Fragment List : P3J5L
Number of Fragments : 381 Ligand Residue Name : Ligand Fragment Number :
1(B:30:ACE)
2(B:31:THR)
3(B:32:ILE)
4(B:33:THR)
5(B:34:VAL)
6(B:35:TRP)
7(B:36:SER)
8(B:37:TRP)
9(B:38:GLN)
10(B:39:THR)
11(B:40:GLY)
12(B:41:PRO)
13(B:42:GLU)
14(B:43:LEU)
15(B:44:GLN)
16(B:45:ASH)
17(B:46:VAL)
18(B:47:LYS)
19(B:48:GLN)
20(B:49:ILE)
21(B:50:ALA)
22(B:51:ALA)
23(B:52:GLN)
24(B:53:TRP)
25(B:54:ALA)
26(B:55:LYS)
27(B:56:ALA)
28(B:57:HIS)
29(B:58:GLY)
30(B:59:ASP)
31(B:60:LYS)
32(B:61:VAL)
33(B:62:ILE)
34(B:63:VAL)
35(B:64:VAL)
36(B:65:ASP)
37(B:66:GLN)
38(B:67:SER)
39(B:68:SER)
40(B:69:ASN)
41(B:70:PRO)
42(B:71:LYS)
43(B:72:GLY)
44(B:73:PHE)
45(B:74:GLN)
46(B:75:PHE)
47(B:76:TYR)
48(B:77:ALA)
49(B:78:THR)
50(B:79:ALA)
51(B:80:ALA)
52(B:81:ARG)
53(B:82:THR)
54(B:83:GLY)
55(B:84:LYS)
56(B:85:GLY)
57(B:86:PRO)
58(B:87:ASP)
59(B:88:VAL)
60(B:89:VAL)
61(B:90:PHE)
62(B:91:GLY)
63(B:92:MET)
64(B:93:PRO)
65(B:94:HIS)
66(B:95:ASP)
67(B:96:ASN)
68(B:97:ASN)
69(B:98:GLY)
70(B:99:VAL)
71(B:100:PHE)
72(B:101:ALA)
73(B:102:GLU)
74(B:103:GLU)
75(B:104:GLY)
76(B:105:LEU)
77(B:106:MET)
78(B:107:ALA)
79(B:108:PRO)
80(B:109:VAL)
81(B:110:PRO)
82(B:111:SER)
83(B:112:GLY)
84(B:113:VAL)
85(B:114:LEU)
86(B:115:ASN)
87(B:116:THR)
88(B:117:GLY)
89(B:118:LEU)
90(B:119:TYR)
91(B:120:ALA)
92(B:121:PRO)
93(B:122:ASN)
94(B:123:THR)
95(B:124:ILE)
96(B:125:ASP)
97(B:126:ALA)
98(B:127:ILE)
99(B:128:LYS)
100(B:129:VAL)
101(B:130:ASN)
102(B:131:GLY)
103(B:132:THR)
104(B:133:MET)
105(B:134:TYR)
106(B:135:SER)
107(B:136:VAL)
108(B:137:PRO)
109(B:138:VAL)
110(B:139:SER)
111(B:140:VAL)
112(B:141:GLN)
113(B:142:VAL)
114(B:143:ALA)
115(B:144:ALA)
116(B:145:ILE)
117(B:146:TYR)
118(B:147:TYR)
119(B:148:ASN)
120(B:149:LYS)
121(B:150:LYS)
122(B:151:LEU)
123(B:152:VAL)
124(B:153:PRO)
125(B:154:GLN)
126(B:155:PRO)
127(B:156:PRO)
128(B:157:GLN)
129(B:158:THR)
130(B:159:TRP)
131(B:160:ALA)
132(B:161:GLU)
133(B:162:PHE)
134(B:163:VAL)
135(B:164:LYS)
136(B:165:ASP)
137(B:166:ALA)
138(B:167:ASN)
139(B:168:ALA)
140(B:169:HIS)
141(B:170:GLY)
142(B:171:PHE)
143(B:172:MET)
144(B:173:TYR)
145(B:174:ASP)
146(B:175:GLN)
147(B:176:ALA)
148(B:177:ASN)
149(B:178:LEU)
150(B:179:TYR)
151(B:180:PHE)
152(B:181:ASP)
153(B:182:TYR)
154(B:183:ALA)
155(B:184:ILE)
