ADA-UCB-6c2cb422-1

Data

Transformations

RUN	Initial microstate				Final microstate				ΔΔG / kcal M-1	Work distributions	Convergence
RUN1317	ADA-UCB-6c2cb422-1_1		sdf	pdb	PET-UNK-12d8d43f-2_1		sdf	pdb	−8.1 ± 0.3
RUN1308	ADA-UCB-6c2cb422-1_1		sdf	pdb	DAR-DIA-56cf811e-1_1		sdf	pdb	−8.1 ± 0.3
RUN1300	ADA-UCB-6c2cb422-1_1		sdf	pdb	JOH-UNI-a38a7bdd-7_2		sdf	pdb	−4.5 ± 0.3
RUN886	ADA-UCB-6c2cb422-1_1		sdf	pdb	TRY-UNI-9f475305-8_1		sdf	pdb	−4.3 ± 0.3
RUN1077	ADA-UCB-6c2cb422-1_1		sdf	pdb	MAT-POS-bfb445d4-2_1		sdf	pdb	−4.0 ± 0.2
RUN1393	ADA-UCB-6c2cb422-1_1		sdf	pdb	EDJ-MED-ee07cf00-13_2		sdf	pdb	−3.4 ± 0.3
RUN1110	ADA-UCB-6c2cb422-1_1		sdf	pdb	EDJ-MED-c8e7a002-17_1		sdf	pdb	−3.2 ± 0.2
RUN1312	ADA-UCB-6c2cb422-1_1		sdf	pdb	JOH-UNI-a38a7bdd-7_3		sdf	pdb	−3.1 ± 0.3
RUN1095	ADA-UCB-6c2cb422-1_1		sdf	pdb	EDJ-MED-c8e7a002-1_1		sdf	pdb	−3.0 ± 0.2
RUN1056	ADA-UCB-6c2cb422-1_1		sdf	pdb	MAT-POS-bb423b95-7_1		sdf	pdb	−3.0 ± 0.4
RUN1355	ADA-UCB-6c2cb422-1_1		sdf	pdb	JOH-UNI-3fc3434e-7_2		sdf	pdb	−3.0 ± 0.5
RUN1247	ADA-UCB-6c2cb422-1_1		sdf	pdb	MIC-UNK-67d4a29a-3_1		sdf	pdb	−2.7 ± 0.5
RUN920	ADA-UCB-6c2cb422-1_1		sdf	pdb	BAR-COM-0f94fc3d-24_1		sdf	pdb	−2.7 ± 0.2
RUN1297	ADA-UCB-6c2cb422-1_1		sdf	pdb	JOH-UNI-ee5ed7c8-5_1		sdf	pdb	−2.7 ± 0.5
RUN1250	ADA-UCB-6c2cb422-1_1		sdf	pdb	MIC-UNK-67d4a29a-2_1		sdf	pdb	−2.6 ± 0.5
RUN970	ADA-UCB-6c2cb422-1_1		sdf	pdb	ALP-POS-3fc1724e-8_2		sdf	pdb	−2.5 ± 0.4
RUN1238	ADA-UCB-6c2cb422-1_1		sdf	pdb	MIC-UNK-5a93dd5f-12_7		sdf	pdb	−2.5 ± 0.2
RUN1440	ADA-UCB-6c2cb422-1_1		sdf	pdb	JIN-POS-6dc588a4-16_1		sdf	pdb	−2.4 ± 0.2
RUN1377	ADA-UCB-6c2cb422-1_1		sdf	pdb	EDJ-MED-ee07cf00-9_2		sdf	pdb	−2.4 ± 0.4
RUN851	ADA-UCB-6c2cb422-1_1		sdf	pdb	JAN-GHE-5a013bed-2_1		sdf	pdb	−2.4 ± 0.1
RUN1473	ADA-UCB-6c2cb422-1_1		sdf	pdb	RUB-POS-1325a9ea-18_1		sdf	pdb	−2.32 ± 0.03
RUN1246	ADA-UCB-6c2cb422-1_1		sdf	pdb	MIC-UNK-67d4a29a-1_1		sdf	pdb	−2.3 ± 0.6
RUN1109	ADA-UCB-6c2cb422-1_1		sdf	pdb	EDJ-MED-c8e7a002-13_1		sdf	pdb	−2.3 ± 0.2
RUN861	ADA-UCB-6c2cb422-1_1		sdf	pdb	BAR-COM-ebf5acce-14_1		sdf	pdb	−2.3 ± 0.3
RUN819	ADA-UCB-6c2cb422-1_1		sdf	pdb	JAN-GHE-83b26c96-7_1		sdf	pdb	−2.2 ± 0.2
RUN993	ADA-UCB-6c2cb422-1_1		sdf	pdb	ALP-POS-3b848b35-4_2		sdf	pdb	−2.1 ± 0.4
RUN1189	ADA-UCB-6c2cb422-1_1		sdf	pdb	MIC-UNK-5a93dd5f-3_1		sdf	pdb	−2.0 ± 0.2
RUN1134	ADA-UCB-6c2cb422-1_1		sdf	pdb	EDJ-MED-97c1bf5c-2_1		sdf	pdb	−2.0 ± 0.3
RUN1383	ADA-UCB-6c2cb422-1_1		sdf	pdb	EDJ-MED-ee07cf00-6_3		sdf	pdb	−1.9 ± 0.3
RUN1020	ADA-UCB-6c2cb422-1_1		sdf	pdb	MIC-UNK-c66144cb-3_2		sdf	pdb	−1.9 ± 0.3
RUN1483	ADA-UCB-6c2cb422-1_1		sdf	pdb	VLA-UNK-dc1d9354-1_1		sdf	pdb	−1.8 ± 0.2
RUN1119	ADA-UCB-6c2cb422-1_1		sdf	pdb	RIT-UNK-fa3975ff-1_2		sdf	pdb	−1.8 ± 0.4
RUN1531	ADA-UCB-6c2cb422-1_1		sdf	pdb	PET-UNK-1320d94d-21_1		sdf	pdb	−1.8 ± 0.3
RUN1318	ADA-UCB-6c2cb422-1_1		sdf	pdb	DAR-DIA-076fb6ea-3_1		sdf	pdb	−1.8 ± 0.4
RUN1523	ADA-UCB-6c2cb422-1_1		sdf	pdb	PET-UNK-10339a1d-1_1		sdf	pdb	−1.8 ± 0.3
RUN1000	ADA-UCB-6c2cb422-1_1		sdf	pdb	JAN-GHE-f4ca5a00-18_2		sdf	pdb	−1.8 ± 0.2
RUN1001	ADA-UCB-6c2cb422-1_1		sdf	pdb	JAN-GHE-f4ca5a00-20_2		sdf	pdb	−1.7 ± 0.2
RUN1291	ADA-UCB-6c2cb422-1_1		sdf	pdb	JOH-UNI-a38a7bdd-3_1		sdf	pdb	−1.7 ± 0.3
RUN1484	ADA-UCB-6c2cb422-1_1		sdf	pdb	VLA-UNK-411a133b-1_1		sdf	pdb	−1.7 ± 0.2
RUN1502	ADA-UCB-6c2cb422-1_1		sdf	pdb	EDJ-MED-cf4b0d25-1_1		sdf	pdb	−1.7 ± 0.3
RUN1263	ADA-UCB-6c2cb422-1_1		sdf	pdb	DAR-DIA-076fb6ea-6_1		sdf	pdb	−1.7 ± 0.3
RUN863	ADA-UCB-6c2cb422-1_1		sdf	pdb	TRY-UNI-9f475305-3_2		sdf	pdb	−1.7 ± 0.1
RUN1253	ADA-UCB-6c2cb422-1_1		sdf	pdb	MAK-UNK-c749d764-22_6		sdf	pdb	−1.7 ± 0.3
RUN848	ADA-UCB-6c2cb422-1_1		sdf	pdb	JAN-GHE-5a013bed-9_1		sdf	pdb	−1.6 ± 0.1
