A 47 GLU HGx 1.0 . 3.86 3522 3288 A 47 GLU H A 47 GLU HGy 1.0 . 3.86 3523 3289 A 47 GLU H A 109 CYS HBy 1.0 . 5.34 3524 3289 A 47 GLU H A 109 CYS HBx 1.0 . 5.34 3525 3290 A 47 GLU HA A 47 GLU HGx 1.0 . 3.41 3526 3290 A 47 GLU HA A 47 GLU HGy 1.0 . 3.41 3527 3291 A 51 VAL H A 47 GLU HGx 1.0 . 5.34 3528 3291 A 51 VAL H A 47 GLU HGy 1.0 . 5.34 3529 3292 A 49 GLY H A 109 CYS HBy 1.0 . 4.64 3530 3292 A 49 GLY H A 109 CYS HBx 1.0 . 4.64 3531 3293 A 50 CYS H A 109 CYS HBy 1.0 . 3.88 3532 3293 A 50 CYS H A 109 CYS HBx 1.0 . 3.88 3533 3294 A 50 CYS HA A 53 LEU HBx 1.0 . 4.51 3534 3294 A 50 CYS HA A 53 LEU HBy 1.0 . 4.51 3535 3295 A 51 VAL HA A 54 CYS HBy 1.0 . 3.75 3536 3295 A 51 VAL HA A 54 CYS HBx 1.0 . 3.75 3537 3296 A 52 ILE HB A 112 MET HGy 1.0 . 4.37 3538 3296 A 52 ILE HB A 112 MET HGx 1.0 . 4.37 3539 3297 A 52 ILE HG2% A 53 LEU HBy 1.0 . 4.75 3540 3297 A 52 ILE HG2% A 53 LEU HBx 1.0 . 4.75 3541 3298 A 52 ILE HG2% A 112 MET HGx 1.0 . 3.61 3542 3298 A 52 ILE HG2% A 112 MET HGy 1.0 . 3.61 3543 3299 A 53 LEU H A 112 MET HGy 1.0 . 4.40 3544 3299 A 53 LEU H A 112 MET HGx 1.0 . 4.40 3545 3300 A 53 LEU HDx% A 53 LEU HBx 1.0 . 3.09 3546 3300 A 53 LEU HDx% A 53 LEU HBy 1.0 . 3.09 3547 3301 A 53 LEU HDy% A 53 LEU HBy 1.0 . 3.09 3548 3301 A 53 LEU HDy% A 53 LEU HBx 1.0 . 3.09 3549 3302 A 54 CYS H A 53 LEU HBx 1.0 . 3.61 3550 3302 A 54 CYS H A 53 LEU HBy 1.0 . 3.61 3551 3303 A 112 MET HA A 53 LEU HBx 1.0 . 5.34 3552 3303 A 112 MET HA A 53 LEU HBy 1.0 . 5.34 3553 3304 A 53 LEU HBy A 112 MET HGy 1.0 . 4.06 3554 3304 A 53 LEU HBx A 112 MET HGy 1.0 . 4.06 3555 3304 A 112 MET HGx A 53 LEU HBx 1.0 . 4.06 3556 3304 A 53 LEU HBy A 112 MET HGx 1.0 . 4.06 3557 3305 A 53 LEU HG A 112 MET HGy 1.0 . 4.35 3558 3305 A 53 LEU HG A 112 MET HGx 1.0 . 4.35 3559 3306 A 53 LEU HDx% A 112 MET HGx 1.0 . 3.93 3560 3306 A 53 LEU HDx% A 112 MET HGy 1.0 . 3.93 3561 3307 A 54 CYS H A 54 CYS HBy 1.0 . 2.94 3562 3307 A 54 CYS H A 54 CYS HBx 1.0 . 2.94 3563 3308 A 54 CYS HA A 57 LYS HBx 1.0 . 3.74 3564 3308 A 54 CYS HA A 57 LYS HBy 1.0 . 3.74 3565 3309 A 54 CYS HA A 57 LYS HGx 1.0 . 4.74 3566 3309 A 54 CYS HA A 57 LYS HGy 1.0 . 4.74 3567 3310 A 54 CYS HA A 58 LYS HGy 1.0 . 4.98 3568 3310 A 54 CYS HA A 58 LYS HGx 1.0 . 4.98 3569 3311 A 55 LEU H A 54 CYS HBy 1.0 . 3.64 3570 3311 A 55 LEU H A 54 CYS HBx 1.0 . 3.64 3571 3312 A 56 ALA H A 57 LYS HBx 1.0 . 5.34 3572 3312 A 56 ALA H A 57 LYS HBy 1.0 . 5.34 3573 3313 A 56 ALA H A 57 LYS HGx 1.0 . 5.19 3574 3313 A 56 ALA H A 57 LYS HGy 1.0 . 5.19 3575 3314 A 57 LYS H A 57 LYS HBx 1.0 . 2.86 3576 3314 A 57 LYS H A 57 LYS HBy 1.0 . 2.86 3577 3315 A 57 LYS H A 57 LYS HGx 1.0 . 3.40 3578 3315 A 57 LYS H A 57 LYS HGy 1.0 . 3.40 3579 3316 A 57 LYS H A 57 LYS HEy 1.0 . 5.34 3580 3316 A 57 LYS H A 57 LYS HEx 1.0 . 5.34 3581 3317 A 57 LYS HA A 57 LYS HGx 1.0 . 3.46 3582 3317 A 57 LYS HA A 57 LYS HGy 1.0 . 3.46 3583 3318 A 57 LYS HA A 57 LYS HDx 1.0 . 4.80 3584 3318 A 57 LYS HA A 57 LYS HDy 1.0 . 4.80 3585 3319 A 57 LYS HBx A 57 LYS HEy 1.0 . 4.39 3586 3319 A 57 LYS HBy A 57 LYS HEy 1.0 . 4.39 3587 3319 A 57 LYS HEx A 57 LYS HBx 1.0 . 4.39 3588 3319 A 57 LYS HBy A 57 LYS HEx 1.0 . 4.39 3589 3320 A 58 LYS H A 57 LYS HBx 1.0 . 3.91 3590 3320 A 58 LYS H A 57 LYS HBy 1.0 . 3.91 3591 3321 A 58 LYS HA A 58 LYS HGy 1.0 . 3.51 3592 3321 A 58 LYS HA A 58 LYS HGx 1.0 . 3.51 3593 3322 A 58 LYS HA A 58 LYS HDx 1.0 . 4.22 3594 3322 A 58 LYS HA A 58 LYS HDy 1.0 . 4.22 3595 3323 A 58 LYS HEx A 58 LYS HGy 1.0 . 3.28 3596 3323 A 58 LYS HEy A 58 LYS HGy 1.0 . 3.28 3597 3323 A 58 LYS HGx A 58 LYS HEx 1.0 . 3.28 3598 3323 A 58 LYS HEy A 58 LYS HGx 1.0 . 3.28 3599 3324 A 61 LEU HDx% A 58 LYS HGx 1.0 . 4.87 3600 3324 A 61 LEU HDx% A 58 LYS HGy 1.0 . 4.87 3601 3325 A 61 LEU HDx% A 58 LYS HEy 1.0 . 4.57 3602 3325 A 61 LEU HDx% A 58 LYS HEx 1.0 . 4.57 3603 3326 A 59 LEU H A 59 LEU HBx 1.0 . 3.16 3604 3326 A 59 LEU H A 59 LEU HBy 1.0 . 3.16 3605 3327 A 59 LEU H A 60 GLU HBx 1.0 . 5.34 3606 3327 A 59 LEU H A 60 GLU HBy 1.0 . 5.34 3607 3328 A 59 LEU H A 60 GLU HGy 1.0 . 5.34 3608 3328 A 59 LEU H A 60 GLU HGx 1.0 . 5.34 3609 3329 A 59 LEU HA A 62 LEU HBx 1.0 . 4.07 3610 3329 A 59 LEU HA A 62 LEU HBy 1.0 . 4.07 3611 3330 A 59 LEU HDx% A 59 LEU HBy 1.0 . 3.14 3612 3330 A 59 LEU HDx% A 59 LEU HBx 1.0 . 3.14 3613 3331 A 59 LEU HDx% A 59 LEU HBx 1.0 . 3.52 3614 3331 A 59 LEU HDx% A 59 LEU HBy 1.0 . 3.52 3615 3332 A 59 LEU HDy% A 59 LEU HBy 1.0 . 3.59 3616 3332 A 59 LEU HDy% A 59 LEU HBx 1.0 . 3.59 3617 3333 A 60 GLU H A 59 LEU HBx 1.0 . 3.25 3618 3333 A 60 GLU H A 59 LEU HBy 1.0 . 3.25 3619 3334 A 69 HIS HA A 59 LEU HBx 1.0 . 4.32 3620 3334 A 69 HIS HA A 59 LEU HBy 1.0 . 4.32 3621 3335 A 60 GLU H A 60 GLU HGy 1.0 . 3.35 3622 3335 A 60 GLU H A 60 GLU HGx 1.0 . 3.35 3623 3336 A 60 GLU HA A 60 GLU HGy 1.0 . 3.52 3624 3336 A 60 GLU HA A 60 GLU HGx 1.0 . 3.52 3625 3337 A 61 LEU HDy% A 60 GLU HBx 1.0 . 5.26 3626 3337 A 61 LEU HDy% A 60 GLU HBy 1.0 . 5.26 3627 3338 A 61 LEU HDy% A 60 GLU HBy 1.0 . 5.34 3628 3338 A 61 LEU HDy% A 60 GLU HBx 1.0 . 5.34 3629 3339 A 62 LEU H A 62 LEU HBx 1.0 . 2.97 3630 3339 A 62 LEU H A 62 LEU HBy 1.0 . 2.97 3631 3340 A 62 LEU HA A 63 ASP HBx 1.0 . 4.55 3632 3340 A 62 LEU HA A 63 ASP HBy 1.0 . 4.55 3633 3341 A 62 LEU HDx% A 62 LEU HBx 1.0 . 3.67 3634 3341 A 62 LEU HDx% A 62 LEU HBy 1.0 . 3.67 3635 3342 A 62 LEU HDx% A 62 LEU HBx 1.0 . 3.27 3636 3342 A 62 LEU HDx% A 62 LEU HBy 1.0 . 3.27 3637 3343 A 63 ASP H A 62 LEU HBx 1.0 . 3.53 3638 3343 A 63 ASP H A 62 LEU HBy 1.0 . 3.53 3639 3344 A 62 LEU HDx% A 66 MET HGy 1.0 . 5.10 3640 3344 A 62 LEU HDx% A 66 MET HGx 1.0 . 5.10 3641 3345 A 63 ASP H A 63 ASP HBx 1.0 . 3.09 3642 3345 A 63 ASP H A 63 ASP HBy 1.0 . 3.09 3643 3346 A 63 ASP HA A 64 GLN HBx 1.0 . 4.24 3644 3346 A 63 ASP HA A 64 GLN HBy 1.0 . 4.24 3645 3347 A 64 GLN H A 63 ASP HBx 1.0 . 3.75 3646 3347 A 64 GLN H A 63 ASP HBy 1.0 . 3.75 3647 3348 A 64 GLN HA A 63 ASP HBx 1.0 . 4.88 3648 3348 A 64 GLN HA A 63 ASP HBy 1.0 . 4.88 3649 3349 A 65 ASP H A 63 ASP HBx 1.0 . 3.23 3650 3349 A 65 ASP H A 63 ASP HBy 1.0 . 3.23 3651 3350 A 66 MET H A 63 ASP HBx 1.0 . 4.36 3652 3350 A 66 MET H A 63 ASP HBy 1.0 . 4.36 3653 3351 A 64 GLN H A 64 GLN HBx 1.0 . 3.18 3654 3351 A 64 GLN H A 64 GLN HBy 1.0 . 3.18 3655 3352 A 65 ASP H A 64 GLN HBx 1.0 . 3.58 3656 3352 A 65 ASP H A 64 GLN HBy 1.0 . 3.58 3657 3353 A 66 MET H A 64 GLN HBx 1.0 . 5.32 3658 3353 A 66 MET H A 64 GLN HBy 1.0 . 5.32 3659 3354 A 67 ASN HD2x A 64 GLN HE2x 1.0 . 4.15 3660 3354 A 67 ASN HD2y A 64 GLN HE2x 1.0 . 4.15 3661 3355 A 67 ASN HD2x A 64 GLN HE2y 1.0 . 4.62 3662 3355 A 67 ASN HD2y A 64 GLN HE2y 1.0 . 4.62 3663 3356 A 65 ASP H A 65 ASP HBx 1.0 . 3.08 3664 3356 A 65 ASP H A 65 ASP HBy 1.0 . 3.08 3665 3357 A 65 ASP HA A 67 ASN HD2x 1.0 . 4.55 3666 3357 A 65 ASP HA A 67 ASN HD2y 1.0 . 4.55 3667 3358 A 66 MET H A 65 ASP HBx 1.0 . 3.43 3668 3358 A 66 MET H A 65 ASP HBy 1.0 . 3.43 3669 3359 A 66 MET HBx A 65 ASP HBx 1.0 . 4.29 3670 3359 A 66 MET HBx A 65 ASP HBy 1.0 . 4.29 3671 3360 A 66 MET H A 66 MET HGx 1.0 . 3.18 3672 3360 A 66 MET H A 66 MET HGy 1.0 . 