156(B:185:ILE)
157(B:186:GLY)
158(B:187:GLY)
159(B:188:TYR)
160(B:189:GLY)
161(B:190:GLY)
162(B:191:TYR)
163(B:192:VAL)
164(B:193:PHE)
165(B:194:LYS)
166(B:195:ASP)
167(B:196:ASN)
168(B:197:ASN)
169(B:198:GLY)
170(B:199:THR)
171(B:200:LEU)
172(B:201:ASP)
173(B:202:PRO)
174(B:203:ASN)
175(B:204:ASN)
176(B:205:ILE)
177(B:206:GLY)
178(B:207:LEU)
179(B:208:ASP)
180(B:209:THR)
181(B:210:PRO)
182(B:211:GLY)
183(B:212:ALA)
184(B:213:VAL)
185(B:214:GLN)
186(B:215:ALA)
187(B:216:TYR)
188(B:217:THR)
189(B:218:LEU)
190(B:219:MET)
191(B:220:ARG)
192(B:221:ASP)
193(B:222:MET)
194(B:223:VAL)
195(B:224:SER)
196(B:225:LYS)
197(B:226:TYR)
198(B:227:HIS)
199(B:228:TRP)
200(B:229:MET)
201(B:230:THR)
202(B:231:PRO)
203(B:232:SER)
204(B:233:THR)
205(B:234:ASN)
206(B:235:GLY)
207(B:236:SER)
208(B:237:ILE)
209(B:238:ALA)
210(B:239:LYS)
211(B:240:ALA)
212(B:241:GLU)
213(B:242:PHE)
214(B:243:LEU)
215(B:244:ALA)
216(B:245:GLY)
217(B:246:LYS)
218(B:247:ILE)
219(B:248:GLY)
220(B:249:MET)
221(B:250:TYR)
222(B:251:VAL)
223(B:252:SER)
224(B:253:GLY)
225(B:254:PRO)
226(B:255:TRP)
227(B:256:ASP)
228(B:257:THR)
229(B:258:ALA)
230(B:259:ASP)
231(B:260:ILE)
232(B:261:GLU)
233(B:262:LYS)
234(B:263:ALA)
235(B:264:LYS)
236(B:265:ILE)
237(B:266:ASP)
238(B:267:PHE)
239(B:268:GLY)
240(B:269:VAL)
241(B:270:THR)
242(B:271:PRO)
243(B:272:TRP)
244(B:273:PRO)
245(B:274:THR)
246(B:275:LEU)
247(B:276:PRO)
248(B:277:ASN)
249(B:278:GLY)
250(B:279:LYS)
251(B:280:HIS)
252(B:281:ALA)
253(B:282:THR)
254(B:283:PRO)
255(B:284:PHE)
256(B:285:LEU)
257(B:286:GLY)
258(B:287:VAL)
259(B:288:ILE)
260(B:289:THR)
261(B:290:ALA)
262(B:291:PHE)
263(B:292:VAL)
264(B:293:ASN)
265(B:294:LYS)
266(B:295:GLU)
267(B:296:SER)
268(B:297:LYS)
269(B:298:THR)
270(B:299:GLN)
271(B:300:ALA)
272(B:301:ALA)
273(B:302:ASP)
274(B:303:TRP)
275(B:304:SER)
276(B:305:LEU)
277(B:306:VAL)
278(B:307:GLN)
279(B:308:ALA)
280(B:309:LEU)
281(B:310:THR)
282(B:311:SER)
283(B:312:ALA)
284(B:313:GLN)
285(B:314:ALA)
286(B:315:GLN)
287(B:316:GLN)
288(B:317:MET)
289(B:318:TYR)
290(B:319:PHE)
291(B:320:ARG)
292(B:321:ASP)
293(B:322:SER)
294(B:323:GLN)
295(B:324:GLN)
296(B:325:ILE)
297(B:326:PRO)
298(B:327:ALA)
299(B:328:LEU)
300(B:329:LEU)
301(B:330:SER)
302(B:331:VAL)
303(B:332:GLN)
304(B:333:ARG)