RUN1397	ADA-UCB-6c2cb422-1_1		sdf	pdb	EDJ-MED-ee07cf00-11_5		sdf	pdb	−1.6 ± 0.3
RUN865	ADA-UCB-6c2cb422-1_1		sdf	pdb	JAN-GHE-5a013bed-4_1		sdf	pdb	−1.6 ± 0.2
RUN1043	ADA-UCB-6c2cb422-1_1		sdf	pdb	MIC-UNK-d36ab305-4_2		sdf	pdb	−1.6 ± 0.3
RUN1249	ADA-UCB-6c2cb422-1_1		sdf	pdb	MIC-UNK-67d4a29a-4_1		sdf	pdb	−1.6 ± 0.4
RUN944	ADA-UCB-6c2cb422-1_1		sdf	pdb	SAM-UNK-2684b532-3_2		sdf	pdb	−1.5 ± 0.2
RUN1512	ADA-UCB-6c2cb422-1_1		sdf	pdb	EDJ-MED-076d6e64-1_1		sdf	pdb	−1.5 ± 0.2
RUN835	ADA-UCB-6c2cb422-1_1		sdf	pdb	JAN-GHE-83b26c96-15_1		sdf	pdb	−1.5 ± 0.2
RUN1385	ADA-UCB-6c2cb422-1_1		sdf	pdb	EDJ-MED-ee07cf00-11_1		sdf	pdb	−1.4 ± 0.3
RUN1382	ADA-UCB-6c2cb422-1_1		sdf	pdb	EDJ-MED-ee07cf00-6_4		sdf	pdb	−1.4 ± 0.4
RUN1366	ADA-UCB-6c2cb422-1_1		sdf	pdb	EDJ-MED-ee07cf00-2_2		sdf	pdb	−1.4 ± 0.3
RUN1380	ADA-UCB-6c2cb422-1_1		sdf	pdb	VLA-UNK-9a7dc93f-7_1		sdf	pdb	−1.42 ± 0.07
RUN1406	ADA-UCB-6c2cb422-1_1		sdf	pdb	EDJ-MED-ee07cf00-5_1		sdf	pdb	−1.4 ± 0.4
RUN1281	ADA-UCB-6c2cb422-1_1		sdf	pdb	MAK-UNK-c749d764-6_4		sdf	pdb	−1.4 ± 0.4
RUN1376	ADA-UCB-6c2cb422-1_1		sdf	pdb	EDJ-MED-ee07cf00-9_1		sdf	pdb	−1.4 ± 0.3
RUN1061	ADA-UCB-6c2cb422-1_1		sdf	pdb	MAT-POS-bb423b95-8_1		sdf	pdb	−1.4 ± 0.2
RUN1279	ADA-UCB-6c2cb422-1_1		sdf	pdb	DAR-DIA-076fb6ea-7_1		sdf	pdb	−1.4 ± 0.2
RUN1044	ADA-UCB-6c2cb422-1_1		sdf	pdb	MIC-UNK-c66144cb-2_2		sdf	pdb	−1.3 ± 0.3
RUN1409	ADA-UCB-6c2cb422-1_1		sdf	pdb	EDJ-MED-ee07cf00-12_1		sdf	pdb	−1.3 ± 0.3
RUN1334	ADA-UCB-6c2cb422-1_1		sdf	pdb	JOH-UNI-ee5ed7c8-6_2		sdf	pdb	−1.3 ± 0.2
RUN1192	ADA-UCB-6c2cb422-1_1		sdf	pdb	MAK-UNK-ffc90da7-4_6		sdf	pdb	−1.2 ± 0.4
RUN1501	ADA-UCB-6c2cb422-1_1		sdf	pdb	PET-UNK-6314f867-3_1		sdf	pdb	−1.2 ± 0.2
RUN1411	ADA-UCB-6c2cb422-1_1		sdf	pdb	EDJ-MED-ee07cf00-4_4		sdf	pdb	−1.2 ± 0.3
RUN1234	ADA-UCB-6c2cb422-1_1		sdf	pdb	MIC-UNK-5a93dd5f-12_1		sdf	pdb	−1.2 ± 0.3
RUN1309	ADA-UCB-6c2cb422-1_1		sdf	pdb	PET-UNK-12d8d43f-1_1		sdf	pdb	−1.2 ± 0.2
RUN1100	ADA-UCB-6c2cb422-1_1		sdf	pdb	EDJ-MED-c8e7a002-8_1		sdf	pdb	−1.2 ± 0.3
RUN1204	ADA-UCB-6c2cb422-1_1		sdf	pdb	MAK-UNK-ffc90da7-4_8		sdf	pdb	−1.2 ± 0.4
RUN1416	ADA-UCB-6c2cb422-1_1		sdf	pdb	MAT-POS-a13804f0-1_3		sdf	pdb	−1.2 ± 0.3
RUN1047	ADA-UCB-6c2cb422-1_1		sdf	pdb	MIC-UNK-c66144cb-1_2		sdf	pdb	−1.2 ± 0.5
RUN1365	ADA-UCB-6c2cb422-1_1		sdf	pdb	EDJ-MED-ee07cf00-1_2		sdf	pdb	−1.1 ± 0.3
RUN1121	ADA-UCB-6c2cb422-1_1		sdf	pdb	PET-UNK-5ecb6237-1_1		sdf	pdb	−1.1 ± 0.2
RUN1098	ADA-UCB-6c2cb422-1_1		sdf	pdb	VLA-UCB-05e51b3f-15_1		sdf	pdb	−1.1 ± 0.3
RUN1530	ADA-UCB-6c2cb422-1_1		sdf	pdb	PET-UNK-1320d94d-22_1		sdf	pdb	−1.1 ± 0.3
RUN1398	ADA-UCB-6c2cb422-1_1		sdf	pdb	EDJ-MED-ee07cf00-15_1		sdf	pdb	−1.1 ± 0.4
RUN1394	ADA-UCB-6c2cb422-1_1		sdf	pdb	EDJ-MED-ee07cf00-11_7		sdf	pdb	−1.1 ± 0.3
RUN1273	ADA-UCB-6c2cb422-1_1		sdf	pdb	MAK-UNK-c749d764-22_8		sdf	pdb	−1.0 ± 0.3
RUN1272	ADA-UCB-6c2cb422-1_1		sdf	pdb	DAR-DIA-076fb6ea-9_2		sdf	pdb	−1.0 ± 0.6
RUN1522	ADA-UCB-6c2cb422-1_1		sdf	pdb	ALP-POS-a9ad2217-2_1		sdf	pdb	−1.0 ± 0.3
RUN1389	ADA-UCB-6c2cb422-1_1		sdf	pdb	EDJ-MED-ee07cf00-11_3		sdf	pdb	−1.0 ± 0.3
RUN958	ADA-UCB-6c2cb422-1_1		sdf	pdb	JAN-GHE-f4ca5a00-17_1		sdf	pdb	−1.0 ± 0.2
RUN1488	ADA-UCB-6c2cb422-1_1		sdf	pdb	ROB-UNI-daaf9793-3_1		sdf	pdb	−1.0 ± 0.3
RUN1327	ADA-UCB-6c2cb422-1_1		sdf	pdb	PET-UNK-6c2be958-1_1		sdf	pdb	−0.9 ± 0.3
RUN932	ADA-UCB-6c2cb422-1_1		sdf	pdb	SAM-UNK-2684b532-1_2		sdf	pdb	−0.9 ± 0.3
RUN1286	ADA-UCB-6c2cb422-1_1		sdf	pdb	JOH-UNI-a38a7bdd-1_1		sdf	pdb	−0.8 ± 0.3
RUN891	ADA-UCB-6c2cb422-1_1		sdf	pdb	TRY-UNI-9f475305-8_2		sdf	pdb	−0.8 ± 0.4
RUN1526	ADA-UCB-6c2cb422-1_1		sdf	pdb	PET-UNK-1320d94d-1_1		sdf	pdb	−0.8 ± 0.3
RUN1449	ADA-UCB-6c2cb422-1_1		sdf	pdb	JIN-POS-6dc588a4-17_1		sdf	pdb	−0.8 ± 0.2
