data_nef_c30571_6nzl 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 6NZL 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 9 CYS SG 2 1 ZN ZN 1 18 CYS SG 2 1 ZN ZN 1 24 CYS SG 2 1 ZN ZN 1 28 HIS NE2 2 1 ZN ZN 1 52 CYS SG 2 2 ZN ZN 1 61 CYS SG 2 2 ZN ZN 1 67 CYS SG 2 2 ZN ZN 1 71 HIS NE2 2 2 ZN ZN stop_ loop_ _nef_sequence.index _nef_sequence.chain_code _nef_sequence.sequence_code _nef_sequence.residue_name _nef_sequence.linking _nef_sequence.residue_variant _nef_sequence.cis_peptide 1 A 96 SER start . . 2 A 97 ASP middle . . 3 A 98 ALA middle . . 4 A 99 PHE middle . . 5 A 100 LYS middle . . 6 A 101 THR middle . . 7 A 102 ALA middle . . 8 A 103 LEU middle . . 9 A 104 CYS middle -HG . 10 A 105 ASP middle . . 11 A 106 ALA middle . . 12 A 107 TYR middle . . 13 A 108 LYS middle . . 14 A 109 ARG middle . . 15 A 110 SER middle . . 16 A 111 GLN middle . . 17 A 112 ALA middle . . 18 A 113 CYS middle -HG . 19 A 114 SER middle . . 20 A 115 TYR middle . . 21 A 116 GLY middle . false 22 A 117 ASP middle . . 23 A 118 GLN middle . . 24 A 119 CYS middle -HG . 25 A 120 ARG middle . . 26 A 121 PHE middle . . 27 A 122 ALA middle . . 28 A 123 HIS middle -HE2 . 29 A 124 GLY middle . false 30 A 125 VAL middle . . 31 A 126 HIS middle . . 32 A 127 GLU middle . . 33 A 128 LEU middle . . 34 A 129 ARG middle . . 35 A 130 LEU middle . . 36 A 131 PRO middle . false 37 A 132 MET middle . . 38 A 133 ASN middle . . 39 A 134 PRO middle . false 40 A 135 ARG middle . . 41 A 136 GLY middle . false 42 A 137 ARG middle . . 43 A 138 ASN middle . . 44 A 139 HIS middle . . 45 A 140 PRO middle . false 46 A 141 LYS middle . . 47 A 142 TYR middle . . 48 A 143 LYS middle . . 49 A 144 THR middle . . 50 A 145 VAL middle . . 51 A 146 LEU middle . . 52 A 147 CYS middle -HG . 53 A 148 ASP middle . . 54 A 149 LYS middle . . 55 A 150 PHE middle . . 56 A 151 SER middle . . 57 A 152 MET middle . . 58 A 153 THR middle . . 59 A 154 GLY middle . false 60 A 155 ASN middle . . 61 A 156 CYS middle -HG . 62 A 157 LYS middle . . 63 A 158 TYR middle . . 64 A 159 GLY middle . false 65 A 160 THR middle . . 66 A 161 ARG middle . . 67 A 162 CYS middle -HG . 68 A 163 GLN middle . . 69 A 164 PHE middle . . 70 A 165 ILE middle . . 71 A 166 HIS middle -HE2 . 72 A 167 LYS middle . . 73 A 168 ILE middle . . 74 A 169 VAL middle . . 75 A 170 ASP middle . . 76 A 171 GLY middle . false 77 A 172 ASN middle . . 78 A 173 ALA end . . 79 B 1 ZN . . . 80 B 2 ZN . . . 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 96 SER HA H 1 3.891 0.001 A 96 SER CA C 13 57.836 0.005 A 97 ASP HA H 1 4.596 0.010 A 97 ASP HBx H 1 2.553 0.001 A 97 ASP HBy H 1 2.622 0.009 A 97 ASP C C 13 175.763 0.001 A 97 ASP CA C 13 54.499 0.001 A 97 ASP CB C 13 41.562 0.065 A 98 ALA H H 1 8.262 0.019 A 98 ALA HA H 1 4.277 0.014 A 98 ALA HB% H 1 1.265 0.009 A 98 ALA C C 13 177.245 0.023 A 98 ALA CA C 13 52.214 0.014 A 98 ALA CB C 13 19.302 0.012 A 98 ALA N N 15 124.212 0.055 A 99 PHE H H 1 8.128 0.015 A 99 PHE HA H 1 4.479 0.011 A 99 PHE HBy H 1 2.969 0.006 A 99 PHE HBx H 1 2.950 0.012 A 99 PHE HDx H 1 7.105 0.016 A 99 PHE HDy H 1 7.105 0.016 A 99 PHE HEx H 1 7.272 0.018 A 99 PHE HEy H 1 7.272 0.018 A 99 PHE C C 13 174.464 0.004 A 99 PHE CA C 13 58.071 0.040 A 99 PHE CB C 13 40.034 0.033 A 99 PHE CDx C 13 131.615 0.000 A 99 PHE CDy C 13 131.615 0.000 A 99 PHE CEx C 13 131.667 0.000 A 99 PHE CEy C 13 131.667 0.000 A 99 PHE N N 15 121.505 0.127 A 100 LYS H H 1 8.495 0.009 A 100 LYS HA H 1 3.687 0.013 A 100 LYS HBy H 1 1.791 0.009 A 100 LYS HBx H 1 1.570 0.015 A 100 LYS HDx H 1 0.996 0.003 A 100 LYS HDy H 1 1.174 0.003 A 100 LYS HEx H 1 2.643 0.006 A 100 LYS HEy H 1 2.772 0.002 A 100 LYS HGy H 1 0.504 0.006 A 100 LYS HGx H 1 0.268 0.006 A 100 LYS C C 13 174.658 0.050 A 100 LYS CA C 13 57.491 0.039 A 100 LYS CB C 13 30.977 0.065 A 100 LYS CD C 13 29.407 0.023 A 100 LYS CE C 13 42.653 0.019 A 100 LYS CG C 13 25.271 0.014 A 100 LYS N N 15 120.693 0.035 A 101 THR H H 1 8.184 0.012 A 101 THR HA H 1 4.498 0.009 A 101 THR HB H 1 4.390 0.009 A 101 THR HG2% H 1 1.082 0.007 A 101 THR C C 13 173.934 0.008 A 101 THR CA C 13 61.795 0.032 A 101 THR CB C 13 69.863 0.024 A 101 THR CG2 C 13 21.988 0.026 A 101 THR N N 15 107.410 0.116 A 102 ALA H H 1 7.822 0.010 A 102 ALA HA H 1 4.676 0.012 A 102 ALA HB% H 1 1.465 0.008 A 102 ALA C C 13 176.560 0.006 A 102 ALA CA C 13 50.729 0.010 A 102 ALA CB C 13 22.266 0.023 A 102 ALA N N 15 123.519 0.050 A 103 LEU H H 1 8.906 0.023 A 103 LEU HA H 1 4.412 0.009 A 103 LEU HBx H 1 1.411 0.008 A 103 LEU HBy H 1 1.720 0.008 A 103 LEU HDx% H 1 0.926 0.011 A 103 LEU HDy% H 1 0.675 0.011 A 103 LEU HG H 1 1.731 0.005 A 103 LEU C C 13 176.288 0.017 A 103 LEU CA C 13 55.069 0.034 A 103 LEU CB C 13 43.046 0.029 A 103 LEU CDy C 13 25.670 0.043 A 103 LEU CDx C 13 23.034 0.030 A 103 LEU CG C 13 27.190 0.034 A 103 LEU N N 15 121.726 0.018 A 104 CYS H H 1 8.854 0.005 A 104 CYS HA H 1 3.726 0.000 A 104 CYS HBx H 1 2.833 0.000 A 104 CYS HBy H 1 3.086 0.000 A 104 CYS C C 13 176.110 0.032 A 104 CYS CA C 13 59.977 0.000 A 104 CYS CB C 13 32.045 0.011 A 104 CYS N N 15 125.160 0.020 A 105 ASP H H 1 8.797 0.016 A 105 ASP HA H 1 4.272 0.008 A 105 ASP HBx H 1 2.561 0.011 A 105 ASP HBy H 1 2.616 0.012 A 105 ASP C C 13 177.381 0.017 A 105 ASP CA C 13 58.186 0.042 A 105 ASP CB C 13 41.633 0.080 A 105 ASP N N 15 132.338 0.103 A 106 ALA H H 1 8.269 0.009 A 106 ALA HA H 1 4.090 0.009 A 106 ALA HB% H 1 1.561 0.006 A 106 ALA CA C 13 55.730 0.008 A 106 ALA CB C 13 18.495 0.011 A 106 ALA N N 15 123.538 0.043 A 107 TYR HA H 1 3.800 0.012 A 107 TYR HBx H 1 2.777 0.007 A 107 TYR HBy H 1 3.145 0.010 A 107 TYR HDx H 1 6.697 0.015 A 107 TYR HDy H 1 6.697 0.015 A 107 TYR HEx H 1 6.714 0.002 A 107 TYR HEy H 1 6.714 0.002 A 107 TYR C C 13 179.005 0.006 A 107 TYR CA C 13 61.825 0.000 A 107 TYR CB C 13 38.252 0.028 A 107 TYR CDx C 13 132.624 0.000 A 107 TYR CDy C 13 132.624 0.000 A 107 TYR CEx C 13 118.395 0.000 A 107 TYR CEy C 13 118.395 0.000 A 108 LYS H H 1 8.332 0.013 A 108 LYS HA H 1 4.015 0.013 A 108 LYS HBy H 1 1.942 0.009 A 108 LYS HBx H 1 1.941 0.000 A 108 LYS HDy H 1 1.675 0.002 A 108 LYS HDx H 1 1.674 0.000 A 108 LYS HEy H 1 2.941 0.000 A 108 LYS HEx H 1 2.932 0.002 A 108 LYS HGy H 1 1.548 0.014 A 108 LYS HGx H 1 1.486 0.014 A 108 LYS C C 13 177.740 0.056 A 108 LYS CA C 13 59.327 0.010 A 108 LYS CB C 13 32.685 0.025 A 108 LYS CD C 13 29.721 0.025 A 108 LYS CE C 13 42.136 0.012 A 108 LYS CG C 13 25.030 0.011 A 108 LYS N N 15 119.794 0.059 A 109 ARG H H 1 7.589 0.012 A 109 ARG HA H 1 4.255 0.010 A 109 ARG HBx H 1 1.808 0.010 A 109 ARG HBy H 1 1.907 0.017 A 109 ARG HDx H 1 3.128 0.018 A 109 ARG HDy H 1 3.164 0.007 A 109 ARG HGx H 1 1.612 0.008 A 109 ARG HGy H 1 1.729 0.007 A 109 ARG C C 13 177.255 0.046 A 109 ARG CA C 13 57.432 0.018 A 109 ARG CB C 13 30.880 0.039 A 109 ARG CD C 13 43.445 0.049 A 109 ARG CG C 13 27.918 0.036 A 109 ARG N N 15 116.411 0.026 A 110 SER H H 1 8.006 0.009 A 110 SER HA H 1 4.367 0.014 A 110 SER HBx H 1 3.876 0.009 A 110 SER C C 13 173.651 0.006 A 110 SER CA C 13 59.099 0.000 A 110 SER CB C 13 64.412 0.091 A 110 SER N N 15 112.119 0.024 A 111 GLN H H 1 8.243 0.002 A 111 GLN N N 15 117.818 0.027 A 112 ALA HA H 1 4.250 0.008 A 112 ALA HB% H 1 1.162 0.009 A 112 ALA CA C 13 51.857 0.034 A 112 ALA CB C 13 20.043 0.004 A 113 CYS H H 1 8.374 0.014 A 113 CYS HA H 1 4.370 0.000 A 113 CYS HBx H 1 2.747 0.000 A 113 CYS HBy H 1 2.804 0.000 A 113 CYS CA C 13 59.157 0.000 A 113 CYS CB C 13 31.591 0.024 A 113 CYS N N 15 123.021 0.009 A 114 SER HA H 1 4.149 0.009 A 114 SER HBy H 1 3.737 0.012 A 114 SER HBx H 1 3.695 0.007 A 114 SER C C 13 174.994 0.003 A 114 SER CA C 13 61.177 0.020 A 114 SER CB C 13 63.025 0.039 A 115 TYR H H 1 8.781 0.011 A 115 TYR HA H 1 4.483 0.009 A 115 TYR HBx H 1 2.910 0.014 A 115 TYR HBy H 1 3.082 0.012 A 115 TYR HDx H 1 7.380 0.011 A 115 TYR HDy H 1 7.380 0.011 A 115 TYR HEx H 1 6.946 0.000 A 115 TYR HEy H 1 6.946 0.000 A 115 TYR C C 13 177.702 0.041 A 115 TYR CA C 13 59.605 0.039 A 115 TYR CB C 13 38.260 0.091 A 115 TYR CDx C 13 133.656 0.000 A 115 TYR CDy C 13 133.656 0.000 A 115 TYR CEx C 13 118.454 0.000 A 115 TYR CEy C 13 118.454 0.000 A 115 TYR N N 15 121.959 0.056 A 116 GLY H H 1 7.918 0.011 A 116 GLY HAx H 1 3.993 0.016 A 116 GLY HAy H 1 4.017 0.012 A 116 GLY C C 13 175.448 0.010 A 116 GLY CA C 13 47.319 0.003 A 116 GLY N N 15 109.257 0.036 A 117 ASP H H 1 8.953 0.019 A 117 ASP HA H 1 4.518 0.011 A 117 ASP HBy H 1 2.796 0.000 A 117 ASP HBx H 1 2.779 0.000 A 117 ASP C C 13 176.898 0.002 A 117 ASP CA C 13 55.788 0.006 A 117 ASP CB C 13 40.230 0.019 A 117 ASP N N 15 125.424 0.065 A 118 GLN H H 1 8.092 0.011 A 118 GLN HA H 1 4.441 0.012 A 118 GLN HBy H 1 2.428 0.008 A 118 GLN HBx H 1 2.116 0.010 A 118 GLN HGy H 1 2.437 0.000 A 118 GLN HGx H 1 2.430 0.000 A 118 GLN C C 13 175.260 0.041 A 118 GLN CA C 13 55.117 0.008 A 118 GLN CB C 13 29.028 0.015 A 118 GLN CG C 13 34.264 0.038 A 118 GLN N N 15 117.058 0.042 A 119 CYS H H 1 7.458 0.002 A 119 CYS HA H 1 3.771 0.000 A 119 CYS HBx H 1 2.599 0.000 A 119 CYS HBy H 1 2.991 0.000 A 119 CYS C C 13 175.822 0.058 A 119 CYS CA C 13 61.813 0.000 A 119 CYS CB C 13 31.147 0.008 A 119 CYS N N 15 124.223 0.048 A 120 ARG H H 1 8.325 0.017 A 120 ARG HA H 1 4.115 0.012 A 120 ARG HBx H 1 1.413 0.009 A 120 ARG HBy H 1 1.629 0.007 A 120 ARG HDx H 1 2.954 0.000 A 120 ARG HDy H 1 2.983 0.000 A 120 ARG HGy H 1 1.368 0.001 A 120 ARG HGx H 1 1.165 0.010 A 120 ARG C C 13 175.055 0.067 A 120 ARG CA C 13 56.544 0.016 A 120 ARG CB C 13 29.799 0.079 A 120 ARG CD C 13 43.236 0.002 A 120 ARG CG C 13 26.999 0.026 A 120 ARG N N 15 125.236 0.031 A 121 PHE H H 1 9.201 0.014 A 121 PHE HA H 1 4.712 0.013 A 121 PHE HBy H 1 3.104 0.006 A 121 PHE HBx H 1 3.066 0.009 A 121 PHE HDx H 1 7.334 0.012 A 121 PHE HDy H 1 7.334 0.012 A 121 PHE C C 13 174.334 0.005 A 121 PHE CA C 13 56.902 0.016 A 121 PHE CB C 13 39.751 0.055 A 121 PHE CDx C 13 132.395 0.000 A 121 PHE CDy C 13 132.395 0.000 A 121 PHE N N 15 122.278 0.052 A 122 ALA H H 1 9.039 0.015 A 122 ALA HA H 1 3.969 0.008 A 122 ALA HB% H 1 1.095 0.010 A 122 ALA C C 13 177.398 0.009 A 122 ALA CA C 13 52.419 0.024 A 122 ALA CB C 13 19.712 0.014 A 122 ALA N N 15 121.435 0.063 A 123 HIS H H 1 9.462 0.013 A 123 HIS HA H 1 4.247 0.010 A 123 HIS HBx H 1 2.745 0.000 A 123 HIS HBy H 1 2.745 0.000 A 123 HIS HD2 H 1 6.512 0.016 A 123 HIS HE1 H 1 8.052 0.013 A 123 HIS C C 13 173.307 0.000 A 123 HIS CA C 13 53.462 0.036 A 123 HIS CB C 13 26.127 0.000 A 123 HIS CD2 C 13 124.277 0.097 A 123 HIS CE1 C 13 139.875 0.010 A 123 HIS N N 15 128.712 0.155 A 124 GLY HAx H 1 3.821 0.006 A 124 GLY HAy H 1 4.397 0.014 A 124 GLY C C 13 174.575 0.009 A 124 GLY CA C 13 43.584 0.071 A 125 VAL H H 1 8.566 0.016 A 125 VAL HA H 1 3.668 0.009 A 125 VAL HB H 1 2.160 0.006 A 125 VAL HGx% H 1 1.002 0.008 A 125 VAL HGy% H 1 0.996 0.009 A 125 VAL C C 13 177.695 0.010 A 125 VAL CA C 13 64.889 0.005 A 125 VAL CB C 13 31.790 0.010 A 125 VAL CGy C 13 21.362 0.018 A 125 VAL CGx C 13 20.517 0.007 A 125 VAL N N 15 117.857 0.028 A 126 HIS H H 1 8.327 0.005 A 126 HIS HA H 1 4.452 0.010 A 126 HIS HBy H 1 3.171 0.011 A 126 HIS HBx H 1 3.056 0.011 A 126 HIS HD2 H 1 7.016 0.016 A 126 HIS HE1 H 1 7.907 0.016 A 126 HIS C C 13 176.248 0.006 A 126 HIS CA C 13 58.036 0.008 A 126 HIS CB C 13 29.607 0.017 A 126 HIS CD2 C 13 118.441 0.049 A 126 HIS CE1 C 13 139.505 0.010 A 126 HIS N N 15 118.174 0.050 A 127 GLU H H 1 6.952 0.012 A 127 GLU HA H 1 4.153 0.006 A 127 GLU HBx H 1 1.601 0.010 A 127 GLU HBy H 1 1.920 0.008 A 127 GLU HGx H 1 1.728 0.008 A 127 GLU HGy H 1 1.849 0.009 A 127 GLU C C 13 176.022 0.017 A 127 GLU CA C 13 56.058 0.074 A 127 GLU CB C 13 31.358 0.064 A 127 GLU CG C 13 36.403 0.009 A 127 GLU N N 15 117.746 0.043 A 128 LEU H H 1 7.106 0.012 A 128 LEU HA H 1 4.119 0.009 A 128 LEU HBx H 1 1.415 0.008 A 128 LEU HBy H 1 1.577 0.006 A 128 LEU HDx% H 1 0.613 0.010 A 128 LEU HDy% H 1 0.813 0.012 A 128 LEU HG H 1 1.341 0.009 A 128 LEU C C 13 177.055 0.018 A 128 LEU CA C 13 55.555 0.034 A 128 LEU CB C 13 42.844 0.028 A 128 LEU CDx C 13 23.998 0.013 A 128 LEU CDy C 13 25.313 0.096 A 128 LEU CG C 13 26.885 0.034 A 128 LEU N N 15 119.847 0.028 A 129 ARG H H 1 8.432 0.015 A 129 ARG HA H 1 4.316 0.013 A 129 ARG HBy H 1 1.735 0.011 A 129 ARG HBx H 1 1.556 0.010 A 129 ARG HDy H 1 3.133 0.008 A 129 ARG HDx H 1 3.098 0.003 A 129 ARG HGx H 1 1.502 0.004 A 129 ARG C C 13 175.317 0.017 A 129 ARG CA C 13 55.188 0.050 A 129 ARG CB C 13 30.925 0.086 A 129 ARG CD C 13 43.450 0.034 A 129 ARG CG C 13 27.303 0.109 A 129 ARG N N 15 123.685 0.061 A 130 LEU H H 1 8.142 0.023 A 130 LEU HA H 1 4.578 0.006 A 130 LEU HBy H 1 1.546 0.006 A 130 LEU HBx H 1 1.524 0.018 A 130 LEU HDx% H 1 0.882 0.002 A 130 LEU HDy% H 1 0.905 0.001 A 130 LEU HG H 1 1.607 0.013 A 130 LEU CA C 13 52.792 0.006 A 130 LEU CB C 13 41.958 0.063 A 130 LEU CDx C 13 23.460 0.005 A 130 LEU CDy C 13 25.398 0.036 A 