3.18 3673 3361 A 66 MET H A 67 ASN HD2x 1.0 . 5.34 3674 3361 A 66 MET H A 67 ASN HD2y 1.0 . 5.34 3675 3362 A 67 ASN H A 66 MET HGx 1.0 . 3.67 3676 3362 A 67 ASN H A 66 MET HGy 1.0 . 3.67 3677 3363 A 68 LEU H A 66 MET HGx 1.0 . 4.12 3678 3363 A 68 LEU H A 66 MET HGy 1.0 . 4.12 3679 3364 A 67 ASN H A 67 ASN HBy 1.0 . 3.52 3680 3364 A 67 ASN H A 67 ASN HBx 1.0 . 3.52 3681 3365 A 67 ASN H A 67 ASN HD2x 1.0 . 4.10 3682 3365 A 67 ASN H A 67 ASN HD2y 1.0 . 4.10 3683 3366 A 67 ASN H A 68 LEU HBx 1.0 . 4.88 3684 3366 A 67 ASN H A 68 LEU HBy 1.0 . 4.88 3685 3367 A 67 ASN HA A 67 ASN HD2x 1.0 . 4.39 3686 3367 A 67 ASN HA A 67 ASN HD2y 1.0 . 4.39 3687 3368 A 67 ASN HD2x A 67 ASN HBx 1.0 . 3.22 3688 3368 A 67 ASN HD2y A 67 ASN HBy 1.0 . 3.22 3689 3368 A 67 ASN HD2x A 67 ASN HBy 1.0 . 3.22 3690 3368 A 67 ASN HD2y A 67 ASN HBx 1.0 . 3.22 3691 3369 A 67 ASN HBx A 79 LYS HGy 1.0 . 3.99 3692 3369 A 67 ASN HBy A 79 LYS HGy 1.0 . 3.99 3693 3369 A 79 LYS HGx A 67 ASN HBy 1.0 . 3.99 3694 3369 A 67 ASN HBx A 79 LYS HGx 1.0 . 3.99 3695 3370 A 67 ASN HBx A 79 LYS HDx 1.0 . 4.14 3696 3370 A 67 ASN HBy A 79 LYS HDx 1.0 . 4.14 3697 3370 A 79 LYS HDy A 67 ASN HBy 1.0 . 4.14 3698 3370 A 67 ASN HBx A 79 LYS HDy 1.0 . 4.14 3699 3371 A 68 LEU H A 68 LEU HBx 1.0 . 3.31 3700 3371 A 68 LEU H A 68 LEU HBy 1.0 . 3.31 3701 3372 A 68 LEU HDx% A 68 LEU HBx 1.0 . 3.51 3702 3372 A 68 LEU HDx% A 68 LEU HBy 1.0 . 3.51 3703 3373 A 69 HIS H A 68 LEU HBx 1.0 . 4.01 3704 3373 A 69 HIS H A 68 LEU HBy 1.0 . 4.01 3705 3374 A 69 HIS H A 69 HIS HBx 1.0 . 3.47 3706 3374 A 69 HIS H A 69 HIS HBy 1.0 . 3.47 3707 3375 A 69 HIS H A 72 LYS HBy 1.0 . 4.15 3708 3375 A 69 HIS H A 72 LYS HBx 1.0 . 4.15 3709 3376 A 70 HIS H A 69 HIS HBx 1.0 . 4.37 3710 3376 A 70 HIS H A 69 HIS HBy 1.0 . 4.37 3711 3377 A 69 HIS HBy A 72 LYS HBy 1.0 . 3.74 3712 3377 A 69 HIS HBx A 72 LYS HBy 1.0 . 3.74 3713 3377 A 72 LYS HBx A 69 HIS HBx 1.0 . 3.74 3714 3377 A 69 HIS HBy A 72 LYS HBx 1.0 . 3.74 3715 3378 A 69 HIS HBy A 72 LYS HGy 1.0 . 4.54 3716 3378 A 69 HIS HBx A 72 LYS HGy 1.0 . 4.54 3717 3378 A 72 LYS HGx A 69 HIS HBx 1.0 . 4.54 3718 3378 A 69 HIS HBy A 72 LYS HGx 1.0 . 4.54 3719 3379 A 69 HIS HBx A 72 LYS HDy 1.0 . 4.24 3720 3379 A 69 HIS HBy A 72 LYS HDy 1.0 . 4.24 3721 3379 A 72 LYS HDx A 69 HIS HBx 1.0 . 4.24 3722 3379 A 69 HIS HBy A 72 LYS HDx 1.0 . 4.24 3723 3380 A 70 HIS HA A 71 GLY HAy 1.0 . 4.48 3724 3380 A 70 HIS HA A 71 GLY HAx 1.0 . 4.48 3725 3381 A 71 GLY H A 70 HIS HBx 1.0 . 4.13 3726 3381 A 71 GLY H A 70 HIS HBy 1.0 . 4.13 3727 3382 A 73 ALA H A 71 GLY HAy 1.0 . 4.44 3728 3382 A 73 ALA H A 71 GLY HAx 1.0 . 4.44 3729 3383 A 72 LYS H A 72 LYS HBy 1.0 . 3.46 3730 3383 A 72 LYS H A 72 LYS HBx 1.0 . 3.46 3731 3384 A 72 LYS H A 72 LYS HGy 1.0 . 4.41 3732 3384 A 72 LYS H A 72 LYS HGx 1.0 . 4.41 3733 3385 A 72 LYS H A 72 LYS HDy 1.0 . 3.49 3734 3385 A 72 LYS H A 72 LYS HDx 1.0 . 3.49 3735 3386 A 72 LYS HA A 72 LYS HGy 1.0 . 3.62 3736 3386 A 72 LYS HA A 72 LYS HGx 1.0 . 3.62 3737 3387 A 72 LYS HA A 72 LYS HDy 1.0 . 3.82 3738 3387 A 72 LYS HA A 72 LYS HDx 1.0 . 3.82 3739 3388 A 72 LYS HBx A 72 LYS HDy 1.0 . 3.32 3740 3388 A 72 LYS HBy A 72 LYS HDy 1.0 . 3.32 3741 3388 A 72 LYS HDx A 72 LYS HBy 1.0 . 3.32 3742 3388 A 72 LYS HBx A 72 LYS HDx 1.0 . 3.32 3743 3389 A 73 ALA H A 72 LYS HBy 1.0 . 3.99 3744 3389 A 73 ALA H A 72 LYS HBx 1.0 . 3.99 3745 3390 A 73 ALA HA A 72 LYS HBy 1.0 . 5.34 3746 3390 A 73 ALA HA A 72 LYS HBx 1.0 . 5.34 3747 3391 A 72 LYS HEx A 72 LYS HGy 1.0 . 3.17 3748 3391 A 72 LYS HEy A 72 LYS HGy 1.0 . 3.17 3749 3391 A 72 LYS HGx A 72 LYS HEy 1.0 . 3.17 3750 3391 A 72 LYS HGx A 72 LYS HEx 1.0 . 3.17 3751 3392 A 73 ALA H A 72 LYS HDy 1.0 . 4.92 3752 3392 A 73 ALA H A 72 LYS HDx 1.0 . 4.92 3753 3393 A 73 ALA H A 74 MET HGx 1.0 . 5.22 3754 3393 A 73 ALA H A 74 MET HGy 1.0 . 5.22 3755 3394 A 73 ALA HA A 138 GLU HGy 1.0 . 4.46 3756 3394 A 73 ALA HA A 138 GLU HGx 1.0 . 4.46 3757 3395 A 73 ALA HB% A 138 GLU HGy 1.0 . 3.14 3758 3395 A 73 ALA HB% A 138 GLU HGx 1.0 . 3.14 3759 3396 A 73 ALA HB% A 74 MET HGy 1.0 . 3.87 3760 3396 A 73 ALA HB% A 74 MET HGx 1.0 . 3.87 3761 3397 A 74 MET H A 74 MET HGx 1.0 . 2.95 3762 3397 A 74 MET H A 74 MET HGy 1.0 . 2.95 3763 3398 A 74 MET HA A 74 MET HGx 1.0 . 3.49 3764 3398 A 74 MET HA A 74 MET HGy 1.0 . 3.49 3765 3399 A 74 MET HBy A 75 GLU HGy 1.0 . 3.81 3766 3399 A 74 MET HBy A 75 GLU HGx 1.0 . 3.81 3767 3400 A 75 GLU H A 74 MET HGx 1.0 . 4.59 3768 3400 A 75 GLU H A 74 MET HGy 1.0 . 4.59 3769 3401 A 91 LEU HG A 74 MET HGx 1.0 . 5.34 3770 3401 A 91 LEU HG A 74 MET HGy 1.0 . 5.34 3771 3402 A 91 LEU HDx% A 74 MET HGy 1.0 . 4.33 3772 3402 A 91 LEU HDx% A 74 MET HGx 1.0 . 4.33 3773 3403 A 91 LEU HDx% A 74 MET HGx 1.0 . 4.24 3774 3403 A 91 LEU HDx% A 74 MET HGy 1.0 . 4.24 3775 3404 A 75 GLU H A 75 GLU HBx 1.0 . 3.08 3776 3404 A 75 GLU H A 75 GLU HBy 1.0 . 3.08 3777 3405 A 75 GLU H A 75 GLU HGy 1.0 . 3.69 3778 3405 A 75 GLU H A 75 GLU HGx 1.0 . 3.69 3779 3406 A 75 GLU HA A 75 GLU HGy 1.0 . 3.30 3780 3406 A 75 GLU HA A 75 GLU HGx 1.0 . 3.30 3781 3407 A 77 ALA H A 75 GLU HBx 1.0 . 5.32 3782 3407 A 77 ALA H A 75 GLU HBy 1.0 . 5.32 3783 3408 A 76 PHE H A 75 GLU HGy 1.0 . 4.67 3784 3408 A 76 PHE H A 75 GLU HGx 1.0 . 4.67 3785 3409 A 76 PHE HA A 79 LYS HBy 1.0 . 3.96 3786 3409 A 76 PHE HA A 79 LYS HBx 1.0 . 3.96 3787 3410 A 76 PHE HA A 79 LYS HGy 1.0 . 4.66 3788 3410 A 76 PHE HA A 79 LYS HGx 1.0 . 4.66 3789 3411 A 77 ALA H A 138 GLU HGy 1.0 . 4.25 3790 3411 A 77 ALA H A 138 GLU HGx 1.0 . 4.25 3791 3412 A 77 ALA HA A 80 HIS HBx 1.0 . 5.34 3792 3412 A 77 ALA HA A 80 HIS HBy 1.0 . 5.34 3793 3413 A 77 ALA HB% A 138 GLU HGy 1.0 . 3.78 3794 3413 A 77 ALA HB% A 138 GLU HGx 1.0 . 3.78 3795 3414 A 77 ALA HB% A 138 GLU HGx 1.0 . 3.41 3796 3414 A 77 ALA HB% A 138 GLU HGy 1.0 . 3.41 3797 3415 A 79 LYS H A 79 LYS HBy 1.0 . 2.93 3798 3415 A 79 LYS H A 79 LYS HBx 1.0 . 2.93 3799 3416 A 79 LYS H A 79 LYS HGy 1.0 . 3.35 3800 3416 A 79 LYS H A 79 LYS HGx 1.0 . 3.35 3801 3417 A 79 LYS H A 80 HIS HBx 1.0 . 5.16 3802 3417 A 79 LYS H A 80 HIS HBy 1.0 . 5.16 3803 3418 A 79 LYS HA A 79 LYS HGy 1.0 . 3.23 3804 3418 A 79 LYS HA A 79 LYS HGx 1.0 . 3.23 3805 3419 A 79 LYS HA A 79 LYS HEx 1.0 . 5.34 3806 3419 A 79 LYS HA A 79 LYS HEy 1.0 . 5.34 3807 3420 A 80 HIS HD2 A 79 LYS HBy 1.0 . 4.23 3808 3420 A 80 HIS HD2 A 79 LYS HBx 1.0 . 4.23 3809 3421 A 80 HIS H A 80 HIS HBx 1.0 . 3.26 3810 3421 A 80 HIS H A 80 HIS HBy 1.0 . 3.26 3811 3422 A 80 HIS H A 81 GLY HAy 1.0 . 5.04 3812 3422 A 80 HIS H A 81 GLY HAx 1.0 . 5.04 3813 3423 A 80 HIS HA A 81 GLY HAy 1.0 . 5.33 3814 3423 A 80 HIS HA A 81 GLY HAx 1.0 . 5.33 3815 3424 A 82 ALA HB% A 80 HIS HBx 1.0 . 5.34 3816 3424 A 82 ALA HB% A 80 HIS HBy 1.0 . 5.34 3817 3425 A 134 VAL HGx% A 80 HIS HBx 1.0 . 2.97 3818 3425 A 134 VAL HGx% A 80 HIS HBy 1.0 . 2.97 3819 3426 A 82 ALA HB% A 81 GLY HAy 1.0 . 5.34 3820 3426 A 82 ALA HB% A 81 GLY HAx 1.0 . 5.34 3821 3427 A 82 ALA HB% A 81 GLY HAx 1.0 . 5.34 3822 3427 A 82 ALA HB% A 81 GLY HAy 1.0 . 5.34 3823 3428 A 82 ALA HA A 86 MET HBx 1.0 . 3.96 3824 3428 A 82 ALA HA A 86 MET HBy 1.0 . 