RUN1063	ADA-UCB-6c2cb422-1_1		sdf	pdb	MAT-POS-f7918075-3_1		sdf	pdb	−0.75 ± 0.06
RUN868	ADA-UCB-6c2cb422-1_1		sdf	pdb	TRY-UNI-9f475305-3_1		sdf	pdb	−0.7 ± 0.2
RUN1504	ADA-UCB-6c2cb422-1_1		sdf	pdb	EDJ-MED-cf4b0d25-1_2		sdf	pdb	−0.7 ± 0.3
RUN1368	ADA-UCB-6c2cb422-1_1		sdf	pdb	EDJ-MED-ee07cf00-3_2		sdf	pdb	−0.7 ± 0.3
RUN1207	ADA-UCB-6c2cb422-1_1		sdf	pdb	MAK-UNK-ffc90da7-1_4		sdf	pdb	−0.7 ± 0.4
RUN1268	ADA-UCB-6c2cb422-1_1		sdf	pdb	JOH-UNI-a38a7bdd-2_1		sdf	pdb	−0.7 ± 0.5
RUN1113	ADA-UCB-6c2cb422-1_1		sdf	pdb	EDJ-MED-c8e7a002-16_1		sdf	pdb	−0.6 ± 0.2
RUN939	ADA-UCB-6c2cb422-1_1		sdf	pdb	SAM-UNK-2684b532-3_1		sdf	pdb	−0.6 ± 0.3
RUN972	ADA-UCB-6c2cb422-1_1		sdf	pdb	ALP-POS-3fc1724e-8_1		sdf	pdb	−0.6 ± 0.5
RUN1515	ADA-UCB-6c2cb422-1_1		sdf	pdb	EDJ-MED-cf4b0d25-5_2		sdf	pdb	−0.6 ± 0.3
RUN1533	ADA-UCB-6c2cb422-1_1		sdf	pdb	PET-UNK-1320d94d-8_1		sdf	pdb	−0.6 ± 0.4
RUN1527	ADA-UCB-6c2cb422-1_1		sdf	pdb	PET-UNK-1320d94d-7_1		sdf	pdb	−0.5 ± 0.3
RUN1335	ADA-UCB-6c2cb422-1_1		sdf	pdb	JOH-UNI-3fc3434e-5_1		sdf	pdb	−0.5 ± 0.4
RUN1039	ADA-UCB-6c2cb422-1_1		sdf	pdb	MIC-UNK-d36ab305-1_1		sdf	pdb	−0.5 ± 0.3
RUN1280	ADA-UCB-6c2cb422-1_1		sdf	pdb	DAR-DIA-076fb6ea-16_1		sdf	pdb	−0.5 ± 0.2
RUN1314	ADA-UCB-6c2cb422-1_1		sdf	pdb	JOH-UNI-a38a7bdd-7_4		sdf	pdb	−0.5 ± 0.3
RUN1424	ADA-UCB-6c2cb422-1_1		sdf	pdb	EDJ-MED-cf4b0d25-3_2		sdf	pdb	−0.5 ± 0.4
RUN1275	ADA-UCB-6c2cb422-1_1		sdf	pdb	DAR-DIA-076fb6ea-9_1		sdf	pdb	−0.5 ± 0.6
RUN1041	ADA-UCB-6c2cb422-1_1		sdf	pdb	MIC-UNK-d36ab305-1_2		sdf	pdb	−0.5 ± 0.2
RUN943	ADA-UCB-6c2cb422-1_1		sdf	pdb	ABI-SAT-4d06482b-2_1		sdf	pdb	−0.4 ± 0.2
RUN1525	ADA-UCB-6c2cb422-1_1		sdf	pdb	EDJ-MED-cf4b0d25-5_1		sdf	pdb	−0.4 ± 0.4
RUN1137	ADA-UCB-6c2cb422-1_1		sdf	pdb	MIC-UNK-50cce87d-2_1		sdf	pdb	−0.4 ± 0.2
RUN849	ADA-UCB-6c2cb422-1_1		sdf	pdb	JAN-GHE-5a013bed-1_1		sdf	pdb	−0.4 ± 0.2
RUN1092	ADA-UCB-6c2cb422-1_1		sdf	pdb	VLA-UCB-05e51b3f-16_1		sdf	pdb	−0.4 ± 0.3
RUN1353	ADA-UCB-6c2cb422-1_1		sdf	pdb	RAL-THA-2d450e86-22_1		sdf	pdb	−0.3 ± 0.2
RUN876	ADA-UCB-6c2cb422-1_1		sdf	pdb	EDG-MED-0da5ad92-18_1		sdf	pdb	−0.3 ± 0.1
RUN1270	ADA-UCB-6c2cb422-1_1		sdf	pdb	JOH-UNI-a38a7bdd-4_1		sdf	pdb	−0.2 ± 0.3
RUN1191	ADA-UCB-6c2cb422-1_1		sdf	pdb	MAK-UNK-ffc90da7-4_5		sdf	pdb	−0.2 ± 0.4
RUN1509	ADA-UCB-6c2cb422-1_1		sdf	pdb	PET-UNK-e274cad4-1_1		sdf	pdb	−0.2 ± 0.2
RUN1157	ADA-UCB-6c2cb422-1_1		sdf	pdb	MIC-UNK-5a93dd5f-1_3		sdf	pdb	−0.2 ± 0.4
RUN1167	ADA-UCB-6c2cb422-1_1		sdf	pdb	MAK-UNK-ffc90da7-9_4		sdf	pdb	−0.2 ± 0.3
RUN1244	ADA-UCB-6c2cb422-1_1		sdf	pdb	MIC-UNK-5a93dd5f-12_5		sdf	pdb	−0.2 ± 0.2
RUN1363	ADA-UCB-6c2cb422-1_1		sdf	pdb	EDJ-MED-ee07cf00-1_1		sdf	pdb	−0.2 ± 0.3
RUN838	ADA-UCB-6c2cb422-1_1		sdf	pdb	ALP-POS-95b75b4d-6_1		sdf	pdb	−0.2 ± 0.2
RUN1343	ADA-UCB-6c2cb422-1_1		sdf	pdb	JOH-UNI-3fc3434e-12_1		sdf	pdb	−0.2 ± 0.2
RUN1068	ADA-UCB-6c2cb422-1_1		sdf	pdb	MAT-POS-f7918075-5_1		sdf	pdb	−0.16 ± 0.02
RUN1407	ADA-UCB-6c2cb422-1_1		sdf	pdb	EDJ-MED-ee07cf00-18_2		sdf	pdb	−0.2 ± 0.4
RUN928	ADA-UCB-6c2cb422-1_1		sdf	pdb	SAM-UNK-2684b532-1_1		sdf	pdb	−0.2 ± 0.2
RUN1252	ADA-UCB-6c2cb422-1_1		sdf	pdb	NAU-LAT-2fed8305-1_1		sdf	pdb	−0.14 ± 0.07
RUN1370	ADA-UCB-6c2cb422-1_1		sdf	pdb	EDJ-MED-ee07cf00-2_1		sdf	pdb	−0.1 ± 0.4
RUN988	ADA-UCB-6c2cb422-1_1		sdf	pdb	EDJ-MED-00c1612e-1_1		sdf	pdb	−0.1 ± 0.2
RUN1419	ADA-UCB-6c2cb422-1_1		sdf	pdb	MAT-POS-a13804f0-4_1		sdf	pdb	−0.1 ± 0.3
RUN1506	ADA-UCB-6c2cb422-1_1		sdf	pdb	PET-UNK-f4e47ebd-1_1		sdf	pdb	−0.1 ± 0.2
RUN1242	ADA-UCB-6c2cb422-1_1		sdf	pdb	MIC-UNK-5a93dd5f-12_3		sdf	pdb	−0.1 ± 0.3
RUN1139	ADA-UCB-6c2cb422-1_1		sdf	pdb	MIC-UNK-50cce87d-3_1		sdf	pdb	−0.1 ± 0.2
RUN1005	ADA-UCB-6c2cb422-1_1		sdf	pdb	PET-UNK-8df914d1-1_1		sdf	pdb	−0.1 ± 0.2