130 LEU CG C 13 27.258 0.076 A 130 LEU N N 15 123.493 0.020 A 131 PRO HA H 1 4.358 0.007 A 131 PRO HBy H 1 2.225 0.011 A 131 PRO HBx H 1 1.863 0.008 A 131 PRO HDy H 1 3.797 0.005 A 131 PRO HDx H 1 3.617 0.004 A 131 PRO HGy H 1 2.008 0.013 A 131 PRO HGx H 1 1.982 0.006 A 131 PRO C C 13 176.685 0.017 A 131 PRO CA C 13 63.019 0.019 A 131 PRO CB C 13 32.062 0.016 A 131 PRO CD C 13 50.525 0.016 A 131 PRO CG C 13 27.460 0.039 A 132 MET H H 1 8.408 0.028 A 132 MET HA H 1 4.366 0.008 A 132 MET HBx H 1 1.953 0.004 A 132 MET HBy H 1 1.982 0.007 A 132 MET HE% H 1 2.048 0.006 A 132 MET HGy H 1 2.538 0.012 A 132 MET HGx H 1 2.496 0.016 A 132 MET C C 13 175.726 0.007 A 132 MET CA C 13 55.611 0.097 A 132 MET CB C 13 33.119 0.016 A 132 MET CE C 13 17.101 0.045 A 132 MET CG C 13 32.032 0.023 A 132 MET N N 15 120.170 0.044 A 133 ASN H H 1 8.422 0.051 A 133 ASN HA H 1 4.932 0.000 A 133 ASN HBy H 1 2.803 0.002 A 133 ASN HBx H 1 2.669 0.005 A 133 ASN C C 13 173.549 0.000 A 133 ASN CA C 13 51.304 0.011 A 133 ASN CB C 13 38.950 0.035 A 133 ASN N N 15 120.617 0.083 A 134 PRO HA H 1 4.358 0.007 A 134 PRO HBy H 1 2.231 0.012 A 134 PRO HBx H 1 1.913 0.002 A 134 PRO HDy H 1 3.757 0.001 A 134 PRO HDx H 1 3.710 0.005 A 134 PRO HGy H 1 1.974 0.005 A 134 PRO HGx H 1 1.973 0.000 A 134 PRO C C 13 177.087 0.000 A 134 PRO CA C 13 63.737 0.039 A 134 PRO CB C 13 32.170 0.021 A 134 PRO CD C 13 50.832 0.059 A 134 PRO CG C 13 27.446 0.045 A 135 ARG H H 1 8.325 0.022 A 135 ARG HA H 1 4.280 0.009 A 135 ARG HBy H 1 1.848 0.003 A 135 ARG HBx H 1 1.742 0.007 A 135 ARG HDy H 1 3.139 0.000 A 135 ARG HDx H 1 3.131 0.000 A 135 ARG C C 13 176.943 0.026 A 135 ARG CA C 13 56.365 0.023 A 135 ARG CB C 13 30.607 0.018 A 135 ARG CD C 13 43.357 0.014 A 135 ARG N N 15 119.886 0.088 A 136 GLY H H 1 8.246 0.011 A 136 GLY HAy H 1 3.936 0.000 A 136 GLY HAx H 1 3.919 0.000 A 136 GLY C C 13 174.108 0.008 A 136 GLY CA C 13 45.575 0.024 A 136 GLY N N 15 109.352 0.057 A 137 ARG H H 1 8.168 0.009 A 137 ARG HA H 1 4.202 0.010 A 137 ARG HBy H 1 1.758 0.008 A 137 ARG HBx H 1 1.672 0.001 A 137 ARG HDx H 1 3.131 0.003 A 137 ARG HGy H 1 1.550 0.000 A 137 ARG HGx H 1 1.535 0.000 A 137 ARG C C 13 175.992 0.000 A 137 ARG CA C 13 56.249 0.090 A 137 ARG CB C 13 30.752 0.009 A 137 ARG CD C 13 43.438 0.022 A 137 ARG CG C 13 27.105 0.018 A 137 ARG N N 15 120.069 0.032 A 139 HIS HA H 1 4.742 0.000 A 139 HIS HBy H 1 3.031 0.002 A 139 HIS HBx H 1 2.990 0.005 A 139 HIS HD2 H 1 7.056 0.010 A 139 HIS HE1 H 1 7.824 0.000 A 139 HIS CA C 13 54.898 0.000 A 139 HIS CB C 13 30.804 0.039 A 139 HIS CD2 C 13 120.228 0.000 A 139 HIS CE1 C 13 138.374 0.000 A 140 PRO HA H 1 4.343 0.008 A 140 PRO HBy H 1 2.198 0.003 A 140 PRO HBx H 1 1.733 0.002 A 140 PRO HDx H 1 3.237 0.003 A 140 PRO HDy H 1 3.657 0.003 A 140 PRO HGy H 1 1.909 0.000 A 140 PRO HGx H 1 1.870 0.009 A 140 PRO C C 13 176.910 0.000 A 140 PRO CA C 13 63.570 0.024 A 140 PRO CB C 13 32.241 0.037 A 140 PRO CD C 13 50.673 0.012 A 140 PRO CG C 13 27.411 0.011 A 141 LYS H H 1 8.845 0.024 A 141 LYS HA H 1 4.214 0.011 A 141 LYS HBx H 1 1.667 0.000 A 141 LYS HBy H 1 1.700 0.007 A 141 LYS HEy H 1 2.924 0.000 A 141 LYS HEx H 1 2.923 0.000 A 141 LYS HGy H 1 1.323 0.006 A 141 LYS HGx H 1 1.264 0.003 A 141 LYS C C 13 176.675 0.018 A 141 LYS CA C 13 56.517 0.062 A 141 LYS CB C 13 32.821 0.025 A 141 LYS CE C 13 42.159 0.006 A 141 LYS CG C 13 24.911 0.046 A 141 LYS N N 15 121.013 0.058 A 142 TYR H H 1 8.053 0.020 A 142 TYR HA H 1 4.485 0.012 A 142 TYR HBx H 1 2.939 0.019 A 142 TYR HBy H 1 2.993 0.014 A 142 TYR HDx H 1 7.060 0.012 A 142 TYR HDy H 1 7.060 0.012 A 142 TYR HEx H 1 6.751 0.012 A 142 TYR HEy H 1 6.751 0.012 A 142 TYR C C 13 175.220 0.044 A 142 TYR CA C 13 58.047 0.033 A 142 TYR CB C 13 38.983 0.045 A 142 TYR CDx C 13 133.262 0.000 A 142 TYR CDy C 13 133.262 0.000 A 142 TYR CEx C 13 118.276 0.000 A 142 TYR CEy C 13 118.276 0.000 A 142 TYR N N 15 121.516 0.134 A 143 LYS H H 1 8.211 0.009 A 143 LYS HA H 1 4.066 0.011 A 143 LYS HBy H 1 1.651 0.000 A 143 LYS HBx H 1 1.631 0.000 A 143 LYS HDy H 1 1.386 0.008 A 143 LYS HDx H 1 1.359 0.002 A 143 LYS HEx H 1 2.838 0.000 A 143 LYS HEy H 1 2.838 0.000 A 143 LYS HGy H 1 1.139 0.000 A 143 LYS HGx H 1 1.113 0.000 A 143 LYS C C 13 175.630 0.070 A 143 LYS CA C 13 56.693 0.042 A 143 LYS CB C 13 32.442 0.010 A 143 LYS CD C 13 29.192 0.030 A 143 LYS CE C 13 42.388 0.000 A 143 LYS CG C 13 24.805 0.000 A 143 LYS N N 15 121.778 0.063 A 144 THR H H 1 8.402 0.024 A 144 THR HA H 1 4.461 0.006 A 144 THR HB H 1 4.236 0.008 A 144 THR HG2% H 1 1.138 0.009 A 144 THR C C 13 174.217 0.014 A 144 THR CA C 13 61.979 0.023 A 144 THR CB C 13 70.579 0.024 A 144 THR CG2 C 13 21.949 0.032 A 144 THR N N 15 111.228 0.129 A 145 VAL H H 1 8.056 0.016 A 145 VAL HA H 1 4.355 0.006 A 145 VAL HB H 1 2.186 0.012 A 145 VAL HGx% H 1 0.961 0.006 A 145 VAL HGy% H 1 0.933 0.001 A 145 VAL C C 13 175.539 0.060 A 145 VAL CA C 13 61.475 0.026 A 145 VAL CB C 13 34.412 0.016 A 145 VAL CGx C 13 21.164 0.015 A 145 VAL CGy C 13 21.390 0.012 A 145 VAL N N 15 122.890 0.138 A 146 LEU H H 1 8.530 0.028 A 146 LEU HA H 1 4.327 0.007 A 146 LEU HBy H 1 1.679 0.005 A 146 LEU HBx H 1 1.451 0.008 A 146 LEU HDx% H 1 0.842 0.016 A 146 LEU HDy% H 1 0.906 0.009 A 146 LEU HG H 1 1.679 0.006 A 146 LEU C C 13 176.496 0.045 A 146 LEU CA C 13 55.654 0.055 A 146 LEU CB C 13 43.018 0.010 A 146 LEU CDx C 13 24.165 0.018 A 146 LEU CDy C 13 25.098 0.014 A 146 LEU CG C 13 27.423 0.014 A 146 LEU N N 15 125.890 0.085 A 147 CYS H H 1 8.887 0.008 A 147 CYS HA H 1 3.919 0.000 A 147 CYS HBy H 1 3.321 0.000 A 147 CYS HBx H 1 3.004 0.000 A 147 CYS C C 13 175.841 0.039 A 147 CYS CA C 13 60.183 0.000 A 147 CYS CB C 13 31.837 0.013 A 147 CYS N N 15 124.911 0.017 A 148 ASP H H 1 8.791 0.009 A 148 ASP HA H 1 4.314 0.012 A 148 ASP HBy H 1 2.672 0.015 A 148 ASP HBx H 1 2.657 0.000 A 148 ASP C C 13 177.653 0.009 A 148 ASP CA C 13 57.602 0.055 A 148 ASP CB C 13 40.535 0.000 A 148 ASP N N 15 133.072 0.060 A 149 LYS H H 1 8.269 0.010 A 149 LYS HA H 1 4.178 0.010 A 149 LYS HBy H 1 2.078 0.011 A 149 LYS HBx H 1 2.070 0.000 A 149 LYS HDx H 1 1.744 0.000 A 149 LYS HDy H 1 1.744 0.000 A 149 LYS HEy H 1 3.059 0.000 A 149 LYS HEx H 1 3.054 0.000 A 149 LYS HGy H 1 1.676 0.004 A 149 LYS HGx H 1 1.656 0.009 A 149 LYS C C 13 180.048 0.014 A 149 LYS CA C 13 58.833 0.015 A 149 LYS CB C 13 32.073 0.000 A 149 LYS CD C 13 28.201 0.000 A 149 LYS CE C 13 42.313 0.010 A 149 LYS CG C 13 24.718 0.010 A 149 LYS N N 15 120.741 0.038 A 150 PHE H H 1 9.183 0.011 A 150 PHE HA H 1 3.736 0.014 A 150 PHE HBx H 1 2.815 0.013 A 150 PHE HBy H 1 3.078 0.019 A 150 PHE HDx H 1 6.688 0.015 A 150 PHE HDy H 1 6.688 0.015 A 150 PHE HEx H 1 7.101 0.012 A 150 PHE HEy H 1 7.101 0.012 A 150 PHE C C 13 178.748 0.003 A 150 PHE CA C 13 62.074 0.035 A 150 PHE CB C 13 38.723 0.045 A 150 PHE CDx C 13 131.018 0.000 A 150 PHE CDy C 13 131.018 0.000 A 150 PHE CEy C 13 133.288 0.000 A 150 PHE CEx C 13 133.241 0.000 A 150 PHE N N 15 125.345 0.074 A 151 SER H H 1 8.480 0.018 A 151 SER HA H 1 4.303 0.012 A 151 SER HBy H 1 4.047 0.009 A 151 SER HBx H 1 4.016 0.022 A 151 SER C C 13 175.598 0.012 A 151 SER CA C 13 61.881 0.034 A 151 SER CB C 13 63.588 0.023 A 151 SER N N 15 114.457 0.076 A 152 MET H H 1 7.879 0.012 A 152 MET HA H 1 4.485 0.010 A 152 MET HBy H 1 2.187 0.012 A 152 MET HBx H 1 2.121 0.012 A 152 MET HE% H 1 2.061 0.002 A 152 MET HGy H 1 2.749 0.007 A 152 MET HGx H 1 2.588 0.008 A 152 MET C C 13 177.930 0.002 A 152 MET CA C 13 57.287 0.025 A 152 MET CB C 13 34.109 0.100 A 152 MET CE C 13 16.942 0.018 A 152 MET CG C 13 32.458 0.021 A 152 MET N N 15 116.223 0.028 A 153 THR H H 1 7.929 0.009 A 153 THR HA H 1 4.644 0.010 A 153 THR HB H 1 4.296 0.010 A 153 THR HG2% H 1 1.200 0.009 A 153 THR C C 13 175.591 0.007 A 153 THR CA C 13 61.846 0.013 A 153 THR CB C 13 72.563 0.039 A 153 THR CG2 C 13 21.351 0.027 A 153 THR N N 15 106.178 0.031 A 154 GLY H H 1 8.248 0.008 A 154 GLY HAy H 1 3.766 0.005 A 154 GLY HAx H 1 2.697 0.010 A 154 GLY C C 13 171.905 0.007 A 154 GLY CA C 13 45.141 0.025 A 154 GLY N N 15 111.883 0.031 A 155 ASN H H 1 7.711 0.011 A 155 ASN HA H 1 4.702 0.001 A 155 ASN HBx H 1 2.444 0.015 A 155 ASN HBy H 1 2.494 0.010 A 155 ASN C C 13 171.914 0.005 A 155 ASN CA C 13 52.226 0.016 A 155 ASN CB C 13 41.895 0.019 A 155 ASN N N 15 116.767 0.020 A 156 CYS H H 1 8.285 0.007 A 156 CYS HA H 1 4.469 0.000 A 156 CYS HBy H 1 2.915 0.000 A 156 CYS HBx H 1 2.691 0.000 A 156 CYS C C 13 176.945 0.000 A 156 CYS CA C 13 59.184 0.000 A 156 CYS CB C 13 32.691 0.011 A 156 CYS N N 15 121.474 0.018 A 157 LYS HA H 1 4.114 0.007 A 157 LYS HBy H 1 1.693 0.008 A 157 LYS HBx H 1 1.576 0.006 A 157 LYS HDy H 1 1.471 0.000 A 157 LYS HDx H 1 1.452 0.000 A 157 LYS HEx H 1 2.767 0.000 A 157 LYS HEy H 1 2.767 0.000 A 157 LYS HGx H 1 0.600 0.008 A 157 LYS HGy H 1 1.097 0.010 A 157 LYS C C 13 176.728 0.001 A 157 LYS CA C 13 58.518 0.018 A 157 LYS CB C 13 31.909 0.031 A 157 LYS CD C 13 29.273 0.016 A 157 LYS CE C 13 42.100 0.000 A 157 LYS CG C 13 23.527 0.026 A 158 TYR H H 1 8.625 0.010 A 158 TYR HA H 1 4.487 0.009 A 158 TYR HBx H 1 2.923 0.022 A 158 TYR HBy H 1 2.970 0.020 A 158 TYR HDx H 1 7.355 0.011 A 158 TYR HDy H 1 7.355 0.011 A 158 TYR HEx H 1 6.945 0.003 A 158 TYR HEy H 1 6.945 0.003 A 158 TYR C C 13 177.504 0.041 A 158 TYR CA C 13 59.360 0.050 A 158 TYR CB C 13 38.055 0.036 A 158 TYR CDx C 13 133.522 0.000 A 158 TYR CDy C 13 133.522 0.000 A 158 TYR CEx C 13 118.454 0.000 A 158 TYR CEy C 13 118.454 0.000 A 158 TYR N N 15 120.439 0.044 A 159 GLY H H 1 7.907 0.007 A 159 GLY HAy H 1 4.142 0.007 A 159 GLY HAx H 1 4.059 0.013 A 159 GLY C C 13 175.855 0.000 A 159 GLY CA C 13 47.206 0.102 A 159 GLY N N 15 108.757 0.060 A 160 THR H H 1 8.723 0.015 A 160 THR HA H 1 4.133 0.008 A 160 THR HB H 1 4.418 0.002 A 160 THR HG2% H 1 1.331 0.007 A 160 THR C C 13 175.653 0.000 A 160 THR CA C 13 63.689 0.011 A 160 THR CB C 13 68.759 0.058 A 160 THR CG2 C 13 22.068 0.026 A 160 THR N N 15 116.582 0.000 A 161 ARG H H 1 8.000 0.014 A 161 ARG HA H 1 4.364 0.010 A 161 ARG HBy H 1 2.066 0.009 A 161 ARG HBx H 1 1.907 0.007 A 161 ARG HDx H 1 3.218 0.000 A 161 ARG HDy H 1 3.218 0.000 A 161 ARG HGy H 1 1.716 0.008 A 161 ARG HGx H 1 1.648 0.012 A 161 ARG C C 13 175.600 0.009 A 161 ARG CA C 13 55.542 0.011 A 161 ARG CB C 13 29.858 0.015 A 161 ARG CD C 13 43.304 0.000 A 161 ARG CG C 13 27.716 0.053 A 161 ARG N N 15 119.141 0.031 A 162 CYS H H 1 7.293 0.001 A 162 CYS HA H 1 3.677 0.000 A 162 CYS HBy H 1 2.940 0.000 A 162 CYS HBx H 1 2.473 0.000 A 162 CYS CA C 13 61.788 0.000 A 162 CYS CB C 13 30.619 0.001 A 162 CYS N N 15 123.866 0.036 A 163 GLN H H 1 8.311 0.015 A 163 GLN HA H 1 4.017 0.012 A 163 GLN HBy H 1 1.633 0.012 A 163 GLN HBx H 1 1.474 0.009 A 163 GLN HE2y H 1 7.154 0.014 A 163 GLN HE2x H 1 6.728 0.000 A 163 GLN HGy H 1 1.835 0.010 A 163 GLN HGx H 1 1.611 0.003 A 163 GLN C C 13 174.882 0.000 A 163 GLN CA C 13 56.738 0.009 A 163 GLN CB C 13 28.837 0.022 A 163 GLN CG C 13 33.294 0.016 A 163 GLN N N 15 125.284 0.049 A 163 GLN NE2 N 15 112.409 0.015 A 164 PHE H H 1 8.962 0.015 A 164 PHE HA H 1 4.933 0.012 A 164 PHE HBy H 1 3.287 0.010 A 164 PHE HBx H 1 3.122 0.010 A 164 PHE HDx H 1 7.390 0.017 A 164 PHE HDy H 1 7.390 0.017 A 164 PHE C C 13 174.036 0.015 A 164 PHE CA C 13 56.260 0.021 A 164 PHE CB C 13 40.012 0.030 A 164 PHE CDx C 13 132.281 0.000 A 164 PHE CDy C 13 132.281 0.000 A 164 PHE N N 15 122.858 0.054 A 165 ILE H H 1 8.678 0.023 A 165 ILE HA H 1 3.681 0.008 A 165 ILE HB H 1 1.612 0.007 A 165 ILE HD1% H 1 0.643 0.008 A 165 ILE HG1x H 1 0.952 0.012 A 165 ILE HG1y H 1 1.356 0.007 A 165 ILE HG2% H 1 0.748 0.008 A 165 ILE C C 13 176.919 0.014 A 165 ILE CA C 13 62.111 0.024 A 165 ILE CB C 13 39.506 0.012 A 165 ILE CD1 C 13 13.124 0.007 A 165 ILE CG1 C 13 28.247 0.015 A 165 ILE CG2 C 13 17.324 0.007 A 165 ILE N N 15 118.514 0.049 A 166 HIS H H 1 8.798 0.021 A 166 HIS HA H 1 4.482 0.008 A 166 HIS HBx H 1 2.580 0.000 A 166 HIS HBy H 1 2.581 0.001 A 166 HIS HD2 H 1 6.484 0.014 A 166 HIS HE1 H 1 7.938 0.000 A 166 HIS C C 13 172.940 0.005 A 166 HIS CA C 13 53.444 0.028 A 166 HIS CB C 13 27.513 0.011 A 166 HIS CD2 C 13 123.858 0.051 A 166 HIS CE1 C 13 139.916 0.072 A 166 HIS N N 15 128.859 0.095 A 167 LYS H H 1 8.217 0.030 A 167 LYS HA H 1 4.415 0.005 A 167 LYS HBy H 1 1.755 0.010 A 167 LYS HBx H 1 1.574 0.007 A 167 LYS HDy H 1 1.636 0.000 A 167 LYS HDx H 1 1.635 0.000 A 167 LYS HEy H 1 2.933 0.000 A 167 LYS HEx H 1 2.931 0.000 A 167 LYS HGy H 1 1.326 0.007 A 167 LYS HGx H 1 1.274 0.006 A 167 LYS C C 13 174.649 0.007 A 167 LYS CA C 13 55.811 0.021 A 167 LYS CB C 13 34.713 0.022 A 167 LYS CD C 13 29.362 0.006 A 167 LYS CE C 13 42.096 0.000 A 167 LYS CG C 13 24.858 0.062 A 167 LYS N N 15 125.523 0.131 A 168 ILE H H 1 8.482 0.020 A 168 ILE HA H 1 4.266 0.008 A 168 ILE HB H 1 1.842 0.007 A 168 ILE HD1% H 1 0.827 0.007 A 168 ILE HG1y H 1 1.537 0.012 A 168 ILE HG1x H 1 1.224 0.012 A 168 