Fragment List : 4N12N
Number of Fragments : 356 Ligand Residue Name : Ligand Fragment Number :
1(B:-1:GLY )
2(B:0:HIS )
3(B:1:MET )
4(B:2:SER )
5(B:3:LEU )
6(B:4:GLU )
7(B:5:ASN )
8(B:6:VAL )
9(B:7:ALA )
10(B:8:PHE )
11(B:9:ASN )
12(B:10:VAL )
13(B:11:VAL )
14(B:12:ASN )
15(B:13:LYS )
16(B:14:GLY )
17(B:15:HIS )
18(B:16:PHE )
19(B:17:ASP )
20(B:18:GLY )
21(B:19:GLN )
22(B:20:GLN )
23(B:21:GLY )
24(B:22:GLU )
25(B:23:VAL )
26(B:24:PRO )
27(B:25:VAL )
28(B:26:SER )
29(B:27:ILE )
30(B:28:ILE )
31(B:29:ASN )
32(B:30:ASN )
33(B:31:THR )
34(B:32:VAL )
35(B:33:TYR )
36(B:34:THR )
37(B:35:LYS )
38(B:36:VAL )
39(B:37:ASP )
40(B:38:GLY )
41(B:39:VAL )
42(B:40:ASP )
43(B:41:VAL )
44(B:42:GLU )
45(B:43:LEU )
46(B:44:PHE )
47(B:45:GLU )
48(B:46:ASN )
49(B:47:LYS )
50(B:48:THR )
51(B:49:THR )
52(B:50:LEU )
53(B:51:PRO )
54(B:52:VAL )
55(B:53:ASN )
56(B:54:VAL )
57(B:55:ALA )
58(B:56:PHE )
59(B:57:GLU )
60(B:58:LEU )
61(B:59:TRP )
62(B:60:ALA )
63(B:61:LYS )
64(B:62:ARG )
65(B:63:ASN )
66(B:64:ILE )
67(B:65:LYS )
68(B:66:PRO )
69(B:67:VAL )
70(B:68:PRO )
71(B:69:GLU )
72(B:70:VAL )
73(B:71:LYS )
74(B:72:ILE )
75(B:73:LEU )
76(B:74:ASN )
77(B:75:ASN )
78(B:76:LEU )
79(B:77:GLY )
80(B:78:VAL )
81(B:79:ASP )
82(B:80:ILE )
83(B:81:ALA )
84(B:82:ALA )
85(B:83:ASN )
86(B:84:THR )
87(B:85:VAL )
88(B:86:ILE )
89(B:87:TRP )
90(B:88:ASP )
91(B:89:TYR )
92(B:90:LYS )
93(B:91:ARG )
94(B:92:ASP )
95(B:93:ALA )
96(B:94:PRO )
97(B:95:ALA )
98(B:96:HIS )
99(B:97:ILE )
100(B:98:SER )
101(B:99:THR )
102(B:100:ILE )
103(B:101:GLY )
104(B:102:VAL )
105(B:103:CYS )
106(B:104:SER )
107(B:105:MET )
108(B:106:THR )
109(B:107:ASP )
110(B:108:ILE )
111(B:109:ALA )
112(B:110:LYS )
113(B:111:LYS )
114(B:112:PRO )
115(B:113:THR )
116(B:114:GLU )
117(B:115:THR )
118(B:116:ILE )
119(B:117:CYS )
120(B:118:ALA )
121(B:119:PRO )
122(B:120:LEU )
123(B:121:THR )
124(B:122:VAL )
125(B:123:PHE )
126(B:124:PHE )
127(B:125:ASP )
128(B:126:GLY )
129(B:127:ARG )
130(B:128:VAL )
131(B:129:ASP )
132(B:130:GLY )
133(B:131:GLN )
134(B:132:VAL )
135(B:133:ASP )
136(B:134:LEU )
137(B:135:PHE )
138(B:136:ARG )
139(B:137:ASN )
140(B:138:ALA )
141(B:139:ARG )
142(B:140:ASN )
143(B:141:GLY )
144(B:142:VAL )
145(B:143:LEU )
146(B:144:ILE )