RUN847	ADA-UCB-6c2cb422-1_1		sdf	pdb	EDG-MED-0da5ad92-1_1		sdf	pdb	−0.1 ± 0.2
RUN1507	ADA-UCB-6c2cb422-1_1		sdf	pdb	PET-UNK-f4e47ebd-2_1		sdf	pdb	−0.0 ± 0.4
RUN1190	ADA-UCB-6c2cb422-1_1		sdf	pdb	MIC-UNK-5a93dd5f-3_14		sdf	pdb	−0.0 ± 0.6
RUN1054	ADA-UCB-6c2cb422-1_1		sdf	pdb	MAT-POS-bb423b95-1_1		sdf	pdb	−0.03 ± 0.03
RUN1322	ADA-UCB-6c2cb422-1_1		sdf	pdb	JOH-UNI-3fc3434e-1_1		sdf	pdb	−0.0 ± 0.3
RUN1400	ADA-UCB-6c2cb422-1_1		sdf	pdb	EDJ-MED-ee07cf00-14_2		sdf	pdb	−0.0 ± 0.4
RUN951	ADA-UCB-6c2cb422-1_1		sdf	pdb	ADA-UCB-6c2cb422-1_1		sdf	pdb	0.001 ± 0.004
RUN1528	ADA-UCB-6c2cb422-1_1		sdf	pdb	PET-UNK-1320d94d-2_1		sdf	pdb	0.0 ± 0.3
RUN1423	ADA-UCB-6c2cb422-1_1		sdf	pdb	MAT-POS-a13804f0-4_2		sdf	pdb	0.0 ± 0.3
RUN1454	ADA-UCB-6c2cb422-1_1		sdf	pdb	RUB-POS-1325a9ea-2_1		sdf	pdb	0.04 ± 0.02
RUN956	ADA-UCB-6c2cb422-1_1		sdf	pdb	JAN-GHE-f4ca5a00-14_1		sdf	pdb	0.0 ± 0.2
RUN1188	ADA-UCB-6c2cb422-1_1		sdf	pdb	MIC-UNK-5a93dd5f-3_3		sdf	pdb	0.1 ± 0.4
RUN994	ADA-UCB-6c2cb422-1_1		sdf	pdb	JAN-GHE-f4ca5a00-20_1		sdf	pdb	0.1 ± 0.2
RUN1144	ADA-UCB-6c2cb422-1_1		sdf	pdb	PET-UNK-a692de38-1_1		sdf	pdb	0.1 ± 0.3
RUN1143	ADA-UCB-6c2cb422-1_1		sdf	pdb	MIC-UNK-50cce87d-1_1		sdf	pdb	0.08 ± 0.02
RUN1210	ADA-UCB-6c2cb422-1_1		sdf	pdb	MIC-UNK-5a93dd5f-5_7		sdf	pdb	0.1 ± 0.4
RUN1374	ADA-UCB-6c2cb422-1_1		sdf	pdb	EDJ-MED-ee07cf00-7_2		sdf	pdb	0.1 ± 0.5
RUN1159	ADA-UCB-6c2cb422-1_1		sdf	pdb	MIC-UNK-5a93dd5f-1_5		sdf	pdb	0.1 ± 0.4
RUN1116	ADA-UCB-6c2cb422-1_1		sdf	pdb	EDJ-MED-c8e7a002-15_1		sdf	pdb	0.1 ± 0.3
RUN1439	ADA-UCB-6c2cb422-1_1		sdf	pdb	JIN-POS-6dc588a4-13_1		sdf	pdb	0.10 ± 0.03
RUN1195	ADA-UCB-6c2cb422-1_1		sdf	pdb	MIC-UNK-5a93dd5f-3_11		sdf	pdb	0.1 ± 0.4
RUN1410	ADA-UCB-6c2cb422-1_1		sdf	pdb	PET-UNK-e8c7a26f-2_1		sdf	pdb	0.1 ± 0.3
RUN1446	ADA-UCB-6c2cb422-1_1		sdf	pdb	RUB-POS-1325a9ea-1_1		sdf	pdb	0.1 ± 0.3
RUN1230	ADA-UCB-6c2cb422-1_1		sdf	pdb	MIC-UNK-5a93dd5f-7_6		sdf	pdb	0.1 ± 0.3
RUN1283	ADA-UCB-6c2cb422-1_1		sdf	pdb	MAK-UNK-c749d764-6_3		sdf	pdb	0.2 ± 0.3
RUN1471	ADA-UCB-6c2cb422-1_1		sdf	pdb	RUB-POS-1325a9ea-17_1		sdf	pdb	0.22 ± 0.03
RUN938	ADA-UCB-6c2cb422-1_1		sdf	pdb	SAM-UNK-2684b532-6_2		sdf	pdb	0.2 ± 0.2
RUN1395	ADA-UCB-6c2cb422-1_1		sdf	pdb	EDJ-MED-ee07cf00-14_1		sdf	pdb	0.2 ± 0.4
RUN1489	ADA-UCB-6c2cb422-1_1		sdf	pdb	ROB-UNI-daaf9793-4_1		sdf	pdb	0.2 ± 0.2
RUN1266	ADA-UCB-6c2cb422-1_1		sdf	pdb	MAK-UNK-c749d764-22_5		sdf	pdb	0.2 ± 0.4
RUN1379	ADA-UCB-6c2cb422-1_1		sdf	pdb	EDJ-MED-ee07cf00-6_2		sdf	pdb	0.3 ± 0.4
RUN828	ADA-UCB-6c2cb422-1_1		sdf	pdb	JAN-GHE-83b26c96-9_1		sdf	pdb	0.3 ± 0.2
RUN889	ADA-UCB-6c2cb422-1_1		sdf	pdb	TRY-UNI-9f475305-7_1		sdf	pdb	0.3 ± 0.3
RUN1532	ADA-UCB-6c2cb422-1_1		sdf	pdb	PET-UNK-1320d94d-5_1		sdf	pdb	0.3 ± 0.4
RUN856	ADA-UCB-6c2cb422-1_1		sdf	pdb	JAN-GHE-5a013bed-3_1		sdf	pdb	0.3 ± 0.2
RUN1466	ADA-UCB-6c2cb422-1_1		sdf	pdb	RUB-POS-1325a9ea-20_1		sdf	pdb	0.3 ± 0.2
RUN1003	ADA-UCB-6c2cb422-1_1		sdf	pdb	JAN-GHE-f4ca5a00-18_1		sdf	pdb	0.3 ± 0.3
RUN1186	ADA-UCB-6c2cb422-1_1		sdf	pdb	MIC-UNK-5a93dd5f-3_9		sdf	pdb	0.3 ± 0.2
RUN1463	ADA-UCB-6c2cb422-1_1		sdf	pdb	RUB-POS-1325a9ea-16_1		sdf	pdb	0.3 ± 0.2
RUN1472	ADA-UCB-6c2cb422-1_1		sdf	pdb	RUB-POS-1325a9ea-14_1		sdf	pdb	0.3 ± 0.2
RUN1114	ADA-UCB-6c2cb422-1_1		sdf	pdb	MAT-POS-199e2e7c-2_1		sdf	pdb	0.4 ± 0.2
RUN1228	ADA-UCB-6c2cb422-1_1		sdf	pdb	MIC-UNK-5a93dd5f-9_8		sdf	pdb	0.4 ± 0.3
RUN1326	ADA-UCB-6c2cb422-1_1		sdf	pdb	DAR-DIA-076fb6ea-12_1		sdf	pdb	0.4 ± 0.7
RUN1171	ADA-UCB-6c2cb422-1_1		sdf	pdb	MAK-UNK-ffc90da7-9_2		sdf	pdb	0.4 ± 0.2
RUN821	ADA-UCB-6c2cb422-1_1		sdf	pdb	JAN-GHE-83b26c96-8_2		sdf	pdb	0.4 ± 0.2
RUN1149	ADA-UCB-6c2cb422-1_1		sdf	pdb	MIC-UNK-5a93dd5f-1_1		sdf	pdb	0.4 ± 0.3
RUN1277	ADA-UCB-6c2cb422-1_1		sdf	pdb	DAR-DIA-076fb6ea-10_2		sdf	pdb	0.4 ± 0.3
