1j3j A 2.3 BS01 CP6 A 1 I14 C15 A16 D54 F58 N108 I112 I164 I14 C15 A16 D54 F58 N98 I102 I154 L46 D54 L46 D54 1.5.1.3,2.1.1.45 0004146,0046654,0050661 Ki=9.8nM Ki=0.6nM, IC50=30900nM P13922 12704428 609 MMEQVCDVFDIYAICACCKVESKNEGKKNEVFNNYTFRGLGNKGVLPWKCNSLDMKYFRAVTTYVNESKYEKLKYKRCKYLNKETKKLQNVVVMGRTNWESIPKKFKPLSNRINVILSRTLKKEDFDEDVYIINKVEDLIVLLGKLNYYKCFIIGGSVVYQEFLEKKLIKKIYFTRINSTYECDVFFPEINENEYQIISVSDVYTSNNTTLDFIIYKKTNN 1j3j A 2.3 BS02 NDP A 1 C15 A16 L40 G44 V45 L46 W48 G105 R106 T107 N108 L127 S128 R129 T130 N144 I164 G165 G166 S167 V168 V169 Y170 E172 V195 C15 A16 L40 G44 V45 L46 W48 G95 R96 T97 N98 L117 S118 R119 T120 N134 I154 G155 G156 S157 V158 V159 Y160 E162 V185 L46 D54 L46 D54 1.5.1.3,2.1.1.45 0004146,0046654,0050661 P13922 12704428 610 MMEQVCDVFDIYAICACCKVESKNEGKKNEVFNNYTFRGLGNKGVLPWKCNSLDMKYFRAVTTYVNESKYEKLKYKRCKYLNKETKKLQNVVVMGRTNWESIPKKFKPLSNRINVILSRTLKKEDFDEDVYIINKVEDLIVLLGKLNYYKCFIIGGSVVYQEFLEKKLIKKIYFTRINSTYECDVFFPEINENEYQIISVSDVYTSNNTTLDFIIYKKTNN 1j3j B 2.3 BS01 CP6 B 1 I14 C15 A16 D54 F58 N108 I112 I164 I14 C15 A16 D54 F58 N93 I97 I149 L46 D54 L46 D54 1.5.1.3,2.1.1.45 0004146,0046654,0050661 Ki=9.8nM Ki=0.6nM, IC50=30900nM P13922 12704428 709 MMEQVCDVFDIYAICACCKVESKNEGKKNEVFNNYTFRGLGNKGVLPWKCNSLDMKYFRAVTTYVNESKYEKLKYKRCKYLKLQNVVVMGRTNWESIPKKFKPLSNRINVILSRTLKKEDFDEDVYIINKVEDLIVLLGKLNYYKCFIIGGSVVYQEFLEKKLIKKIYFTRINSTYECDVFFPEINENEYQIISVSDVYTSNNTTLDFIIYKKTNN 1j3j B 2.3 BS02 NDP B 1 C15 A16 L40 G44 G105 R106 T107 N108 L127 S128 R129 T130 N144 I164 G165 G166 S167 V168 Y170 V195 C15 A16 L40 G44 G90 R91 T92 N93 L112 S113 R114 T115 N129 I149 G150 G151 S152 V153 Y155 V180 L46 D54 L46 D54 1.5.1.3,2.1.1.45 0004146,0046654,0050661 P13922 12704428 710 MMEQVCDVFDIYAICACCKVESKNEGKKNEVFNNYTFRGLGNKGVLPWKCNSLDMKYFRAVTTYVNESKYEKLKYKRCKYLKLQNVVVMGRTNWESIPKKFKPLSNRINVILSRTLKKEDFDEDVYIINKVEDLIVLLGKLNYYKCFIIGGSVVYQEFLEKKLIKKIYFTRINSTYECDVFFPEINENEYQIISVSDVYTSNNTTLDFIIYKKTNN 1j3j C 2.3 BS01 UMP C 1 C490 H491 R510 S511 D513 N521 H551 C208 H209 R228 S229 D231 N239 