3.96 3825 3429 A 82 ALA HB% A 86 MET HBy 1.0 . 3.32 3826 3429 A 82 ALA HB% A 86 MET HBx 1.0 . 3.32 3827 3430 A 82 ALA HB% A 86 MET HBy 1.0 . 4.55 3828 3430 A 82 ALA HB% A 86 MET HBx 1.0 . 4.55 3829 3431 A 83 ASP H A 83 ASP HBx 1.0 . 3.25 3830 3431 A 83 ASP H A 83 ASP HBy 1.0 . 3.25 3831 3432 A 83 ASP H A 86 MET HBx 1.0 . 3.22 3832 3432 A 83 ASP H A 86 MET HBy 1.0 . 3.22 3833 3433 A 83 ASP H A 86 MET HGx 1.0 . 4.67 3834 3433 A 83 ASP H A 86 MET HGy 1.0 . 4.67 3835 3434 A 83 ASP HA A 86 MET HGx 1.0 . 5.34 3836 3434 A 83 ASP HA A 86 MET HGy 1.0 . 5.34 3837 3435 A 84 GLU H A 83 ASP HBx 1.0 . 2.79 3838 3435 A 84 GLU H A 83 ASP HBy 1.0 . 2.79 3839 3436 A 84 GLU HBx A 83 ASP HBx 1.0 . 4.97 3840 3436 A 84 GLU HBx A 83 ASP HBy 1.0 . 4.97 3841 3437 A 85 ALA H A 83 ASP HBx 1.0 . 3.43 3842 3437 A 85 ALA H A 83 ASP HBy 1.0 . 3.43 3843 3438 A 86 MET H A 83 ASP HBx 1.0 . 4.36 3844 3438 A 86 MET H A 83 ASP HBy 1.0 . 4.36 3845 3439 A 84 GLU HA A 84 GLU HGy 1.0 . 3.43 3846 3439 A 84 GLU HA A 84 GLU HGx 1.0 . 3.43 3847 3440 A 85 ALA H A 84 GLU HGy 1.0 . 3.65 3848 3440 A 85 ALA H A 84 GLU HGx 1.0 . 3.65 3849 3441 A 85 ALA HA A 84 GLU HGy 1.0 . 4.50 3850 3441 A 85 ALA HA A 84 GLU HGx 1.0 . 4.50 3851 3442 A 85 ALA HB% A 84 GLU HGy 1.0 . 4.03 3852 3442 A 85 ALA HB% A 84 GLU HGx 1.0 . 4.03 3853 3443 A 85 ALA HA A 88 LYS HGx 1.0 . 3.89 3854 3443 A 85 ALA HA A 88 LYS HGy 1.0 . 3.89 3855 3444 A 85 ALA HA A 88 LYS HDy 1.0 . 3.57 3856 3444 A 85 ALA HA A 88 LYS HDx 1.0 . 3.57 3857 3445 A 86 MET H A 86 MET HBx 1.0 . 2.89 3858 3445 A 86 MET H A 86 MET HBy 1.0 . 2.89 3859 3446 A 86 MET H A 86 MET HGx 1.0 . 3.21 3860 3446 A 86 MET H A 86 MET HGy 1.0 . 3.21 3861 3447 A 86 MET HA A 89 GLN HBx 1.0 . 3.52 3862 3447 A 86 MET HA A 89 GLN HBy 1.0 . 3.52 3863 3448 A 89 GLN HE2x A 86 MET HA 1.0 . 4.68 3864 3448 A 89 GLN HE2y A 86 MET HA 1.0 . 4.68 3865 3449 A 87 ALA H A 86 MET HBx 1.0 . 3.02 3866 3449 A 87 ALA H A 86 MET HBy 1.0 . 3.02 3867 3450 A 89 GLN HGy A 86 MET HBx 1.0 . 5.18 3868 3450 A 89 GLN HGy A 86 MET HBy 1.0 . 5.18 3869 3451 A 128 TRP HH2 A 86 MET HBx 1.0 . 4.51 3870 3451 A 128 TRP HH2 A 86 MET HBy 1.0 . 4.51 3871 3452 A 87 ALA H A 86 MET HGx 1.0 . 4.45 3872 3452 A 87 ALA H A 86 MET HGy 1.0 . 4.45 3873 3453 A 128 TRP HE1 A 86 MET HGx 1.0 . 4.60 3874 3453 A 128 TRP HE1 A 86 MET HGy 1.0 . 4.60 3875 3454 A 128 TRP HH2 A 86 MET HGx 1.0 . 4.94 3876 3454 A 128 TRP HH2 A 86 MET HGy 1.0 . 4.94 3877 3455 A 87 ALA H A 88 LYS HGx 1.0 . 4.52 3878 3455 A 87 ALA H A 88 LYS HGy 1.0 . 4.52 3879 3456 A 87 ALA HA A 90 LEU HBx 1.0 . 4.64 3880 3456 A 87 ALA HA A 90 LEU HBy 1.0 . 4.64 3881 3457 A 88 LYS H A 88 LYS HGx 1.0 . 3.85 3882 3457 A 88 LYS H A 88 LYS HGy 1.0 . 3.85 3883 3458 A 88 LYS H A 88 LYS HDy 1.0 . 4.75 3884 3458 A 88 LYS H A 88 LYS HDx 1.0 . 4.75 3885 3459 A 89 GLN H A 88 LYS HGx 1.0 . 4.00 3886 3459 A 89 GLN H A 88 LYS HGy 1.0 . 4.00 3887 3460 A 89 GLN HA A 88 LYS HGx 1.0 . 4.86 3888 3460 A 89 GLN HA A 88 LYS HGy 1.0 . 4.86 3889 3461 A 89 GLN H A 88 LYS HDy 1.0 . 5.34 3890 3461 A 89 GLN H A 88 LYS HDx 1.0 . 5.34 3891 3462 A 89 GLN H A 89 GLN HBx 1.0 . 2.75 3892 3462 A 89 GLN H A 89 GLN HBy 1.0 . 2.75 3893 3463 A 89 GLN H A 92 ASP HBx 1.0 . 5.34 3894 3463 A 89 GLN H A 92 ASP HBy 1.0 . 5.34 3895 3464 A 89 GLN HA A 92 ASP HBx 1.0 . 3.13 3896 3464 A 89 GLN HA A 92 ASP HBy 1.0 . 3.13 3897 3465 A 89 GLN HE2y A 89 GLN HBy 1.0 . 3.94 3898 3465 A 89 GLN HE2x A 89 GLN HBx 1.0 . 3.94 3899 3465 A 89 GLN HE2x A 89 GLN HBy 1.0 . 3.94 3900 3465 A 89 GLN HE2y A 89 GLN HBx 1.0 . 3.94 3901 3466 A 90 LEU H A 89 GLN HBx 1.0 . 3.27 3902 3466 A 90 LEU H A 89 GLN HBy 1.0 . 3.27 3903 3467 A 93 ILE HD1% A 89 GLN HBx 1.0 . 4.75 3904 3467 A 93 ILE HD1% A 89 GLN HBy 1.0 . 4.75 3905 3468 A 126 LEU HDy% A 89 GLN HBx 1.0 . 5.34 3906 3468 A 126 LEU HDy% A 89 GLN HBy 1.0 . 5.34 3907 3469 A 128 TRP HZ2 A 89 GLN HBx 1.0 . 4.34 3908 3469 A 128 TRP HZ2 A 89 GLN HBy 1.0 . 4.34 3909 3470 A 89 GLN HE2x A 89 GLN HGy 1.0 . 3.23 3910 3470 A 89 GLN HE2y A 89 GLN HGy 1.0 . 3.23 3911 3471 A 89 GLN HE2y A 93 ILE HD1% 1.0 . 4.76 3912 3471 A 89 GLN HE2x A 93 ILE HD1% 1.0 . 4.76 3913 3472 A 89 GLN HE2x A 93 ILE HD1% 1.0 . 4.57 3914 3472 A 89 GLN HE2y A 93 ILE HD1% 1.0 . 4.57 3915 3473 A 126 LEU HDx% A 89 GLN HE2y 1.0 . 4.62 3916 3473 A 126 LEU HDx% A 89 GLN HE2x 1.0 . 4.62 3917 3474 A 126 LEU HDy% A 89 GLN HE2x 1.0 . 3.45 3918 3474 A 126 LEU HDy% A 89 GLN HE2y 1.0 . 3.45 3919 3475 A 89 GLN HE2x A 128 TRP HE1 1.0 . 3.68 3920 3475 A 89 GLN HE2y A 128 TRP HE1 1.0 . 3.68 3921 3476 A 90 LEU H A 90 LEU HBx 1.0 . 2.88 3922 3476 A 90 LEU H A 90 LEU HBy 1.0 . 2.88 3923 3477 A 90 LEU HDx% A 90 LEU HBx 1.0 . 3.34 3924 3477 A 90 LEU HDx% A 90 LEU HBy 1.0 . 3.34 3925 3478 A 90 LEU HDx% A 90 LEU HBx 1.0 . 3.66 3926 3478 A 90 LEU HDx% A 90 LEU HBy 1.0 . 3.66 3927 3479 A 91 LEU H A 90 LEU HBx 1.0 . 3.77 3928 3479 A 91 LEU H A 90 LEU HBy 1.0 . 3.77 3929 3480 A 119 PHE HZ A 90 LEU HBx 1.0 . 5.04 3930 3480 A 119 PHE HZ A 90 LEU HBy 1.0 . 5.04 3931 3481 A 119 PHE HEy A 90 LEU HBx 1.0 . 4.55 3932 3481 A 119 PHE HEy A 90 LEU HBy 1.0 . 4.55 3933 3482 A 135 ALA HA A 90 LEU HBx 1.0 . 5.06 3934 3482 A 135 ALA HA A 90 LEU HBy 1.0 . 5.06 3935 3483 A 90 LEU HDx% A 138 GLU HGy 1.0 . 4.13 3936 3483 A 90 LEU HDx% A 138 GLU HGx 1.0 . 4.13 3937 3484 A 90 LEU HDx% A 130 PRO HBy 1.0 . 3.52 3938 3484 A 90 LEU HDx% A 130 PRO HBx 1.0 . 3.52 3939 3485 A 90 LEU HDy% A 130 PRO HBx 1.0 . 3.92 3940 3485 A 90 LEU HDy% A 130 PRO HBy 1.0 . 3.92 3941 3486 A 90 LEU HDy% A 130 PRO HGx 1.0 . 3.72 3942 3486 A 90 LEU HDy% A 130 PRO HGy 1.0 . 3.72 3943 3487 A 90 LEU HDy% A 130 PRO HBy 1.0 . 4.43 3944 3487 A 90 LEU HDy% A 130 PRO HBx 1.0 . 4.43 3945 3488 A 90 LEU HDy% A 130 PRO HGy 1.0 . 4.20 3946 3488 A 90 LEU HDy% A 130 PRO HGx 1.0 . 4.20 3947 3489 A 91 LEU HA A 94 LYS HBy 1.0 . 4.08 3948 3489 A 91 LEU HA A 94 LYS HBx 1.0 . 4.08 3949 3490 A 92 ASP H A 92 ASP HBx 1.0 . 2.86 3950 3490 A 92 ASP H A 92 ASP HBy 1.0 . 2.86 3951 3491 A 92 ASP HA A 95 HIS HBy 1.0 . 3.41 3952 3491 A 92 ASP HA A 95 HIS HBx 1.0 . 3.41 3953 3492 A 93 ILE H A 92 ASP HBx 1.0 . 3.31 3954 3492 A 93 ILE H A 92 ASP HBy 1.0 . 3.31 3955 3493 A 92 ASP HBy A 95 HIS HBy 1.0 . 5.16 3956 3493 A 92 ASP HBx A 95 HIS HBy 1.0 . 5.16 3957 3493 A 95 HIS HBx A 92 ASP HBx 1.0 . 5.16 3958 3493 A 92 ASP HBy A 95 HIS HBx 1.0 . 5.16 3959 3494 A 93 ILE HG2% A 122 GLU HGy 1.0 . 3.56 3960 3494 A 93 ILE HG2% A 122 GLU HGx 1.0 . 3.56 3961 3495 A 94 LYS H A 94 LYS HBy 1.0 . 3.07 3962 3495 A 94 LYS H A 94 LYS HBx 1.0 . 3.07 3963 3496 A 94 LYS H A 94 LYS HGx 1.0 . 4.14 3964 3496 A 94 LYS H A 94 LYS HGy 1.0 . 4.14 3965 3497 A 94 LYS H A 94 LYS HDy 1.0 . 4.69 3966 3497 A 94 LYS H A 94 LYS HDx 1.0 . 4.69 3967 3498 A 94 LYS H A 95 HIS HBy 1.0 . 4.75 3968 3498 A 94 LYS H A 95 HIS HBx 1.0 . 4.75 3969 3499 A 94 LYS HA A 94 LYS HGx 1.0 . 3.57 3970 3499 A 94 LYS HA A 94 LYS HGy 1.0 . 3.57 3971 3500 A 94 LYS HA A 94 LYS HDy 1.0 . 4.60 3972 3500 A 94 LYS HA A 94 LYS HDx 1.0 . 4.60 3973 3501 A 95 HIS H A 94 LYS HBy 1.0 . 3.18 3974 3501 A 95 HIS H A 94 LYS HBx 1.0 . 