RUN1162	ADA-UCB-6c2cb422-1_1		sdf	pdb	MAK-UNK-ffc90da7-9_3		sdf	pdb	0.4 ± 0.3
RUN1229	ADA-UCB-6c2cb422-1_1		sdf	pdb	MIC-UNK-5a93dd5f-9_7		sdf	pdb	0.4 ± 0.3
RUN1074	ADA-UCB-6c2cb422-1_1		sdf	pdb	MAT-POS-afd4d4fd-1_1		sdf	pdb	0.45 ± 0.07
RUN1087	ADA-UCB-6c2cb422-1_1		sdf	pdb	ALP-POS-8b8a49e1-6_1		sdf	pdb	0.5 ± 0.2
RUN1013	ADA-UCB-6c2cb422-1_1		sdf	pdb	MIC-UNK-8971c93c-1_1		sdf	pdb	0.5 ± 0.2
RUN946	ADA-UCB-6c2cb422-1_1		sdf	pdb	PET-UNK-bbe8d7ff-1_1		sdf	pdb	0.5 ± 0.2
RUN1214	ADA-UCB-6c2cb422-1_1		sdf	pdb	MAK-UNK-ffc90da7-6_1		sdf	pdb	0.5 ± 0.3
RUN844	ADA-UCB-6c2cb422-1_1		sdf	pdb	JAN-GHE-5a013bed-10_1		sdf	pdb	0.5 ± 0.1
RUN1296	ADA-UCB-6c2cb422-1_1		sdf	pdb	JOH-UNI-a38a7bdd-5_3		sdf	pdb	0.5 ± 0.4
RUN1492	ADA-UCB-6c2cb422-1_1		sdf	pdb	PET-UNK-f92d7c0c-1_1		sdf	pdb	0.5 ± 0.2
RUN1426	ADA-UCB-6c2cb422-1_1		sdf	pdb	EDJ-MED-cf4b0d25-3_1		sdf	pdb	0.5 ± 0.3
RUN1421	ADA-UCB-6c2cb422-1_1		sdf	pdb	EDJ-MED-cf4b0d25-4_2		sdf	pdb	0.5 ± 0.3
RUN1103	ADA-UCB-6c2cb422-1_1		sdf	pdb	EDJ-MED-c8e7a002-7_1		sdf	pdb	0.5 ± 0.3
RUN1447	ADA-UCB-6c2cb422-1_1		sdf	pdb	EDJ-MED-cf4b0d25-2_1		sdf	pdb	0.5 ± 0.4
RUN1303	ADA-UCB-6c2cb422-1_1		sdf	pdb	JOH-UNI-a38a7bdd-9_4		sdf	pdb	0.5 ± 0.2
RUN822	ADA-UCB-6c2cb422-1_1		sdf	pdb	JAN-GHE-83b26c96-8_1		sdf	pdb	0.5 ± 0.3
RUN1206	ADA-UCB-6c2cb422-1_1		sdf	pdb	MAK-UNK-ffc90da7-6_2		sdf	pdb	0.5 ± 0.5
RUN980	ADA-UCB-6c2cb422-1_1		sdf	pdb	ALP-POS-3b848b35-3_1		sdf	pdb	0.6 ± 0.2
RUN1381	ADA-UCB-6c2cb422-1_1		sdf	pdb	EDJ-MED-ee07cf00-10_1		sdf	pdb	0.6 ± 0.4
RUN1224	ADA-UCB-6c2cb422-1_1		sdf	pdb	MIC-UNK-5a93dd5f-9_5		sdf	pdb	0.6 ± 0.4
RUN1524	ADA-UCB-6c2cb422-1_1		sdf	pdb	PET-UNK-10339a1d-1_2		sdf	pdb	0.6 ± 0.3
RUN1151	ADA-UCB-6c2cb422-1_1		sdf	pdb	MIC-UNK-5a93dd5f-2_1		sdf	pdb	0.6 ± 0.5
RUN1304	ADA-UCB-6c2cb422-1_1		sdf	pdb	DAR-DIA-076fb6ea-4_1		sdf	pdb	0.6 ± 0.4
RUN1529	ADA-UCB-6c2cb422-1_1		sdf	pdb	PET-UNK-1320d94d-4_1		sdf	pdb	0.6 ± 0.3
RUN1513	ADA-UCB-6c2cb422-1_1		sdf	pdb	PET-UNK-b1ef24dc-4_1		sdf	pdb	0.6 ± 0.2
RUN858	ADA-UCB-6c2cb422-1_1		sdf	pdb	JAN-GHE-5a013bed-5_1		sdf	pdb	0.6 ± 0.2
RUN1386	ADA-UCB-6c2cb422-1_1		sdf	pdb	EDJ-MED-ee07cf00-13_1		sdf	pdb	0.6 ± 0.4
RUN1371	ADA-UCB-6c2cb422-1_1		sdf	pdb	EDJ-MED-ee07cf00-3_1		sdf	pdb	0.6 ± 0.4
RUN1356	ADA-UCB-6c2cb422-1_1		sdf	pdb	RAL-THA-2d450e86-19_1		sdf	pdb	0.65 ± 0.03
RUN1290	ADA-UCB-6c2cb422-1_1		sdf	pdb	JOH-UNI-a38a7bdd-8_1		sdf	pdb	0.7 ± 0.2
RUN1460	ADA-UCB-6c2cb422-1_1		sdf	pdb	RUB-POS-1325a9ea-12_1		sdf	pdb	0.7 ± 0.2
RUN1174	ADA-UCB-6c2cb422-1_1		sdf	pdb	MIC-UNK-5a93dd5f-3_5		sdf	pdb	0.7 ± 0.2
RUN802	ADA-UCB-6c2cb422-1_1		sdf	pdb	TRY-UNI-714a760b-15_2		sdf	pdb	0.7 ± 0.2
RUN1212	ADA-UCB-6c2cb422-1_1		sdf	pdb	MAK-UNK-ffc90da7-1_3		sdf	pdb	0.7 ± 0.3
RUN1408	ADA-UCB-6c2cb422-1_1		sdf	pdb	EDJ-MED-ee07cf00-4_3		sdf	pdb	0.7 ± 0.3
RUN1278	ADA-UCB-6c2cb422-1_1		sdf	pdb	MAK-UNK-c749d764-22_7		sdf	pdb	0.7 ± 0.4
RUN1059	ADA-UCB-6c2cb422-1_1		sdf	pdb	MAT-POS-bb423b95-2_1		sdf	pdb	0.7 ± 0.2
RUN1202	ADA-UCB-6c2cb422-1_1		sdf	pdb	MIC-UNK-5a93dd5f-5_5		sdf	pdb	0.7 ± 0.6
RUN1354	ADA-UCB-6c2cb422-1_1		sdf	pdb	RAL-THA-2d450e86-21_1		sdf	pdb	0.8 ± 0.1
RUN1514	ADA-UCB-6c2cb422-1_1		sdf	pdb	PET-UNK-b1ef24dc-2_1		sdf	pdb	0.8 ± 0.2
RUN1350	ADA-UCB-6c2cb422-1_1		sdf	pdb	RAL-THA-2d450e86-20_1		sdf	pdb	0.76 ± 0.08
RUN1078	ADA-UCB-6c2cb422-1_1		sdf	pdb	MAT-POS-afd4d4fd-3_1		sdf	pdb	0.81 ± 0.06
RUN1231	ADA-UCB-6c2cb422-1_1		sdf	pdb	MIC-UNK-5a93dd5f-7_5		sdf	pdb	0.8 ± 0.4
RUN870	ADA-UCB-6c2cb422-1_1		sdf	pdb	BAR-COM-ebf5acce-11_1		sdf	pdb	0.8 ± 0.5
RUN1148	ADA-UCB-6c2cb422-1_1		sdf	pdb	MIC-UNK-5a93dd5f-2_5		sdf	pdb	0.8 ± 0.5
RUN1438	ADA-UCB-6c2cb422-1_1		sdf	pdb	JIN-POS-6dc588a4-11_1		sdf	pdb	0.8 ± 0.3