H269 E382 W404 Y430 C490 R510 D513 E100 W122 Y148 C208 R228 D231 1.5.1.3,2.1.1.45 0004799,0006231,0016741 P13922 12704428 611 DDEEEDDFVYFNFNKEKEEKNKNSIHPNDFQIYNSLKYKYHPEYQYLNIIYDIMMNGNKQSDRTGVGVLSKFGYIMKFDLSQYFPLLTTKKLFLRGIIEELLWFIRGETNGNTLLNKNVRIWEANGTREFLDNRKLFHREVNDLGPIYGFQWRHFGAEYTNMYDNYENKGVDQLKNIINLIKNDPTSRRILLCAWNVKDLDQMALPPCHILCQFYVFDGKLSCIMYQRSCDLGLGVPFNIASYSIFTHMIAQVCNLQPAQFIHVLGNAHVYNNHIDSLKIQLNRIPYPFPTLKLNPDIKNIEDFTISDFTIQNYVHHEKISMDMAA 1j3j C 2.3 BS02 UMP D 1 R470 R471 R188 R189 E382 W404 Y430 C490 R510 D513 E100 W122 Y148 C208 R228 D231 1.5.1.3,2.1.1.45 0004799,0006231,0016741 P13922 12704428 711 DDEEEDDFVYFNFNKEKEEKNKNSIHPNDFQIYNSLKYKYHPEYQYLNIIYDIMMNGNKQSDRTGVGVLSKFGYIMKFDLSQYFPLLTTKKLFLRGIIEELLWFIRGETNGNTLLNKNVRIWEANGTREFLDNRKLFHREVNDLGPIYGFQWRHFGAEYTNMYDNYENKGVDQLKNIINLIKNDPTSRRILLCAWNVKDLDQMALPPCHILCQFYVFDGKLSCIMYQRSCDLGLGVPFNIASYSIFTHMIAQVCNLQPAQFIHVLGNAHVYNNHIDSLKIQLNRIPYPFPTLKLNPDIKNIEDFTISDFTIQNYVHHEKISMDMAA 1j3j D 2.3 BS01 UMP C 1 R470 R471 R188 R189 E382 W404 Y430 C490 R510 D513 E100 W122 Y148 C208 R228 D231 1.5.1.3,2.1.1.45 0004799,0006231,0016741 P13922 12704428 611 DDEEEDDFVYFNFNKEKEEKNKNSIHPNDFQIYNSLKYKYHPEYQYLNIIYDIMMNGNKQSDRTGVGVLSKFGYIMKFDLSQYFPLLTTKKLFLRGIIEELLWFIRGETNGNTLLNKNVRIWEANGTREFLDNRKLFHREVNDLGPIYGFQWRHFGAEYTNMYDNYENKGVDQLKNIINLIKNDPTSRRILLCAWNVKDLDQMALPPCHILCQFYVFDGKLSCIMYQRSCDLGLGVPFNIASYSIFTHMIAQVCNLQPAQFIHVLGNAHVYNNHIDSLKIQLNRIPYPFPTLKLNPDIKNIEDFTISDFTIQNYVHHEKISMDMAA 1j3j D 2.3 BS02 UMP D 1 C490 H491 Q509 R510 S511 D513 N521 H551 C208 H209 Q227 R228 S229 D231 N239 H269 E382 W404 Y430 C490 R510 D513 E100 W122 Y148 C208 R228 D231 1.5.1.3,2.1.1.45 0004799,0006231,0016741 P13922 12704428 711 DDEEEDDFVYFNFNKEKEEKNKNSIHPNDFQIYNSLKYKYHPEYQYLNIIYDIMMNGNKQSDRTGVGVLSKFGYIMKFDLSQYFPLLTTKKLFLRGIIEELLWFIRGETNGNTLLNKNVRIWEANGTREFLDNRKLFHREVNDLGPIYGFQWRHFGAEYTNMYDNYENKGVDQLKNIINLIKNDPTSRRILLCAWNVKDLDQMALPPCHILCQFYVFDGKLSCIMYQRSCDLGLGVPFNIASYSIFTHMIAQVCNLQPAQFIHVLGNAHVYNNHIDSLKIQLNRIPYPFPTLKLNPDIKNIEDFTISDFTIQNYVHHEKISMDMAA