3.18 3975 3502 A 95 HIS HA A 94 LYS HBy 1.0 . 4.57 3976 3502 A 95 HIS HA A 94 LYS HBx 1.0 . 4.57 3977 3503 A 96 SER H A 94 LYS HBy 1.0 . 5.08 3978 3503 A 96 SER H A 94 LYS HBx 1.0 . 5.08 3979 3504 A 97 CYS H A 94 LYS HBy 1.0 . 5.31 3980 3504 A 97 CYS H A 94 LYS HBx 1.0 . 5.31 3981 3505 A 119 PHE HEy A 94 LYS HBy 1.0 . 4.58 3982 3505 A 119 PHE HEy A 94 LYS HBx 1.0 . 4.58 3983 3506 A 94 LYS HEx A 94 LYS HGx 1.0 . 3.07 3984 3506 A 94 LYS HEy A 94 LYS HGx 1.0 . 3.07 3985 3506 A 94 LYS HGy A 94 LYS HEx 1.0 . 3.07 3986 3506 A 94 LYS HGy A 94 LYS HEy 1.0 . 3.07 3987 3507 A 95 HIS H A 94 LYS HGx 1.0 . 4.05 3988 3507 A 95 HIS H A 94 LYS HGy 1.0 . 4.05 3989 3508 A 95 HIS HA A 94 LYS HGx 1.0 . 4.12 3990 3508 A 95 HIS HA A 94 LYS HGy 1.0 . 4.12 3991 3509 A 94 LYS HGy A 95 HIS HBy 1.0 . 4.18 3992 3509 A 94 LYS HGx A 95 HIS HBy 1.0 . 4.18 3993 3509 A 95 HIS HBx A 94 LYS HGx 1.0 . 4.18 3994 3509 A 95 HIS HBx A 94 LYS HGy 1.0 . 4.18 3995 3510 A 95 HIS HD2 A 94 LYS HGx 1.0 . 4.45 3996 3510 A 95 HIS HD2 A 94 LYS HGy 1.0 . 4.45 3997 3511 A 96 SER H A 94 LYS HGx 1.0 . 5.34 3998 3511 A 96 SER H A 94 LYS HGy 1.0 . 5.34 3999 3512 A 97 CYS H A 94 LYS HGx 1.0 . 5.33 4000 3512 A 97 CYS H A 94 LYS HGy 1.0 . 5.33 4001 3513 A 97 CYS HBy A 94 LYS HGx 1.0 . 5.34 4002 3513 A 97 CYS HBy A 94 LYS HGy 1.0 . 5.34 4003 3514 A 98 GLU H A 94 LYS HGx 1.0 . 4.37 4004 3514 A 98 GLU H A 94 LYS HGy 1.0 . 4.37 4005 3515 A 94 LYS HGy A 98 GLU HGy 1.0 . 4.04 4006 3515 A 94 LYS HGx A 98 GLU HGy 1.0 . 4.04 4007 3515 A 98 GLU HGx A 94 LYS HGx 1.0 . 4.04 4008 3515 A 94 LYS HGy A 98 GLU HGx 1.0 . 4.04 4009 3516 A 119 PHE HDy A 94 LYS HGx 1.0 . 5.34 4010 3516 A 119 PHE HDy A 94 LYS HGy 1.0 . 5.34 4011 3517 A 139 LEU HDy% A 94 LYS HGx 1.0 . 4.40 4012 3517 A 139 LEU HDy% A 94 LYS HGy 1.0 . 4.40 4013 3518 A 139 LEU HDy% A 94 LYS HGx 1.0 . 4.78 4014 3518 A 139 LEU HDy% A 94 LYS HGy 1.0 . 4.78 4015 3519 A 95 HIS H A 94 LYS HDy 1.0 . 4.59 4016 3519 A 95 HIS H A 94 LYS HDx 1.0 . 4.59 4017 3520 A 139 LEU HA A 94 LYS HDy 1.0 . 3.87 4018 3520 A 139 LEU HA A 94 LYS HDx 1.0 . 3.87 4019 3521 A 139 LEU HDy% A 94 LYS HDy 1.0 . 5.28 4020 3521 A 139 LEU HDy% A 94 LYS HDx 1.0 . 5.28 4021 3522 A 139 LEU HDy% A 94 LYS HDx 1.0 . 3.60 4022 3522 A 139 LEU HDy% A 94 LYS HDy 1.0 . 3.60 4023 3523 A 142 ASP HBx A 94 LYS HDy 1.0 . 4.67 4024 3523 A 142 ASP HBx A 94 LYS HDx 1.0 . 4.67 4025 3524 A 95 HIS HA A 94 LYS HEx 1.0 . 4.21 4026 3524 A 95 HIS HA A 94 LYS HEy 1.0 . 4.21 4027 3525 A 139 LEU HA A 94 LYS HEx 1.0 . 5.25 4028 3525 A 139 LEU HA A 94 LYS HEy 1.0 . 5.25 4029 3526 A 139 LEU HDy% A 94 LYS HEy 1.0 . 3.74 4030 3526 A 139 LEU HDy% A 94 LYS HEx 1.0 . 3.74 4031 3527 A 142 ASP HBx A 94 LYS HEx 1.0 . 4.36 4032 3527 A 142 ASP HBx A 94 LYS HEy 1.0 . 4.36 4033 3528 A 95 HIS H A 95 HIS HBy 1.0 . 2.92 4034 3528 A 95 HIS H A 95 HIS HBx 1.0 . 2.92 4035 3529 A 95 HIS H A 98 GLU HGy 1.0 . 4.62 4036 3529 A 95 HIS H A 98 GLU HGx 1.0 . 4.62 4037 3530 A 95 HIS HA A 98 GLU HBx 1.0 . 3.73 4038 3530 A 95 HIS HA A 98 GLU HBy 1.0 . 3.73 4039 3531 A 95 HIS HA A 98 GLU HGy 1.0 . 3.76 4040 3531 A 95 HIS HA A 98 GLU HGx 1.0 . 3.76 4041 3532 A 95 HIS HA A 99 LYS HDx 1.0 . 5.34 4042 3532 A 95 HIS HA A 99 LYS HDy 1.0 . 5.34 4043 3533 A 96 SER H A 95 HIS HBy 1.0 . 3.23 4044 3533 A 96 SER H A 95 HIS HBx 1.0 . 3.23 4045 3534 A 96 SER H A 99 LYS HDx 1.0 . 5.05 4046 3534 A 96 SER H A 99 LYS HDy 1.0 . 5.05 4047 3535 A 96 SER HA A 99 LYS HBy 1.0 . 4.36 4048 3535 A 96 SER HA A 99 LYS HBx 1.0 . 4.36 4049 3536 A 96 SER HA A 99 LYS HDx 1.0 . 3.65 4050 3536 A 96 SER HA A 99 LYS HDy 1.0 . 3.65 4051 3537 A 96 SER HA A 99 LYS HEy 1.0 . 4.49 4052 3537 A 96 SER HA A 99 LYS HEx 1.0 . 4.49 4053 3538 A 96 SER HBy A 99 LYS HDx 1.0 . 4.75 4054 3538 A 96 SER HBy A 99 LYS HDy 1.0 . 4.75 4055 3539 A 97 CYS H A 98 GLU HGy 1.0 . 4.06 4056 3539 A 97 CYS H A 98 GLU HGx 1.0 . 4.06 4057 3540 A 97 CYS H A 99 LYS HDx 1.0 . 4.89 4058 3540 A 97 CYS H A 99 LYS HDy 1.0 . 4.89 4059 3541 A 98 GLU H A 98 GLU HBx 1.0 . 3.29 4060 3541 A 98 GLU H A 98 GLU HBy 1.0 . 3.29 4061 3542 A 98 GLU H A 98 GLU HGy 1.0 . 2.93 4062 3542 A 98 GLU H A 98 GLU HGx 1.0 . 2.93 4063 3543 A 98 GLU H A 99 LYS HGx 1.0 . 4.83 4064 3543 A 98 GLU H A 99 LYS HGy 1.0 . 4.83 4065 3544 A 98 GLU H A 99 LYS HDx 1.0 . 4.93 4066 3544 A 98 GLU H A 99 LYS HDy 1.0 . 4.93 4067 3545 A 99 LYS H A 98 GLU HBx 1.0 . 3.89 4068 3545 A 99 LYS H A 98 GLU HBy 1.0 . 3.89 4069 3546 A 101 ILE HG1x A 98 GLU HBx 1.0 . 5.34 4070 3546 A 101 ILE HG1x A 98 GLU HBy 1.0 . 5.34 4071 3547 A 101 ILE HG1y A 98 GLU HBx 1.0 . 5.34 4072 3547 A 101 ILE HG1y A 98 GLU HBy 1.0 . 5.34 4073 3548 A 101 ILE HD1% A 98 GLU HBy 1.0 . 5.34 4074 3548 A 101 ILE HD1% A 98 GLU HBx 1.0 . 5.34 4075 3549 A 115 LEU HDy% A 98 GLU HBy 1.0 . 4.60 4076 3549 A 115 LEU HDy% A 98 GLU HBx 1.0 . 4.60 4077 3550 A 115 LEU HDy% A 98 GLU HBy 1.0 . 4.83 4078 3550 A 115 LEU HDy% A 98 GLU HBx 1.0 . 4.83 4079 3551 A 99 LYS H A 98 GLU HGy 1.0 . 4.79 4080 3551 A 99 LYS H A 98 GLU HGx 1.0 . 4.79 4081 3552 A 115 LEU HG A 98 GLU HGy 1.0 . 4.21 4082 3552 A 115 LEU HG A 98 GLU HGx 1.0 . 4.21 4083 3553 A 115 LEU HDx% A 98 GLU HGy 1.0 . 4.50 4084 3553 A 115 LEU HDx% A 98 GLU HGx 1.0 . 4.50 4085 3554 A 115 LEU HDy% A 98 GLU HGy 1.0 . 3.16 4086 3554 A 115 LEU HDy% A 98 GLU HGx 1.0 . 3.16 4087 3555 A 99 LYS H A 99 LYS HBy 1.0 . 2.87 4088 3555 A 99 LYS H A 99 LYS HBx 1.0 . 2.87 4089 3556 A 99 LYS H A 99 LYS HGx 1.0 . 3.40 4090 3556 A 99 LYS H A 99 LYS HGy 1.0 . 3.40 4091 3557 A 99 LYS H A 99 LYS HDx 1.0 . 3.54 4092 3557 A 99 LYS H A 99 LYS HDy 1.0 . 3.54 4093 3558 A 99 LYS HA A 99 LYS HGx 1.0 . 3.64 4094 3558 A 99 LYS HA A 99 LYS HGy 1.0 . 3.64 4095 3559 A 99 LYS HBx A 99 LYS HDx 1.0 . 3.12 4096 3559 A 99 LYS HBy A 99 LYS HDx 1.0 . 3.12 4097 3559 A 99 LYS HDy A 99 LYS HBy 1.0 . 3.12 4098 3559 A 99 LYS HDy A 99 LYS HBx 1.0 . 3.12 4099 3560 A 100 VAL H A 99 LYS HBy 1.0 . 4.04 4100 3560 A 100 VAL H A 99 LYS HBx 1.0 . 4.04 4101 3561 A 99 LYS HDx A 99 LYS HGx 1.0 . 2.35 4102 3561 A 99 LYS HDy A 99 LYS HGx 1.0 . 2.35 4103 3561 A 99 LYS HGy A 99 LYS HDx 1.0 . 2.35 4104 3561 A 99 LYS HDy A 99 LYS HGy 1.0 . 2.35 4105 3562 A 100 VAL H A 99 LYS HGx 1.0 . 4.31 4106 3562 A 100 VAL H A 99 LYS HGy 1.0 . 4.31 4107 3563 A 100 VAL H A 99 LYS HDx 1.0 . 5.34 4108 3563 A 100 VAL H A 99 LYS HDy 1.0 . 5.34 4109 3564 A 104 VAL HGx% A 106 ASP HBx 1.0 . 3.43 4110 3564 A 104 VAL HGx% A 106 ASP HBy 1.0 . 3.43 4111 3565 A 105 ALA HB% A 106 ASP HBx 1.0 . 5.34 4112 3565 A 105 ALA HB% A 106 ASP HBy 1.0 . 5.34 4113 3566 A 105 ALA HB% A 106 ASP HBy 1.0 . 5.34 4114 3566 A 105 ALA HB% A 106 ASP HBx 1.0 . 5.34 4115 3567 A 107 ASP H A 106 ASP HBx 1.0 . 3.76 4116 3567 A 107 ASP H A 106 ASP HBy 1.0 . 3.76 4117 3568 A 107 ASP HBy A 106 ASP HBx 1.0 . 4.77 4118 3568 A 107 ASP HBy A 106 ASP HBy 1.0 . 4.77 4119 3569 A 107 ASP H A 108 PRO HDy 1.0 . 3.88 4120 3569 A 107 ASP H A 108 PRO HDx 1.0 . 3.88 4121 3570 A 109 CYS H A 109 CYS HBy 1.0 . 3.17 4122 3570 A 109 CYS H A 109 CYS HBx 1.0 . 3.17 4123 3571 A 110 GLN H A 109 CYS HBy 1.0 . 3.73 4124 3571 A 110 GLN H A 109 CYS HBx 1.0 . 