147(B:145:THR )
148(B:146:GLU )
149(B:147:GLY )
150(B:148:SER )
151(B:149:VAL )
152(B:150:LYS )
153(B:151:GLY )
154(B:152:LEU )
155(B:153:GLN )
156(B:154:PRO )
157(B:155:SER )
158(B:156:VAL )
159(B:157:GLY )
160(B:158:PRO )
161(B:159:LYS )
162(B:160:GLN )
163(B:161:ALA )
164(B:162:SER )
165(B:163:LEU )
166(B:164:ASN )
167(B:165:GLY )
168(B:166:VAL )
169(B:167:THR )
170(B:168:LEU )
171(B:169:ILE )
172(B:170:GLY )
173(B:171:GLU )
174(B:172:ALA )
175(B:173:VAL )
176(B:174:LYS )
177(B:175:THR )
178(B:176:GLN )
179(B:177:PHE )
180(B:178:ASN )
181(B:179:TYR )
182(B:180:TYR )
183(B:181:LYS )
184(B:182:LYS )
185(B:183:VAL )
186(B:184:ASP )
187(B:185:GLY )
188(B:186:VAL )
189(B:187:VAL )
190(B:188:GLN )
191(B:189:GLN )
192(B:190:LEU )
193(B:191:PRO )
194(B:192:GLU )
195(B:193:THR )
196(B:194:TYR )
197(B:195:PHE )
198(B:196:THR )
199(B:197:GLN )
200(B:198:SER )
201(B:199:ARG )
202(B:200:ASN )
203(B:201:LEU )
204(B:202:GLN )
205(B:203:GLU )
206(B:204:PHE )
207(B:205:LYS )
208(B:206:PRO )
209(B:207:ARG )
210(B:208:SER )
211(B:209:GLN )
212(B:210:MET )
213(B:211:GLU )
214(B:212:ILE )
215(B:213:ASP )
216(B:214:PHE )
217(B:215:LEU )
218(B:216:GLU )
219(B:217:LEU )
220(B:218:ALA )
221(B:219:MET )
222(B:220:ASP )
223(B:221:GLU )
224(B:222:PHE )
225(B:223:ILE )
226(B:224:GLU )
227(B:225:ARG )
228(B:226:TYR )
229(B:227:LYS )
230(B:228:LEU )
231(B:229:GLU )
232(B:230:GLY )
233(B:231:TYR )
234(B:232:ALA )
235(B:233:PHE )
236(B:234:GLU )
237(B:235:HIS )
238(B:236:ILE )
239(B:237:VAL )
240(B:238:TYR )
241(B:239:GLY )
242(B:240:ASP )
243(B:241:PHE )
244(B:242:SER )
245(B:243:HIS )
246(B:244:SER )
247(B:245:GLN )
248(B:246:LEU )
249(B:247:GLY )
250(B:248:GLY )
251(B:249:LEU )
252(B:250:HIS )
253(B:251:LEU )
254(B:252:LEU )
255(B:253:ILE )
256(B:254:GLY )
257(B:255:LEU )
258(B:256:ALA )
259(B:257:LYS )
260(B:258:ARG )
261(B:259:PHE )
262(B:260:LYS )
263(B:261:GLU )
264(B:262:SER )
265(B:263:PRO )
266(B:264:PHE )
267(B:265:GLU )
268(B:266:LEU )
269(B:267:GLU )
270(B:268:ASP )
271(B:269:PHE )
272(B:270:ILE )
273(B:271:PRO )
274(B:272:MET )
275(B:273:ASP )
276(B:274:SER )
277(B:275:THR )
278(B:276:VAL )
279(B:277:LYS )
280(B:278:ASN )
281(B:279:TYR )
282(B:280:PHE )
283(B:281:ILE )
284(B:282:THR )