ILE HG2% H 1 0.890 0.008 A 168 ILE C C 13 176.323 0.019 A 168 ILE CA C 13 61.109 0.004 A 168 ILE CB C 13 38.613 0.006 A 168 ILE CD1 C 13 12.845 0.011 A 168 ILE CG1 C 13 27.620 0.017 A 168 ILE CG2 C 13 17.577 0.007 A 168 ILE N N 15 125.189 0.122 A 169 VAL H H 1 8.397 0.019 A 169 VAL HA H 1 4.140 0.010 A 169 VAL HB H 1 2.062 0.010 A 169 VAL HGx% H 1 0.912 0.008 A 169 VAL HGy% H 1 0.903 0.010 A 169 VAL C C 13 175.541 0.007 A 169 VAL CA C 13 62.232 0.005 A 169 VAL CB C 13 32.939 0.004 A 169 VAL CGx C 13 20.734 0.017 A 169 VAL CGy C 13 21.236 0.008 A 169 VAL N N 15 125.753 0.103 A 170 ASP H H 1 8.404 0.014 A 170 ASP HA H 1 4.611 0.011 A 170 ASP HBx H 1 2.651 0.023 A 170 ASP HBy H 1 2.676 0.010 A 170 ASP C C 13 176.600 0.002 A 170 ASP CA C 13 54.364 0.051 A 170 ASP CB C 13 41.495 0.003 A 170 ASP N N 15 124.703 0.082 A 171 GLY H H 1 8.387 0.013 A 171 GLY HAy H 1 3.968 0.000 A 171 GLY HAx H 1 3.934 0.022 A 171 GLY C C 13 174.001 0.008 A 171 GLY CA C 13 45.516 0.000 A 171 GLY N N 15 109.709 0.068 A 172 ASN H H 1 8.363 0.006 A 172 ASN HA H 1 4.749 0.000 A 172 ASN HBy H 1 2.818 0.010 A 172 ASN HBx H 1 2.715 0.011 A 172 ASN C C 13 174.036 0.008 A 172 ASN CA C 13 53.157 0.000 A 172 ASN CB C 13 39.286 0.037 A 172 ASN N N 15 118.977 0.021 A 173 ALA H H 1 7.851 0.014 A 173 ALA HA H 1 4.096 0.010 A 173 ALA HB% H 1 1.322 0.008 A 173 ALA C C 13 167.457 0.000 A 173 ALA CA C 13 54.041 0.026 A 173 ALA CB C 13 20.215 0.040 A 173 ALA N N 15 129.537 0.034 stop_ save_ save_CNS/XPLOR_distance_constraints_3 _nef_distance_restraint_list.sf_category nef_distance_restraint_list _nef_distance_restraint_list.sf_framecode CNS/XPLOR_distance_constraints_3 _nef_distance_restraint_list.restraint_origin noe _nef_distance_restraint_list.potential_type square-well-parabolic loop_ _nef_distance_restraint.index _nef_distance_restraint.restraint_id _nef_distance_restraint.chain_code_1 _nef_distance_restraint.sequence_code_1 _nef_distance_restraint.residue_name_1 _nef_distance_restraint.atom_name_1 _nef_distance_restraint.chain_code_2 _nef_distance_restraint.sequence_code_2 _nef_distance_restraint.residue_name_2 _nef_distance_restraint.atom_name_2 _nef_distance_restraint.weight _nef_distance_restraint.lower_limit _nef_distance_restraint.upper_limit 1 1 A 104 CYS HBy A 123 HIS HD2 1.0 1.8 4.04 2 2 A 147 CYS HBx A 166 HIS HD2 1.0 1.8 3.99 3 3 A 116 GLY HAx A 123 HIS HE1 1.0 1.8 4.95 4 4 A 166 HIS HE1 A 159 GLY HAx 1.0 1.8 4.83 5 5 A 166 HIS HE1 A 162 CYS HBy 1.0 1.8 4.36 6 6 A 123 HIS HE1 A 119 CYS HBy 1.0 1.8 4.47 7 7 A 164 PHE HA A 164 PHE HD% 1.0 1.8 4.16 8 8 A 164 PHE HD% A 145 VAL HB 1.0 1.8 4.08 9 9 A 115 TYR HD% A 119 CYS HA 1.0 1.8 5.60 10 10 A 142 TYR HA A 142 TYR HD% 1.0 1.8 4.26 11 11 A 123 HIS HE1 A 113 CYS HBx 1.0 1.8 4.35 12 12 A 166 HIS HE1 A 156 CYS HBx 1.0 1.8 3.66 13 13 A 142 TYR HE% A 143 LYS HEx 1.0 1.8 5.57 14 14 A 142 TYR HE% A 143 LYS HEy 1.0 1.8 5.57 15 15 A 142 TYR HD% A 163 GLN HA 1.0 1.8 4.59 16 16 A 121 PHE HA A 121 PHE HD% 1.0 1.8 4.29 17 17 A 99 PHE HD% A 120 ARG HBy 1.0 1.8 5.33 18 18 A 107 TYR HE% A 123 HIS HBy 1.0 1.8 4.21 19 19 A 166 HIS HD2 A 147 CYS HBy 1.0 1.8 3.95 20 20 A 123 HIS HD2 A 104 CYS HBx 1.0 1.8 4.14 21 21 A 150 PHE HD% A 156 CYS HA 1.0 1.8 5.36 22 22 A 99 PHE HD% A 120 ARG HA 1.0 1.8 4.32 23 23 A 99 PHE HA A 99 PHE HE% 1.0 1.8 4.80 24 24 A 123 HIS HE1 A 119 CYS HBx 1.0 1.8 4.25 25 25 A 164 PHE HD% A 145 VAL HGx% 1.0 1.8 4.32 26 26 A 115 TYR HA A 115 TYR HE% 1.0 1.8 5.51 27 27 A 158 TYR HA A 158 TYR HE% 1.0 1.8 5.93 28 28 A 158 TYR HE% A 157 LYS HEx 1.0 1.8 6.05 29 29 A 158 TYR HE% A 157 LYS HEy 1.0 1.8 6.05 30 30 A 166 HIS HE1 A 162 CYS HBx 1.0 1.8 4.36 31 31 A 142 TYR HE% A 163 GLN HA 1.0 1.8 4.35 32 32 A 107 TYR HE% A 123 HIS HA 1.0 1.8 5.37 33 33 A 107 TYR HE% A 103 LEU HDy% 1.0 1.8 6.05 34 34 A 142 TYR HD% A 143 LYS HGy 1.0 1.8 6.05 35 35 A 142 TYR HD% A 143 LYS HGx 1.0 1.8 6.05 36 36 A 121 PHE HD% A 104 CYS HA 1.0 1.8 5.12 37 37 A 99 PHE HE% A 120 ARG HBx 1.0 1.8 5.26 38 38 A 99 PHE HD% A 120 ARG HBx 1.0 1.8 5.07 39 39 A 158 TYR HE% A 157 LYS HDy 1.0 1.8 6.05 40 40 A 158 TYR HE% A 157 LYS HDx 1.0 1.8 6.05 41 41 A 166 HIS HD2 A 150 PHE HBy 1.0 1.8 4.53 42 42 A 166 HIS HD2 A 150 PHE HBx 1.0 1.8 4.70 43 43 A 142 TYR HD% A 142 TYR H 1.0 1.8 4.96 44 44 A 142 TYR HE% A 143 LYS HGy 1.0 1.8 6.05 45 45 A 142 TYR HE% A 143 LYS HGx 1.0 1.8 6.05 46 46 A 150 PHE HE% A 156 CYS HBy 1.0 1.8 5.26 47 47 A 158 TYR HD% A 162 CYS HA 1.0 1.8 4.98 48 48 A 148 ASP HA A 152 MET HE% 1.0 1.8 5.05 49 49 A 152 MET HE% A 152 MET HA 1.0 1.8 4.86 50 50 A 131 PRO HA A 132 MET HE% 1.0 1.8 4.91 51 51 A 152 MET HE% A 148 ASP HBy 1.0 1.8 5.59 52 52 A 152 MET HE% A 148 ASP HBx 1.0 1.8 5.59 53 53 A 132 MET HE% A 130 LEU HG 1.0 1.8 5.49 54 54 A 132 MET HE% A 130 LEU HDx% 1.0 1.8 4.61 55 55 A 132 MET HE% A 101 THR HG2% 1.0 1.8 5.62 56 56 A 132 MET HE% A 129 ARG HBy 1.0 1.8 6.05 57 57 A 132 MET HE% A 130 LEU HBy 1.0 1.8 6.05 58 58 A 132 MET HE% A 131 PRO HDx 1.0 1.8 6.05 59 59 A 152 MET HE% A 153 THR HG2% 1.0 1.8 4.51 60 60 A 98 ALA H A 97 ASP HBy 1.0 1.8 5.06 61 61 A 98 ALA H A 97 ASP HBx 1.0 1.8 5.06 62 62 A 99 PHE HA A 120 ARG HBx 1.0 1.8 4.72 63 63 A 120 ARG HBy A 99 PHE HA 1.0 1.8 6.05 64 64 A 99 PHE HA A 101 THR HG2% 1.0 1.8 5.52 65 65 A 126 HIS HA A 125 VAL HGx% 1.0 1.8 5.25 66 66 A 129 ARG HBy A 130 LEU H 1.0 1.8 6.05 67 67 A 129 ARG HBy A 101 THR HA 1.0 1.8 6.05 68 68 A 101 THR HG2% A 129 ARG HBx 1.0 1.8 5.37 69 69 A 101 THR HG2% A 131 PRO HDx 1.0 1.8 5.05 70 70 A 101 THR HG2% A 99 PHE HBy 1.0 1.8 6.05 71 71 A 101 THR HG2% A 99 PHE HBx 1.0 1.8 6.05 72 72 A 101 THR HG2% A 101 THR HA 1.0 1.8 3.50 73 73 A 101 THR HG2% A 98 ALA HA 1.0 1.8 4.36 74 74 A 101 THR HG2% A 102 ALA H 1.0 1.8 5.53 75 75 A 102 ALA HB% A 128 LEU HDx% 1.0 1.8 5.30 76 76 A 102 ALA HB% A 128 LEU HDy% 1.0 1.8 5.30 77 77 A 101 THR HG2% A 102 ALA HB% 1.0 1.8 5.76 78 78 A 102 ALA HB% A 122 ALA HB% 1.0 1.8 6.05 79 79 A 102 ALA HB% A 121 PHE HBx 1.0 1.8 5.43 80 80 A 102 ALA HB% A 101 THR HB 1.0 1.8 5.31 81 81 A 102 ALA HB% A 103 LEU HA 1.0 1.8 5.70 82 82 A 121 PHE HD% A 102 ALA HB% 1.0 1.8 3.45 83 83 A 102 ALA HB% A 101 THR H 1.0 1.8 5.38 84 84 A 121 PHE HBx A 103 LEU HA 1.0 1.8 4.87 85 85 A 103 LEU HA A 103 LEU HG 1.0 1.8 4.66 86 86 A 103 LEU HBx A 103 LEU HDy% 1.0 1.8 4.52 87 87 A 146 LEU H A 146 LEU HBy 1.0 1.8 4.21 88 88 A 103 LEU HBy A 103 LEU HDx% 1.0 1.8 3.74 89 89 A 103 LEU HBx A 103 LEU HDx% 1.0 1.8 4.52 90 90 A 103 LEU HA A 103 LEU HDx% 1.0 1.8 4.74 91 91 A 130 LEU HDy% A 131 PRO HDy 1.0 1.8 5.05 92 92 A 107 TYR HD% A 103 LEU HDx% 1.0 1.8 6.05 93 93 A 107 TYR HE% A 103 LEU HDx% 1.0 1.8 6.05 94 94 A 103 LEU HBy A 103 LEU HDy% 1.0 1.8 3.74 95 95 A 103 LEU HA A 103 LEU HDy% 1.0 1.8 4.74 96 96 A 107 TYR HD% A 103 LEU HDy% 1.0 1.8 6.05 97 97 A 104 CYS HA A 103 LEU HA 1.0 1.8 5.03 98 98 A 104 CYS HA A 121 PHE HBx 1.0 1.8 3.75 99 99 A 104 CYS HBy A 103 LEU HA 1.0 1.8 5.56 100 100 A 104 CYS HBx A 123 HIS HA 1.0 1.8 5.44 101 101 A 105 ASP HA A 108 LYS HEy 1.0 1.8 5.86 102 102 A 105 ASP HA A 108 LYS HEx 1.0 1.8 5.86 103 103 A 105 ASP HA A 108 LYS HDy 1.0 1.8 6.05 104 104 A 105 ASP HA A 108 LYS HDx 1.0 1.8 6.05 105 105 A 105 ASP HA A 109 ARG H 1.0 1.8 5.68 106 106 A 171 GLY H A 170 ASP HBy 1.0 1.8 5.60 107 107 A 106 ALA HA A 109 ARG HBy 1.0 1.8 5.16 108 108 A 106 ALA HA A 109 ARG HBx 1.0 1.8 5.16 109 109 A 113 CYS HBx A 106 ALA HB% 1.0 1.8 4.43 110 110 A 106 ALA HB% A 113 CYS HA 1.0 1.8 4.32 111 111 A 107 TYR HD% A 107 TYR HA 1.0 1.8 5.42 112 112 A 123 HIS HD2 A 107 TYR HBx 1.0 1.8 5.44 113 113 A 123 HIS HD2 A 107 TYR HBy 1.0 1.8 5.44 114 114 A 108 LYS H A 107 TYR HBy 1.0 1.8 4.75 115 115 A 108 LYS HA A 108 LYS HDy 1.0 1.8 5.97 116 116 A 108 LYS HA A 108 LYS HDx 1.0 1.8 5.97 117 117 A 108 LYS HA A 108 LYS HGx 1.0 1.8 4.17 118 118 A 107 TYR HD% A 108 LYS HA 1.0 1.8 4.97 119 119 A 108 LYS H A 108 LYS HDy 1.0 1.8 6.05 120 120 A 165 ILE HG2% A 167 LYS HEy 1.0 1.8 6.01 121 121 A 165 ILE HG2% A 167 LYS HEx 1.0 1.8 6.01 122 122 A 109 ARG HA A 110 SER HA 1.0 1.8 5.15 123 123 A 129 ARG HA A 129 ARG HDx 1.0 1.8 5.06 124 124 A 129 ARG HA A 129 ARG HDy 1.0 1.8 5.06 125 125 A 109 ARG HA A 109 ARG HGx 1.0 1.8 4.47 126 126 A 109 ARG HA A 109 ARG HGy 1.0 1.8 4.47 127 127 A 149 LYS HA A 149 LYS HDx 1.0 1.8 5.52 128 128 A 149 LYS HA A 149 LYS HDy 1.0 1.8 5.52 129 129 A 161 ARG HA A 161 ARG HGy 1.0 1.8 4.23 130 130 A 107 TYR HD% A 112 ALA HA 1.0 1.8 5.50 131 131 A 106 ALA HB% A 113 CYS HBy 1.0 1.8 5.82 132 132 A 123 HIS HE1 A 113 CYS HBy 1.0 1.8 4.92 133 133 A 114 SER HA A 116 GLY H 1.0 1.8 5.58 134 134 A 156 CYS HA A 149 LYS HBy 1.0 1.8 5.30 135 135 A 156 CYS HA A 149 LYS HBx 1.0 1.8 5.84 136 136 A 115 TYR HD% A 115 TYR HA 1.0 1.8 3.76 137 137 A 158 TYR HA A 158 TYR HD% 1.0 1.8 4.09 138 138 A 119 CYS HBy A 115 TYR HBy 1.0 1.8 5.25 139 139 A 119 CYS HBy A 115 TYR HBx 1.0 1.8 5.25 140 140 A 158 TYR HBy A 159 GLY H 1.0 1.8 6.05 141 141 A 123 HIS HE1 A 116 GLY HAy 1.0 1.8 5.60 142 142 A 116 GLY HAx A 113 CYS HBy 1.0 1.8 5.65 143 143 A 113 CYS HBy A 116 GLY HAy 1.0 1.8 5.89 144 144 A 119 CYS HA A 115 TYR HBy 1.0 1.8 4.07 145 145 A 119 CYS HA A 115 TYR HBx 1.0 1.8 4.07 146 146 A 119 CYS HA A 120 ARG HBy 1.0 1.8 5.84 147 147 A 120 ARG HA A 99 PHE HE% 1.0 1.8 4.38 148 148 A 120 ARG HA A 120 ARG HDx 1.0 1.8 6.05 149 149 A 120 ARG HA A 120 ARG HDy 1.0 1.8 6.05 150 150 A 128 LEU H A 128 LEU HG 1.0 1.8 4.65 151 151 A 104 CYS HBx A 121 PHE HBx 1.0 1.8 4.16 152 152 A 104 CYS HBx A 121 PHE HBy 1.0 1.8 4.23 153 153 A 104 CYS HA A 121 PHE HBy 1.0 1.8 4.51 154 154 A 121 PHE HBy A 104 CYS H 1.0 1.8 5.50 155 155 A 121 PHE HBy A 122 ALA H 1.0 1.8 4.82 156 156 A 123 HIS HA A 122 ALA HA 1.0 1.8 5.07 157 157 A 122 ALA HA A 127 GLU HBy 1.0 1.8 5.15 158 158 A 122 ALA HB% A 100 LYS HA 1.0 1.8 4.92 159 159 A 122 ALA HB% A 128 LEU HA 1.0 1.8 3.74 160 160 A 122 ALA HB% A 103 LEU HA 1.0 1.8 3.60 161 161 A 122 ALA HB% A 104 CYS H 1.0 1.8 4.89 162 162 A 104 CYS HBy A 123 HIS HA 1.0 1.8 5.14 163 163 A 123 HIS HD2 A 123 HIS HA 1.0 1.8 3.97 164 164 A 123 HIS HA A 107 TYR HD% 1.0 1.8 4.69 165 165 A 123 HIS HA A 104 CYS H 1.0 1.8 5.61 166 166 A 128 LEU HG A 125 VAL HA 1.0 1.8 4.26 167 167 A 125 VAL HA A 125 VAL HGy% 1.0 1.8 3.69 168 168 A 125 VAL HA A 125 VAL HGx% 1.0 1.8 3.69 169 169 A 126 HIS HA A 125 VAL HGy% 1.0 1.8 5.25 170 170 A 125 VAL H A 125 VAL HGy% 1.0 1.8 4.29 171 171 A 99 PHE HD% A 99 PHE HA 1.0 1.8 3.97 172 172 A 127 GLU HA A 127 GLU HGx 1.0 1.8 4.20 173 173 A 127 GLU HA A 127 GLU HGy 1.0 1.8 4.20 174 174 A 122 ALA HA A 127 GLU HBx 1.0 1.8 5.15 175 175 A 129 ARG HA A 128 LEU HA 1.0 1.8 4.97 176 176 A 128 LEU HA A 128 LEU HDx% 1.0 1.8 4.46 177 177 A 103 LEU HA A 128 LEU HDx% 1.0 1.8 5.83 178 178 A 101 THR HA A 128 LEU HDx% 1.0 1.8 5.75 179 179 A 122 ALA H A 128 LEU HDx% 1.0 1.8 6.05 180 180 A 128 LEU HDy% A 128 LEU HBx 1.0 1.8 3.92 181 181 A 128 LEU HDy% A 128 LEU HBy 1.0 1.8 3.92 182 182 A 103 LEU HG A 128 LEU HDy% 1.0 1.8 4.69 183 183 A 128 LEU HA A 128 LEU HDy% 1.0 1.8 4.46 184 184 A 101 THR HA A 128 LEU HDy% 1.0 1.8 5.75 185 185 A 103 LEU HA A 128 LEU HDy% 1.0 1.8 5.83 186 186 A 129 ARG H A 128 LEU HDy% 1.0 1.8 5.35 187 187 A 131 PRO HDx A 130 LEU HA 1.0 1.8 3.25 188 188 A 130 LEU HDx% A 130 LEU HBy 1.0 1.8 3.72 189 189 A 130 LEU HDy% A 130 LEU HBx 1.0 1.8 3.76 190 190 A 131 PRO HDy A 130 LEU HBx 1.0 1.8 4.59 191 191 A 131 PRO HDx A 130 LEU HBx 1.0 1.8 5.27 192 192 A 129 ARG HA A 130 LEU HBx 1.0 1.8 5.63 193 193 A 131 PRO HA A 130 LEU HBy 1.0 1.8 5.60 194 194 A 130 LEU HBy A 130 LEU H 1.0 1.8 4.22 195 195 A 130 LEU HDx% A 131 PRO HDy 1.0 1.8 4.08 196 196 A 130 LEU HDx% A 131 PRO HDx 1.0 1.8 5.20 197 197 A 131 PRO HA A 130 LEU HDx% 1.0 1.8 5.13 198 198 A 130 LEU HDx% A 132 MET HA 1.0 1.8 5.31 199 199 A 146 LEU HDx% A 146 LEU HBx 1.0 1.8 3.81 200 200 A 130 LEU HBy A 130 LEU HDy% 1.0 1.8 3.71 201 201 A 146 LEU HDx% A 146 LEU HBy 1.0 1.8 3.81 202 202 A 146 LEU HDx% A 146 LEU HA 1.0 1.8 4.44 203 203 A 130 LEU HDy% A 130 LEU HA 1.0 1.8 4.50 204 204 A 131 PRO HDx A 130 LEU HDy% 1.0 1.8 6.05 205 205 A 146 LEU H A 146 LEU HDx% 1.0 1.8 4.97 206 206 A 146 LEU HDx% A 147 CYS H 1.0 1.8 5.44 207 207 A 130 LEU HG A 130 LEU HA 1.0 1.8 4.65 208 208 A 130 LEU HG A 129 ARG HA 1.0 1.8 4.16 209 209 A 131 PRO HA A 101 THR HG2% 1.0 1.8 4.57 210 210 A 130 LEU HBy A 131 PRO HDx 1.0 1.8 4.70 211 211 A 130 LEU HBy A 131 PRO HDy 1.0 1.8 3.93 212 212 A 101 THR HB A 131 PRO HDy 1.0 1.8 5.87 213 213 A 131 PRO HDy A 130 LEU HA 1.0 1.8 3.40 214 214 A 131 PRO HDx A 101 THR HB 1.0 1.8 5.35 215 215 A 133 ASN HA A 134 PRO HGy 1.0 1.8 5.89 216 216 A 161 ARG HA A 161 ARG HDx 1.0 1.8 5.97 217 217 A 161 ARG HA A 161 ARG HDy 1.0 1.8 5.97 218 218 A 132 MET HE% A 132 MET HA 1.0 1.8 4.21 219 219 A 161 ARG HA A 161 ARG HGx 1.0 1.8 4.23 220 220 A 134 PRO HDy A 133 ASN HBx 1.0 1.8 5.19 221 221 A 133 ASN HBy A 134 PRO HDx 1.0 1.8 5.19 222 222 A 133 ASN HA A 134 PRO HDx 1.0 1.8 3.36 223 223 A 130 LEU HA A 131 PRO HGx 1.0 1.8 