3.73 4125 3572 A 113 LEU H A 112 MET HGy 1.0 . 4.82 4126 3572 A 113 LEU H A 112 MET HGx 1.0 . 4.82 4127 3573 A 115 LEU HDx% A 112 MET HGx 1.0 . 5.34 4128 3573 A 115 LEU HDx% A 112 MET HGy 1.0 . 5.34 4129 3574 A 117 MET HA A 120 LYS HGx 1.0 . 5.34 4130 3574 A 117 MET HA A 120 LYS HGy 1.0 . 5.34 4131 3575 A 119 PHE H A 120 LYS HBy 1.0 . 5.34 4132 3575 A 119 PHE H A 120 LYS HBx 1.0 . 5.34 4133 3576 A 120 LYS H A 120 LYS HBy 1.0 . 2.98 4134 3576 A 120 LYS H A 120 LYS HBx 1.0 . 2.98 4135 3577 A 120 LYS H A 120 LYS HGx 1.0 . 3.90 4136 3577 A 120 LYS H A 120 LYS HGy 1.0 . 3.90 4137 3578 A 120 LYS H A 120 LYS HDy 1.0 . 4.84 4138 3578 A 120 LYS H A 120 LYS HDx 1.0 . 4.84 4139 3579 A 120 LYS HA A 120 LYS HGx 1.0 . 3.63 4140 3579 A 120 LYS HA A 120 LYS HGy 1.0 . 3.63 4141 3580 A 120 LYS HBx A 120 LYS HDy 1.0 . 3.28 4142 3580 A 120 LYS HBy A 120 LYS HDy 1.0 . 3.28 4143 3580 A 120 LYS HDx A 120 LYS HBy 1.0 . 3.28 4144 3580 A 120 LYS HBx A 120 LYS HDx 1.0 . 3.28 4145 3581 A 120 LYS HBy A 120 LYS HEy 1.0 . 5.18 4146 3581 A 120 LYS HBx A 120 LYS HEy 1.0 . 5.18 4147 3581 A 120 LYS HEx A 120 LYS HBy 1.0 . 5.18 4148 3581 A 120 LYS HBx A 120 LYS HEx 1.0 . 5.18 4149 3582 A 121 ALA H A 120 LYS HBy 1.0 . 3.20 4150 3582 A 121 ALA H A 120 LYS HBx 1.0 . 3.20 4151 3583 A 121 ALA HB% A 120 LYS HBx 1.0 . 4.75 4152 3583 A 121 ALA HB% A 120 LYS HBy 1.0 . 4.75 4153 3584 A 123 ILE HD1% A 120 LYS HBy 1.0 . 4.84 4154 3584 A 123 ILE HD1% A 120 LYS HBx 1.0 . 4.84 4155 3585 A 124 HIS H A 120 LYS HBy 1.0 . 5.34 4156 3585 A 124 HIS H A 120 LYS HBx 1.0 . 5.34 4157 3586 A 120 LYS HEy A 120 LYS HGx 1.0 . 3.27 4158 3586 A 120 LYS HEx A 120 LYS HGx 1.0 . 3.27 4159 3586 A 120 LYS HGy A 120 LYS HEy 1.0 . 3.27 4160 3586 A 120 LYS HGy A 120 LYS HEx 1.0 . 3.27 4161 3587 A 121 ALA H A 120 LYS HGx 1.0 . 4.67 4162 3587 A 121 ALA H A 120 LYS HGy 1.0 . 4.67 4163 3588 A 121 ALA H A 124 HIS HBx 1.0 . 5.34 4164 3588 A 121 ALA H A 124 HIS HBy 1.0 . 5.34 4165 3589 A 121 ALA HA A 124 HIS HBx 1.0 . 3.59 4166 3589 A 121 ALA HA A 124 HIS HBy 1.0 . 3.59 4167 3590 A 121 ALA HB% A 124 HIS HBx 1.0 . 4.80 4168 3590 A 121 ALA HB% A 124 HIS HBy 1.0 . 4.80 4169 3591 A 121 ALA HB% A 122 GLU HGx 1.0 . 4.39 4170 3591 A 121 ALA HB% A 122 GLU HGy 1.0 . 4.39 4171 3592 A 121 ALA HB% A 124 HIS HBy 1.0 . 5.34 4172 3592 A 121 ALA HB% A 124 HIS HBx 1.0 . 5.34 4173 3593 A 122 GLU H A 122 GLU HGy 1.0 . 3.38 4174 3593 A 122 GLU H A 122 GLU HGx 1.0 . 3.38 4175 3594 A 122 GLU HA A 125 LYS HDy 1.0 . 3.59 4176 3594 A 122 GLU HA A 125 LYS HDx 1.0 . 3.59 4177 3595 A 122 GLU HA A 125 LYS HEy 1.0 . 3.93 4178 3595 A 122 GLU HA A 125 LYS HEx 1.0 . 3.93 4179 3596 A 123 ILE H A 124 HIS HBx 1.0 . 5.34 4180 3596 A 123 ILE H A 124 HIS HBy 1.0 . 5.34 4181 3597 A 123 ILE HA A 126 LEU HBx 1.0 . 4.26 4182 3597 A 123 ILE HA A 126 LEU HBy 1.0 . 4.26 4183 3598 A 123 ILE HG2% A 130 PRO HBx 1.0 . 5.34 4184 3598 A 123 ILE HG2% A 130 PRO HBy 1.0 . 5.34 4185 3599 A 123 ILE HG2% A 130 PRO HGx 1.0 . 3.53 4186 3599 A 123 ILE HG2% A 130 PRO HGy 1.0 . 3.53 4187 3600 A 123 ILE HG2% A 130 PRO HBy 1.0 . 5.34 4188 3600 A 123 ILE HG2% A 130 PRO HBx 1.0 . 5.34 4189 3601 A 123 ILE HG2% A 130 PRO HGy 1.0 . 4.50 4190 3601 A 123 ILE HG2% A 130 PRO HGx 1.0 . 4.50 4191 3602 A 123 ILE HD1% A 130 PRO HBy 1.0 . 5.14 4192 3602 A 123 ILE HD1% A 130 PRO HBx 1.0 . 5.14 4193 3603 A 124 HIS H A 124 HIS HBx 1.0 . 2.70 4194 3603 A 124 HIS H A 124 HIS HBy 1.0 . 2.70 4195 3604 A 125 LYS H A 124 HIS HBx 1.0 . 3.75 4196 3604 A 125 LYS H A 124 HIS HBy 1.0 . 3.75 4197 3605 A 125 LYS HBy A 125 LYS HEy 1.0 . 4.64 4198 3605 A 125 LYS HBy A 125 LYS HEx 1.0 . 4.64 4199 3606 A 125 LYS HGx A 125 LYS HEy 1.0 . 3.55 4200 3606 A 125 LYS HGx A 125 LYS HEx 1.0 . 3.55 4201 3607 A 126 LEU H A 126 LEU HBx 1.0 . 3.35 4202 3607 A 126 LEU H A 126 LEU HBy 1.0 . 3.35 4203 3608 A 126 LEU HA A 127 ASP HBx 1.0 . 4.77 4204 3608 A 126 LEU HA A 127 ASP HBy 1.0 . 4.77 4205 3609 A 126 LEU HDx% A 126 LEU HBy 1.0 . 3.41 4206 3609 A 126 LEU HDx% A 126 LEU HBx 1.0 . 3.41 4207 3610 A 126 LEU HDx% A 126 LEU HBx 1.0 . 3.36 4208 3610 A 126 LEU HDx% A 126 LEU HBy 1.0 . 3.36 4209 3611 A 126 LEU HDy% A 126 LEU HBx 1.0 . 3.07 4210 3611 A 126 LEU HDy% A 126 LEU HBy 1.0 . 3.07 4211 3612 A 127 ASP H A 126 LEU HBx 1.0 . 3.33 4212 3612 A 127 ASP H A 126 LEU HBy 1.0 . 3.33 4213 3613 A 128 TRP HE1 A 126 LEU HBx 1.0 . 3.62 4214 3613 A 128 TRP HE1 A 126 LEU HBy 1.0 . 3.62 4215 3614 A 130 PRO HDy A 126 LEU HBx 1.0 . 5.02 4216 3614 A 130 PRO HDy A 126 LEU HBy 1.0 . 5.02 4217 3615 A 130 PRO HDx A 126 LEU HBx 1.0 . 4.55 4218 3615 A 130 PRO HDx A 126 LEU HBy 1.0 . 4.55 4219 3616 A 126 LEU HDy% A 127 ASP HBx 1.0 . 5.34 4220 3616 A 126 LEU HDy% A 127 ASP HBy 1.0 . 5.34 4221 3617 A 127 ASP H A 127 ASP HBx 1.0 . 3.07 4222 3617 A 127 ASP H A 127 ASP HBy 1.0 . 3.07 4223 3618 A 128 TRP H A 127 ASP HBx 1.0 . 3.68 4224 3618 A 128 TRP H A 127 ASP HBy 1.0 . 3.68 4225 3619 A 128 TRP H A 128 TRP HBx 1.0 . 3.37 4226 3619 A 128 TRP H A 128 TRP HBy 1.0 . 3.37 4227 3620 A 128 TRP HE3 A 128 TRP HBx 1.0 . 3.59 4228 3620 A 128 TRP HE3 A 128 TRP HBy 1.0 . 3.59 4229 3621 A 128 TRP HE1 A 128 TRP HBx 1.0 . 4.62 4230 3621 A 128 TRP HE1 A 128 TRP HBy 1.0 . 4.62 4231 3622 A 129 ALA H A 128 TRP HBx 1.0 . 3.35 4232 3622 A 129 ALA H A 128 TRP HBy 1.0 . 3.35 4233 3623 A 128 TRP HZ3 A 130 PRO HBx 1.0 . 3.95 4234 3623 A 128 TRP HZ3 A 130 PRO HBy 1.0 . 3.95 4235 3624 A 128 TRP HZ3 A 130 PRO HGx 1.0 . 5.35 4236 3624 A 128 TRP HZ3 A 130 PRO HGy 1.0 . 5.35 4237 3625 A 128 TRP HZ2 A 130 PRO HBx 1.0 . 5.34 4238 3625 A 128 TRP HZ2 A 130 PRO HBy 1.0 . 5.34 4239 3626 A 128 TRP HH2 A 130 PRO HBx 1.0 . 4.35 4240 3626 A 128 TRP HH2 A 130 PRO HBy 1.0 . 4.35 4241 3627 A 128 TRP HH2 A 130 PRO HGx 1.0 . 5.35 4242 3627 A 128 TRP HH2 A 130 PRO HGy 1.0 . 5.35 4243 3628 A 131 THR H A 130 PRO HBx 1.0 . 3.65 4244 3628 A 131 THR H A 130 PRO HBy 1.0 . 3.65 4245 3629 A 134 VAL HGx% A 130 PRO HBy 1.0 . 4.61 4246 3629 A 134 VAL HGx% A 130 PRO HBx 1.0 . 4.61 4247 3630 A 134 VAL HGy% A 130 PRO HBx 1.0 . 4.53 4248 3630 A 134 VAL HGy% A 130 PRO HBy 1.0 . 4.53 4249 3631 A 134 VAL HGy% A 130 PRO HBx 1.0 . 5.20 4250 3631 A 134 VAL HGy% A 130 PRO HBy 1.0 . 5.20 4251 3632 A 135 ALA HA A 130 PRO HBx 1.0 . 5.34 4252 3632 A 135 ALA HA A 130 PRO HBy 1.0 . 5.34 4253 3633 A 135 ALA HB% A 130 PRO HBx 1.0 . 3.72 4254 3633 A 135 ALA HB% A 130 PRO HBy 1.0 . 3.72 4255 3634 A 131 THR H A 130 PRO HGx 1.0 . 4.77 4256 3634 A 131 THR H A 130 PRO HGy 1.0 . 4.77 4257 3635 A 131 THR HA A 132 LEU HBx 1.0 . 4.88 4258 3635 A 131 THR HA A 132 LEU HBy 1.0 . 4.88 4259 3636 A 132 LEU HDx% A 132 LEU HBx 1.0 . 3.59 4260 3636 A 132 LEU HDx% A 132 LEU HBy 1.0 . 3.59 4261 3637 A 132 LEU HDy% A 132 LEU HBx 1.0 . 3.67 4262 3637 A 132 LEU HDy% A 132 LEU HBy 1.0 . 3.67 4263 3638 A 133 ASP H A 132 LEU HBx 1.0 . 3.64 4264 3638 A 133 ASP H A 132 LEU HBy 1.0 . 3.64 4265 3639 A 133 ASP H A 133 ASP HBx 1.0 . 3.44 4266 3639 A 133 ASP H A 133 ASP HBy 1.0 . 3.44 4267 3640 A 134 VAL H A 133 ASP HBx 1.0 . 3.97 4268 3640 A 134 VAL H A 133 ASP HBy 1.0 . 3.97 4269 3641 A 134 VAL HB A 133 ASP HBx 1.0 . 