285(B:283:ASP )
286(B:284:ALA )
287(B:285:GLN )
288(B:286:THR )
289(B:287:GLY )
290(B:288:SER )
291(B:289:SER )
292(B:290:LYS )
293(B:291:CYS )
294(B:292:VAL )
295(B:293:CYS )
296(B:294:SER )
297(B:295:VAL )
298(B:296:ILE )
299(B:297:ASP )
300(B:298:LEU )
301(B:299:LEU )
302(B:300:LEU )
303(B:301:ASP )
304(B:302:ASP )
305(B:303:PHE )
306(B:304:VAL )
307(B:305:GLU )
308(B:306:ILE )
309(B:307:ILE )
310(B:308:LYS )
311(B:309:SER )
312(B:310:GLN )
313(B:311:ASP )
314(B:312:LEU )
315(B:313:SER )
316(B:314:VAL )
317(B:315:VAL )
318(B:316:SER )
319(B:317:LYS )
320(B:318:VAL )
321(B:319:VAL )
322(B:320:LYS )
323(B:321:VAL )
324(B:322:THR )
325(B:323:ILE )
326(B:324:ASP )
327(B:325:TYR )
328(B:326:THR )
329(B:327:GLU )
330(B:328:ILE )
331(B:329:SER )
332(B:330:PHE )
333(B:331:MET )
334(B:332:LEU )
335(B:333:TRP )
336(B:334:CYS )
337(B:335:LYS )
338(B:336:ASP )
339(B:337:GLY )
340(B:338:HIS )
341(B:339:VAL )
342(B:340:GLU )
343(B:341:THR )
344(B:342:PHE )
345(B:343:TYR )
346(B:344:PRO )
347(B:345:LYS )
348(B:346:LEU )
349(B:347:GLN )
350(B:601:HOH )
351(B:602:HOH )
352(B:603:HOH )
353(B:604:HOH )
354(B:605:HOH )
355(B:606:HOH )
356(B:607:HOH )
2(B:0:HIS )
3(B:1:MET )
4(B:2:SER )
5(B:3:LEU )
6(B:4:GLU )
7(B:5:ASN )
8(B:6:VAL )
9(B:7:ALA )
10(B:8:PHE )
11(B:9:ASN )
12(B:10:VAL )
13(B:11:VAL )
14(B:12:ASN )
15(B:13:LYS )
16(B:14:GLY )
17(B:15:HIS )
18(B:16:PHE )
19(B:17:ASP )
20(B:18:GLY )
21(B:19:GLN )
22(B:20:GLN )
23(B:21:GLY )
24(B:22:GLU )
25(B:23:VAL )
26(B:24:PRO )
27(B:25:VAL )
28(B:26:SER )
29(B:27:ILE )
30(B:28:ILE )
31(B:29:ASN )
32(B:30:ASN )
33(B:31:THR )
34(B:32:VAL )
35(B:33:TYR )
36(B:34:THR )
37(B:35:LYS )
38(B:36:VAL )
39(B:37:ASP )
40(B:38:GLY )
41(B:39:VAL )
42(B:40:ASP )
43(B:41:VAL )
44(B:42:GLU )
45(B:43:LEU )
46(B:44:PHE )
47(B:45:GLU )
48(B:46:ASN )
49(B:47:LYS )
50(B:48:THR )
51(B:49:THR )
52(B:50:LEU )
53(B:51:PRO )
54(B:52:VAL )
55(B:53:ASN )
56(B:54:VAL )
57(B:55:ALA )
58(B:56:PHE )
59(B:57:GLU )
60(B:58:LEU )
61(B:59:TRP )
62(B:60:ALA )
63(B:61:LYS )
64(B:62:ARG )
65(B:63:ASN )
66(B:64:ILE )
67(B:65:LYS )
68(B:66:PRO )
69(B:67:VAL )
70(B:68:PRO )
71(B:69:GLU )
72(B:70:VAL )
73(B:71:LYS )
74(B:72:ILE )
75(B:73:LEU )
76(B:74:ASN )
77(B:75:ASN )