5.42 224 224 A 130 LEU HA A 131 PRO HGy 1.0 1.8 5.42 225 225 A 135 ARG HA A 135 ARG HDy 1.0 1.8 6.05 226 226 A 135 ARG HA A 135 ARG HDx 1.0 1.8 6.05 227 227 A 133 ASN HBx A 134 PRO HDx 1.0 1.8 5.19 228 228 A 133 ASN HBy A 134 PRO HDy 1.0 1.8 5.19 229 229 A 140 PRO HDx A 139 HIS HBx 1.0 1.8 6.05 230 230 A 139 HIS HBy A 140 PRO HDx 1.0 1.8 6.05 231 231 A 141 LYS HA A 141 LYS HEy 1.0 1.8 6.05 232 232 A 141 LYS HA A 141 LYS HEx 1.0 1.8 6.05 233 233 A 141 LYS HA A 141 LYS HGx 1.0 1.8 4.35 234 234 A 141 LYS HA A 144 THR HG2% 1.0 1.8 5.47 235 235 A 167 LYS HA A 167 LYS HGx 1.0 1.8 4.65 236 236 A 143 LYS HA A 165 ILE HG1x 1.0 1.8 5.41 237 237 A 143 LYS HA A 143 LYS HDx 1.0 1.8 5.59 238 238 A 143 LYS HA A 143 LYS HDy 1.0 1.8 5.59 239 239 A 144 THR HA A 145 VAL HGy% 1.0 1.8 5.48 240 240 A 144 THR HA A 165 ILE HD1% 1.0 1.8 3.92 241 241 A 165 ILE HD1% A 144 THR HB 1.0 1.8 5.61 242 242 A 144 THR HG2% A 165 ILE HD1% 1.0 1.8 4.81 243 243 A 141 LYS HEy A 144 THR HG2% 1.0 1.8 6.05 244 244 A 141 LYS HEx A 144 THR HG2% 1.0 1.8 6.05 245 245 A 144 THR HG2% A 144 THR HA 1.0 1.8 3.31 246 246 A 142 TYR H A 144 THR HG2% 1.0 1.8 5.31 247 247 A 145 VAL HA A 146 LEU HG 1.0 1.8 4.82 248 248 A 149 LYS HA A 152 MET HBx 1.0 1.8 5.21 249 249 A 145 VAL HGy% A 146 LEU HG 1.0 1.8 6.05 250 250 A 145 VAL HGy% A 144 THR HB 1.0 1.8 4.95 251 251 A 145 VAL HGy% A 145 VAL HA 1.0 1.8 3.62 252 252 A 146 LEU H A 145 VAL HGy% 1.0 1.8 4.79 253 253 A 164 PHE HD% A 145 VAL HGy% 1.0 1.8 4.93 254 254 A 145 VAL HGx% A 146 LEU HG 1.0 1.8 6.00 255 255 A 145 VAL HGx% A 145 VAL HA 1.0 1.8 3.81 256 256 A 146 LEU HDy% A 167 LYS HEy 1.0 1.8 6.04 257 257 A 146 LEU HDy% A 167 LYS HEx 1.0 1.8 6.04 258 258 A 146 LEU HA A 146 LEU HDy% 1.0 1.8 3.53 259 259 A 146 LEU H A 146 LEU HDy% 1.0 1.8 4.92 260 260 A 146 LEU HDy% A 165 ILE H 1.0 1.8 5.32 261 261 A 147 CYS HBy A 146 LEU HA 1.0 1.8 5.62 262 262 A 146 LEU HA A 165 ILE HB 1.0 1.8 3.43 263 263 A 146 LEU HA A 147 CYS HA 1.0 1.8 5.47 264 264 A 148 ASP HA A 147 CYS HA 1.0 1.8 5.87 265 265 A 147 CYS HA A 164 PHE HBy 1.0 1.8 4.38 266 266 A 147 CYS HA A 164 PHE HBx 1.0 1.8 4.38 267 267 A 164 PHE HD% A 147 CYS HA 1.0 1.8 5.20 268 268 A 147 CYS HBy A 150 PHE HBx 1.0 1.8 4.60 269 269 A 149 LYS HA A 149 LYS HEy 1.0 1.8 6.05 270 270 A 149 LYS HA A 149 LYS HEx 1.0 1.8 6.05 271 271 A 152 MET HE% A 149 LYS HA 1.0 1.8 3.65 272 272 A 149 LYS HA A 152 MET HBy 1.0 1.8 5.21 273 273 A 149 LYS H A 149 LYS HDx 1.0 1.8 6.05 274 274 A 149 LYS H A 149 LYS HDy 1.0 1.8 6.05 275 275 A 152 MET HE% A 149 LYS HEy 1.0 1.8 5.97 276 276 A 152 MET HE% A 149 LYS HEx 1.0 1.8 5.97 277 277 A 153 THR HG2% A 149 LYS HEy 1.0 1.8 6.05 278 278 A 153 THR HG2% A 149 LYS HEx 1.0 1.8 6.05 279 279 A 150 PHE HD% A 150 PHE HA 1.0 1.8 4.77 280 280 A 150 PHE HA A 154 GLY H 1.0 1.8 5.07 281 281 A 147 CYS HBx A 150 PHE HBx 1.0 1.8 4.79 282 282 A 156 CYS HA A 150 PHE HBx 1.0 1.8 6.05 283 283 A 150 PHE HBx A 166 HIS HA 1.0 1.8 6.05 284 284 A 150 PHE HD% A 151 SER HA 1.0 1.8 5.37 285 285 A 152 MET HA A 153 THR HG2% 1.0 1.8 5.19 286 286 A 156 CYS HBx A 150 PHE HD% 1.0 1.8 4.72 287 287 A 153 THR HG2% A 152 MET HBx 1.0 1.8 3.88 288 288 A 153 THR HG2% A 152 MET HBy 1.0 1.8 3.88 289 289 A 153 THR HG2% A 152 MET HGx 1.0 1.8 5.85 290 290 A 153 THR HG2% A 152 MET HGy 1.0 1.8 5.85 291 291 A 153 THR HG2% A 149 LYS HA 1.0 1.8 4.28 292 292 A 153 THR HG2% A 153 THR HA 1.0 1.8 3.42 293 293 A 150 PHE HBx A 156 CYS HBy 1.0 1.8 4.05 294 294 A 150 PHE HD% A 156 CYS HBy 1.0 1.8 4.68 295 295 A 166 HIS HE1 A 156 CYS HBy 1.0 1.8 4.64 296 296 A 156 CYS HA A 157 LYS HA 1.0 1.8 5.51 297 297 A 158 TYR HA A 157 LYS HA 1.0 1.8 6.05 298 298 A 157 LYS HA A 157 LYS HDy 1.0 1.8 6.05 299 299 A 157 LYS HA A 157 LYS HDx 1.0 1.8 6.05 300 300 A 159 GLY H A 157 LYS HA 1.0 1.8 5.38 301 301 A 128 LEU HBx A 128 LEU HDx% 1.0 1.8 3.92 302 302 A 128 LEU HBy A 128 LEU HDx% 1.0 1.8 3.92 303 303 A 103 LEU HG A 128 LEU HDx% 1.0 1.8 4.69 304 304 A 162 CYS HA A 158 TYR HBx 1.0 1.8 4.64 305 305 A 160 THR HA A 160 THR HB 1.0 1.8 3.26 306 306 A 160 THR HB A 161 ARG H 1.0 1.8 5.38 307 307 A 160 THR HA A 160 THR HG2% 1.0 1.8 3.53 308 308 A 162 CYS HA A 158 TYR HBy 1.0 1.8 3.84 309 309 A 163 GLN H A 162 CYS HBy 1.0 1.8 5.64 310 310 A 163 GLN HA A 143 LYS HEx 1.0 1.8 6.05 311 311 A 163 GLN HA A 143 LYS HEy 1.0 1.8 6.05 312 312 A 146 LEU HDy% A 165 ILE HB 1.0 1.8 4.35 313 313 A 165 ILE HD1% A 165 ILE HB 1.0 1.8 3.69 314 314 A 165 ILE HD1% A 165 ILE HA 1.0 1.8 4.54 315 315 A 165 ILE HD1% A 145 VAL HA 1.0 1.8 4.76 316 316 A 146 LEU HA A 165 ILE HD1% 1.0 1.8 5.12 317 317 A 165 ILE HG2% A 165 ILE HG1x 1.0 1.8 4.18 318 318 A 143 LYS HA A 165 ILE HG1y 1.0 1.8 5.41 319 319 A 146 LEU HA A 165 ILE HG1y 1.0 1.8 6.05 320 320 A 165 ILE HG2% A 165 ILE HG1y 1.0 1.8 4.18 321 321 A 165 ILE HG2% A 165 ILE HA 1.0 1.8 3.78 322 322 A 165 ILE HG2% A 167 LYS HA 1.0 1.8 4.61 323 323 A 165 ILE HG2% A 146 LEU HA 1.0 1.8 4.33 324 324 A 165 ILE HG2% A 165 ILE H 1.0 1.8 4.83 325 325 A 147 CYS HBx A 166 HIS HA 1.0 1.8 5.24 326 326 A 150 PHE HBy A 166 HIS HA 1.0 1.8 4.99 327 327 A 165 ILE HG2% A 166 HIS HA 1.0 1.8 5.50 328 328 A 166 HIS HD2 A 166 HIS HA 1.0 1.8 4.03 329 329 A 150 PHE HD% A 166 HIS HA 1.0 1.8 4.77 330 330 A 167 LYS HA A 167 LYS HGy 1.0 1.8 4.65 331 331 A 150 PHE HE% A 167 LYS HA 1.0 1.8 5.38 332 332 A 146 LEU HDy% A 167 LYS HBy 1.0 1.8 4.65 333 333 A 165 ILE HG2% A 167 LYS HBy 1.0 1.8 4.96 334 334 A 146 LEU HDy% A 167 LYS HBx 1.0 1.8 4.65 335 335 A 165 ILE HG2% A 167 LYS HBx 1.0 1.8 4.96 336 336 A 165 ILE HG2% A 167 LYS HDy 1.0 1.8 6.01 337 337 A 165 ILE HG2% A 167 LYS HDx 1.0 1.8 6.01 338 338 A 167 LYS HA A 167 LYS HDy 1.0 1.8 6.05 339 339 A 167 LYS HA A 167 LYS HDx 1.0 1.8 6.05 340 340 A 168 ILE HA A 168 ILE HG1y 1.0 1.8 4.68 341 341 A 168 ILE HA A 168 ILE HG1x 1.0 1.8 4.68 342 342 A 150 PHE HE% A 168 ILE HA 1.0 1.8 5.24 343 343 A 168 ILE HG2% A 168 ILE HG1x 1.0 1.8 3.97 344 344 A 168 ILE HG2% A 168 ILE HG1y 1.0 1.8 3.97 345 345 A 168 ILE HG2% A 169 VAL HA 1.0 1.8 4.81 346 346 A 168 ILE HA A 168 ILE HG2% 1.0 1.8 3.51 347 347 A 169 VAL HA A 169 VAL HGy% 1.0 1.8 3.64 348 348 A 151 SER HA A 169 VAL HGy% 1.0 1.8 4.98 349 349 A 168 ILE HA A 169 VAL HGy% 1.0 1.8 5.50 350 350 A 169 VAL HA A 169 VAL HGx% 1.0 1.8 3.73 351 351 A 169 VAL HGx% A 170 ASP HA 1.0 1.8 4.86 352 352 A 169 VAL HGx% A 170 ASP HBy 1.0 1.8 5.53 353 353 A 169 VAL HGx% A 170 ASP HBx 1.0 1.8 5.53 354 354 A 133 ASN HA A 134 PRO HDy 1.0 1.8 3.36 355 355 A 133 ASN HA A 134 PRO HGx 1.0 1.8 5.89 356 356 A 168 ILE HB A 168 ILE HD1% 1.0 1.8 3.89 357 357 A 168 ILE HA A 168 ILE HD1% 1.0 1.8 4.44 358 358 A 150 PHE HE% A 168 ILE HD1% 1.0 1.8 5.33 359 359 A 104 CYS HBy A 106 ALA HB% 1.0 1.8 5.56 360 360 A 142 TYR HE% A 144 THR HG2% 1.0 1.8 6.05 361 361 A 142 TYR HD% A 144 THR HG2% 1.0 1.8 5.52 362 362 A 101 THR HG2% A 129 ARG HBy 1.0 1.8 5.24 363 363 A 139 HIS HBy A 140 PRO HDy 1.0 1.8 6.05 364 364 A 139 HIS HBx A 140 PRO HDy 1.0 1.8 6.05 365 365 A 165 ILE HG2% A 165 ILE HD1% 1.0 1.8 3.05 366 366 A 146 LEU HA A 165 ILE HG1x 1.0 1.8 6.05 367 367 A 160 THR HG2% A 160 THR H 1.0 1.8 5.86 368 368 A 156 CYS HBy A 150 PHE HA 1.0 1.8 5.32 369 369 A 156 CYS HBx A 150 PHE HA 1.0 1.8 5.78 370 370 A 160 THR HG2% A 159 GLY HAy 1.0 1.8 5.64 371 371 A 160 THR HG2% A 159 GLY HAx 1.0 1.8 5.64 372 372 A 166 HIS HE1 A 159 GLY HAy 1.0 1.8 4.83 373 373 A 156 CYS HBy A 149 LYS HBy 1.0 1.8 4.99 374 374 A 156 CYS HBx A 149 LYS HBy 1.0 1.8 6.05 375 375 A 113 CYS HBx A 107 TYR HD% 1.0 1.8 5.51 376 376 A 107 TYR HD% A 113 CYS HBy 1.0 1.8 6.05 377 377 A 113 CYS HBx A 112 ALA HA 1.0 1.8 5.87 378 378 A 161 ARG H A 159 GLY HAy 1.0 1.8 5.71 379 379 A 103 LEU H A 103 LEU HDy% 1.0 1.8 4.64 380 380 A 108 LYS HA A 108 LYS HGy 1.0 1.8 4.17 381 381 A 119 CYS HBx A 120 ARG H 1.0 1.8 5.69 382 382 A 141 LYS HA A 141 LYS HGy 1.0 1.8 4.35 383 383 A 130 LEU HDx% A 130 LEU HA 1.0 1.8 4.17 384 384 A 154 GLY H A 153 THR H 1.0 1.8 3.41 385 385 A 152 MET HA A 154 GLY H 1.0 1.8 5.30 386 386 A 154 GLY H A 151 SER HA 1.0 1.8 5.07 387 387 A 154 GLY H A 153 THR HB 1.0 1.8 5.62 388 388 A 153 THR HG2% A 154 GLY H 1.0 1.8 4.83 389 389 A 171 GLY H A 170 ASP HBx 1.0 1.8 5.60 390 390 A 171 GLY H A 169 VAL HGx% 1.0 1.8 5.24 391 391 A 144 THR HG2% A 144 THR H 1.0 1.8 4.94 392 392 A 144 THR H A 143 LYS HBy 1.0 1.8 6.05 393 393 A 144 THR H A 143 LYS HBx 1.0 1.8 6.05 394 394 A 101 THR H A 100 LYS H 1.0 1.8 4.57 395 395 A 101 THR H A 100 LYS HBy 1.0 1.8 5.40 396 396 A 101 THR H A 100 LYS HBx 1.0 1.8 5.40 397 397 A 101 THR HG2% A 101 THR H 1.0 1.8 3.83 398 398 A 110 SER H A 111 GLN H 1.0 1.8 3.58 399 399 A 109 ARG H A 110 SER H 1.0 1.8 3.67 400 400 A 108 LYS HA A 110 SER H 1.0 1.8 5.69 401 401 A 110 SER H A 109 ARG HBy 1.0 1.8 4.46 402 402 A 110 SER H A 109 ARG HBx 1.0 1.8 4.46 403 403 A 153 THR H A 155 ASN H 1.0 1.8 4.95 404 404 A 149 LYS HA A 153 THR H 1.0 1.8 5.30 405 405 A 150 PHE HA A 153 THR H 1.0 1.8 5.12 406 406 A 153 THR H A 154 GLY HAy 1.0 1.8 5.91 407 407 A 153 THR H A 154 GLY HAx 1.0 1.8 5.91 408 408 A 153 THR H A 152 MET HBy 1.0 1.8 4.41 409 409 A 153 THR H A 152 MET HBx 1.0 1.8 4.41 410 410 A 153 THR HG2% A 153 THR H 1.0 1.8 3.78 411 411 A 158 TYR HD% A 159 GLY H 1.0 1.8 5.02 412 412 A 156 CYS HBx A 159 GLY H 1.0 1.8 4.25 413 413 A 116 GLY H A 115 TYR H 1.0 1.8 3.34 414 414 A 116 GLY HAx A 116 GLY H 1.0 1.8 2.97 415 415 A 116 GLY H A 115 TYR HBy 1.0 1.8 4.19 416 416 A 113 CYS HBy A 116 GLY H 1.0 1.8 4.14 417 417 A 116 GLY H A 115 TYR HBx 1.0 1.8 4.19 418 418 A 109 ARG H A 106 ALA HA 1.0 1.8 4.70 419 419 A 109 ARG H A 109 ARG HBy 1.0 1.8 4.08 420 420 A 109 ARG H A 109 ARG HBx 1.0 1.8 4.08 421 421 A 109 ARG H A 109 ARG HGx 1.0 1.8 4.65 422 422 A 154 GLY H A 155 ASN H 1.0 1.8 3.66 423 423 A 150 PHE HD% A 155 ASN H 1.0 1.8 5.52 424 424 A 153 THR HB A 155 ASN H 1.0 1.8 4.42 425 425 A 150 PHE HA A 155 ASN H 1.0 1.8 3.61 426 426 A 155 ASN H A 155 ASN HBx 1.0 1.8 3.74 427 427 A 155 ASN H A 155 ASN HBy 1.0 1.8 4.39 428 428 A 153 THR HG2% A 155 ASN H 1.0 1.8 4.93 429 429 A 149 LYS HA A 152 MET H 1.0 1.8 5.07 430 430 A 152 MET H A 152 MET HGy 1.0 1.8 4.57 431 431 A 152 MET H A 152 MET HGx 1.0 1.8 4.57 432 432 A 152 MET H A 152 MET HBy 1.0 1.8 4.10 433 433 A 152 MET H A 152 MET HBx 1.0 1.8 4.10 434 434 A 153 THR HG2% A 152 MET H 1.0 1.8 5.30 435 435 A 128 LEU H A 127 GLU H 1.0 1.8 3.58 436 436 A 126 HIS HA A 128 LEU H 1.0 1.8 5.22 437 437 A 128 LEU H A 125 VAL HA 1.0 1.8 4.70 438 438 A 128 LEU H A 128 LEU HBy 1.0 1.8 4.05 439 439 A 128 LEU H A 128 LEU HBx 1.0 1.8 4.05 440 440 A 122 ALA HB% A 128 LEU H 1.0 1.8 4.58 441 441 A 128 LEU H A 128 LEU HDy% 1.0 1.8 4.73 442 442 A 128 LEU H A 128 LEU HDx% 1.0 1.8 4.73 443 443 A 128 LEU H A 125 VAL HGx% 1.0 1.8 6.05 444 444 A 128 LEU H A 125 VAL HGy% 1.0 1.8 6.05 445 445 A 161 ARG H A 161 ARG HDx 1.0 1.8 6.05 446 446 A 161 ARG H A 161 ARG HDy 1.0 1.8 6.05 447 447 A 158 TYR HBy A 161 ARG H 1.0 1.8 4.53 448 448 A 161 ARG H A 161 ARG HBx 1.0 1.8 4.06 449 449 A 161 ARG H A 161 ARG HBy 1.0 1.8 3.38 450 450 A 161 ARG H A 161 ARG HGy 1.0 1.8 3.90 451 451 A 161 ARG H A 161 ARG HGx 1.0 1.8 3.90 452 452 A 161 ARG H A 160 THR HG2% 1.0 1.8 4.87 453 453 A 117 ASP H A 118 GLN H 1.0 1.8 4.54 454 454 A 118 GLN H A 119 CYS H 1.0 1.8 3.17 455 455 A 116 GLY HAy A 118 GLN H 1.0 1.8 4.55 456 456 A 119 CYS HA A 118 GLN H 1.0 1.8 5.86 457 457 A 118 GLN H A 115 TYR HBy 1.0 1.8 5.22 458 458 A 119 CYS HBx A 118 GLN H 1.0 1.8 4.94 459 459 A 118 GLN H A 115 TYR HBx 1.0 1.8 5.22 460 460 A 118 GLN H A 118 GLN HGy 1.0 1.8 4.33 461 461 A 118 GLN H A 118 GLN HGx 1.0 1.8 4.33 462 462 A 118 GLN H A 118 GLN HBy 1.0 1.8 3.22 463 463 A 109 ARG H A 111 GLN H 1.0 1.8 4.61 464 464 A 107 TYR HD% A 111 GLN H 1.0 1.8 5.52 465 465 A 109 ARG HA A 111 GLN H 1.0 1.8 6.05 466 466 A 112 ALA HA A 111 GLN H 1.0 1.8 6.05 467 467 A 107 TYR HA A 111 GLN H 1.0 1.8 4.50 468 468 A 127 GLU H A 126 HIS H 1.0 1.8 5.38 469 469 A 149 LYS H A 148 ASP H 1.0 1.8 4.27 470 470 A 149 LYS H A 150 PHE H 1.0 1.8 3.65 471 471 A 147 CYS HA A 149 LYS H 1.0 1.8 4.70 472 472 A 149 LYS H A 149 LYS HEy 1.0 1.8 6.05 473 473 A 149 LYS H A 149 LYS HEx 1.0 1.8 6.05 474 474 A 150 PHE HBy A 149 LYS H 1.0 1.8 6.05 475 475 A 149 LYS HBy A 149 LYS H 1.0 1.8 3.01 476 476 A 153 THR HG2% A 149 LYS H 1.0 1.8 6.05 477 477 A 142 TYR H A 141 LYS HBx 1.0 1.8 5.80 478 478 A 142 TYR H A 141 LYS HBy 1.0 1.8 5.80 479 479 A 98 ALA HA A 99 PHE H 1.0 1.8 3.88 480 480 A 99 PHE H A 99 PHE HBy 1.0 1.8 4.43 481 481 A 99 PHE H A 99 PHE HBx 1.0 1.8 4.43 482 482 A 99 PHE H A 98 ALA HB% 1.0 1.8 4.75 483 483 A 101 THR HG2% A 99 PHE H 1.0 1.8 5.59 484 484 A 142 TYR HD% A 143 LYS H 1.0 1.8 5.13 485 485 A 143 LYS H A 142 TYR HBx 1.0 1.8 4.79 486 486 A 143 LYS H A 142 TYR HBy 1.0 1.8 4.79 487 487 A 143 LYS H A 165 ILE HG1y 1.0 1.8 6.05 488 488 A 144 THR HG2% A 143 LYS H 1.0 1.8 5.30 489 489 A 143 LYS H A 165 ILE HG1x 1.0 1.8 6.05 490 490 A 159 GLY H A 156 CYS H 1.0 1.8 5.74 491 491 A 166 HIS HE1 A 156 