RUN1414	ADA-UCB-6c2cb422-1_1		sdf	pdb	EDJ-MED-ee07cf00-12_2		sdf	pdb	0.9 ± 0.3
RUN1450	ADA-UCB-6c2cb422-1_1		sdf	pdb	JIN-POS-6dc588a4-21_1		sdf	pdb	0.9 ± 0.1
RUN924	ADA-UCB-6c2cb422-1_1		sdf	pdb	ANN-UNI-98d2bf15-3_1		sdf	pdb	0.9 ± 0.2
RUN1519	ADA-UCB-6c2cb422-1_1		sdf	pdb	PET-UNK-158bee2a-4_1		sdf	pdb	0.9 ± 0.2
RUN1146	ADA-UCB-6c2cb422-1_1		sdf	pdb	MAK-UNK-ffc90da7-8_1		sdf	pdb	0.9 ± 0.2
RUN1399	ADA-UCB-6c2cb422-1_1		sdf	pdb	EDJ-MED-ee07cf00-16_2		sdf	pdb	0.9 ± 0.3
RUN995	ADA-UCB-6c2cb422-1_1		sdf	pdb	EDJ-MED-50fe53e8-3_1		sdf	pdb	0.9 ± 0.3
RUN818	ADA-UCB-6c2cb422-1_1		sdf	pdb	JAN-GHE-83b26c96-6_2		sdf	pdb	0.9 ± 0.2
RUN1306	ADA-UCB-6c2cb422-1_1		sdf	pdb	JOH-UNI-a38a7bdd-6_3		sdf	pdb	0.9 ± 0.3
RUN1375	ADA-UCB-6c2cb422-1_1		sdf	pdb	EDJ-MED-ee07cf00-8_2		sdf	pdb	0.9 ± 0.3
RUN1391	ADA-UCB-6c2cb422-1_1		sdf	pdb	EDJ-MED-ee07cf00-11_6		sdf	pdb	1.0 ± 0.4
RUN999	ADA-UCB-6c2cb422-1_1		sdf	pdb	JAN-GHE-f4ca5a00-19_2		sdf	pdb	1.0 ± 0.3
RUN1305	ADA-UCB-6c2cb422-1_1		sdf	pdb	JOH-UNI-ee5ed7c8-3_1		sdf	pdb	1.0 ± 0.3
RUN841	ADA-UCB-6c2cb422-1_1		sdf	pdb	TRY-UNI-2eddb1ff-5_1		sdf	pdb	1.0 ± 0.2
RUN823	ADA-UCB-6c2cb422-1_1		sdf	pdb	JAN-GHE-83b26c96-4_1		sdf	pdb	1.0 ± 0.2
RUN805	ADA-UCB-6c2cb422-1_1		sdf	pdb	ADA-UNI-f8e79267-10_1		sdf	pdb	1.0 ± 0.3
RUN1064	ADA-UCB-6c2cb422-1_1		sdf	pdb	MAT-POS-bb423b95-9_1		sdf	pdb	1.02 ± 0.04
RUN1115	ADA-UCB-6c2cb422-1_1		sdf	pdb	PET-UNK-e44ffd04-1_1		sdf	pdb	1.0 ± 0.2
RUN1390	ADA-UCB-6c2cb422-1_1		sdf	pdb	EDJ-MED-ee07cf00-11_4		sdf	pdb	1.0 ± 0.4
RUN919	ADA-UCB-6c2cb422-1_1		sdf	pdb	BAR-COM-0f94fc3d-38_2		sdf	pdb	1.0 ± 0.2
RUN1199	ADA-UCB-6c2cb422-1_1		sdf	pdb	MIC-UNK-5a93dd5f-5_6		sdf	pdb	1.0 ± 0.6
RUN1241	ADA-UCB-6c2cb422-1_1		sdf	pdb	MIC-UNK-5a93dd5f-12_4		sdf	pdb	1.1 ± 0.3
RUN957	ADA-UCB-6c2cb422-1_1		sdf	pdb	ADA-UCB-6c2cb422-11_1		sdf	pdb	1.1 ± 0.4
RUN843	ADA-UCB-6c2cb422-1_1		sdf	pdb	ALP-POS-95b75b4d-7_1		sdf	pdb	1.1 ± 0.2
RUN1017	ADA-UCB-6c2cb422-1_1		sdf	pdb	MIC-UNK-08cd9c58-1_1		sdf	pdb	1.09 ± 0.04
RUN1452	ADA-UCB-6c2cb422-1_1		sdf	pdb	RUB-POS-1325a9ea-4_1		sdf	pdb	1.1 ± 0.2
RUN1422	ADA-UCB-6c2cb422-1_1		sdf	pdb	JIN-POS-6dc588a4-3_1		sdf	pdb	1.1 ± 0.4
RUN1217	ADA-UCB-6c2cb422-1_1		sdf	pdb	MIC-UNK-5a93dd5f-7_2		sdf	pdb	1.1 ± 0.3
RUN1453	ADA-UCB-6c2cb422-1_1		sdf	pdb	JIN-POS-6dc588a4-22_1		sdf	pdb	1.1 ± 0.2
RUN1503	ADA-UCB-6c2cb422-1_1		sdf	pdb	VLA-UNK-4cf5aa07-2_1		sdf	pdb	1.1 ± 0.2
RUN884	ADA-UCB-6c2cb422-1_1		sdf	pdb	BAR-COM-ebf5acce-15_1		sdf	pdb	1.1 ± 0.4
RUN810	ADA-UCB-6c2cb422-1_1		sdf	pdb	ADA-UNI-f8e79267-7_1		sdf	pdb	1.1 ± 0.5
RUN1269	ADA-UCB-6c2cb422-1_1		sdf	pdb	DAR-DIA-076fb6ea-1_1		sdf	pdb	1.2 ± 0.3
RUN871	ADA-UCB-6c2cb422-1_1		sdf	pdb	EDG-MED-0da5ad92-13_1		sdf	pdb	1.2 ± 0.2
RUN1420	ADA-UCB-6c2cb422-1_1		sdf	pdb	EDJ-MED-cf4b0d25-4_1		sdf	pdb	1.2 ± 0.2
RUN1184	ADA-UCB-6c2cb422-1_1		sdf	pdb	MIC-UNK-5a93dd5f-3_7		sdf	pdb	1.2 ± 0.6
RUN1490	ADA-UCB-6c2cb422-1_1		sdf	pdb	PET-UNK-f92d7c0c-2_1		sdf	pdb	1.2 ± 0.2
RUN1418	ADA-UCB-6c2cb422-1_1		sdf	pdb	MAT-POS-a13804f0-1_4		sdf	pdb	1.2 ± 0.4
RUN839	ADA-UCB-6c2cb422-1_1		sdf	pdb	ALP-POS-95b75b4d-5_1		sdf	pdb	1.2 ± 0.2
RUN931	ADA-UCB-6c2cb422-1_1		sdf	pdb	MAK-UNK-6ca90168-23_1		sdf	pdb	1.2 ± 0.2
RUN874	ADA-UCB-6c2cb422-1_1		sdf	pdb	EDG-MED-0da5ad92-15_1		sdf	pdb	1.2 ± 0.2
RUN1122	ADA-UCB-6c2cb422-1_1		sdf	pdb	NAU-LAT-a5c7d7cb-13_1		sdf	pdb	1.2 ± 0.3
RUN882	ADA-UCB-6c2cb422-1_1		sdf	pdb	EDJ-MED-49816e9b-2_1		sdf	pdb	1.3 ± 0.2
RUN842	ADA-UCB-6c2cb422-1_1		sdf	pdb	TRY-UNI-2eddb1ff-4_1		sdf	pdb	1.3 ± 0.2
RUN942	ADA-UCB-6c2cb422-1_1		sdf	pdb	SAM-UNK-2684b532-13_1		sdf	pdb	1.3 ± 0.2
RUN1282	ADA-UCB-6c2cb422-1_1		sdf	pdb	DAR-DIA-076fb6ea-15_1		sdf	pdb	1.3 ± 0.2
RUN1482	ADA-UCB-6c2cb422-1_1		sdf	pdb	ROB-UNI-daaf9793-1_1		sdf	pdb	1.3 ± 0.3