305(B:334:SER)
306(B:335:SER)
307(B:336:ALA)
308(B:337:VAL)
309(B:338:GLN)
310(B:339:SER)
311(B:340:SER)
312(B:341:PRO)
313(B:342:THR)
314(B:343:PHE)
315(B:344:LYS)
316(B:345:ALA)
317(B:346:PHE)
318(B:347:VAL)
319(B:348:GLU)
320(B:349:GLN)
321(B:350:LEU)
322(B:351:ARG)
323(B:352:TYR)
324(B:353:ALA)
325(B:354:VAL)
326(B:355:PRO)
327(B:356:MET)
328(B:357:PRO)
329(B:358:ASN)
330(B:359:ILE)
331(B:360:PRO)
332(B:361:GLN)
333(B:362:MET)
334(B:363:GLN)
335(B:364:ALA)
336(B:365:VAL)
337(B:366:TRP)
338(B:367:GLN)
339(B:368:ALA)
340(B:369:MET)
341(B:370:SER)
342(B:371:ILE)
343(B:372:LEU)
344(B:373:GLN)
345(B:374:ASN)
346(B:375:ILE)
347(B:376:ILE)
348(B:377:ALA)
349(B:378:GLY)
350(B:379:LYS)
351(B:380:VAL)
352(B:381:SER)
353(B:382:PRO)
354(B:383:GLU)
355(B:384:GLN)
356(B:385:GLY)
357(B:386:ALA)
358(B:387:LYS)
359(B:388:ASP)
360(B:389:PHE)
361(B:390:VAL)
362(B:391:GLN)
363(B:392:ASN)
364(B:393:ILE)
365(B:394:GLN)
366(B:395:LYS)
367(B:396:NME)
368(B:1396:MLR)
369(A:2005:HOH)
370(A:2010:HOH)
371(A:2011:HOH)
372(A:2147:HOH)
373(A:2150:HOH)
374(A:2153:HOH)
375(A:2160:HOH)
376(B:2004:HOH)
377(B:2115:HOH)
378(B:2151:HOH)
379(B:2240:HOH)
380(B:2241:HOH)
381(B:2242:HOH)
2(B:31:THR)
3(B:32:ILE)
4(B:33:THR)
5(B:34:VAL)
6(B:35:TRP)
7(B:36:SER)
8(B:37:TRP)
9(B:38:GLN)
10(B:39:THR)
11(B:40:GLY)
12(B:41:PRO)
13(B:42:GLU)
14(B:43:LEU)
15(B:44:GLN)
16(B:45:ASH)
17(B:46:VAL)
18(B:47:LYS)
19(B:48:GLN)
20(B:49:ILE)
21(B:50:ALA)
22(B:51:ALA)
23(B:52:GLN)
24(B:53:TRP)
25(B:54:ALA)
26(B:55:LYS)
27(B:56:ALA)
28(B:57:HIS)
29(B:58:GLY)
30(B:59:ASP)
31(B:60:LYS)
32(B:61:VAL)
33(B:62:ILE)
34(B:63:VAL)
35(B:64:VAL)
36(B:65:ASP)
37(B:66:GLN)
38(B:67:SER)
39(B:68:SER)
40(B:69:ASN)
41(B:70:PRO)
42(B:71:LYS)
43(B:72:GLY)
44(B:73:PHE)
45(B:74:GLN)
46(B:75:PHE)
47(B:76:TYR)
48(B:77:ALA)
49(B:78:THR)
50(B:79:ALA)
51(B:80:ALA)
52(B:81:ARG)
53(B:82:THR)
54(B:83:GLY)
55(B:84:LYS)
56(B:85:GLY)
57(B:86:PRO)
58(B:87:ASP)
59(B:88:VAL)
60(B:89:VAL)
61(B:90:PHE)
62(B:91:GLY)
63(B:92:MET)
64(B:93:PRO)
65(B:94:HIS)
66(B:95:ASP)
67(B:96:ASN)
68(B:97:ASN)
69(B:98:GLY)
70(B:99:VAL)
71(B:100:PHE)
72(B:101:ALA)
73(B:102:GLU)
74(B:103:GLU)
75(B:104:GLY)
76(B:105:LEU)
77(B:106:MET)
78(B:107:ALA)
79(B:108:PRO)
80(B:109:VAL)
81(B:110:PRO)
82(B:111:SER)
83(B:112:GLY)