CYS H 1.0 1.8 6.05 492 492 A 155 ASN H A 156 CYS H 1.0 1.8 5.04 493 493 A 150 PHE HD% A 156 CYS H 1.0 1.8 4.41 494 494 A 157 LYS HA A 156 CYS H 1.0 1.8 5.70 495 495 A 156 CYS HBy A 156 CYS H 1.0 1.8 3.99 496 496 A 156 CYS HBx A 156 CYS H 1.0 1.8 3.66 497 497 A 155 ASN HBy A 156 CYS H 1.0 1.8 3.99 498 498 A 155 ASN HBx A 156 CYS H 1.0 1.8 4.32 499 499 A 134 PRO HA A 135 ARG H 1.0 1.8 3.52 500 500 A 109 ARG H A 108 LYS H 1.0 1.8 3.55 501 501 A 107 TYR HD% A 108 LYS H 1.0 1.8 4.52 502 502 A 105 ASP HA A 108 LYS H 1.0 1.8 4.31 503 503 A 108 LYS H A 107 TYR HBx 1.0 1.8 4.75 504 504 A 108 LYS H A 108 LYS HGx 1.0 1.8 4.22 505 505 A 108 LYS H A 108 LYS HGy 1.0 1.8 4.22 506 506 A 131 PRO HA A 132 MET H 1.0 1.8 3.58 507 507 A 132 MET H A 131 PRO HBy 1.0 1.8 5.12 508 508 A 132 MET H A 131 PRO HBx 1.0 1.8 5.12 509 509 A 100 LYS H A 99 PHE H 1.0 1.8 4.30 510 510 A 99 PHE HD% A 100 LYS H 1.0 1.8 5.10 511 511 A 120 ARG HA A 100 LYS H 1.0 1.8 6.05 512 512 A 98 ALA HA A 100 LYS H 1.0 1.8 5.84 513 513 A 100 LYS H A 100 LYS HBy 1.0 1.8 4.59 514 514 A 100 LYS H A 100 LYS HBx 1.0 1.8 4.59 515 515 A 101 THR HG2% A 100 LYS H 1.0 1.8 5.26 516 516 A 100 LYS H A 100 LYS HGy 1.0 1.8 4.66 517 517 A 100 LYS H A 100 LYS HGx 1.0 1.8 4.66 518 518 A 133 ASN H A 132 MET HBx 1.0 1.8 5.60 519 519 A 133 ASN H A 132 MET HBy 1.0 1.8 5.60 520 520 A 125 VAL H A 125 VAL HB 1.0 1.8 4.19 521 521 A 125 VAL H A 125 VAL HGx% 1.0 1.8 4.29 522 522 A 146 LEU HA A 165 ILE H 1.0 1.8 4.26 523 523 A 165 ILE H A 164 PHE HBy 1.0 1.8 4.88 524 524 A 165 ILE H A 164 PHE HBx 1.0 1.8 4.88 525 525 A 165 ILE H A 165 ILE HB 1.0 1.8 3.85 526 526 A 165 ILE H A 165 ILE HG1y 1.0 1.8 4.40 527 527 A 165 ILE H A 165 ILE HG1x 1.0 1.8 4.40 528 528 A 165 ILE HD1% A 165 ILE H 1.0 1.8 4.88 529 529 A 159 GLY H A 158 TYR H 1.0 1.8 3.28 530 530 A 158 TYR HD% A 158 TYR H 1.0 1.8 3.67 531 531 A 158 TYR HE% A 158 TYR H 1.0 1.8 5.51 532 532 A 162 CYS HA A 158 TYR H 1.0 1.8 6.05 533 533 A 158 TYR HBx A 158 TYR H 1.0 1.8 3.26 534 534 A 158 TYR HBy A 158 TYR H 1.0 1.8 4.08 535 535 A 156 CYS HBx A 158 TYR H 1.0 1.8 4.92 536 536 A 158 TYR H A 157 LYS HBy 1.0 1.8 4.73 537 537 A 158 TYR H A 157 LYS HBx 1.0 1.8 4.73 538 538 A 158 TYR H A 157 LYS HGy 1.0 1.8 4.37 539 539 A 158 TYR H A 157 LYS HGx 1.0 1.8 4.37 540 540 A 115 TYR HD% A 115 TYR H 1.0 1.8 4.16 541 541 A 115 TYR H A 115 TYR HBy 1.0 1.8 4.08 542 542 A 115 TYR H A 115 TYR HBx 1.0 1.8 4.08 543 543 A 113 CYS HBy A 115 TYR H 1.0 1.8 5.21 544 544 A 103 LEU H A 102 ALA HA 1.0 1.8 3.40 545 545 A 103 LEU HBx A 103 LEU H 1.0 1.8 3.40 546 546 A 103 LEU HG A 103 LEU H 1.0 1.8 3.72 547 547 A 102 ALA HB% A 103 LEU H 1.0 1.8 3.62 548 548 A 103 LEU HBy A 103 LEU H 1.0 1.8 3.99 549 549 A 122 ALA HB% A 103 LEU H 1.0 1.8 5.25 550 550 A 103 LEU H A 103 LEU HDx% 1.0 1.8 4.64 551 551 A 103 LEU H A 128 LEU HDy% 1.0 1.8 4.83 552 552 A 103 LEU H A 128 LEU HDx% 1.0 1.8 4.83 553 553 A 104 CYS H A 122 ALA H 1.0 1.8 4.30 554 554 A 121 PHE HD% A 122 ALA H 1.0 1.8 4.88 555 555 A 103 LEU HA A 122 ALA H 1.0 1.8 3.95 556 556 A 122 ALA H A 100 LYS HA 1.0 1.8 4.66 557 557 A 121 PHE HBx A 122 ALA H 1.0 1.8 3.61 558 558 A 104 CYS HBx A 122 ALA H 1.0 1.8 5.05 559 559 A 102 ALA HB% A 122 ALA H 1.0 1.8 5.22 560 560 A 122 ALA HB% A 122 ALA H 1.0 1.8 3.31 561 561 A 122 ALA H A 128 LEU HDy% 1.0 1.8 6.05 562 562 A 130 LEU H A 129 ARG H 1.0 1.8 4.60 563 563 A 128 LEU H A 129 ARG H 1.0 1.8 5.10 564 564 A 101 THR HA A 129 ARG H 1.0 1.8 4.08 565 565 A 128 LEU HA A 129 ARG H 1.0 1.8 2.97 566 566 A 129 ARG HBx A 129 ARG H 1.0 1.8 4.46 567 567 A 129 ARG HBy A 129 ARG H 1.0 1.8 3.41 568 568 A 101 THR HG2% A 129 ARG H 1.0 1.8 4.71 569 569 A 122 ALA HB% A 129 ARG H 1.0 1.8 5.15 570 570 A 129 ARG H A 128 LEU HDx% 1.0 1.8 5.35 571 571 A 107 TYR HD% A 113 CYS H 1.0 1.8 5.32 572 572 A 112 ALA HA A 113 CYS H 1.0 1.8 3.59 573 573 A 113 CYS HBy A 113 CYS H 1.0 1.8 4.03 574 574 A 113 CYS H A 112 ALA HB% 1.0 1.8 4.16 575 575 A 105 ASP H A 106 ALA H 1.0 1.8 3.95 576 576 A 104 CYS HA A 106 ALA H 1.0 1.8 4.53 577 577 A 104 CYS HBx A 106 ALA H 1.0 1.8 5.14 578 578 A 106 ALA H A 105 ASP HBx 1.0 1.8 3.83 579 579 A 104 CYS HBy A 106 ALA H 1.0 1.8 4.87 580 580 A 106 ALA H A 105 ASP HBy 1.0 1.8 3.83 581 581 A 106 ALA HB% A 106 ALA H 1.0 1.8 2.83 582 582 A 98 ALA H A 98 ALA HB% 1.0 1.8 4.55 583 583 A 169 VAL HA A 170 ASP H 1.0 1.8 3.00 584 584 A 170 ASP H A 170 ASP HBx 1.0 1.8 4.36 585 585 A 170 ASP H A 170 ASP HBy 1.0 1.8 4.36 586 586 A 170 ASP H A 169 VAL HB 1.0 1.8 4.31 587 587 A 169 VAL HGx% A 170 ASP H 1.0 1.8 3.76 588 588 A 167 LYS H A 168 ILE H 1.0 1.8 5.08 589 589 A 167 LYS HA A 168 ILE H 1.0 1.8 2.90 590 590 A 168 ILE HB A 168 ILE H 1.0 1.8 3.31 591 591 A 168 ILE H A 168 ILE HG1y 1.0 1.8 4.10 592 592 A 168 ILE H A 168 ILE HG1x 1.0 1.8 4.10 593 593 A 168 ILE HG2% A 168 ILE H 1.0 1.8 4.36 594 594 A 168 ILE HD1% A 168 ILE H 1.0 1.8 5.07 595 595 A 168 ILE HA A 169 VAL H 1.0 1.8 2.89 596 596 A 169 VAL HB A 169 VAL H 1.0 1.8 3.53 597 597 A 168 ILE HB A 169 VAL H 1.0 1.8 4.73 598 598 A 169 VAL H A 168 ILE HG1y 1.0 1.8 5.83 599 599 A 169 VAL H A 168 ILE HG1x 1.0 1.8 5.83 600 600 A 168 ILE HG2% A 169 VAL H 1.0 1.8 3.52 601 601 A 169 VAL HGy% A 169 VAL H 1.0 1.8 3.74 602 602 A 146 LEU H A 145 VAL HA 1.0 1.8 3.41 603 603 A 145 VAL HB A 146 LEU H 1.0 1.8 4.76 604 604 A 146 LEU H A 146 LEU HG 1.0 1.8 3.54 605 605 A 146 LEU H A 146 LEU HBx 1.0 1.8 4.21 606 606 A 145 VAL HGx% A 146 LEU H 1.0 1.8 3.93 607 607 A 163 GLN H A 164 PHE H 1.0 1.8 3.78 608 608 A 121 PHE HD% A 120 ARG H 1.0 1.8 5.28 609 609 A 119 CYS HA A 120 ARG H 1.0 1.8 3.00 610 610 A 162 CYS HA A 163 GLN H 1.0 1.8 3.16 611 611 A 121 PHE HBy A 120 ARG H 1.0 1.8 5.20 612 612 A 120 ARG H A 120 ARG HDx 1.0 1.8 6.05 613 613 A 120 ARG H A 120 ARG HDy 1.0 1.8 6.05 614 614 A 119 CYS HBy A 120 ARG H 1.0 1.8 5.17 615 615 A 163 GLN H A 162 CYS HBx 1.0 1.8 5.64 616 616 A 120 ARG HBy A 120 ARG H 1.0 1.8 3.67 617 617 A 120 ARG H A 120 ARG HGy 1.0 1.8 4.00 618 618 A 120 ARG H A 120 ARG HGx 1.0 1.8 4.00 619 619 A 150 PHE HD% A 167 LYS H 1.0 1.8 4.43 620 620 A 166 HIS HD2 A 167 LYS H 1.0 1.8 5.50 621 621 A 166 HIS HA A 167 LYS H 1.0 1.8 3.49 622 622 A 167 LYS H A 166 HIS HBx 1.0 1.8 6.05 623 623 A 167 LYS H A 166 HIS HBy 1.0 1.8 6.05 624 624 A 167 LYS H A 167 LYS HBy 1.0 1.8 4.11 625 625 A 167 LYS H A 167 LYS HGy 1.0 1.8 6.05 626 626 A 167 LYS H A 167 LYS HGx 1.0 1.8 6.05 627 627 A 167 LYS H A 167 LYS HBx 1.0 1.8 4.11 628 628 A 146 LEU HDy% A 167 LYS H 1.0 1.8 4.96 629 629 A 165 ILE HG2% A 167 LYS H 1.0 1.8 4.64 630 630 A 146 LEU HDx% A 167 LYS H 1.0 1.8 5.51 631 631 A 147 CYS H A 165 ILE H 1.0 1.8 4.50 632 632 A 146 LEU H A 147 CYS H 1.0 1.8 5.38 633 633 A 166 HIS HD2 A 147 CYS H 1.0 1.8 4.86 634 634 A 146 LEU HA A 147 CYS H 1.0 1.8 3.39 635 635 A 147 CYS HBx A 147 CYS H 1.0 1.8 4.02 636 636 A 147 CYS HBy A 147 CYS H 1.0 1.8 3.90 637 637 A 147 CYS H A 165 ILE HB 1.0 1.8 4.53 638 638 A 147 CYS H A 146 LEU HBy 1.0 1.8 4.63 639 639 A 147 CYS H A 146 LEU HBx 1.0 1.8 4.63 640 640 A 147 CYS H A 146 LEU HDy% 1.0 1.8 4.86 641 641 A 147 CYS H A 167 LYS H 1.0 1.8 5.15 642 642 A 123 HIS HD2 A 104 CYS H 1.0 1.8 4.97 643 643 A 103 LEU HA A 104 CYS H 1.0 1.8 3.08 644 644 A 104 CYS HBy A 104 CYS H 1.0 1.8 3.52 645 645 A 121 PHE HBx A 104 CYS H 1.0 1.8 3.94 646 646 A 104 CYS HBx A 104 CYS H 1.0 1.8 3.61 647 647 A 103 LEU HBx A 104 CYS H 1.0 1.8 4.71 648 648 A 103 LEU HBy A 104 CYS H 1.0 1.8 4.17 649 649 A 145 VAL HGx% A 147 CYS H 1.0 1.8 6.05 650 650 A 165 ILE H A 164 PHE H 1.0 1.8 5.32 651 651 A 164 PHE HD% A 164 PHE H 1.0 1.8 4.23 652 652 A 164 PHE H A 162 CYS H 1.0 1.8 5.93 653 653 A 162 CYS HA A 164 PHE H 1.0 1.8 4.80 654 654 A 164 PHE H A 164 PHE HBy 1.0 1.8 4.19 655 655 A 164 PHE H A 164 PHE HBx 1.0 1.8 4.19 656 656 A 147 CYS HBy A 164 PHE H 1.0 1.8 4.93 657 657 A 164 PHE H A 162 CYS HBy 1.0 1.8 5.19 658 658 A 164 PHE H A 162 CYS HBx 1.0 1.8 5.19 659 659 A 164 PHE H A 163 GLN HBy 1.0 1.8 5.42 660 660 A 164 PHE H A 163 GLN HBx 1.0 1.8 5.42 661 661 A 165 ILE HG2% A 166 HIS H 1.0 1.8 4.73 662 662 A 150 PHE HD% A 150 PHE H 1.0 1.8 5.50 663 663 A 147 CYS HBx A 150 PHE H 1.0 1.8 5.13 664 664 A 150 PHE HBy A 150 PHE H 1.0 1.8 4.11 665 665 A 156 CYS HBy A 150 PHE H 1.0 1.8 4.95 666 666 A 150 PHE HBx A 150 PHE H 1.0 1.8 4.05 667 667 A 149 LYS HBy A 150 PHE H 1.0 1.8 4.06 668 668 A 104 CYS HA A 105 ASP H 1.0 1.8 3.74 669 669 A 104 CYS HBy A 105 ASP H 1.0 1.8 5.58 670 670 A 121 PHE HBx A 105 ASP H 1.0 1.8 6.05 671 671 A 105 ASP H A 105 ASP HBy 1.0 1.8 4.31 672 672 A 105 ASP H A 105 ASP HBx 1.0 1.8 4.31 673 673 A 122 ALA HA A 123 HIS H 1.0 1.8 3.66 674 674 A 123 HIS H A 123 HIS HBx 1.0 1.8 4.42 675 675 A 123 HIS H A 127 GLU HBy 1.0 1.8 4.85 676 676 A 123 HIS H A 127 GLU HBx 1.0 1.8 4.85 677 677 A 122 ALA HB% A 123 HIS H 1.0 1.8 4.57 678 678 A 173 ALA H A 172 ASN HBy 1.0 1.8 5.15 679 679 A 173 ALA H A 172 ASN HBx 1.0 1.8 5.15 680 680 A 173 ALA H A 173 ALA HB% 1.0 1.8 4.17 681 681 A 102 ALA H A 101 THR H 1.0 1.8 3.19 682 682 A 121 PHE HD% A 102 ALA H 1.0 1.8 4.37 683 683 A 102 ALA H A 122 ALA H 1.0 1.8 4.64 684 684 A 102 ALA H A 103 LEU H 1.0 1.8 5.39 685 685 A 101 THR HA A 102 ALA H 1.0 1.8 3.86 686 686 A 102 ALA H A 101 THR HB 1.0 1.8 5.07 687 687 A 102 ALA H A 100 LYS HA 1.0 1.8 4.47 688 688 A 102 ALA H A 102 ALA HB% 1.0 1.8 3.32 689 689 A 102 ALA H A 122 ALA HB% 1.0 1.8 4.10 690 690 A 102 ALA H A 128 LEU HDy% 1.0 1.8 5.85 691 691 A 102 ALA H A 128 LEU HDx% 1.0 1.8 5.85 692 692 A 146 LEU H A 145 VAL H 1.0 1.8 5.03 693 693 A 144 THR H A 145 VAL H 1.0 1.8 4.07 694 694 A 164 PHE HD% A 145 VAL H 1.0 1.8 4.96 695 695 A 144 THR HA A 145 VAL H 1.0 1.8 3.89 696 696 A 144 THR HB A 145 VAL H 1.0 1.8 5.15 697 697 A 143 LYS HA A 145 VAL H 1.0 1.8 5.21 698 698 A 145 VAL HB A 145 VAL H 1.0 1.8 3.69 699 699 A 165 ILE HB A 145 VAL H 1.0 1.8 6.05 700 700 A 144 THR HG2% A 145 VAL H 1.0 1.8 4.79 701 701 A 145 VAL HGy% A 145 VAL H 1.0 1.8 3.64 702 702 A 146 LEU HDy% A 145 VAL H 1.0 1.8 5.68 703 703 A 165 ILE HD1% A 145 VAL H 1.0 1.8 4.88 704 704 A 130 LEU H A 129 ARG HA 1.0 1.8 3.15 705 705 A 130 LEU H A 128 LEU HA 1.0 1.8 6.05 706 706 A 130 LEU H A 129 ARG HBx 1.0 1.8 4.51 707 707 A 130 LEU H A 130 LEU HBx 1.0 1.8 3.21 708 708 A 130 LEU HDx% A 130 LEU H 1.0 1.8 4.79 709 709 A 130 LEU H A 130 LEU HDy% 1.0 1.8 5.01 710 710 A 119 CYS H A 117 ASP HA 1.0 1.8 4.29 711 711 A 119 CYS H A 118 GLN HA 1.0 1.8 3.84 712 712 A 119 CYS HBx A 119 CYS H 1.0 1.8 3.15 713 713 A 119 CYS H A 115 TYR HBy 1.0 1.8 4.08 714 714 A 119 CYS H A 115 TYR HBx 1.0 1.8 4.08 715 715 A 119 CYS HBy A 119 CYS H 1.0 1.8 3.30 716 716 A 119 CYS H A 118 GLN HBx 1.0 1.8 4.47 717 717 A 119 CYS H A 118 GLN HBy 1.0 1.8 4.42 718 718 A 161 ARG H A 162 CYS H 1.0 1.8 3.34 719 719 A 159 GLY H A 162 CYS H 1.0 1.8 5.01 720 720 A 166 HIS HE1 A 162 CYS H 1.0 1.8 5.41 721 721 A 163 GLN H A 162 CYS H 1.0 1.8 5.39 722 722 A 161 ARG HA A 162 CYS H 1.0 1.8 3.87 723 723 A 158 TYR HBy A 162 CYS H 1.0 1.8 3.47 724 724 A 162 CYS H A 162 CYS HBy 1.0 1.8 3.59 725 725 A 162 CYS H A 162 CYS HBx 1.0 1.8 3.59 726 726 A 161 ARG HBx A 162 CYS H 1.0 1.8 4.84 727 727 A 161 ARG HBy A 162 CYS H 1.0 1.8 4.49 728 728 A 162 CYS H A 161 ARG HGx 1.0 1.8 5.75 729 729 A 125 VAL H A 127 GLU H 1.0 1.8 5.30 730 730 A 125 VAL HA A 127 GLU H 1.0 1.8 5.32 731 731 A 127 GLU H A 127 GLU HBy 1.0 1.8 4.51 732 732 A 127 GLU H A 127 GLU HGy 1.0 1.8 4.75 733 733 A 127 GLU H A 127 GLU HGx 1.0 1.8 4.75 734 734 A 127 GLU H A 127 GLU HBx 1.0 1.8 4.51 735 735 A 122 ALA HB% A 127 GLU H 1.0 1.8 5.18 736 736 A 120 ARG H A 121 PHE H 1.0 1.8 3.60 737 737 A 121 PHE HD% A 121 PHE H 1.0 1.8 4.00 738 738 A 119 CYS HA A 121 PHE H 1.0 1.8 4.57 739 739 A 121 PHE HBy A 121 PHE H 1.0 1.8 3.59 740 740 A 119 CYS HBx A 121 PHE H 1.0 1.8 5.79 741 741 A 104 CYS HBx A 121 PHE H 1.0 1.8 5.06 742 742 A 119 CYS HBy A 121 PHE H 1.0 1.8 4.65 743 743 A 120 ARG HBx A 121 PHE H 1.0 1.8 5.28 744 744 A 120 ARG HBy A 121 PHE H 1.0 1.8 5.25 745 745 A 121 PHE H A 120 ARG HGy 1.0 1.8 5.54 746 746 A 121 PHE H A 120 ARG HGx 1.0 1.8 5.54 747 747 A 152 MET H A 151 SER H 1.0 1.8 4.16 748 748 A 150 PHE H A 151 SER H 1.0 1.8 4.00 749 749 A 149 LYS H A 151 SER H 1.0 1.8 5.28 750 750 A 154 GLY H A 151 SER H 1.0 1.8 5.73 751 751 A 150 PHE HD% A 151 SER H 1.0 1.8 5.06 752 752 A 152 MET HA A 151 SER H 1.0 1.8 5.51 753 753 A 148 ASP HA A 151 SER H 1.0 1.8 4.07 754 754 A 147 CYS HBx A 151 SER H 1.0 1.8 5.02 755 755 A 150 PHE HBy A 151 SER H 1.0 1.8 3.93 756 756 A 150 PHE HBx A 151 SER H 1.0 1.8 4.50 757 757 A 108 LYS H A 108 LYS HDx 1.0 1.8 6.05 758 758 A 109 ARG H A 109 ARG HGy 1.0 1.8 4.65 759 759 A 120 ARG H A 119 CYS H 1.0 1.8 5.26 760 760 A 130 LEU HG A 130 LEU H 1.0 1.8 3.67 761 761 A 173 ALA H A 172 ASN H 1.0 1.8 5.65 762 762 A 115 TYR HD% A 116 GLY H 1.0 1.8 5.09 763 763 A 161 ARG H A 159 GLY HAx 1.0 1.8 5.71 764 764 A 162 CYS HA A 161 ARG H 1.0 1.8 5.83 765 765 A 160 THR HA A 162 CYS H 1.0 1.8 4.53 766 766 A 