RUN1396	ADA-UCB-6c2cb422-1_1		sdf	pdb	EDJ-MED-ee07cf00-11_8		sdf	pdb	1.3 ± 0.3
RUN1150	ADA-UCB-6c2cb422-1_1		sdf	pdb	MIC-UNK-5a93dd5f-2_2		sdf	pdb	1.3 ± 0.5
RUN983	ADA-UCB-6c2cb422-1_1		sdf	pdb	EDJ-MED-50fe53e8-1_1		sdf	pdb	1.3 ± 0.2
RUN1085	ADA-UCB-6c2cb422-1_1		sdf	pdb	ALP-POS-8b8a49e1-5_1		sdf	pdb	1.3 ± 0.4
RUN935	ADA-UCB-6c2cb422-1_1		sdf	pdb	SAM-UNK-2684b532-7_2		sdf	pdb	1.3 ± 0.2
RUN1464	ADA-UCB-6c2cb422-1_1		sdf	pdb	RUB-POS-1325a9ea-13_1		sdf	pdb	1.3 ± 0.2
RUN1096	ADA-UCB-6c2cb422-1_1		sdf	pdb	EDJ-MED-c8e7a002-3_1		sdf	pdb	1.3 ± 0.3
RUN1239	ADA-UCB-6c2cb422-1_1		sdf	pdb	MIC-UNK-5a93dd5f-7_8		sdf	pdb	1.3 ± 0.4
RUN846	ADA-UCB-6c2cb422-1_1		sdf	pdb	BAR-COM-ebf5acce-4_1		sdf	pdb	1.3 ± 0.2
RUN1510	ADA-UCB-6c2cb422-1_1		sdf	pdb	PET-UNK-b1ef24dc-1_1		sdf	pdb	1.3 ± 0.1
RUN1402	ADA-UCB-6c2cb422-1_1		sdf	pdb	EDJ-MED-ee07cf00-17_2		sdf	pdb	1.3 ± 0.3
RUN1378	ADA-UCB-6c2cb422-1_1		sdf	pdb	EDJ-MED-ee07cf00-6_1		sdf	pdb	1.4 ± 0.3
RUN852	ADA-UCB-6c2cb422-1_1		sdf	pdb	BAR-COM-ebf5acce-5_1		sdf	pdb	1.4 ± 0.4
RUN1495	ADA-UCB-6c2cb422-1_1		sdf	pdb	PET-UNK-f92d7c0c-4_1		sdf	pdb	1.4 ± 0.2
RUN1141	ADA-UCB-6c2cb422-1_1		sdf	pdb	EDJ-MED-97c1bf5c-1_1		sdf	pdb	1.4 ± 0.3
RUN1448	ADA-UCB-6c2cb422-1_1		sdf	pdb	RUB-POS-1325a9ea-3_1		sdf	pdb	1.4 ± 0.2
RUN826	ADA-UCB-6c2cb422-1_1		sdf	pdb	JAN-GHE-83b26c96-10_1		sdf	pdb	1.4 ± 0.3
RUN1445	ADA-UCB-6c2cb422-1_1		sdf	pdb	JIN-POS-6dc588a4-9_1		sdf	pdb	1.4 ± 0.2
RUN982	ADA-UCB-6c2cb422-1_1		sdf	pdb	ALP-POS-0c2c77e1-1_1		sdf	pdb	1.4 ± 0.3
RUN1534	ADA-UCB-6c2cb422-1_1		sdf	pdb	PET-UNK-7f7e354d-7_1		sdf	pdb	1.4 ± 0.2
RUN859	ADA-UCB-6c2cb422-1_1		sdf	pdb	JAN-GHE-5a013bed-6_1		sdf	pdb	1.4 ± 0.2
RUN1164	ADA-UCB-6c2cb422-1_1		sdf	pdb	MAK-UNK-ffc90da7-9_1		sdf	pdb	1.4 ± 0.3
RUN977	ADA-UCB-6c2cb422-1_1		sdf	pdb	MIC-UNK-fc94cdb5-1_2		sdf	pdb	1.4 ± 0.4
RUN1066	ADA-UCB-6c2cb422-1_1		sdf	pdb	MAT-POS-f7918075-6_1		sdf	pdb	1.45 ± 0.05
RUN811	ADA-UCB-6c2cb422-1_1		sdf	pdb	ADA-UNI-f8e79267-7_2		sdf	pdb	1.5 ± 0.6
RUN1069	ADA-UCB-6c2cb422-1_1		sdf	pdb	MAT-POS-f7918075-7_1		sdf	pdb	1.5 ± 0.4
RUN1336	ADA-UCB-6c2cb422-1_1		sdf	pdb	JOH-UNI-3fc3434e-3_1		sdf	pdb	1.5 ± 0.4
RUN1169	ADA-UCB-6c2cb422-1_1		sdf	pdb	MIC-UNK-5a93dd5f-3_6		sdf	pdb	1.5 ± 0.4
RUN878	ADA-UCB-6c2cb422-1_1		sdf	pdb	BAR-COM-ebf5acce-2_1		sdf	pdb	1.5 ± 0.2
RUN1232	ADA-UCB-6c2cb422-1_1		sdf	pdb	MIC-UNK-5a93dd5f-7_7		sdf	pdb	1.5 ± 0.4
RUN1437	ADA-UCB-6c2cb422-1_1		sdf	pdb	JIN-POS-6dc588a4-18_1		sdf	pdb	1.5 ± 0.3
RUN1002	ADA-UCB-6c2cb422-1_1		sdf	pdb	JAN-GHE-f4ca5a00-19_1		sdf	pdb	1.5 ± 0.3
RUN1089	ADA-UCB-6c2cb422-1_1		sdf	pdb	ALP-POS-8b8a49e1-5_2		sdf	pdb	1.5 ± 0.3
RUN1178	ADA-UCB-6c2cb422-1_1		sdf	pdb	MAK-UNK-ffc90da7-9_5		sdf	pdb	1.5 ± 0.3
RUN1060	ADA-UCB-6c2cb422-1_1		sdf	pdb	MAT-POS-bb423b95-4_1		sdf	pdb	1.5 ± 0.2
RUN1008	ADA-UCB-6c2cb422-1_1		sdf	pdb	PET-UNK-8df914d1-3_1		sdf	pdb	1.5 ± 0.2
RUN1468	ADA-UCB-6c2cb422-1_1		sdf	pdb	RUB-POS-1325a9ea-20_2		sdf	pdb	1.5 ± 0.2
RUN1201	ADA-UCB-6c2cb422-1_1		sdf	pdb	MIC-UNK-5a93dd5f-3_13		sdf	pdb	1.5 ± 0.4
RUN824	ADA-UCB-6c2cb422-1_1		sdf	pdb	ADA-UNI-f8e79267-11_2		sdf	pdb	1.5 ± 0.2
RUN1209	ADA-UCB-6c2cb422-1_1		sdf	pdb	MAK-UNK-ffc90da7-4_7		sdf	pdb	1.5 ± 0.4
RUN888	ADA-UCB-6c2cb422-1_1		sdf	pdb	JAG-UCB-a3ef7265-9_1		sdf	pdb	1.5 ± 0.2
RUN803	ADA-UCB-6c2cb422-1_1		sdf	pdb	TRY-UNI-714a760b-3_1		sdf	pdb	1.5 ± 0.1
RUN1276	ADA-UCB-6c2cb422-1_1		sdf	pdb	DAR-DIA-076fb6ea-8_1		sdf	pdb	1.5 ± 0.4
RUN1023	ADA-UCB-6c2cb422-1_1		sdf	pdb	MIC-UNK-8373f97b-4_3		sdf	pdb	1.6 ± 0.2
RUN1129	ADA-UCB-6c2cb422-1_1		sdf	pdb	NAU-LAT-a5c7d7cb-2_2		sdf	pdb	1.6 ± 0.2
RUN1511	ADA-UCB-6c2cb422-1_1		sdf	pdb	PET-UNK-b1ef24dc-3_1		sdf	pdb	1.6 ± 0.2
RUN997	ADA-UCB-6c2cb422-1_1		sdf	pdb	EDJ-MED-a364e151-2_1		sdf	pdb	1.6 ± 0.2