4.97 4270 3641 A 134 VAL HB A 133 ASP HBy 1.0 . 4.97 4271 3642 A 134 VAL HGx% A 133 ASP HBy 1.0 . 4.08 4272 3642 A 134 VAL HGx% A 133 ASP HBx 1.0 . 4.08 4273 3643 A 134 VAL HGy% A 138 GLU HGx 1.0 . 3.79 4274 3643 A 134 VAL HGy% A 138 GLU HGy 1.0 . 3.79 4275 3644 A 136 VAL HA A 139 LEU HBx 1.0 . 3.57 4276 3644 A 136 VAL HA A 139 LEU HBy 1.0 . 3.57 4277 3645 A 138 GLU H A 138 GLU HGy 1.0 . 3.19 4278 3645 A 138 GLU H A 138 GLU HGx 1.0 . 3.19 4279 3646 A 138 GLU HA A 138 GLU HGy 1.0 . 3.51 4280 3646 A 138 GLU HA A 138 GLU HGx 1.0 . 3.51 4281 3647 A 139 LEU H A 138 GLU HGy 1.0 . 5.03 4282 3647 A 139 LEU H A 138 GLU HGx 1.0 . 5.03 4283 3648 A 139 LEU H A 139 LEU HBx 1.0 . 2.95 4284 3648 A 139 LEU H A 139 LEU HBy 1.0 . 2.95 4285 3649 A 139 LEU HDx% A 139 LEU HBx 1.0 . 3.28 4286 3649 A 139 LEU HDx% A 139 LEU HBy 1.0 . 3.28 4287 3650 A 139 LEU HDy% A 139 LEU HBy 1.0 . 3.69 4288 3650 A 139 LEU HDy% A 139 LEU HBx 1.0 . 3.69 4289 3651 A 140 LEU H A 139 LEU HBx 1.0 . 4.00 4290 3651 A 140 LEU H A 139 LEU HBy 1.0 . 4.00 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 12 PHE C A 13 ALA N A 13 ALA CA A 13 ALA C 1.0 -79.7 -39.7 PHI 2 2 A 13 ALA N A 13 ALA CA A 13 ALA C A 14 LYS N 1.0 -58.4 -18.4 PSI 3 3 A 13 ALA C A 14 LYS N A 14 LYS CA A 14 LYS C 1.0 -82.0 -42.0 PHI 4 4 A 14 LYS N A 14 LYS CA A 14 LYS C A 15 PRO N 1.0 -69.1 -29.1 PSI 5 5 A 15 PRO N A 15 PRO CA A 15 PRO C A 16 MET N 1.0 -59.5 -19.5 PSI 6 6 A 15 PRO C A 16 MET N A 16 MET CA A 16 MET C 1.0 -83.4 -43.4 PHI 7 7 A 16 MET N A 16 MET CA A 16 MET C A 17 GLU N 1.0 -63.3 -23.3 PSI 8 8 A 16 MET C A 17 GLU N A 17 GLU CA A 17 GLU C 1.0 -84.7 -44.7 PHI 9 9 A 17 GLU N A 17 GLU CA A 17 GLU C A 18 ALA N 1.0 -60.9 -20.9 PSI 10 10 A 17 GLU C A 18 ALA N A 18 ALA CA A 18 ALA C 1.0 -85.1 -45.1 PHI 11 11 A 18 ALA N A 18 ALA CA A 18 ALA C A 19 CYS N 1.0 -61.5 -21.5 PSI 12 12 A 18 ALA C A 19 CYS N A 19 CYS CA A 19 CYS C 1.0 -85.1 -45.1 PHI 13 13 A 19 CYS N A 19 CYS CA A 19 CYS C A 20 LYS N 1.0 -60.1 -20.1 PSI 14 14 A 19 CYS C A 20 LYS N A 20 LYS CA A 20 LYS C 1.0 -81.6 -41.6 PHI 15 15 A 20 LYS N A 20 LYS CA A 20 LYS C A 21 GLN N 1.0 -65.1 -25.1 PSI 16 16 A 20 LYS C A 21 GLN N A 21 GLN CA A 21 GLN C 1.0 -89.2 -49.2 PHI 17 17 A 21 GLN N A 21 GLN CA A 21 GLN C A 22 GLU N 1.0 -61.8 -21.8 PSI 18 18 A 21 GLN C A 22 GLU N A 22 GLU CA A 22 GLU C 1.0 -90.3 -50.3 PHI 19 19 A 22 GLU N A 22 GLU CA A 22 GLU C A 23 LEU N 1.0 -58.1 -18.0 PSI 20 20 A 22 GLU C A 23 LEU N A 23 LEU CA A 23 LEU C 1.0 -111.2 -71.2 PHI 21 21 A 23 LEU N A 23 LEU CA A 23 LEU C A 24 ASN N 1.0 -27.4 12.6 PSI 22 22 A 23 LEU C A 24 ASN N A 24 ASN CA A 24 ASN C 1.0 35.1 75.1 PHI 23 23 A 24 ASN N A 24 ASN CA A 24 ASN C A 25 VAL N 1.0 29.3 69.3 PSI 24 24 A 24 ASN C A 25 VAL N A 25 VAL CA A 25 VAL C 1.0 -151.9 -111.9 PHI 25 25 A 25 VAL N A 25 VAL CA A 25 VAL C A 26 PRO N 1.0 134.9 174.9 PSI 26 26 A 26 PRO C A 27 ASP N A 27 ASP CA A 27 ASP C 1.0 -78.5 -38.5 PHI 27 27 A 27 ASP N A 27 ASP CA A 27 ASP C A 28 ALA N 1.0 -59.1 -19.1 PSI 28 28 A 27 ASP C A 28 ALA N A 28 ALA CA A 28 ALA C 1.0 -83.4 -43.4 PHI 29 29 A 28 ALA N A 28 ALA CA A 28 ALA C A 29 VAL N 1.0 -57.4 -17.4 PSI 30 30 A 28 ALA C A 29 VAL N A 29 VAL CA A 29 VAL C 1.0 -89.4 -49.4 PHI 31 31 A 29 VAL N A 29 VAL CA A 29 VAL C A 30 MET N 1.0 -61.9 -21.9 PSI 32 32 A 29 VAL C A 30 MET N A 30 MET CA A 30 MET C 1.0 -87.0 -47.0 PHI 33 33 A 30 MET N A 30 MET CA A 30 MET C A 31 GLN N 1.0 -53.8 -13.8 PSI 34 34 A 30 MET C A 31 GLN N A 31 GLN CA A 31 GLN C 1.0 -85.9 -45.9 PHI 35 35 A 31 GLN N A 31 GLN CA A 31 GLN C A 32 ASP N 1.0 -56.1 -16.1 PSI 36 36 A 31 GLN C A 32 ASP N A 32 ASP CA A 32 ASP C 1.0 -87.2 -47.2 PHI 37 37 A 32 ASP N A 32 ASP CA A 32 ASP C A 33 PHE N 1.0 -60.1 -20.1 PSI 38 38 A 32 ASP C A 33 PHE N A 33 PHE CA A 33 PHE C 1.0 -84.2 -44.2 PHI 39 39 A 33 PHE N A 33 PHE CA A 33 PHE C A 34 PHE N 1.0 -65.5 -25.5 PSI 40 40 A 33 PHE C A 34 PHE N A 34 PHE CA A 34 PHE C 1.0 -85.0 -45.0 PHI 41 41 A 34 PHE N A 34 PHE CA A 34 PHE C A 35 ASN N 1.0 -58.4 -18.4 PSI 42 42 A 34 PHE C A 35 ASN N A 35 ASN CA A 35 ASN C 1.0 -84.7 -44.7 PHI 43 43 A 35 ASN N A 35 ASN CA A 35 ASN C A 36 PHE N 1.0 -56.6 -16.6 PSI 44 44 A 35 ASN C A 36 PHE N A 36 PHE CA A 36 PHE C 1.0 -85.4 -45.4 PHI 45 45 A 36 PHE N A 36 PHE CA A 36 PHE C A 37 TRP N 1.0 -54.0 -14.0 PSI 46 46 A 36 PHE C A 37 TRP N A 37 TRP CA A 37 TRP C 1.0 -127.4 -73.6 PHI 47 47 A 37 TRP N A 37 TRP CA A 37 TRP C A 38 LYS N 1.0 -30.8 17.0 PSI 48 48 A 37 TRP C A 38 LYS N A 38 LYS CA A 38 LYS C 1.0 -88.8 -48.8 PHI 49 49 A 38 LYS N A 38 LYS CA A 38 LYS C A 39 GLU N 1.0 120.6 162.5 PSI 50 50 A 38 LYS C A 39 GLU N A 39 GLU CA A 39 GLU C 1.0 -83.7 -43.7 PHI 51 51 A 39 GLU N A 39 GLU CA A 39 GLU C A 40 GLY N 1.0 112.2 152.2 PSI 52 52 A 39 GLU C A 40 GLY N A 40 GLY CA A 40 GLY C 1.0 66.5 106.5 PHI 53 53 A 40 GLY N A 40 GLY CA A 40 GLY C A 41 TYR N 1.0 -21.4 18.6 PSI 54 54 A 40 GLY C A 41 TYR N A 41 TYR CA A 41 TYR C 1.0 -114.4 -54.0 PHI 55 55 A 41 TYR N A 41 TYR CA A 41 TYR C A 42 GLN N 1.0 118.1 163.4 PSI 56 56 A 41 TYR C A 42 GLN N A 42 GLN CA A 42 GLN C 1.0 -121.2 -63.3 PHI 57 57 A 42 GLN N A 42 GLN CA A 42 GLN C A 43 ILE N 1.0 99.1 148.6 PSI 58 58 A 42 GLN C A 43 ILE N A 43 ILE CA A 43 ILE C 1.0 -111.6 -60.5 PHI 59 59 A 43 ILE N A 43 ILE CA A 43 ILE C A 44 THR N 1.0 108.1 157.2 PSI 60 60 A 43 ILE C A 44 THR N A 44 THR CA A 44 THR C 1.0 -135.2 -92.5 PHI 61 61 A 44 THR N A 44 THR CA A 44 THR C A 45 ASN N 1.0 -35.5 20.1 PSI 62 62 A 44 THR C A 45 ASN N A 45 ASN CA A 45 ASN C 1.0 -106.5 -39.9 PHI 63 63 A 45 ASN N A 45 ASN CA A 45 ASN C A 46 ARG N 1.0 98.5 155.0 PSI 64 64 A 45 ASN C A 46 ARG N A 46 ARG CA A 46 ARG C 1.0 -78.4 -38.4 PHI 65 65 A 46 ARG N A 46 ARG CA A 46 ARG C A 47 GLU N 1.0 -60.4 -20.4 PSI 66 66 A 46 ARG C A 47 GLU N A 47 GLU CA A 47 GLU C 1.0 -85.0 -45.0 PHI 67 67 A 47 GLU N A 47 GLU CA A 47 GLU C A 48 ALA N 1.0 -59.8 -19.8 PSI 68 68 A 47 GLU C A 48 ALA N A 48 ALA CA A 48 ALA C 1.0 -86.3 -46.3 PHI 69 69 A 48 ALA N A 48 ALA CA A 48 ALA C A 49 GLY N 1.0 -56.9 -16.9 PSI 70 70 A 48 ALA C A 49 GLY N A 49 GLY CA A 49 GLY C 1.0 -86.4 -46.4 PHI 71 71 A 49 GLY N A 49 GLY CA A 49 GLY C A 50 CYS N 1.0 -58.9 -18.9 PSI 72 72 A 49 GLY C A 50 CYS N A 50 CYS CA A 50 CYS C 1.0 -85.9 -45.9 PHI 73 73 A 50 CYS N A 50 CYS CA A 50 CYS C A 51 VAL N 1.0 -58.7 -18.7 PSI 74 74 A 50 CYS C A 51 VAL N A 51 VAL CA A 51 VAL C 1.0 -84.0 -44.0 PHI 75 75 A 51 VAL N A 51 VAL CA A 51 VAL C A 52 ILE N 1.0 -65.1 -25.1 PSI 76 76 A 51 VAL C A 52 ILE N A 52 ILE CA A 52 ILE C 1.0 -83.9 -43.9 PHI 77 77 A 52 ILE N A 52 ILE CA A 52 ILE C A 53 LEU N 1.0 -62.8 -22.8 PSI 78 78 A 52 ILE C A 53 LEU N A 53 LEU CA A 53 LEU C 1.0 -83.5 -43.5 PHI 79 79 A 53 LEU N A 53 LEU CA A 53 LEU C A 54 CYS N 1.0 -60.8 -20.8 PSI 80 80 A 53 LEU C A 54 CYS N A 54 CYS CA A 54 CYS C 1.0 -84.0 -44.0 PHI 81 81 A 54 CYS N A 54 CYS CA A 54 CYS C A 55 LEU N 1.0 -62.2 -22.2 PSI 82 82 A 54 CYS C A 55 LEU N A 55 LEU CA A 55 LEU C 1.0 -84.0 -44.0 PHI 83 83 A 55 LEU N A 55 LEU CA A 55 LEU C A 56 ALA N 1.0 -64.0 -24.0 PSI 84 84 A 55 LEU C A 56 ALA N A 56 ALA CA A 56 ALA C 1.0 -85.1 -45.1 PHI 85 85 A 56 ALA N A 56 ALA CA A 56 ALA C A 57 LYS N 1.0 -55.3 -15.3 PSI 86 86 A 56 ALA C A 57 LYS N A 57 LYS CA A 57 LYS C 1.0 -90.7 -50.7 PHI 87 87 A 57 LYS N A 57 LYS CA A 57 LYS C A 58 LYS N 1.0 -45.1 -5.1 PSI 88 88 A 57 LYS C A 58 LYS N A 58 LYS CA A 58 LYS C 1.0 -129.4 -89.4 PHI 89 89 A 58 LYS N A 58 LYS CA A 58 LYS C A 59 LEU N 1.0 -7.5 34.3 PSI 90 90 A 58 LYS C A 59 LEU N A 59 LEU CA A 59 LEU C 1.0 -80.2 -40.2 PHI 91 91 A 59 LEU N A 59 LEU CA A 59 LEU C A 60 GLU N 1.0 -54.0 -14.0 PSI 92 92 A 59 LEU C A 60 GLU N A 60 GLU CA A 60 GLU C 1.0 -89.0 -49.0 PHI 93 93 A 60 GLU N A 60 GLU CA A 60 GLU C A 61 LEU N 1.0 -37.5 2.5 PSI 94 94 A 60 GLU C A 61 LEU N A 61 LEU CA A 61 LEU C 1.0 -103.3 -63.3 PHI 95 95 A 61 LEU N A 61 LEU CA A 61 LEU C A 62 LEU N 1.0 -36.6 3.4 PSI 96 96 A 61 LEU C A 62 LEU N A 62 LEU CA A 62 LEU C 1.0 -102.9 -54.2 PHI 97 97 A 62 LEU N A 62 LEU CA A 62 LEU C A 63 ASP N 1.0 128.8 170.0 PSI 98 98 A 62 LEU C A 63 ASP N A 63 ASP CA A 63 ASP C 1.0 -83.8 -43.8 PHI 99 99 A 63 ASP N A 63 ASP CA A 63 ASP C A 64 GLN N 1.0 121.7 161.7 PSI 100 100 A 63 ASP C A 64 GLN N A 64 GLN CA A 64 GLN C 1.0 -77.2 -37.2 PHI 101 101 A 64 GLN N A 64 GLN CA A 64 GLN C A 65 ASP N 1.0 -54.7 -14.7 PSI 102 102 A 64 GLN C A 65 ASP N A 65 ASP CA A 65 ASP C 1.0 -87.5 -47.5 PHI 103 103 A 65 ASP N A 65 ASP CA A 65 ASP C A 66 MET N 1.0 -45.5 -5.5 PSI 104 104 A 65 ASP C A 66 MET N A 66 MET CA A 66 MET C 1.0 -119.6 -58.9 PHI 105 105 A 66 MET N A 66 MET CA A 66 MET C A 67 ASN N 1.0 -49.9 22.0 PSI 106 106 A 66 MET C A 67 ASN N A 67 ASN CA A 67 ASN C 1.0 51.0 92.5 PHI 107 107 A 67 ASN N A 67 ASN CA A 67 ASN C A 68 LEU N 1.0 6.4 46.4 PSI 108 108 A 67 ASN C A 68 LEU N A 68 LEU CA A 68 LEU C 1.0 -111.3 -49.4 PHI 109 109 A 68 LEU N A 68 LEU CA A 68 LEU C A 69 HIS N 1.0 106.1 166.7 PSI 110 110 A 68 LEU C A 69 HIS N A 69 HIS CA A 69 HIS C 1.0 -155.6 -101.3 PHI 111 111 A 69 HIS N A 69 HIS CA A 69 HIS C A 70 HIS N 1.0 131.6 171.6 PSI 112 112 A 69 HIS C A 70 HIS N A 70 HIS CA A 70 HIS C 1.0 -92.3 -52.3 PHI 113 113 A 70 HIS N A 70 HIS CA A 70 HIS C A 71 GLY N 1.0 113.7 153.7 PSI 114 114 A 70 HIS C A 71 GLY N A 71 GLY CA A 71 GLY C 1.0 70.3 119.0 PHI 115 115 A 71 GLY N A 71 GLY CA A 71 GLY C A 72 LYS N 1.0 -33.8 15.9 PSI 116 116 A 71 GLY C A 72 LYS N A 72 LYS CA A 72 LYS C 1.0 -102.9 -56.3 PHI 117 117 A 73 ALA N A 73 ALA CA A 73 ALA C A 74 MET N 1.0 -61.7 -21.7 PSI 118 118 A 73 ALA C A 74 MET N A 74 MET CA A 74 MET C 1.0 -86.3 -46.3 PHI 119 119 A 74 MET N A 74 MET CA A 74 MET C A 75 GLU N 1.0 -58.7 -18.7 PSI 120 120 A 74 MET C A 75 GLU N A 75 GLU CA A 75 GLU C 1.0 -84.8 -44.8 PHI 121 121 A 75 GLU N A 75 GLU CA A 75 GLU C A 76 PHE N 1.0 -62.3 -22.3 PSI 122 122 A 75 GLU C A 76 PHE N A 76 PHE CA A 76 PHE C 1.0 -84.5 -44.5 PHI 123 123 A 76 PHE N A 76 PHE CA A 76 PHE C A 77 ALA N 1.0 -63.9 -23.9 PSI 124 124 A 76 PHE C A 77 ALA N A 77 ALA CA A 77 ALA C 1.0 -82.9 -42.9 PHI 125 125 A 77 ALA N A 77 ALA CA A 77 ALA C A 78 MET N 1.0 -63.9 -23.9 PSI 126 126 A 77 ALA C A 78 MET N A 78 MET CA A 78 MET C 1.0 -84.6 -44.6 PHI 127 127 A 78 MET N A 78 MET CA A 78 MET C A 79 LYS N 1.0 -54.5 -14.5 PSI 128 128 A 78 MET C A 79 LYS N A 79 LYS CA A 79 LYS C 1.0 -92.3 -52.3 PHI 129 129 A 79 LYS N A 79 LYS CA A 79 LYS C A 80 HIS N 1.0 -36.5 3.5 PSI 130 130 A 79 LYS C A 80 HIS N A 80 HIS CA A 80 HIS C 1.0 -117.7 -77.7 PHI 131 131 A 80 HIS N A 80 HIS CA A 80 HIS C A 81 GLY N 1.0 -11.4 28.6 PSI 132 132 A 80 HIS C A 81 GLY N A 81 GLY CA A 81 GLY C 1.0 60.6 125.4 PHI 133 133 A 81 GLY N A 81 GLY CA A 81 GLY C A 82 ALA N 1.0 -21.4 41.0 PSI 134 134 A 81 GLY C A 82 ALA N A 82 ALA CA A 82 ALA C 1.0 -94.8 -49.8 PHI 135 135 A 82 ALA N A 82 ALA CA A 82 ALA C A 83 ASP N 1.0 115.1 165.8 PSI 136 136 A 82 ALA C A 83 ASP N A 83 ASP CA A 83 ASP C 1.0 -97.5 -57.5 PHI 137 137 A 83 ASP N A 83 ASP CA A 83 ASP C A 84 GLU N 1.0 145.6 185.6 PSI 138 138 A 83 ASP C A 84 GLU N A 84 GLU CA A 84 GLU C 1.0 -79.8 -39.8 PHI 139 139 A 84 GLU N A 84 GLU CA A 84 GLU C A 85 ALA N 1.0 -60.3 -20.3 PSI 140 140 A 84 GLU C A 85 ALA N A 85 ALA CA A 85 ALA C 1.0 -83.4 -43.4 PHI 141 141 A 85 ALA N A 85 ALA CA A 85 ALA C A 86 MET N 1.0 -60.2 -20.2 PSI 142 142 A 85 ALA C A 86 MET N A 86 MET CA A 86 MET C 1.0 -88.4 -48.4 PHI 143 143 A 86 MET N A 86 MET CA A 86 MET C A 87 ALA N 1.0 -63.8 -23.8 PSI 144 144 A 86 MET C A 87 ALA N A 87 ALA CA A 87 ALA C 1.0 -84.3 -44.3 PHI 145 145 A 87 ALA N A 87 ALA CA A 87 ALA C A 88 LYS N 1.0 -58.9 -18.9 PSI 146 146 A 87 ALA C A 88 LYS N A 88 LYS CA A 88 LYS C 1.0 -85.1 -45.1 PHI 147 147 A 88 LYS N A 88 LYS CA A 88 LYS C A 89 GLN N 1.0 -60.0 -20.0 PSI 148 148 A 88 LYS C A 89 GLN N A 89 GLN CA A 89 GLN C 1.0 -85.7 -45.7 PHI 149 149 A 89 GLN N A 89 GLN CA A 89 GLN C A 90 LEU N 1.0 -62.3 -22.3 PSI 150 150 A 89 GLN C A 90 LEU N A 90 LEU CA A 90 LEU C 1.0 -86.5 -46.5 PHI 151 151 A 90 LEU N A 90 LEU CA A 90 LEU C A 91 LEU N 1.0 -58.6 -18.6 PSI 152 152 A 90 LEU C A 91 LEU N A 91 LEU CA A 91 LEU C 1.0 -85.7 -45.7 PHI 153 153 A 91 LEU N A 91 LEU CA A 91 LEU C A 92 ASP N 1.0 -62.1 -22.1 PSI 154 154 A 91 LEU C A 92 ASP N A 92 ASP CA A 92 ASP C 1.0 -83.7 -43.7 PHI 155 155 A 92 ASP N A 92 ASP CA A 92 ASP C A 93 ILE N 1.0 -61.8 -21.8 PSI 156 156 A 92 ASP C A 93 ILE N A 93 ILE CA A 93 ILE C 1.0 -84.6 -44.6 PHI 157 157 A 93 ILE N A 93 ILE CA A 93 ILE C A 94 LYS N 1.0 -62.4 -22.4 PSI 158 158 A 93 ILE C A 94 LYS N A 94 LYS CA A 94 LYS C 1.0 -82.2 -42.2 PHI 159 159 A 94 LYS N A 94 LYS CA A 94 LYS C A 95 HIS N 1.0 -62.6 -22.6 PSI 160 160 A 94 LYS C A 95 HIS N A 95 HIS CA A 95 HIS C 1.0 -86.7 -46.7 PHI 161 161 A 95 HIS N A 95 HIS CA A 95 HIS C A 96 SER N 1.0 -57.7 -17.7 PSI 162 162 A 95 HIS C A 96 SER N A 96 SER CA A 96 SER C 1.0 -85.7 -45.7 PHI 163 163 A 96 SER N A 96 SER CA A 96 SER C A 97 CYS N 1.0 -60.4 -20.4 PSI 164 164 A 96 SER C A 97 CYS N A 97 CYS CA A 97 CYS C 1.0 -85.5 -45.5 PHI 165 165 A 97 CYS N A 97 CYS CA A 97 CYS C A 98 GLU N 1.0 -58.7 -18.7 PSI 166 166 A 97 CYS C A 98 GLU N A 98 GLU CA A 98 GLU C 1.0 -84.7 -44.7 PHI 167 167 A 98 GLU N A 98 GLU CA A 98 GLU C A 99 LYS N 1.0 -50.1 -10.1 PSI 168 168 A 98 GLU C A 99 LYS N A 99 LYS CA A 99 LYS C 1.0 -99.0 -59.0 PHI 169 169 A 99 LYS N A 99 LYS CA A 99 LYS C A 100 VAL N 1.0 -40.6 0.0 PSI 170 170 A 99 LYS C A 100 VAL N A 100 VAL CA A 100 VAL C 1.0 -132.1 -84.5 PHI 171 171 A 100 VAL N A 100 VAL CA A 100 VAL C A 101 ILE N 1.0 -33.0 7.0 PSI 172 172 A 100 VAL C A 101 ILE N A 101 ILE CA A 101 ILE C 1.0 -157.8 -56.5 PHI 173 173 A 101 ILE N A 101 ILE CA A 101 ILE C A 102 THR N 1.0 118.8 171.8 PSI 174 174 A 101 ILE C A 102 THR N A 102 THR CA A 102 THR C 1.0 -107.0 -35.7 PHI 175 175 A 102 THR N A 102 THR CA A 102 THR C A 103 ILE N 1.0 105.1 155.3 PSI 176 176 A 102 THR C A 103 ILE N A 103 ILE CA A 103 ILE C 1.0 -124.6 -57.8 PHI 177 177 A 103 ILE N A 103 ILE CA A 103 ILE C A 104 VAL N 1.0 101.3 150.7 PSI 178 178 A 103 ILE C A 104 VAL N A 104 VAL CA A 104 VAL C 1.0 -107.2 -57.1 PHI 179 179 A 104 VAL N A 104 VAL CA A 104 VAL C A 105 ALA N 1.0 87.7 161.8 PSI 180 180 A 104 VAL C A 105 ALA N A 105 ALA CA A 105 ALA C 