119 CYS H A 117 ASP HBy 1.0 1.8 6.05 767 767 A 119 CYS H A 117 ASP HBx 1.0 1.8 6.05 768 768 A 116 GLY HAx A 119 CYS H 1.0 1.8 5.53 769 769 A 116 GLY HAy A 119 CYS H 1.0 1.8 6.02 770 770 A 162 CYS H A 161 ARG HGy 1.0 1.8 5.75 771 771 A 98 ALA H A 97 ASP HBx 1.0 1.8 4.39 772 771 A 98 ALA H A 97 ASP HBy 1.0 1.8 4.39 773 772 A 98 ALA HB% A 99 PHE HBx 1.0 1.8 5.61 774 772 A 98 ALA HB% A 99 PHE HBy 1.0 1.8 5.61 775 773 A 99 PHE H A 99 PHE HBx 1.0 1.8 3.63 776 773 A 99 PHE H A 99 PHE HBy 1.0 1.8 3.63 777 774 A 100 LYS H A 99 PHE HBx 1.0 1.8 4.30 778 774 A 100 LYS H A 99 PHE HBy 1.0 1.8 4.30 779 775 A 99 PHE HBy A 100 LYS HEx 1.0 1.8 3.88 780 775 A 100 LYS HEy A 99 PHE HBx 1.0 1.8 3.88 781 775 A 99 PHE HBy A 100 LYS HEy 1.0 1.8 3.88 782 775 A 99 PHE HBx A 100 LYS HEx 1.0 1.8 3.88 783 776 A 120 ARG HA A 99 PHE HBx 1.0 1.8 5.87 784 776 A 120 ARG HA A 99 PHE HBy 1.0 1.8 5.87 785 777 A 99 PHE HD% A 120 ARG HDx 1.0 1.8 5.87 786 777 A 99 PHE HD% A 120 ARG HDy 1.0 1.8 5.87 787 778 A 99 PHE HE% A 100 LYS HEx 1.0 1.8 4.57 788 778 A 99 PHE HE% A 100 LYS HEy 1.0 1.8 4.57 789 779 A 99 PHE HE% A 120 ARG HDx 1.0 1.8 5.87 790 779 A 99 PHE HE% A 120 ARG HDy 1.0 1.8 5.87 791 780 A 100 LYS H A 100 LYS HBx 1.0 1.8 3.86 792 780 A 100 LYS H A 100 LYS HBy 1.0 1.8 3.86 793 781 A 100 LYS H A 100 LYS HGy 1.0 1.8 3.99 794 781 A 100 LYS H A 100 LYS HGx 1.0 1.8 3.99 795 782 A 100 LYS HA A 100 LYS HDx 1.0 1.8 5.60 796 782 A 100 LYS HA A 100 LYS HDy 1.0 1.8 5.60 797 783 A 100 LYS HA A 128 LEU HDx% 1.0 1.8 5.78 798 783 A 100 LYS HA A 128 LEU HDy% 1.0 1.8 5.78 799 784 A 101 THR H A 100 LYS HBx 1.0 1.8 4.64 800 784 A 101 THR H A 100 LYS HBy 1.0 1.8 4.64 801 785 A 101 THR HA A 100 LYS HBx 1.0 1.8 5.71 802 785 A 101 THR HA A 100 LYS HBy 1.0 1.8 5.71 803 786 A 102 ALA H A 100 LYS HBx 1.0 1.8 5.68 804 786 A 102 ALA H A 100 LYS HBy 1.0 1.8 5.68 805 787 A 122 ALA H A 100 LYS HBx 1.0 1.8 4.93 806 787 A 122 ALA H A 100 LYS HBy 1.0 1.8 4.93 807 788 A 122 ALA HA A 100 LYS HBx 1.0 1.8 5.60 808 788 A 122 ALA HA A 100 LYS HBy 1.0 1.8 5.60 809 789 A 122 ALA HB% A 100 LYS HBx 1.0 1.8 4.20 810 789 A 122 ALA HB% A 100 LYS HBy 1.0 1.8 4.20 811 790 A 128 LEU HA A 100 LYS HBx 1.0 1.8 5.65 812 790 A 128 LEU HA A 100 LYS HBy 1.0 1.8 5.65 813 791 A 122 ALA HA A 100 LYS HDx 1.0 1.8 4.39 814 791 A 122 ALA HA A 100 LYS HDy 1.0 1.8 4.39 815 792 A 120 ARG HA A 100 LYS HEx 1.0 1.8 5.44 816 792 A 120 ARG HA A 100 LYS HEy 1.0 1.8 5.44 817 793 A 101 THR HA A 128 LEU HDx% 1.0 1.8 4.29 818 793 A 101 THR HA A 128 LEU HDy% 1.0 1.8 4.29 819 794 A 101 THR HB A 128 LEU HDx% 1.0 1.8 5.51 820 794 A 101 THR HB A 128 LEU HDy% 1.0 1.8 5.51 821 795 A 101 THR HB A 131 PRO HGy 1.0 1.8 5.89 822 795 A 101 THR HB A 131 PRO HGx 1.0 1.8 5.89 823 796 A 101 THR HG2% A 131 PRO HBy 1.0 1.8 5.33 824 796 A 101 THR HG2% A 131 PRO HBx 1.0 1.8 5.33 825 797 A 101 THR HG2% A 131 PRO HGy 1.0 1.8 5.24 826 797 A 101 THR HG2% A 131 PRO HGx 1.0 1.8 5.24 827 798 A 102 ALA H A 128 LEU HDx% 1.0 1.8 4.20 828 798 A 102 ALA H A 128 LEU HDy% 1.0 1.8 4.20 829 799 A 102 ALA HA A 128 LEU HDx% 1.0 1.8 4.20 830 799 A 102 ALA HA A 128 LEU HDy% 1.0 1.8 4.20 831 800 A 102 ALA HB% A 103 LEU HDx% 1.0 1.8 5.81 832 800 A 102 ALA HB% A 103 LEU HDy% 1.0 1.8 5.81 833 801 A 102 ALA HB% A 128 LEU HDx% 1.0 1.8 4.42 834 801 A 102 ALA HB% A 128 LEU HDy% 1.0 1.8 4.42 835 802 A 103 LEU H A 103 LEU HDx% 1.0 1.8 4.05 836 802 A 103 LEU H A 103 LEU HDy% 1.0 1.8 4.05 837 803 A 103 LEU H A 128 LEU HDx% 1.0 1.8 4.09 838 803 A 103 LEU H A 128 LEU HDy% 1.0 1.8 4.09 839 804 A 103 LEU HA A 103 LEU HDx% 1.0 1.8 3.26 840 804 A 103 LEU HA A 103 LEU HDy% 1.0 1.8 3.26 841 805 A 103 LEU HA A 128 LEU HDx% 1.0 1.8 4.84 842 805 A 103 LEU HA A 128 LEU HDy% 1.0 1.8 4.84 843 806 A 103 LEU HBy A 103 LEU HDx% 1.0 1.8 3.22 844 806 A 103 LEU HBy A 103 LEU HDy% 1.0 1.8 3.22 845 807 A 103 LEU HG A 128 LEU HDx% 1.0 1.8 3.92 846 807 A 103 LEU HG A 128 LEU HDy% 1.0 1.8 3.92 847 808 A 104 CYS H A 103 LEU HDx% 1.0 1.8 4.21 848 808 A 104 CYS H A 103 LEU HDy% 1.0 1.8 4.21 849 809 A 107 TYR HD% A 103 LEU HDx% 1.0 1.8 4.84 850 809 A 107 TYR HD% A 103 LEU HDy% 1.0 1.8 4.84 851 810 A 107 TYR HE% A 103 LEU HDx% 1.0 1.8 4.98 852 810 A 107 TYR HE% A 103 LEU HDy% 1.0 1.8 4.98 853 811 A 103 LEU HDx% A 108 LYS HBy 1.0 1.8 5.33 854 811 A 103 LEU HDy% A 108 LYS HBy 1.0 1.8 5.33 855 811 A 108 LYS HBx A 103 LEU HDx% 1.0 1.8 5.33 856 811 A 103 LEU HDy% A 108 LYS HBx 1.0 1.8 5.33 857 812 A 103 LEU HDx% A 108 LYS HDx 1.0 1.8 4.97 858 812 A 103 LEU HDy% A 108 LYS HDx 1.0 1.8 4.97 859 812 A 108 LYS HDy A 103 LEU HDx% 1.0 1.8 4.97 860 812 A 103 LEU HDy% A 108 LYS HDy 1.0 1.8 4.97 861 813 A 103 LEU HDy% A 108 LYS HEx 1.0 1.8 4.14 862 813 A 103 LEU HDx% A 108 LYS HEx 1.0 1.8 4.14 863 813 A 108 LYS HEy A 103 LEU HDx% 1.0 1.8 4.14 864 813 A 103 LEU HDy% A 108 LYS HEy 1.0 1.8 4.14 865 814 A 122 ALA H A 103 LEU HDx% 1.0 1.8 5.36 866 814 A 122 ALA H A 103 LEU HDy% 1.0 1.8 5.36 867 815 A 122 ALA HA A 103 LEU HDx% 1.0 1.8 5.98 868 815 A 122 ALA HA A 103 LEU HDy% 1.0 1.8 5.98 869 816 A 122 ALA HB% A 103 LEU HDx% 1.0 1.8 3.44 870 816 A 122 ALA HB% A 103 LEU HDy% 1.0 1.8 3.44 871 817 A 123 HIS HA A 103 LEU HDx% 1.0 1.8 4.93 872 817 A 123 HIS HA A 103 LEU HDy% 1.0 1.8 4.93 873 818 A 103 LEU HDx% A 124 GLY HAx 1.0 1.8 4.30 874 818 A 103 LEU HDy% A 124 GLY HAx 1.0 1.8 4.30 875 818 A 124 GLY HAy A 103 LEU HDx% 1.0 1.8 4.30 876 818 A 103 LEU HDy% A 124 GLY HAy 1.0 1.8 4.30 877 819 A 125 VAL H A 103 LEU HDx% 1.0 1.8 5.30 878 819 A 125 VAL H A 103 LEU HDy% 1.0 1.8 5.30 879 820 A 125 VAL HA A 103 LEU HDx% 1.0 1.8 3.75 880 820 A 125 VAL HA A 103 LEU HDy% 1.0 1.8 3.75 881 821 A 103 LEU HDx% A 128 LEU HBy 1.0 1.8 4.21 882 821 A 103 LEU HDy% A 128 LEU HBy 1.0 1.8 4.21 883 821 A 128 LEU HBx A 103 LEU HDx% 1.0 1.8 4.21 884 821 A 103 LEU HDy% A 128 LEU HBx 1.0 1.8 4.21 885 822 A 103 LEU HDy% A 128 LEU HDx% 1.0 1.8 2.80 886 822 A 103 LEU HDx% A 128 LEU HDx% 1.0 1.8 2.80 887 822 A 128 LEU HDy% A 103 LEU HDx% 1.0 1.8 2.80 888 822 A 128 LEU HDy% A 103 LEU HDy% 1.0 1.8 2.80 889 823 A 104 CYS HA A 105 ASP HBx 1.0 1.8 5.41 890 823 A 104 CYS HA A 105 ASP HBy 1.0 1.8 5.41 891 824 A 105 ASP H A 105 ASP HBx 1.0 1.8 3.66 892 824 A 105 ASP H A 105 ASP HBy 1.0 1.8 3.66 893 825 A 105 ASP HA A 108 LYS HBy 1.0 1.8 3.86 894 825 A 105 ASP HA A 108 LYS HBx 1.0 1.8 3.86 895 826 A 105 ASP HA A 108 LYS HGy 1.0 1.8 4.81 896 826 A 105 ASP HA A 108 LYS HGx 1.0 1.8 4.81 897 827 A 105 ASP HA A 108 LYS HEx 1.0 1.8 5.05 898 827 A 105 ASP HA A 108 LYS HEy 1.0 1.8 5.05 899 828 A 106 ALA H A 109 ARG HBy 1.0 1.8 5.87 900 828 A 106 ALA H A 109 ARG HBx 1.0 1.8 5.87 901 829 A 106 ALA HA A 109 ARG HBy 1.0 1.8 4.22 902 829 A 106 ALA HA A 109 ARG HBx 1.0 1.8 4.22 903 830 A 106 ALA HB% A 109 ARG HBy 1.0 1.8 5.19 904 830 A 106 ALA HB% A 109 ARG HBx 1.0 1.8 5.19 905 831 A 108 LYS H A 107 TYR HBy 1.0 1.8 4.03 906 831 A 108 LYS H A 107 TYR HBx 1.0 1.8 4.03 907 832 A 111 GLN H A 107 TYR HBy 1.0 1.8 5.19 908 832 A 111 GLN H A 107 TYR HBx 1.0 1.8 5.19 909 833 A 123 HIS HA A 107 TYR HBy 1.0 1.8 5.16 910 833 A 123 HIS HA A 107 TYR HBx 1.0 1.8 5.16 911 834 A 107 TYR HE% A 108 LYS HBy 1.0 1.8 5.87 912 834 A 107 TYR HE% A 108 LYS HBx 1.0 1.8 5.87 913 835 A 107 TYR HE% A 124 GLY HAx 1.0 1.8 4.62 914 835 A 107 TYR HE% A 124 GLY HAy 1.0 1.8 4.62 915 836 A 108 LYS H A 108 LYS HBy 1.0 1.8 2.90 916 836 A 108 LYS H A 108 LYS HBx 1.0 1.8 2.90 917 837 A 108 LYS H A 108 LYS HGy 1.0 1.8 3.47 918 837 A 108 LYS H A 108 LYS HGx 1.0 1.8 3.47 919 838 A 108 LYS H A 108 LYS HDx 1.0 1.8 5.29 920 838 A 108 LYS H A 108 LYS HDy 1.0 1.8 5.29 921 839 A 108 LYS HA A 108 LYS HDx 1.0 1.8 5.13 922 839 A 108 LYS HA A 108 LYS HDy 1.0 1.8 5.13 923 840 A 108 LYS HBy A 108 LYS HDx 1.0 1.8 3.53 924 840 A 108 LYS HBx A 108 LYS HDx 1.0 1.8 3.53 925 840 A 108 LYS HDy A 108 LYS HBy 1.0 1.8 3.53 926 840 A 108 LYS HBx A 108 LYS HDy 1.0 1.8 3.53 927 841 A 108 LYS HBx A 108 LYS HEx 1.0 1.8 4.29 928 841 A 108 LYS HBy A 108 LYS HEx 1.0 1.8 4.29 929 841 A 108 LYS HEy A 108 LYS HBy 1.0 1.8 4.29 930 841 A 108 LYS HBx A 108 LYS HEy 1.0 1.8 4.29 931 842 A 109 ARG H A 108 LYS HBy 1.0 1.8 4.20 932 842 A 109 ARG H A 108 LYS HBx 1.0 1.8 4.20 933 843 A 109 ARG H A 109 ARG HBy 1.0 1.8 3.34 934 843 A 109 ARG H A 109 ARG HBx 1.0 1.8 3.34 935 844 A 109 ARG H A 109 ARG HGy 1.0 1.8 3.72 936 844 A 109 ARG H A 109 ARG HGx 1.0 1.8 3.72 937 845 A 109 ARG H A 109 ARG HDx 1.0 1.8 5.80 938 845 A 109 ARG H A 109 ARG HDy 1.0 1.8 5.80 939 846 A 109 ARG HA A 109 ARG HGy 1.0 1.8 3.85 940 846 A 109 ARG HA A 109 ARG HGx 1.0 1.8 3.85 941 847 A 109 ARG HBy A 109 ARG HDx 1.0 1.8 3.60 942 847 A 109 ARG HBx A 109 ARG HDx 1.0 1.8 3.60 943 847 A 109 ARG HDy A 109 ARG HBy 1.0 1.8 3.60 944 847 A 109 ARG HBx A 109 ARG HDy 1.0 1.8 3.60 945 848 A 110 SER H A 109 ARG HBy 1.0 1.8 3.86 946 848 A 110 SER H A 109 ARG HBx 1.0 1.8 3.86 947 849 A 110 SER H A 110 SER HBx 1.0 1.8 3.62 948 849 A 110 SER H A 110 SER HBy 1.0 1.8 3.62 949 850 A 111 GLN H A 110 SER HBx 1.0 1.8 4.46 950 850 A 111 GLN H A 110 SER HBy 1.0 1.8 4.46 951 851 A 115 TYR H A 114 SER HBy 1.0 1.8 4.92 952 851 A 115 TYR H A 114 SER HBx 1.0 1.8 4.92 953 852 A 115 TYR HA A 114 SER HBy 1.0 1.8 5.15 954 852 A 115 TYR HA A 114 SER HBx 1.0 1.8 5.15 955 853 A 115 TYR HD% A 114 SER HBy 1.0 1.8 5.20 956 853 A 115 TYR HD% A 114 SER HBx 1.0 1.8 5.20 957 854 A 115 TYR H A 115 TYR HBy 1.0 1.8 3.42 958 854 A 115 TYR H A 115 TYR HBx 1.0 1.8 3.42 959 855 A 118 GLN H A 115 TYR HBy 1.0 1.8 4.44 960 855 A 118 GLN H A 115 TYR HBx 1.0 1.8 4.44 961 856 A 118 GLN HBy A 115 TYR HBy 1.0 1.8 5.18 962 856 A 118 GLN HBy A 115 TYR HBx 1.0 1.8 5.18 963 857 A 118 GLN HBx A 115 TYR HBy 1.0 1.8 5.20 964 857 A 118 GLN HBx A 115 TYR HBx 1.0 1.8 5.20 965 858 A 119 CYS H A 115 TYR HBy 1.0 1.8 3.54 966 858 A 119 CYS H A 115 TYR HBx 1.0 1.8 3.54 967 859 A 119 CYS HA A 115 TYR HBy 1.0 1.8 3.53 968 859 A 119 CYS HA A 115 TYR HBx 1.0 1.8 3.53 969 860 A 119 CYS HBy A 115 TYR HBy 1.0 1.8 4.61 970 860 A 119 CYS HBy A 115 TYR HBx 1.0 1.8 4.61 971 861 A 116 GLY HAy A 117 ASP HBy 1.0 1.8 5.87 972 861 A 116 GLY HAy A 117 ASP HBx 1.0 1.8 5.87 973 862 A 117 ASP H A 117 ASP HBy 1.0 1.8 4.05 974 862 A 117 ASP H A 117 ASP HBx 1.0 1.8 4.05 975 863 A 118 GLN H A 117 ASP HBy 1.0 1.8 4.20 976 863 A 118 GLN H A 117 ASP HBx 1.0 1.8 4.20 977 864 A 118 GLN HA A 118 GLN HGx 1.0 1.8 3.51 978 864 A 118 GLN HA A 118 GLN HGy 1.0 1.8 3.51 979 865 A 119 CYS HA A 120 ARG HGx 1.0 1.8 5.87 980 865 A 119 CYS HA A 120 ARG HGy 1.0 1.8 5.87 981 866 A 120 ARG H A 120 ARG HDx 1.0 1.8 5.21 982 866 A 120 ARG H A 120 ARG HDy 1.0 1.8 5.21 983 867 A 120 ARG HBx A 120 ARG HDx 1.0 1.8 4.07 984 867 A 120 ARG HBx A 120 ARG HDy 1.0 1.8 4.07 985 868 A 121 PHE H A 120 ARG HGx 1.0 1.8 4.77 986 868 A 121 PHE H A 120 ARG HGy 1.0 1.8 4.77 987 869 A 121 PHE H A 120 ARG HDx 1.0 1.8 5.87 988 869 A 121 PHE H A 120 ARG HDy 1.0 1.8 5.87 989 870 A 121 PHE HD% A 120 ARG HDx 1.0 1.8 5.87 990 870 A 121 PHE HD% A 120 ARG HDy 1.0 1.8 5.87 991 871 A 122 ALA H A 128 LEU HDx% 1.0 1.8 5.19 992 871 A 122 ALA H A 128 LEU HDy% 1.0 1.8 5.19 993 872 A 122 ALA HA A 127 GLU HBy 1.0 1.8 4.50 994 872 A 122 ALA HA A 127 GLU HBx 1.0 1.8 4.50 995 873 A 122 ALA HB% A 127 GLU HBy 1.0 1.8 3.43 996 873 A 122 ALA HB% A 127 GLU HBx 1.0 1.8 3.43 997 874 A 122 ALA HB% A 128 LEU HDx% 1.0 1.8 3.86 998 874 A 122 ALA HB% A 128 LEU HDy% 1.0 1.8 3.86 999 875 A 122 ALA HB% A 129 ARG HDy 1.0 1.8 5.87 1000 875 A 122 ALA HB% A 129 ARG HDx 1.0 1.8 5.87 1001 876 A 123 HIS H A 127 GLU HGy 1.0 1.8 5.40 1002 876 A 123 HIS H A 127 GLU HGx 1.0 1.8 5.40 1003 877 A 124 GLY HAx A 125 VAL HGy% 1.0 1.8 4.81 1004 877 A 125 VAL HGx% A 124 GLY HAx 1.0 1.8 4.81 1005 877 A 124 GLY HAy A 125 VAL HGx% 1.0 1.8 4.81 1006 877 A 124 GLY HAy A 125 VAL HGy% 1.0 1.8 4.81 1007 878 A 126 HIS H A 124 GLY HAx 1.0 1.8 5.75 1008 878 A 126 HIS H A 124 GLY HAy 1.0 1.8 5.75 1009 879 A 126 HIS HE1 A 124 GLY HAx 1.0 1.8 4.76 1010 879 A 124 GLY HAy A 126 HIS HE1 1.0 1.8 4.76 1011 880 A 125 VAL H A 125 VAL HGy% 1.0 1.8 3.47 1012 880 A 125 VAL H A 125 VAL HGx% 1.0 1.8 3.47 1013 881 A 125 VAL H A 128 LEU HDx% 1.0 1.8 5.47 1014 881 A 125 VAL H A 128 LEU HDy% 1.0 1.8 5.47 1015 882 A 125 VAL HA A 128 LEU HBy 1.0 1.8 4.55 1016 882 A 125 VAL HA A 128 LEU HBx 1.0 1.8 4.55 1017 883 A 125 VAL HA A 128 LEU HDx% 1.0 1.8 3.76 1018 883 A 125 VAL HA A 128 LEU HDy% 1.0 1.8 3.76 1019 884 A 125 VAL HB A 128 LEU HDx% 1.0 1.8 5.15 1020 884 A 125 VAL HB A 128 LEU HDy% 1.0 1.8 5.15 1021 885 A 126 HIS H A 125 VAL HGy% 1.0 1.8 5.22 1022 885 A 126 HIS H A 125 VAL HGx% 1.0 1.8 5.22 1023 886 A 125 VAL HGx% A 128 LEU HBy 1.0 1.8 5.69 1024 886 A 125 VAL HGy% A 128 LEU HBy 1.0 1.8 5.69 1025 886 A 128 LEU HBx A 125 VAL HGy% 1.0 1.8 5.69 1026 886 A 128 LEU HBx A 125 VAL HGx% 1.0 1.8 5.69 1027 887 A 125 VAL HGx% A 128 LEU HDx% 1.0 1.8 3.00 1028 887 A 125 VAL HGy% A 128 LEU HDx% 1.0 1.8 3.00 1029 887 A 128 LEU HDy% A 125 VAL HGy% 1.0 1.8 3.00 1030 887 A 128 LEU HDy% A 125 VAL