84(B:113:VAL)
85(B:114:LEU)
86(B:115:ASN)
87(B:116:THR)
88(B:117:GLY)
89(B:118:LEU)
90(B:119:TYR)
91(B:120:ALA)
92(B:121:PRO)
93(B:122:ASN)
94(B:123:THR)
95(B:124:ILE)
96(B:125:ASP)
97(B:126:ALA)
98(B:127:ILE)
99(B:128:LYS)
100(B:129:VAL)
101(B:130:ASN)
102(B:131:GLY)
103(B:132:THR)
104(B:133:MET)
105(B:134:TYR)
106(B:135:SER)
107(B:136:VAL)
108(B:137:PRO)
109(B:138:VAL)
110(B:139:SER)
111(B:140:VAL)
112(B:141:GLN)
113(B:142:VAL)
114(B:143:ALA)
115(B:144:ALA)
116(B:145:ILE)
117(B:146:TYR)
118(B:147:TYR)
119(B:148:ASN)
120(B:149:LYS)
121(B:150:LYS)
122(B:151:LEU)
123(B:152:VAL)
124(B:153:PRO)
125(B:154:GLN)
126(B:155:PRO)
127(B:156:PRO)
128(B:157:GLN)
129(B:158:THR)
130(B:159:TRP)
131(B:160:ALA)
132(B:161:GLU)
133(B:162:PHE)
134(B:163:VAL)
135(B:164:LYS)
136(B:165:ASP)
137(B:166:ALA)
138(B:167:ASN)
139(B:168:ALA)
140(B:169:HIS)
141(B:170:GLY)
142(B:171:PHE)
143(B:172:MET)
144(B:173:TYR)
145(B:174:ASP)
146(B:175:GLN)
147(B:176:ALA)
148(B:177:ASN)
149(B:178:LEU)
150(B:179:TYR)
151(B:180:PHE)
152(B:181:ASP)
153(B:182:TYR)
154(B:183:ALA)
155(B:184:ILE)
156(B:185:ILE)
157(B:186:GLY)
158(B:187:GLY)
159(B:188:TYR)
160(B:189:GLY)
161(B:190:GLY)
162(B:191:TYR)
163(B:192:VAL)
164(B:193:PHE)
165(B:194:LYS)
166(B:195:ASP)
167(B:196:ASN)
168(B:197:ASN)
169(B:198:GLY)
170(B:199:THR)
171(B:200:LEU)
172(B:201:ASP)
173(B:202:PRO)
174(B:203:ASN)
175(B:204:ASN)
176(B:205:ILE)
177(B:206:GLY)
178(B:207:LEU)
179(B:208:ASP)
180(B:209:THR)
181(B:210:PRO)
182(B:211:GLY)
183(B:212:ALA)
184(B:213:VAL)
185(B:214:GLN)
186(B:215:ALA)
187(B:216:TYR)
188(B:217:THR)
189(B:218:LEU)
190(B:219:MET)
191(B:220:ARG)
192(B:221:ASP)
193(B:222:MET)
194(B:223:VAL)
195(B:224:SER)
196(B:225:LYS)
197(B:226:TYR)
198(B:227:HIS)
199(B:228:TRP)
200(B:229:MET)
201(B:230:THR)
202(B:231:PRO)
203(B:232:SER)
204(B:233:THR)
205(B:234:ASN)
206(B:235:GLY)
207(B:236:SER)
208(B:237:ILE)
209(B:238:ALA)
210(B:239:LYS)
211(B:240:ALA)
212(B:241:GLU)
213(B:242:PHE)
214(B:243:LEU)
215(B:244:ALA)
216(B:245:GLY)
217(B:246:LYS)
218(B:247:ILE)
219(B:248:GLY)
220(B:249:MET)
221(B:250:TYR)
222(B:251:VAL)
223(B:252:SER)
224(B:253:GLY)
225(B:254:PRO)
226(B:255:TRP)
227(B:256:ASP)
228(B:257:THR)
229(B:258:ALA)
230(B:259:ASP)
231(B:260:ILE)
232(B:261:GLU)
233(B:262:LYS)