78(B:76:LEU )
79(B:77:GLY )
80(B:78:VAL )
81(B:79:ASP )
82(B:80:ILE )
83(B:81:ALA )
84(B:82:ALA )
85(B:83:ASN )
86(B:84:THR )
87(B:85:VAL )
88(B:86:ILE )
89(B:87:TRP )
90(B:88:ASP )
91(B:89:TYR )
92(B:90:LYS )
93(B:91:ARG )
94(B:92:ASP )
95(B:93:ALA )
96(B:94:PRO )
97(B:95:ALA )
98(B:96:HIS )
99(B:97:ILE )
100(B:98:SER )
101(B:99:THR )
102(B:100:ILE )
103(B:101:GLY )
104(B:102:VAL )
105(B:103:CYS )
106(B:104:SER )
107(B:105:MET )
108(B:106:THR )
109(B:107:ASP )
110(B:108:ILE )
111(B:109:ALA )
112(B:110:LYS )
113(B:111:LYS )
114(B:112:PRO )
115(B:113:THR )
116(B:114:GLU )
117(B:115:THR )
118(B:116:ILE )
119(B:117:CYS )
120(B:118:ALA )
121(B:119:PRO )
122(B:120:LEU )
123(B:121:THR )
124(B:122:VAL )
125(B:123:PHE )
126(B:124:PHE )
127(B:125:ASP )
128(B:126:GLY )
129(B:127:ARG )
130(B:128:VAL )
131(B:129:ASP )
132(B:130:GLY )
133(B:131:GLN )
134(B:132:VAL )
135(B:133:ASP )
136(B:134:LEU )
137(B:135:PHE )
138(B:136:ARG )
139(B:137:ASN )
140(B:138:ALA )
141(B:139:ARG )
142(B:140:ASN )
143(B:141:GLY )
144(B:142:VAL )
145(B:143:LEU )
146(B:144:ILE )
147(B:145:THR )
148(B:146:GLU )
149(B:147:GLY )
150(B:148:SER )
151(B:149:VAL )
152(B:150:LYS )
153(B:151:GLY )
154(B:152:LEU )
155(B:153:GLN )
156(B:154:PRO )
157(B:155:SER )
158(B:156:VAL )
159(B:157:GLY )
160(B:158:PRO )
161(B:159:LYS )
162(B:160:GLN )
163(B:161:ALA )
164(B:162:SER )
165(B:163:LEU )
166(B:164:ASN )
167(B:165:GLY )
168(B:166:VAL )
169(B:167:THR )
170(B:168:LEU )
171(B:169:ILE )
172(B:170:GLY )
173(B:171:GLU )
174(B:172:ALA )
175(B:173:VAL )
176(B:174:LYS )
177(B:175:THR )
178(B:176:GLN )
179(B:177:PHE )
180(B:178:ASN )
181(B:179:TYR )
182(B:180:TYR )
183(B:181:LYS )
184(B:182:LYS )
185(B:183:VAL )
186(B:184:ASP )
187(B:185:GLY )
188(B:186:VAL )
189(B:187:VAL )
190(B:188:GLN )
191(B:189:GLN )
192(B:190:LEU )
193(B:191:PRO )
194(B:192:GLU )
195(B:193:THR )
196(B:194:TYR )
197(B:195:PHE )
198(B:196:THR )
199(B:197:GLN )
200(B:198:SER )
201(B:199:ARG )
202(B:200:ASN )
203(B:201:LEU )
204(B:202:GLN )
205(B:203:GLU )
206(B:204:PHE )
207(B:205:LYS )
208(B:206:PRO )
209(B:207:ARG )
210(B:208:SER )
211(B:209:GLN )
212(B:210:MET )
213(B:211:GLU )
214(B:212:ILE )
215(B:213:ASP )
216(B:214:PHE )
217(B:215:LEU )
218(B:216:GLU )