HGx% 1.0 1.8 3.00 1031 888 A 126 HIS HD2 A 126 HIS HBy 1.0 1.8 3.83 1032 888 A 126 HIS HBx A 126 HIS HD2 1.0 1.8 3.83 1033 889 A 127 GLU H A 127 GLU HBy 1.0 1.8 3.67 1034 889 A 127 GLU H A 127 GLU HBx 1.0 1.8 3.67 1035 890 A 127 GLU H A 127 GLU HGy 1.0 1.8 4.15 1036 890 A 127 GLU H A 127 GLU HGx 1.0 1.8 4.15 1037 891 A 127 GLU HA A 127 GLU HGy 1.0 1.8 3.44 1038 891 A 127 GLU HA A 127 GLU HGx 1.0 1.8 3.44 1039 892 A 128 LEU H A 128 LEU HBy 1.0 1.8 3.22 1040 892 A 128 LEU H A 128 LEU HBx 1.0 1.8 3.22 1041 893 A 128 LEU H A 128 LEU HDx% 1.0 1.8 4.16 1042 893 A 128 LEU H A 128 LEU HDy% 1.0 1.8 4.16 1043 894 A 128 LEU H A 129 ARG HDy 1.0 1.8 5.05 1044 894 A 128 LEU H A 129 ARG HDx 1.0 1.8 5.05 1045 895 A 128 LEU HA A 128 LEU HDx% 1.0 1.8 3.39 1046 895 A 128 LEU HA A 128 LEU HDy% 1.0 1.8 3.39 1047 896 A 128 LEU HBy A 128 LEU HDx% 1.0 1.8 2.92 1048 896 A 128 LEU HBx A 128 LEU HDx% 1.0 1.8 2.92 1049 896 A 128 LEU HDy% A 128 LEU HBy 1.0 1.8 2.92 1050 896 A 128 LEU HDy% A 128 LEU HBx 1.0 1.8 2.92 1051 897 A 129 ARG H A 128 LEU HBy 1.0 1.8 4.07 1052 897 A 129 ARG H A 128 LEU HBx 1.0 1.8 4.07 1053 898 A 129 ARG H A 128 LEU HDx% 1.0 1.8 4.09 1054 898 A 129 ARG H A 128 LEU HDy% 1.0 1.8 4.09 1055 899 A 129 ARG H A 129 ARG HGx 1.0 1.8 4.76 1056 899 A 129 ARG H A 129 ARG HGy 1.0 1.8 4.76 1057 900 A 129 ARG H A 129 ARG HDy 1.0 1.8 4.93 1058 900 A 129 ARG H A 129 ARG HDx 1.0 1.8 4.93 1059 901 A 129 ARG HA A 129 ARG HGx 1.0 1.8 4.04 1060 901 A 129 ARG HA A 129 ARG HGy 1.0 1.8 4.04 1061 902 A 129 ARG HA A 129 ARG HDy 1.0 1.8 4.41 1062 902 A 129 ARG HA A 129 ARG HDx 1.0 1.8 4.41 1063 903 A 130 LEU H A 129 ARG HGx 1.0 1.8 5.62 1064 903 A 130 LEU H A 129 ARG HGy 1.0 1.8 5.62 1065 904 A 130 LEU HA A 131 PRO HGy 1.0 1.8 4.68 1066 904 A 130 LEU HA A 131 PRO HGx 1.0 1.8 4.68 1067 905 A 132 MET H A 131 PRO HBy 1.0 1.8 4.48 1068 905 A 132 MET H A 131 PRO HBx 1.0 1.8 4.48 1069 906 A 132 MET H A 132 MET HBy 1.0 1.8 3.78 1070 906 A 132 MET H A 132 MET HBx 1.0 1.8 3.78 1071 907 A 132 MET H A 132 MET HGy 1.0 1.8 5.13 1072 907 A 132 MET H A 132 MET HGx 1.0 1.8 5.13 1073 908 A 133 ASN H A 132 MET HBy 1.0 1.8 4.77 1074 908 A 133 ASN H A 132 MET HBx 1.0 1.8 4.77 1075 909 A 133 ASN HA A 134 PRO HGy 1.0 1.8 5.17 1076 909 A 133 ASN HA A 134 PRO HGx 1.0 1.8 5.17 1077 910 A 133 ASN HBx A 134 PRO HDx 1.0 1.8 3.89 1078 910 A 134 PRO HDy A 133 ASN HBx 1.0 1.8 3.89 1079 910 A 133 ASN HBy A 134 PRO HDy 1.0 1.8 3.89 1080 910 A 133 ASN HBy A 134 PRO HDx 1.0 1.8 3.89 1081 911 A 135 ARG H A 135 ARG HBy 1.0 1.8 3.67 1082 911 A 135 ARG H A 135 ARG HBx 1.0 1.8 3.67 1083 912 A 135 ARG HA A 135 ARG HDy 1.0 1.8 5.30 1084 912 A 135 ARG HA A 135 ARG HDx 1.0 1.8 5.30 1085 913 A 135 ARG HBy A 135 ARG HDy 1.0 1.8 3.66 1086 913 A 135 ARG HBx A 135 ARG HDy 1.0 1.8 3.66 1087 913 A 135 ARG HDx A 135 ARG HBy 1.0 1.8 3.66 1088 913 A 135 ARG HBx A 135 ARG HDx 1.0 1.8 3.66 1089 914 A 137 ARG HA A 137 ARG HGy 1.0 1.8 4.08 1090 914 A 137 ARG HA A 137 ARG HGx 1.0 1.8 4.08 1091 915 A 137 ARG HA A 137 ARG HDx 1.0 1.8 4.64 1092 915 A 137 ARG HA A 137 ARG HDy 1.0 1.8 4.64 1093 916 A 137 ARG HBx A 137 ARG HDx 1.0 1.8 3.66 1094 916 A 137 ARG HBy A 137 ARG HDx 1.0 1.8 3.66 1095 916 A 137 ARG HDy A 137 ARG HBy 1.0 1.8 3.66 1096 916 A 137 ARG HDy A 137 ARG HBx 1.0 1.8 3.66 1097 917 A 139 HIS HBy A 140 PRO HDy 1.0 1.8 4.32 1098 917 A 140 PRO HDx A 139 HIS HBx 1.0 1.8 4.32 1099 917 A 139 HIS HBy A 140 PRO HDx 1.0 1.8 4.32 1100 917 A 139 HIS HBx A 140 PRO HDy 1.0 1.8 4.32 1101 918 A 139 HIS HE1 A 141 LYS HBy 1.0 1.8 4.42 1102 918 A 139 HIS HE1 A 141 LYS HBx 1.0 1.8 4.42 1103 919 A 141 LYS HA A 141 LYS HGy 1.0 1.8 3.76 1104 919 A 141 LYS HA A 141 LYS HGx 1.0 1.8 3.76 1105 920 A 144 THR HA A 141 LYS HBy 1.0 1.8 5.56 1106 920 A 144 THR HA A 141 LYS HBx 1.0 1.8 5.56 1107 921 A 144 THR HG2% A 141 LYS HBy 1.0 1.8 3.97 1108 921 A 144 THR HG2% A 141 LYS HBx 1.0 1.8 3.97 1109 922 A 142 TYR H A 142 TYR HBy 1.0 1.8 4.05 1110 922 A 142 TYR H A 142 TYR HBx 1.0 1.8 4.05 1111 923 A 142 TYR HD% A 143 LYS HGy 1.0 1.8 5.12 1112 923 A 142 TYR HD% A 143 LYS HGx 1.0 1.8 5.12 1113 924 A 142 TYR HD% A 163 GLN HBy 1.0 1.8 5.18 1114 924 A 142 TYR HD% A 163 GLN HBx 1.0 1.8 5.18 1115 925 A 142 TYR HE% A 143 LYS HGy 1.0 1.8 5.17 1116 925 A 142 TYR HE% A 143 LYS HGx 1.0 1.8 5.17 1117 926 A 142 TYR HE% A 143 LYS HEy 1.0 1.8 4.75 1118 926 A 142 TYR HE% A 143 LYS HEx 1.0 1.8 4.75 1119 927 A 142 TYR HE% A 163 GLN HBy 1.0 1.8 4.70 1120 927 A 142 TYR HE% A 163 GLN HBx 1.0 1.8 4.70 1121 928 A 143 LYS H A 143 LYS HBx 1.0 1.8 3.90 1122 928 A 143 LYS H A 143 LYS HBy 1.0 1.8 3.90 1123 929 A 143 LYS H A 143 LYS HGy 1.0 1.8 5.13 1124 929 A 143 LYS H A 143 LYS HGx 1.0 1.8 5.13 1125 930 A 143 LYS H A 143 LYS HDx 1.0 1.8 5.73 1126 930 A 143 LYS H A 143 LYS HDy 1.0 1.8 5.73 1127 931 A 143 LYS HA A 143 LYS HDx 1.0 1.8 4.83 1128 931 A 143 LYS HA A 143 LYS HDy 1.0 1.8 4.83 1129 932 A 143 LYS HBx A 143 LYS HDx 1.0 1.8 3.15 1130 932 A 143 LYS HBy A 143 LYS HDx 1.0 1.8 3.15 1131 932 A 143 LYS HDy A 143 LYS HBx 1.0 1.8 3.15 1132 932 A 143 LYS HBy A 143 LYS HDy 1.0 1.8 3.15 1133 933 A 143 LYS HBy A 143 LYS HEy 1.0 1.8 4.80 1134 933 A 143 LYS HEx A 143 LYS HBx 1.0 1.8 4.80 1135 933 A 143 LYS HEx A 143 LYS HBy 1.0 1.8 4.80 1136 933 A 143 LYS HBx A 143 LYS HEy 1.0 1.8 4.80 1137 934 A 145 VAL H A 143 LYS HBx 1.0 1.8 5.87 1138 934 A 145 VAL H A 143 LYS HBy 1.0 1.8 5.87 1139 935 A 143 LYS HBx A 165 ILE HG1y 1.0 1.8 4.22 1140 935 A 143 LYS HBy A 165 ILE HG1y 1.0 1.8 4.22 1141 935 A 165 ILE HG1x A 143 LYS HBx 1.0 1.8 4.22 1142 935 A 143 LYS HBy A 165 ILE HG1x 1.0 1.8 4.22 1143 936 A 165 ILE HA A 143 LYS HDx 1.0 1.8 4.55 1144 936 A 165 ILE HA A 143 LYS HDy 1.0 1.8 4.55 1145 937 A 144 THR HA A 165 ILE HG1y 1.0 1.8 5.73 1146 937 A 144 THR HA A 165 ILE HG1x 1.0 1.8 5.73 1147 938 A 145 VAL H A 165 ILE HG1y 1.0 1.8 4.87 1148 938 A 145 VAL H A 165 ILE HG1x 1.0 1.8 4.87 1149 939 A 145 VAL HA A 165 ILE HG1y 1.0 1.8 5.86 1150 939 A 145 VAL HA A 165 ILE HG1x 1.0 1.8 5.86 1151 940 A 145 VAL HGx% A 146 LEU HBx 1.0 1.8 5.37 1152 940 A 145 VAL HGx% A 146 LEU HBy 1.0 1.8 5.37 1153 941 A 146 LEU H A 146 LEU HBx 1.0 1.8 3.69 1154 941 A 146 LEU H A 146 LEU HBy 1.0 1.8 3.69 1155 942 A 146 LEU HA A 164 PHE HBx 1.0 1.8 5.02 1156 942 A 146 LEU HA A 164 PHE HBy 1.0 1.8 5.02 1157 943 A 146 LEU HA A 165 ILE HG1y 1.0 1.8 5.22 1158 943 A 146 LEU HA A 165 ILE HG1x 1.0 1.8 5.22 1159 944 A 146 LEU HDx% A 146 LEU HBx 1.0 1.8 3.28 1160 944 A 146 LEU HDx% A 146 LEU HBy 1.0 1.8 3.28 1161 945 A 146 LEU HDy% A 146 LEU HBx 1.0 1.8 3.60 1162 945 A 146 LEU HDy% A 146 LEU HBy 1.0 1.8 3.60 1163 946 A 147 CYS H A 146 LEU HBx 1.0 1.8 3.99 1164 946 A 147 CYS H A 146 LEU HBy 1.0 1.8 3.99 1165 947 A 146 LEU HDx% A 167 LYS HGy 1.0 1.8 4.91 1166 947 A 146 LEU HDx% A 167 LYS HGx 1.0 1.8 4.91 1167 948 A 146 LEU HDy% A 167 LYS HGy 1.0 1.8 4.25 1168 948 A 146 LEU HDy% A 167 LYS HGx 1.0 1.8 4.25 1169 949 A 146 LEU HDy% A 167 LYS HEx 1.0 1.8 5.17 1170 949 A 146 LEU HDy% A 167 LYS HEy 1.0 1.8 5.17 1171 950 A 147 CYS H A 164 PHE HBx 1.0 1.8 4.40 1172 950 A 147 CYS H A 164 PHE HBy 1.0 1.8 4.40 1173 951 A 147 CYS HA A 148 ASP HBy 1.0 1.8 5.50 1174 951 A 147 CYS HA A 148 ASP HBx 1.0 1.8 5.50 1175 952 A 147 CYS HA A 164 PHE HBx 1.0 1.8 3.76 1176 952 A 147 CYS HA A 164 PHE HBy 1.0 1.8 3.76 1177 953 A 147 CYS HBy A 164 PHE HBx 1.0 1.8 4.15 1178 953 A 147 CYS HBy A 164 PHE HBy 1.0 1.8 4.15 1179 954 A 148 ASP H A 148 ASP HBy 1.0 1.8 3.96 1180 954 A 148 ASP H A 148 ASP HBx 1.0 1.8 3.96 1181 955 A 148 ASP HA A 151 SER HBy 1.0 1.8 4.18 1182 955 A 148 ASP HA A 151 SER HBx 1.0 1.8 4.18 1183 956 A 149 LYS H A 148 ASP HBy 1.0 1.8 3.48 1184 956 A 149 LYS H A 148 ASP HBx 1.0 1.8 3.48 1185 957 A 148 ASP HBx A 149 LYS HGy 1.0 1.8 5.70 1186 957 A 148 ASP HBy A 149 LYS HGy 1.0 1.8 5.70 1187 957 A 149 LYS HGx A 148 ASP HBy 1.0 1.8 5.70 1188 957 A 148 ASP HBx A 149 LYS HGx 1.0 1.8 5.70 1189 958 A 150 PHE H A 148 ASP HBy 1.0 1.8 5.38 1190 958 A 150 PHE H A 148 ASP HBx 1.0 1.8 5.38 1191 959 A 152 MET HE% A 148 ASP HBy 1.0 1.8 4.84 1192 959 A 152 MET HE% A 148 ASP HBx 1.0 1.8 4.84 1193 960 A 149 LYS H A 149 LYS HGy 1.0 1.8 3.51 1194 960 A 149 LYS H A 149 LYS HGx 1.0 1.8 3.51 1195 961 A 149 LYS HA A 149 LYS HDy 1.0 1.8 4.58 1196 961 A 149 LYS HA A 149 LYS HDx 1.0 1.8 4.58 1197 962 A 149 LYS HA A 152 MET HBx 1.0 1.8 4.46 1198 962 A 149 LYS HA A 152 MET HBy 1.0 1.8 4.46 1199 963 A 149 LYS HEx A 149 LYS HGy 1.0 1.8 3.65 1200 963 A 149 LYS HEy A 149 LYS HGy 1.0 1.8 3.65 1201 963 A 149 LYS HGx A 149 LYS HEx 1.0 1.8 3.65 1202 963 A 149 LYS HGx A 149 LYS HEy 1.0 1.8 3.65 1203 964 A 153 THR HG2% A 149 LYS HDy 1.0 1.8 4.31 1204 964 A 153 THR HG2% A 149 LYS HDx 1.0 1.8 4.31 1205 965 A 150 PHE HBy A 166 HIS HBy 1.0 1.8 5.67 1206 965 A 150 PHE HBy A 166 HIS HBx 1.0 1.8 5.67 1207 966 A 151 SER H A 151 SER HBy 1.0 1.8 3.45 1208 966 A 151 SER H A 151 SER HBx 1.0 1.8 3.45 1209 967 A 152 MET H A 151 SER HBy 1.0 1.8 4.20 1210 967 A 152 MET H A 151 SER HBx 1.0 1.8 4.20 1211 968 A 169 VAL HGy% A 151 SER HBy 1.0 1.8 4.52 1212 968 A 169 VAL HGy% A 151 SER HBx 1.0 1.8 4.52 1213 969 A 152 MET H A 152 MET HBx 1.0 1.8 3.53 1214 969 A 152 MET H A 152 MET HBy 1.0 1.8 3.53 1215 970 A 152 MET HA A 152 MET HGx 1.0 1.8 3.85 1216 970 A 152 MET HA A 152 MET HGy 1.0 1.8 3.85 1217 971 A 153 THR H A 154 GLY HAy 1.0 1.8 5.02 1218 971 A 153 THR H A 154 GLY HAx 1.0 1.8 5.02 1219 972 A 157 LYS HBx A 157 LYS HDx 1.0 1.8 3.59 1220 972 A 157 LYS HBy A 157 LYS HDx 1.0 1.8 3.59 1221 972 A 157 LYS HDy A 157 LYS HBx 1.0 1.8 3.59 1222 972 A 157 LYS HBy A 157 LYS HDy 1.0 1.8 3.59 1223 973 A 157 LYS HBx A 157 LYS HEy 1.0 1.8 5.09 1224 973 A 157 LYS HBy A 157 LYS HEy 1.0 1.8 5.09 1225 973 A 157 LYS HEx A 157 LYS HBx 1.0 1.8 5.09 1226 973 A 157 LYS HBy A 157 LYS HEx 1.0 1.8 5.09 1227 974 A 157 LYS HEy A 157 LYS HGx 1.0 1.8 3.67 1228 974 A 157 LYS HEx A 157 LYS HGx 1.0 1.8 3.67 1229 974 A 157 LYS HGy A 157 LYS HEy 1.0 1.8 3.67 1230 974 A 157 LYS HEx A 157 LYS HGy 1.0 1.8 3.67 1231 975 A 158 TYR HE% A 157 LYS HGx 1.0 1.8 5.12 1232 975 A 158 TYR HE% A 157 LYS HGy 1.0 1.8 5.12 1233 976 A 158 TYR H A 159 GLY HAy 1.0 1.8 5.69 1234 976 A 158 TYR H A 159 GLY HAx 1.0 1.8 5.69 1235 977 A 158 TYR HBx A 162 CYS HBx 1.0 1.8 5.24 1236 977 A 158 TYR HBx A 162 CYS HBy 1.0 1.8 5.24 1237 978 A 159 GLY H A 162 CYS HBx 1.0 1.8 3.86 1238 978 A 159 GLY H A 162 CYS HBy 1.0 1.8 3.86 1239 979 A 160 THR HG2% A 159 GLY HAy 1.0 1.8 4.95 1240 979 A 160 THR HG2% A 159 GLY HAx 1.0 1.8 4.95 1241 980 A 161 ARG H A 159 GLY HAy 1.0 1.8 4.93 1242 980 A 161 ARG H A 159 GLY HAx 1.0 1.8 4.93 1243 981 A 166 HIS HE1 A 159 GLY HAy 1.0 1.8 4.15 1244 981 A 166 HIS HE1 A 159 GLY HAx 1.0 1.8 4.15 1245 982 A 161 ARG H A 161 ARG HGx 1.0 1.8 3.36 1246 982 A 161 ARG H A 161 ARG HGy 1.0 1.8 3.36 1247 983 A 161 ARG HA A 161 ARG HGx 1.0 1.8 3.51 1248 983 A 161 ARG HA A 161 ARG HGy 1.0 1.8 3.51 1249 984 A 161 ARG HA A 161 ARG HDx 1.0 1.8 5.16 1250 984 A 161 ARG HA A 161 ARG HDy 1.0 1.8 5.16 1251 985 A 161 ARG HBy A 161 ARG HDx 1.0 1.8 4.06 1252 985 A 161 ARG HBy A 161 ARG HDy 1.0 1.8 4.06 1253 986 A 161 ARG HBx A 161 ARG HDx 1.0 1.8 4.09 1254 986 A 161 ARG HBx A 161 ARG HDy 1.0 1.8 4.09 1255 987 A 162 CYS H A 162 CYS HBx 1.0 1.8 3.04 1256 987 A 162 CYS H A 162 CYS HBy 1.0 1.8 3.04 1257 988 A 163 GLN H A 162 CYS HBx 1.0 1.8 4.84 1258 988 A 163 GLN H A 162 CYS HBy 1.0 1.8 4.84 1259 989 A 164 PHE H A 162 CYS HBx 1.0 1.8 4.42 1260 989 A 164 PHE H A 162 CYS HBy 1.0 1.8 4.42 1261 990 A 166 HIS HE1 A 162 CYS HBx 1.0 1.8 3.55 1262 990 A 166 HIS HE1 A 162 CYS HBy 1.0 1.8 3.55 1263 991 A 163 GLN H A 163 GLN HBy 1.0 1.8 3.52 1264 991 A 163 GLN H A 163 GLN HBx 1.0 1.8 3.52 1265 992 A 163 GLN H A 163 GLN HGy 1.0 1.8 3.81 1266 992 A 163 GLN H A 163 GLN HGx 1.0 1.8 3.81 1267 993 A 163 GLN H A 163 GLN HE2x 1.0 1.8 4.77 1268 993 A 163 GLN H A 163 GLN HE2y 1.0 1.8 4.77 1269 994 A 163 GLN HA A 163 GLN HGy 1.0 1.8 4.04 1270 994 A 163 GLN HA A 163 GLN HGx 1.0 1.8 4.04 1271 995 A 164 PHE H A 163 GLN HBy 1.0 1.8 4.65 1272 995 A 164 PHE H A 163 GLN HBx 1.0 1.8 4.65 1273 996 A 163 GLN HE2x A 163 GLN HGy 1.0 1.8 3.51 1274 996 A 163 GLN HE2y A 163 GLN HGy 1.0 1.8 3.51 1275 996 A 163 GLN HGx A 163 GLN HE2x 1.0 1.8 3.51 1276 996 A 163 GLN HGx A 163 GLN HE2y 1.0 1.8 3.51 1277 997 A 164 PHE H A 163 GLN HGy 1.0 1.8 4.85 1278 997 A 164 PHE H A 163 GLN HGx 1.0 1.8 4.85 1279 998 A 164 PHE H A 164 PHE HBx 1.0 1.8 3.50 1280 998 A 164 PHE H A 164 PHE HBy 1.0 1.8 3.50 1281 999 A 165 ILE H A 164 PHE HBx 1.0 1.8 3.92 1282 999 A 165 ILE H A 164 PHE HBy 1.0 1.8 3.92 1283 1000 A 165 ILE H A 165 ILE HG1y 1.0 1.8 3.70 1284 1000 A 165 ILE H A 165 ILE HG1x 1.0 1.8 3.70 1285 1001 A 165 ILE HA A 165 ILE HG1y 1.0 1.8 3.96 1286 1001 A 165 ILE HA A 165 ILE HG1x 1.0 1.8 3.96 1287 1002 A 165 ILE HG2% A 167 LYS HBx 1.0 1.8 4.19 1288 1002 A 165 ILE HG2% A 167 LYS HBy 1.0 1.8 4.19 1289 1003 A 165 ILE HG2% A 167 LYS HGy 1.0 1.8 4.19 1290 1003 A 165 ILE HG2% A 167 