1.0 -83.7 -43.7 PHI 181 181 A 105 ALA N A 105 ALA CA A 105 ALA C A 106 ASP N 1.0 -46.7 -6.7 PSI 182 182 A 105 ALA C A 106 ASP N A 106 ASP CA A 106 ASP C 1.0 -108.5 -66.9 PHI 183 183 A 106 ASP N A 106 ASP CA A 106 ASP C A 107 ASP N 1.0 -23.9 21.1 PSI 184 184 A 106 ASP C A 107 ASP N A 107 ASP CA A 107 ASP C 1.0 -158.4 -72.5 PHI 185 185 A 107 ASP N A 107 ASP CA A 107 ASP C A 108 PRO N 1.0 54.3 130.6 PSI 186 186 A 108 PRO N A 108 PRO CA A 108 PRO C A 109 CYS N 1.0 -51.7 -11.7 PSI 187 187 A 108 PRO C A 109 CYS N A 109 CYS CA A 109 CYS C 1.0 -84.2 -44.2 PHI 188 188 A 109 CYS N A 109 CYS CA A 109 CYS C A 110 GLN N 1.0 -61.7 -21.7 PSI 189 189 A 109 CYS C A 110 GLN N A 110 GLN CA A 110 GLN C 1.0 -87.0 -47.0 PHI 190 190 A 110 GLN N A 110 GLN CA A 110 GLN C A 111 THR N 1.0 -56.4 -16.4 PSI 191 191 A 110 GLN C A 111 THR N A 111 THR CA A 111 THR C 1.0 -83.1 -43.1 PHI 192 192 A 111 THR N A 111 THR CA A 111 THR C A 112 MET N 1.0 -63.6 -23.6 PSI 193 193 A 111 THR C A 112 MET N A 112 MET CA A 112 MET C 1.0 -87.8 -47.8 PHI 194 194 A 112 MET N A 112 MET CA A 112 MET C A 113 LEU N 1.0 -58.3 -18.3 PSI 195 195 A 112 MET C A 113 LEU N A 113 LEU CA A 113 LEU C 1.0 -84.0 -44.0 PHI 196 196 A 113 LEU N A 113 LEU CA A 113 LEU C A 114 ASN N 1.0 -63.3 -23.3 PSI 197 197 A 113 LEU C A 114 ASN N A 114 ASN CA A 114 ASN C 1.0 -85.1 -45.1 PHI 198 198 A 114 ASN N A 114 ASN CA A 114 ASN C A 115 LEU N 1.0 -59.3 -19.3 PSI 199 199 A 114 ASN C A 115 LEU N A 115 LEU CA A 115 LEU C 1.0 -83.5 -43.5 PHI 200 200 A 115 LEU N A 115 LEU CA A 115 LEU C A 116 ALA N 1.0 -66.1 -26.1 PSI 201 201 A 115 LEU C A 116 ALA N A 116 ALA CA A 116 ALA C 1.0 -82.9 -42.9 PHI 202 202 A 116 ALA N A 116 ALA CA A 116 ALA C A 117 MET N 1.0 -59.2 -19.2 PSI 203 203 A 116 ALA C A 117 MET N A 117 MET CA A 117 MET C 1.0 -84.7 -44.7 PHI 204 204 A 117 MET N A 117 MET CA A 117 MET C A 118 CYS N 1.0 -62.5 -22.5 PSI 205 205 A 117 MET C A 118 CYS N A 118 CYS CA A 118 CYS C 1.0 -85.9 -45.9 PHI 206 206 A 118 CYS N A 118 CYS CA A 118 CYS C A 119 PHE N 1.0 -60.0 -20.0 PSI 207 207 A 118 CYS C A 119 PHE N A 119 PHE CA A 119 PHE C 1.0 -83.6 -43.6 PHI 208 208 A 119 PHE N A 119 PHE CA A 119 PHE C A 120 LYS N 1.0 -64.4 -24.4 PSI 209 209 A 119 PHE C A 120 LYS N A 120 LYS CA A 120 LYS C 1.0 -82.6 -42.6 PHI 210 210 A 120 LYS N A 120 LYS CA A 120 LYS C A 121 ALA N 1.0 -60.8 -20.8 PSI 211 211 A 120 LYS C A 121 ALA N A 121 ALA CA A 121 ALA C 1.0 -82.7 -42.7 PHI 212 212 A 121 ALA N A 121 ALA CA A 121 ALA C A 122 GLU N 1.0 -61.8 -21.8 PSI 213 213 A 121 ALA C A 122 GLU N A 122 GLU CA A 122 GLU C 1.0 -84.5 -44.5 PHI 214 214 A 122 GLU N A 122 GLU CA A 122 GLU C A 123 ILE N 1.0 -61.4 -21.4 PSI 215 215 A 122 GLU C A 123 ILE N A 123 ILE CA A 123 ILE C 1.0 -84.8 -44.8 PHI 216 216 A 123 ILE N A 123 ILE CA A 123 ILE C A 124 HIS N 1.0 -57.0 -17.0 PSI 217 217 A 123 ILE C A 124 HIS N A 124 HIS CA A 124 HIS C 1.0 -90.0 -50.0 PHI 218 218 A 124 HIS N A 124 HIS CA A 124 HIS C A 125 LYS N 1.0 -43.0 -3.0 PSI 219 219 A 124 HIS C A 125 LYS N A 125 LYS CA A 125 LYS C 1.0 -105.9 -65.9 PHI 220 220 A 125 LYS N A 125 LYS CA A 125 LYS C A 126 LEU N 1.0 -32.7 7.3 PSI 221 221 A 125 LYS C A 126 LEU N A 126 LEU CA A 126 LEU C 1.0 -107.2 -53.1 PHI 222 222 A 126 LEU N A 126 LEU CA A 126 LEU C A 127 ASP N 1.0 115.1 166.0 PSI 223 223 A 126 LEU C A 127 ASP N A 127 ASP CA A 127 ASP C 1.0 -107.9 -58.4 PHI 224 224 A 127 ASP N A 127 ASP CA A 127 ASP C A 128 TRP N 1.0 -48.1 6.7 PSI 225 225 A 127 ASP C A 128 TRP N A 128 TRP CA A 128 TRP C 1.0 -169.9 -100.2 PHI 226 226 A 128 TRP N A 128 TRP CA A 128 TRP C A 129 ALA N 1.0 122.6 169.5 PSI 227 227 A 128 TRP C A 129 ALA N A 129 ALA CA A 129 ALA C 1.0 -162.3 -71.2 PHI 228 228 A 129 ALA N A 129 ALA CA A 129 ALA C A 130 PRO N 1.0 86.0 172.2 PSI 229 229 A 130 PRO N A 130 PRO CA A 130 PRO C A 131 THR N 1.0 129.0 169.2 PSI 230 230 A 130 PRO C A 131 THR N A 131 THR CA A 131 THR C 1.0 -89.2 -49.2 PHI 231 231 A 131 THR N A 131 THR CA A 131 THR C A 132 LEU N 1.0 142.1 182.1 PSI 232 232 A 131 THR C A 132 LEU N A 132 LEU CA A 132 LEU C 1.0 -78.6 -38.6 PHI 233 233 A 132 LEU N A 132 LEU CA A 132 LEU C A 133 ASP N 1.0 -60.9 -20.9 PSI 234 234 A 132 LEU C A 133 ASP N A 133 ASP CA A 133 ASP C 1.0 -83.9 -43.9 PHI 235 235 A 133 ASP N A 133 ASP CA A 133 ASP C A 134 VAL N 1.0 -60.7 -20.7 PSI 236 236 A 134 VAL N A 134 VAL CA A 134 VAL C A 135 ALA N 1.0 -61.5 -21.5 PSI 237 237 A 134 VAL C A 135 ALA N A 135 ALA CA A 135 ALA C 1.0 -83.9 -43.9 PHI 238 238 A 135 ALA N A 135 ALA CA A 135 ALA C A 136 VAL N 1.0 -62.7 -22.7 PSI 239 239 A 135 ALA C A 136 VAL N A 136 VAL CA A 136 VAL C 1.0 -83.8 -43.8 PHI 240 240 A 136 VAL N A 136 VAL CA A 136 VAL C A 137 GLY N 1.0 -63.3 -23.3 PSI 241 241 A 136 VAL C A 137 GLY N A 137 GLY CA A 137 GLY C 1.0 -83.2 -43.2 PHI 242 242 A 137 GLY N A 137 GLY CA A 137 GLY C A 138 GLU N 1.0 -61.4 -21.4 PSI 243 243 A 137 GLY C A 138 GLU N A 138 GLU CA A 138 GLU C 1.0 -83.2 -43.2 PHI 244 244 A 138 GLU N A 138 GLU CA A 138 GLU C A 139 LEU N 1.0 -63.9 -23.9 PSI 245 245 A 138 GLU C A 139 LEU N A 139 LEU CA A 139 LEU C 1.0 -83.2 -43.2 PHI 246 246 A 139 LEU N A 139 LEU CA A 139 LEU C A 140 LEU N 1.0 -65.1 -25.1 PSI 247 247 A 139 LEU C A 140 LEU N A 140 LEU CA A 140 LEU C 1.0 -83.8 -43.8 PHI 248 248 A 140 LEU N A 140 LEU CA A 140 LEU C A 141 ALA N 1.0 -59.7 -19.7 PSI 249 249 A 140 LEU C A 141 ALA N A 141 ALA CA A 141 ALA C 1.0 -88.3 -48.3 PHI 250 250 A 141 ALA N A 141 ALA CA A 141 ALA C A 142 ASP N 1.0 -47.4 -7.4 PSI 251 251 A 141 ALA C A 142 ASP N A 142 ASP CA A 142 ASP C 1.0 -132.9 -89.2 PHI 252 252 A 142 ASP N A 142 ASP CA A 142 ASP C A 143 THR N 1.0 -21.8 65.2 PSI stop_ save_ save_spectral_peak_list_1 _nef_nmr_spectrum.sf_category nef_nmr_spectrum _nef_nmr_spectrum.sf_framecode spectral_peak_list_1 _nef_nmr_spectrum.experiment_classification . _nef_nmr_spectrum.experiment_type . _nef_nmr_spectrum.num_dimensions 3 _nef_nmr_spectrum.chemical_shift_list . loop_ _nef_spectrum_dimension.dimension_id _nef_spectrum_dimension.axis_unit _nef_spectrum_dimension.axis_code _nef_spectrum_dimension.spectrometer_frequency _nef_spectrum_dimension.spectral_width _nef_spectrum_dimension.value_first_point _nef_spectrum_dimension.folding _nef_spectrum_dimension.absolute_peak_positions _nef_spectrum_dimension.is_acquisition 1 ppm . . 16 . . . . 2 ppm . . 16 . . . . 3 ppm . . 24 . aliased . . stop_ save_ save_spectral_peak_list_2 _nef_nmr_spectrum.sf_category nef_nmr_spectrum _nef_nmr_spectrum.sf_framecode spectral_peak_list_2 _nef_nmr_spectrum.experiment_classification . _nef_nmr_spectrum.experiment_type . _nef_nmr_spectrum.num_dimensions 3 _nef_nmr_spectrum.chemical_shift_list . loop_ _nef_spectrum_dimension.dimension_id _nef_spectrum_dimension.axis_unit _nef_spectrum_dimension.axis_code _nef_spectrum_dimension.spectrometer_frequency _nef_spectrum_dimension.spectral_width _nef_spectrum_dimension.value_first_point _nef_spectrum_dimension.folding _nef_spectrum_dimension.absolute_peak_positions _nef_spectrum_dimension.is_acquisition 1 ppm . . 11 . . . . 2 ppm . . 16 . . . . 3 ppm . . 32 . . . . stop_ save_