219(B:217:LEU )
220(B:218:ALA )
221(B:219:MET )
222(B:220:ASP )
223(B:221:GLU )
224(B:222:PHE )
225(B:223:ILE )
226(B:224:GLU )
227(B:225:ARG )
228(B:226:TYR )
229(B:227:LYS )
230(B:228:LEU )
231(B:229:GLU )
232(B:230:GLY )
233(B:231:TYR )
234(B:232:ALA )
235(B:233:PHE )
236(B:234:GLU )
237(B:235:HIS )
238(B:236:ILE )
239(B:237:VAL )
240(B:238:TYR )
241(B:239:GLY )
242(B:240:ASP )
243(B:241:PHE )
244(B:242:SER )
245(B:243:HIS )
246(B:244:SER )
247(B:245:GLN )
248(B:246:LEU )
249(B:247:GLY )
250(B:248:GLY )
251(B:249:LEU )
252(B:250:HIS )
253(B:251:LEU )
254(B:252:LEU )
255(B:253:ILE )
256(B:254:GLY )
257(B:255:LEU )
258(B:256:ALA )
259(B:257:LYS )
260(B:258:ARG )
261(B:259:PHE )
262(B:260:LYS )
263(B:261:GLU )
264(B:262:SER )
265(B:263:PRO )
266(B:264:PHE )
267(B:265:GLU )
268(B:266:LEU )
269(B:267:GLU )
270(B:268:ASP )
271(B:269:PHE )
272(B:270:ILE )
273(B:271:PRO )
274(B:272:MET )
275(B:273:ASP )
276(B:274:SER )
277(B:275:THR )
278(B:276:VAL )
279(B:277:LYS )
280(B:278:ASN )
281(B:279:TYR )
282(B:280:PHE )
283(B:281:ILE )
284(B:282:THR )
285(B:283:ASP )
286(B:284:ALA )
287(B:285:GLN )
288(B:286:THR )
289(B:287:GLY )
290(B:288:SER )
291(B:289:SER )
292(B:290:LYS )
293(B:291:CYS )
294(B:292:VAL )
295(B:293:CYS )
296(B:294:SER )
297(B:295:VAL )
298(B:296:ILE )
299(B:297:ASP )
300(B:298:LEU )
301(B:299:LEU )
302(B:300:LEU )
303(B:301:ASP )
304(B:302:ASP )
305(B:303:PHE )
306(B:304:VAL )
307(B:305:GLU )
308(B:306:ILE )
309(B:307:ILE )
310(B:308:LYS )
311(B:309:SER )
312(B:310:GLN )
313(B:311:ASP )
314(B:312:LEU )
315(B:313:SER )
316(B:314:VAL )
317(B:315:VAL )
318(B:316:SER )
319(B:317:LYS )
320(B:318:VAL )
321(B:319:VAL )
322(B:320:LYS )
323(B:321:VAL )
324(B:322:THR )
325(B:323:ILE )
326(B:324:ASP )
327(B:325:TYR )
328(B:326:THR )
329(B:327:GLU )
330(B:328:ILE )
331(B:329:SER )
332(B:330:PHE )
333(B:331:MET )
334(B:332:LEU )
335(B:333:TRP )
336(B:334:CYS )
337(B:335:LYS )
338(B:336:ASP )
339(B:337:GLY )
340(B:338:HIS )
341(B:339:VAL )
342(B:340:GLU )
343(B:341:THR )
344(B:342:PHE )
345(B:343:TYR )
346(B:344:PRO )
347(B:345:LYS )
348(B:346:LEU )
349(B:347:GLN )
350(B:601:HOH )
351(B:602:HOH )
352(B:603:HOH )
353(B:604:HOH )
354(B:605:HOH )
355(B:606:HOH )
356(B:607:HOH )