LYS HGx 1.0 1.8 4.19 1291 1004 A 165 ILE HG2% A 167 LYS HDx 1.0 1.8 5.15 1292 1004 A 165 ILE HG2% A 167 LYS HDy 1.0 1.8 5.15 1293 1005 A 165 ILE HG2% A 167 LYS HEx 1.0 1.8 5.16 1294 1005 A 165 ILE HG2% A 167 LYS HEy 1.0 1.8 5.16 1295 1006 A 166 HIS H A 165 ILE HG1y 1.0 1.8 5.31 1296 1006 A 166 HIS H A 165 ILE HG1x 1.0 1.8 5.31 1297 1007 A 167 LYS H A 167 LYS HGy 1.0 1.8 5.13 1298 1007 A 167 LYS H A 167 LYS HGx 1.0 1.8 5.13 1299 1008 A 167 LYS HA A 167 LYS HGy 1.0 1.8 3.89 1300 1008 A 167 LYS HA A 167 LYS HGx 1.0 1.8 3.89 1301 1009 A 167 LYS HA A 167 LYS HDx 1.0 1.8 5.25 1302 1009 A 167 LYS HA A 167 LYS HDy 1.0 1.8 5.25 1303 1010 A 168 ILE H A 167 LYS HBx 1.0 1.8 4.14 1304 1010 A 168 ILE H A 167 LYS HBy 1.0 1.8 4.14 1305 1011 A 168 ILE H A 167 LYS HGy 1.0 1.8 5.86 1306 1011 A 168 ILE H A 167 LYS HGx 1.0 1.8 5.86 1307 1012 A 168 ILE H A 168 ILE HG1x 1.0 1.8 3.59 1308 1012 A 168 ILE H A 168 ILE HG1y 1.0 1.8 3.59 1309 1013 A 168 ILE HA A 168 ILE HG1x 1.0 1.8 3.94 1310 1013 A 168 ILE HA A 168 ILE HG1y 1.0 1.8 3.94 1311 1014 A 168 ILE HG2% A 168 ILE HG1x 1.0 1.8 3.41 1312 1014 A 168 ILE HG2% A 168 ILE HG1y 1.0 1.8 3.41 1313 1015 A 169 VAL H A 168 ILE HG1x 1.0 1.8 5.10 1314 1015 A 169 VAL H A 168 ILE HG1y 1.0 1.8 5.10 1315 1016 A 169 VAL HGx% A 170 ASP HBx 1.0 1.8 4.83 1316 1016 A 169 VAL HGx% A 170 ASP HBy 1.0 1.8 4.83 1317 1017 A 169 VAL HGx% A 171 GLY HAy 1.0 1.8 5.05 1318 1017 A 169 VAL HGx% A 171 GLY HAx 1.0 1.8 5.05 1319 1018 A 170 ASP H A 170 ASP HBx 1.0 1.8 3.55 1320 1018 A 170 ASP H A 170 ASP HBy 1.0 1.8 3.55 1321 1019 A 171 GLY H A 170 ASP HBx 1.0 1.8 4.93 1322 1019 A 171 GLY H A 170 ASP HBy 1.0 1.8 4.93 1323 1020 A 173 ALA H A 172 ASN HBx 1.0 1.8 4.51 1324 1020 A 173 ALA H A 172 ASN HBy 1.0 1.8 4.51 stop_ save_ save_CNS/XPLOR_dihedral_2 _nef_dihedral_restraint_list.sf_category nef_dihedral_restraint_list _nef_dihedral_restraint_list.sf_framecode CNS/XPLOR_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 96 SER C A 97 ASP N A 97 ASP CA A 97 ASP C 1.0 -87.3 -46.0 PHI 2 2 A 97 ASP N A 97 ASP CA A 97 ASP C A 98 ALA N 1.0 116.4 169.0 PSI 3 3 A 101 THR C A 102 ALA N A 102 ALA CA A 102 ALA C 1.0 -161.2 -91.5 PHI 4 4 A 102 ALA N A 102 ALA CA A 102 ALA C A 103 LEU N 1.0 115.7 173.9 PSI 5 5 A 102 ALA C A 103 LEU N A 103 LEU CA A 103 LEU C 1.0 -96.1 -56.1 PHI 6 6 A 103 LEU N A 103 LEU CA A 103 LEU C A 104 CYS N 1.0 116.9 157.1 PSI 7 7 A 103 LEU C A 104 CYS N A 104 CYS CA A 104 CYS C 1.0 -100.4 -38.6 PHI 8 8 A 104 CYS N A 104 CYS CA A 104 CYS C A 105 ASP N 1.0 113.6 163.4 PSI 9 9 A 104 CYS C A 105 ASP N A 105 ASP CA A 105 ASP C 1.0 -79.1 -39.1 PHI 10 10 A 105 ASP N A 105 ASP CA A 105 ASP C A 106 ALA N 1.0 -56.6 -16.6 PSI 11 11 A 105 ASP C A 106 ALA N A 106 ALA CA A 106 ALA C 1.0 -84.9 -44.9 PHI 12 12 A 106 ALA N A 106 ALA CA A 106 ALA C A 107 TYR N 1.0 -60.3 -20.3 PSI 13 13 A 106 ALA C A 107 TYR N A 107 TYR CA A 107 TYR C 1.0 -85.8 -45.8 PHI 14 14 A 107 TYR N A 107 TYR CA A 107 TYR C A 108 LYS N 1.0 -62.4 -22.4 PSI 15 15 A 107 TYR C A 108 LYS N A 108 LYS CA A 108 LYS C 1.0 -84.5 -44.5 PHI 16 16 A 108 LYS N A 108 LYS CA A 108 LYS C A 109 ARG N 1.0 -57.3 -17.3 PSI 17 17 A 108 LYS C A 109 ARG N A 109 ARG CA A 109 ARG C 1.0 -90.5 -50.5 PHI 18 18 A 109 ARG N A 109 ARG CA A 109 ARG C A 110 SER N 1.0 -49.0 -9.0 PSI 19 19 A 109 ARG C A 110 SER N A 110 SER CA A 110 SER C 1.0 -111.6 -66.2 PHI 20 20 A 110 SER N A 110 SER CA A 110 SER C A 111 GLN N 1.0 -35.7 4.3 PSI 21 21 A 112 ALA C A 113 CYS N A 113 CYS CA A 113 CYS C 1.0 -119.6 -38.0 PHI 22 22 A 113 CYS N A 113 CYS CA A 113 CYS C A 114 SER N 1.0 127.5 172.5 PSI 23 23 A 113 CYS C A 114 SER N A 114 SER CA A 114 SER C 1.0 -83.1 -43.1 PHI 24 24 A 114 SER N A 114 SER CA A 114 SER C A 115 TYR N 1.0 -53.5 -13.5 PSI 25 25 A 114 SER C A 115 TYR N A 115 TYR CA A 115 TYR C 1.0 -92.9 -50.2 PHI 26 26 A 115 TYR N A 115 TYR CA A 115 TYR C A 116 GLY N 1.0 -61.1 0.5 PSI 27 27 A 116 GLY C A 117 ASP N A 117 ASP CA A 117 ASP C 1.0 -87.5 -47.5 PHI 28 28 A 117 ASP N A 117 ASP CA A 117 ASP C A 118 GLN N 1.0 -44.3 -4.1 PSI 29 29 A 117 ASP C A 118 GLN N A 118 GLN CA A 118 GLN C 1.0 -114.7 -74.5 PHI 30 30 A 118 GLN N A 118 GLN CA A 118 GLN C A 119 CYS N 1.0 -20.8 19.2 PSI 31 31 A 118 GLN C A 119 CYS N A 119 CYS CA A 119 CYS C 1.0 -85.8 -45.8 PHI 32 32 A 119 CYS N A 119 CYS CA A 119 CYS C A 120 ARG N 1.0 119.1 159.1 PSI 33 33 A 120 ARG C A 121 PHE N A 121 PHE CA A 121 PHE C 1.0 -132.2 -66.6 PHI 34 34 A 121 PHE N A 121 PHE CA A 121 PHE C A 122 ALA N 1.0 103.0 158.6 PSI 35 35 A 121 PHE C A 122 ALA N A 122 ALA CA A 122 ALA C 1.0 -127.6 -48.3 PHI 36 36 A 122 ALA N A 122 ALA CA A 122 ALA C A 123 HIS N 1.0 111.1 151.1 PSI 37 37 A 122 ALA C A 123 HIS N A 123 HIS CA A 123 HIS C 1.0 -127.1 -56.2 PHI 38 38 A 123 HIS N A 123 HIS CA A 123 HIS C A 124 GLY N 1.0 30.2 164.4 PSI 39 39 A 124 GLY C A 125 VAL N A 125 VAL CA A 125 VAL C 1.0 -82.8 -42.3 PHI 40 40 A 125 VAL N A 125 VAL CA A 125 VAL C A 126 HIS N 1.0 -52.0 -12.0 PSI 41 41 A 125 VAL C A 126 HIS N A 126 HIS CA A 126 HIS C 1.0 -88.7 -48.7 PHI 42 42 A 126 HIS N A 126 HIS CA A 126 HIS C A 127 GLU N 1.0 -41.7 -1.7 PSI 43 43 A 126 HIS C A 127 GLU N A 127 GLU CA A 127 GLU C 1.0 -114.2 -74.2 PHI 44 44 A 127 GLU N A 127 GLU CA A 127 GLU C A 128 LEU N 1.0 -24.1 16.5 PSI 45 45 A 127 GLU C A 128 LEU N A 128 LEU CA A 128 LEU C 1.0 -89.3 -49.3 PHI 46 46 A 128 LEU N A 128 LEU CA A 128 LEU C A 129 ARG N 1.0 114.7 154.7 PSI 47 47 A 144 THR C A 145 VAL N A 145 VAL CA A 145 VAL C 1.0 -141.3 -79.4 PHI 48 48 A 145 VAL N A 145 VAL CA A 145 VAL C A 146 LEU N 1.0 105.3 157.0 PSI 49 49 A 145 VAL C A 146 LEU N A 146 LEU CA A 146 LEU C 1.0 -92.3 -52.3 PHI 50 50 A 146 LEU N A 146 LEU CA A 146 LEU C A 147 CYS N 1.0 119.7 159.7 PSI 51 51 A 146 LEU C A 147 CYS N A 147 CYS CA A 147 CYS C 1.0 -106.2 -33.5 PHI 52 52 A 147 CYS N A 147 CYS CA A 147 CYS C A 148 ASP N 1.0 116.8 164.6 PSI 53 53 A 147 CYS C A 148 ASP N A 148 ASP CA A 148 ASP C 1.0 -79.4 -39.4 PHI 54 54 A 148 ASP N A 148 ASP CA A 148 ASP C A 149 LYS N 1.0 -55.5 -15.5 PSI 55 55 A 148 ASP C A 149 LYS N A 149 LYS CA A 149 LYS C 1.0 -84.7 -44.7 PHI 56 56 A 149 LYS N A 149 LYS CA A 149 LYS C A 150 PHE N 1.0 -57.3 -17.3 PSI 57 57 A 149 LYS C A 150 PHE N A 150 PHE CA A 150 PHE C 1.0 -87.5 -47.5 PHI 58 58 A 150 PHE N A 150 PHE CA A 150 PHE C A 151 SER N 1.0 -64.3 -24.3 PSI 59 59 A 150 PHE C A 151 SER N A 151 SER CA A 151 SER C 1.0 -86.0 -46.0 PHI 60 60 A 151 SER N A 151 SER CA A 151 SER C A 152 MET N 1.0 -51.8 -11.8 PSI 61 61 A 151 SER C A 152 MET N A 152 MET CA A 152 MET C 1.0 -108.0 -68.0 PHI 62 62 A 152 MET N A 152 MET CA A 152 MET C A 153 THR N 1.0 -52.0 -12.0 PSI 63 63 A 152 MET C A 153 THR N A 153 THR CA A 153 THR C 1.0 -138.3 -98.3 PHI 64 64 A 153 THR N A 153 THR CA A 153 THR C A 154 GLY N 1.0 -41.9 -1.9 PSI 65 65 A 154 GLY C A 155 ASN N A 155 ASN CA A 155 ASN C 1.0 -163.9 -66.6 PHI 66 66 A 155 ASN N A 155 ASN CA A 155 ASN C A 156 CYS N 1.0 126.9 180.2 PSI 67 67 A 155 ASN C A 156 CYS N A 156 CYS CA A 156 CYS C 1.0 -121.2 -42.2 PHI 68 68 A 156 CYS N A 156 CYS CA A 156 CYS C A 157 LYS N 1.0 123.4 173.8 PSI 69 69 A 156 CYS C A 157 LYS N A 157 LYS CA A 157 LYS C 1.0 -81.5 -41.5 PHI 70 70 A 157 LYS N A 157 LYS CA A 157 LYS C A 158 TYR N 1.0 -55.4 -15.4 PSI 71 71 A 157 LYS C A 158 TYR N A 158 TYR CA A 158 TYR C 1.0 -89.0 -49.0 PHI 72 72 A 158 TYR N A 158 TYR CA A 158 TYR C A 159 GLY N 1.0 -57.2 -13.3 PSI 73 73 A 159 GLY C A 160 THR N A 160 THR CA A 160 THR C 1.0 -90.4 -50.4 PHI 74 74 A 160 THR N A 160 THR CA A 160 THR C A 161 ARG N 1.0 -41.6 -1.6 PSI 75 75 A 160 THR C A 161 ARG N A 161 ARG CA A 161 ARG C 1.0 -113.9 -73.9 PHI 76 76 A 161 ARG N A 161 ARG CA A 161 ARG C A 162 CYS N 1.0 -27.6 12.4 PSI 77 77 A 161 ARG C A 162 CYS N A 162 CYS CA A 162 CYS C 1.0 -87.9 -47.9 PHI 78 78 A 162 CYS N A 162 CYS CA A 162 CYS C A 163 GLN N 1.0 118.6 158.6 PSI 79 79 A 163 GLN C A 164 PHE N A 164 PHE CA A 164 PHE C 1.0 -128.7 -73.7 PHI 80 80 A 164 PHE N A 164 PHE CA A 164 PHE C A 165 ILE N 1.0 104.5 147.7 PSI 81 81 A 165 ILE C A 166 HIS N A 166 HIS CA A 166 HIS C 1.0 -115.7 -67.2 PHI 82 82 A 166 HIS N A 166 HIS CA A 166 HIS C A 167 LYS N 1.0 95.6 146.9 PSI 83 83 A 166 HIS C A 167 LYS N A 167 LYS CA A 167 LYS C 1.0 -117.4 -72.8 PHI 84 84 A 167 LYS N A 167 LYS CA A 167 LYS C A 168 ILE N 1.0 96.4 153.1 PSI 85 85 A 167 LYS C A 168 ILE N A 168 ILE CA A 168 ILE C 1.0 -121.5 -68.0 PHI 86 86 A 168 ILE N A 168 ILE CA A 168 ILE C A 169 VAL N 1.0 98.9 139.0 PSI 87 87 A 168 ILE C A 169 VAL N A 169 VAL CA A 169 VAL C 1.0 -116.1 -44.9 PHI 88 88 A 169 VAL N A 169 VAL CA A 169 VAL C A 170 ASP N 1.0 110.3 159.2 PSI 89 89 A 113 CYS N A 113 CYS CA A 113 CYS CB A 113 CYS SG 1.0 -200.0 -150.0 CHI1 90 90 A 113 CYS N A 113 CYS CA A 113 CYS CB A 113 CYS SG 1.0 -200.0 -150.0 CHI1 91 91 A 147 CYS N A 147 CYS CA A 147 CYS CB A 147 CYS SG 1.0 -200.0 -150.0 CHI1 92 92 A 147 CYS N A 147 CYS CA A 147 CYS CB A 147 CYS SG 1.0 -193.5 -165.1 CHI1 93 93 A 147 CYS N A 147 CYS CA A 147 CYS CB A 147 CYS SG 1.0 -200.0 -150.0 CHI1 94 94 A 101 THR N A 101 THR CA A 101 THR CB A 101 THR OG1 1.0 34.1 73.7 CHI1 95 95 A 104 CYS N A 104 CYS CA A 104 CYS CB A 104 CYS SG 1.0 165.4 193.0 CHI1 96 96 A 117 ASP N A 117 ASP CA A 117 ASP CB A 117 ASP CG 1.0 -92.3 -55.9 CHI1 97 97 A 118 GLN N A 118 GLN CA A 118 GLN CB A 118 GLN CG 1.0 -77.9 -42.3 CHI1 98 98 A 121 PHE N A 121 PHE CA A 121 PHE CB A 121 PHE CG 1.0 -81.6 -44.0 CHI1 99 99 A 145 VAL N A 145 VAL CA A 145 VAL CB A 145 VAL CG1 1.0 -185.4 -168.6 CHI1 100 100 A 150 PHE N A 150 PHE CA A 150 PHE CB A 150 PHE CG 1.0 166.6 192.6 CHI1 101 101 A 152 MET N A 152 MET CA A 152 MET CB A 152 MET CG 1.0 -83.4 -44.6 CHI1 102 102 A 153 THR N A 153 THR CA A 153 THR CB A 153 THR OG1 1.0 49.8 71.8 CHI1 103 103 A 155 ASN N A 155 ASN CA A 155 ASN CB A 155 ASN CG 1.0 -83.5 -46.3 CHI1 104 104 A 161 ARG N A 161 ARG CA A 161 ARG CB A 161 ARG CG 1.0 -78.4 -46.4 CHI1 105 105 A 165 ILE N A 165 ILE CA A 165 ILE CB A 165 ILE CG1 1.0 -71.0 -41.0 CHI1 106 106 A 168 ILE N A 168 ILE CA A 168 ILE CB A 168 ILE CG1 1.0 -79.9 -43.1 CHI1 107 107 A 169 VAL N A 169 VAL CA A 169 VAL CB A 169 VAL CG1 1.0 -189.4 -160.6 CHI1 108 108 A 98 ALA C A 99 PHE N A 99 PHE CA A 99 PHE C 1.0 -175.0 -30.0 PHI 109 109 A 99 PHE N A 99 PHE CA A 99 PHE C A 100 LYS N 1.0 75.0 180.0 PSI 110 110 A 111 GLN C A 112 ALA N A 112 ALA CA A 112 ALA C 1.0 -175.0 -30.0 PHI 111 111 A 112 ALA N A 112 ALA CA A 112 ALA C A 113 CYS N 1.0 75.0 180.0 PSI 112 112 A 128 LEU C A 129 ARG N A 129 ARG CA A 129 ARG C 1.0 -175.0 -30.0 PHI 113 113 A 129 ARG N A 129 ARG CA A 129 ARG C A 130 LEU N 1.0 75.0 180.0 PSI 114 114 A 129 ARG C A 130 LEU N A 130 LEU CA A 130 LEU C 1.0 -175.0 -30.0 PHI 115 115 A 130 LEU N A 130 LEU CA A 130 LEU C A 131 PRO N 1.0 75.0 180.0 PSI 116 116 A 132 MET C A 133 ASN N A 133 ASN CA A 133 ASN C 1.0 -175.0 -30.0 PHI 117 117 A 133 ASN N A 133 ASN CA A 133 ASN C A 134 PRO N 1.0 75.0 180.0 PSI 118 118 A 138 ASN C A 139 HIS N A 139 HIS CA A 139 HIS C 1.0 -175.0 -30.0 PHI 119 119 A 139 HIS N A 139 HIS CA A 139 HIS C A 140 PRO N 1.0 75.0 180.0 PSI 120 120 A 164 PHE C A 165 ILE N A 165 ILE CA A 165 ILE C 1.0 -175.0 -30.0 PHI 121 121 A 165 ILE N A 165 ILE CA A 165 ILE C A 166 HIS N 1.0 75.0 180.0 PSI 122 122 A 100 LYS C A 101 THR N A 101 THR CA A 101 THR C 1.0 -135.0 15.0 PHI 123 123 A 101 THR N A 101 THR CA A 101 THR C A 102 ALA N 1.0 -75.0 30.0 PSI 124 124 A 119 CYS C A 120 ARG N A 120 ARG CA A 120 ARG C 1.0 -135.0 15.0 PHI 125 125 A 120 ARG N A 120 ARG CA A 120 ARG C A 121 PHE N 1.0 -75.0 30.0 PSI 126 126 A 141 LYS C A 142 TYR N A 142 TYR CA A 142 TYR C 1.0 -135.0 15.0 PHI 127 127 A 142 TYR N A 142 TYR CA A 142 TYR C A 143 LYS N 1.0 -75.0 30.0 PSI 128 128 A 143 LYS C A 144 THR N A 144 THR CA A 144 THR C 1.0 -135.0 15.0 PHI 129 129 A 144 THR N A 144 THR CA A 144 THR C A 145 VAL N 1.0 -75.0 30.0 PSI 130 130 A 162 CYS C A 163 GLN N A 163 GLN CA A 163 GLN C 1.0 -135.0 15.0 PHI 131 131 A 163 GLN N A 163 GLN CA A 163 GLN C A 164 PHE N 1.0 -75.0 30.0 PSI 132 132 A 147 CYS SG A 156 CYS SG A 162 CYS SG A 166 HIS NE2 1.0 68.5 72.5 . 133 133 A 147 CYS SG A 156 CYS SG A 162 CYS SG A 166 HIS NE2 1.0 68.5 72.5 . 134 134 A 147 CYS SG A 156 CYS SG A 162 CYS SG A 166 HIS NE2 1.0 68.5 72.5 . 135 135 A 147 CYS SG A 156 CYS SG A 162 CYS SG A 166 HIS NE2 1.0 68.5 72.5 . 136 136 A 104 CYS SG A 113 CYS SG A 119 CYS SG A 123 HIS NE2 1.0 68.5 72.5 . 137 137 A 104 CYS SG A 113 CYS SG A 119 CYS SG A 123 HIS NE2 1.0 68.5 72.5 . 138 138 A 104 CYS SG A 113 CYS SG A 119 CYS SG A 123 HIS NE2 1.0 68.5 72.5 . 139 139 A 104 CYS SG A 113 CYS SG A 119 CYS SG A 123 HIS NE2 1.0 68.5 72.5 . 140 140 A 123 HIS CA A 123 HIS CB A 123 HIS CG A 123 HIS ND1 1.0 170.0 190.0 CHI2 141 141 A 166 HIS CA A 166 HIS CB A 166 HIS CG A 166 HIS ND1 1.0 170.0 190.0 CHI2 142 142 A 123 HIS N A 123 HIS CA A 123 HIS CB A 123 HIS CG 1.0 -70.0 -50.0 CHI1 143 143 A 166 HIS N A 166 HIS CA A 166 HIS CB A 166 HIS CG 1.0 -70.0 -50.0 CHI1 stop_ save_