234(B:263:ALA)
235(B:264:LYS)
236(B:265:ILE)
237(B:266:ASP)
238(B:267:PHE)
239(B:268:GLY)
240(B:269:VAL)
241(B:270:THR)
242(B:271:PRO)
243(B:272:TRP)
244(B:273:PRO)
245(B:274:THR)
246(B:275:LEU)
247(B:276:PRO)
248(B:277:ASN)
249(B:278:GLY)
250(B:279:LYS)
251(B:280:HIS)
252(B:281:ALA)
253(B:282:THR)
254(B:283:PRO)
255(B:284:PHE)
256(B:285:LEU)
257(B:286:GLY)
258(B:287:VAL)
259(B:288:ILE)
260(B:289:THR)
261(B:290:ALA)
262(B:291:PHE)
263(B:292:VAL)
264(B:293:ASN)
265(B:294:LYS)
266(B:295:GLU)
267(B:296:SER)
268(B:297:LYS)
269(B:298:THR)
270(B:299:GLN)
271(B:300:ALA)
272(B:301:ALA)
273(B:302:ASP)
274(B:303:TRP)
275(B:304:SER)
276(B:305:LEU)
277(B:306:VAL)
278(B:307:GLN)
279(B:308:ALA)
280(B:309:LEU)
281(B:310:THR)
282(B:311:SER)
283(B:312:ALA)
284(B:313:GLN)
285(B:314:ALA)
286(B:315:GLN)
287(B:316:GLN)
288(B:317:MET)
289(B:318:TYR)
290(B:319:PHE)
291(B:320:ARG)
292(B:321:ASP)
293(B:322:SER)
294(B:323:GLN)
295(B:324:GLN)
296(B:325:ILE)
297(B:326:PRO)
298(B:327:ALA)
299(B:328:LEU)
300(B:329:LEU)
301(B:330:SER)
302(B:331:VAL)
303(B:332:GLN)
304(B:333:ARG)
305(B:334:SER)
306(B:335:SER)
307(B:336:ALA)
308(B:337:VAL)
309(B:338:GLN)
310(B:339:SER)
311(B:340:SER)
312(B:341:PRO)
313(B:342:THR)
314(B:343:PHE)
315(B:344:LYS)
316(B:345:ALA)
317(B:346:PHE)
318(B:347:VAL)
319(B:348:GLU)
320(B:349:GLN)
321(B:350:LEU)
322(B:351:ARG)
323(B:352:TYR)
324(B:353:ALA)
325(B:354:VAL)
326(B:355:PRO)
327(B:356:MET)
328(B:357:PRO)
329(B:358:ASN)
330(B:359:ILE)
331(B:360:PRO)
332(B:361:GLN)
333(B:362:MET)
334(B:363:GLN)
335(B:364:ALA)
336(B:365:VAL)
337(B:366:TRP)
338(B:367:GLN)
339(B:368:ALA)
340(B:369:MET)
341(B:370:SER)
342(B:371:ILE)
343(B:372:LEU)
344(B:373:GLN)
345(B:374:ASN)
346(B:375:ILE)
347(B:376:ILE)
348(B:377:ALA)
349(B:378:GLY)
350(B:379:LYS)
351(B:380:VAL)
352(B:381:SER)
353(B:382:PRO)
354(B:383:GLU)
355(B:384:GLN)
356(B:385:GLY)
357(B:386:ALA)
358(B:387:LYS)
359(B:388:ASP)
360(B:389:PHE)
361(B:390:VAL)
362(B:391:GLN)
363(B:392:ASN)
364(B:393:ILE)
365(B:394:GLN)
366(B:395:LYS)
367(B:396:NME)
368(B:1396:MLR)
369(A:2005:HOH)
370(A:2010:HOH)
371(A:2011:HOH)
372(A:2147:HOH)
373(A:2150:HOH)
374(A:2153:HOH)
375(A:2160:HOH)
376(B:2004:HOH)
377(B:2115:HOH)
378(B:2151:HOH)
379(B:2240:HOH)
380(B:2241:HOH)
381(B:2242:HOH)