RUN1428	ADA-UCB-6c2cb422-1_1		sdf	pdb	JIN-POS-6dc588a4-7_1		sdf	pdb	1.6 ± 0.2
RUN962	ADA-UCB-6c2cb422-1_1		sdf	pdb	JAN-GHE-f4ca5a00-16_1		sdf	pdb	1.6 ± 0.4
RUN1321	ADA-UCB-6c2cb422-1_1		sdf	pdb	JOH-UNI-ee5ed7c8-12_1		sdf	pdb	1.6 ± 0.3
RUN1097	ADA-UCB-6c2cb422-1_1		sdf	pdb	EDJ-MED-c8e7a002-2_1		sdf	pdb	1.6 ± 0.2
RUN1175	ADA-UCB-6c2cb422-1_1		sdf	pdb	MIC-UNK-5a93dd5f-3_2		sdf	pdb	1.6 ± 0.3
RUN975	ADA-UCB-6c2cb422-1_1		sdf	pdb	NAU-LAT-e1818702-10_1		sdf	pdb	1.6 ± 0.2
RUN864	ADA-UCB-6c2cb422-1_1		sdf	pdb	EDG-MED-0da5ad92-10_1		sdf	pdb	1.6 ± 0.2
RUN1070	ADA-UCB-6c2cb422-1_1		sdf	pdb	MAT-POS-f7918075-8_1		sdf	pdb	1.6 ± 0.1
RUN996	ADA-UCB-6c2cb422-1_1		sdf	pdb	EDJ-MED-a364e151-3_1		sdf	pdb	1.6 ± 0.2
RUN940	ADA-UCB-6c2cb422-1_1		sdf	pdb	SAM-UNK-2684b532-5_1		sdf	pdb	1.6 ± 0.2
RUN836	ADA-UCB-6c2cb422-1_1		sdf	pdb	JAN-GHE-83b26c96-3_1		sdf	pdb	1.6 ± 0.2
RUN1311	ADA-UCB-6c2cb422-1_1		sdf	pdb	JOH-UNI-ee5ed7c8-9_1		sdf	pdb	1.6 ± 0.6
RUN832	ADA-UCB-6c2cb422-1_1		sdf	pdb	JAN-GHE-83b26c96-7_2		sdf	pdb	1.6 ± 0.2
RUN801	ADA-UCB-6c2cb422-1_1		sdf	pdb	TRY-UNI-714a760b-6_1		sdf	pdb	1.7 ± 0.2
RUN984	ADA-UCB-6c2cb422-1_1		sdf	pdb	EDJ-MED-50fe53e8-2_1		sdf	pdb	1.66 ± 0.06
RUN1432	ADA-UCB-6c2cb422-1_1		sdf	pdb	JIN-POS-6dc588a4-4_1		sdf	pdb	1.7 ± 0.1
RUN1142	ADA-UCB-6c2cb422-1_1		sdf	pdb	EDJ-MED-7bb79bc5-1_1		sdf	pdb	1.7 ± 0.2
RUN978	ADA-UCB-6c2cb422-1_1		sdf	pdb	ADA-UCB-6c2cb422-9_1		sdf	pdb	1.7 ± 0.4
RUN1067	ADA-UCB-6c2cb422-1_1		sdf	pdb	MAT-POS-f7918075-4_1		sdf	pdb	1.7 ± 0.2
RUN890	ADA-UCB-6c2cb422-1_1		sdf	pdb	EDJ-MED-49816e9b-3_1		sdf	pdb	1.7 ± 0.3
RUN1319	ADA-UCB-6c2cb422-1_1		sdf	pdb	JOH-UNI-ee5ed7c8-2_1		sdf	pdb	1.7 ± 0.3
RUN1071	ADA-UCB-6c2cb422-1_1		sdf	pdb	MAT-POS-1e5f28a7-1_1		sdf	pdb	1.7 ± 0.4
RUN1384	ADA-UCB-6c2cb422-1_1		sdf	pdb	EDJ-MED-ee07cf00-10_2		sdf	pdb	1.7 ± 0.3
RUN815	ADA-UCB-6c2cb422-1_1		sdf	pdb	JAN-GHE-83b26c96-1_1		sdf	pdb	1.7 ± 0.3
RUN1187	ADA-UCB-6c2cb422-1_1		sdf	pdb	MIC-UNK-5a93dd5f-3_10		sdf	pdb	1.7 ± 0.5
RUN1079	ADA-UCB-6c2cb422-1_1		sdf	pdb	MAT-POS-500ca5bf-2_1		sdf	pdb	1.8 ± 0.3
RUN817	ADA-UCB-6c2cb422-1_1		sdf	pdb	JAN-GHE-83b26c96-2_2		sdf	pdb	1.8 ± 0.2
RUN1194	ADA-UCB-6c2cb422-1_1		sdf	pdb	MIC-UNK-5a93dd5f-3_12		sdf	pdb	1.8 ± 0.5
RUN840	ADA-UCB-6c2cb422-1_1		sdf	pdb	ALP-POS-95b75b4d-8_1		sdf	pdb	1.8 ± 0.1
RUN1284	ADA-UCB-6c2cb422-1_1		sdf	pdb	JOH-UNI-a38a7bdd-9_1		sdf	pdb	1.8 ± 0.2
RUN1521	ADA-UCB-6c2cb422-1_1		sdf	pdb	ALP-POS-a9ad2217-2_2		sdf	pdb	1.8 ± 0.3
RUN804	ADA-UCB-6c2cb422-1_1		sdf	pdb	TRY-UNI-714a760b-18_2		sdf	pdb	1.8 ± 0.2
RUN1298	ADA-UCB-6c2cb422-1_1		sdf	pdb	JOH-UNI-a38a7bdd-5_4		sdf	pdb	1.8 ± 0.4
RUN1216	ADA-UCB-6c2cb422-1_1		sdf	pdb	MIC-UNK-5a93dd5f-6_2		sdf	pdb	1.8 ± 0.3
RUN1152	ADA-UCB-6c2cb422-1_1		sdf	pdb	MIC-UNK-5a93dd5f-1_2		sdf	pdb	1.8 ± 0.4
RUN1498	ADA-UCB-6c2cb422-1_1		sdf	pdb	PET-UNK-f92d7c0c-9_1		sdf	pdb	1.8 ± 0.2
RUN1111	ADA-UCB-6c2cb422-1_1		sdf	pdb	MAT-POS-199e2e7c-1_1		sdf	pdb	1.8 ± 0.2
RUN906	ADA-UCB-6c2cb422-1_1		sdf	pdb	JAG-UCB-a3ef7265-10_1		sdf	pdb	1.8 ± 0.2
RUN990	ADA-UCB-6c2cb422-1_1		sdf	pdb	EDJ-MED-a364e151-1_1		sdf	pdb	1.9 ± 0.2
RUN869	ADA-UCB-6c2cb422-1_1		sdf	pdb	EDG-MED-0da5ad92-12_1		sdf	pdb	1.9 ± 0.1
RUN816	ADA-UCB-6c2cb422-1_1		sdf	pdb	JAN-GHE-83b26c96-5_1		sdf	pdb	1.9 ± 0.2
RUN1126	ADA-UCB-6c2cb422-1_1		sdf	pdb	NAU-LAT-a5c7d7cb-14_1		sdf	pdb	1.9 ± 0.6
RUN1415	ADA-UCB-6c2cb422-1_1		sdf	pdb	MAT-POS-a13804f0-1_1		sdf	pdb	1.9 ± 0.4
RUN915	ADA-UCB-6c2cb422-1_1		sdf	pdb	MAK-UNK-f203cb68-4_2		sdf	pdb	1.9 ± 0.5
RUN1352	ADA-UCB-6c2cb422-1_1		sdf	pdb	NIR-THE-590dedc7-1_2		sdf	pdb	1.9 ± 0.3
RUN1293	ADA-UCB-6c2cb422-1_1		sdf	pdb	JOH-UNI-a38a7bdd-6_1		sdf	pdb	1.9 ± 0.6
RUN1493	ADA-UCB-6c2cb422-1_1		sdf	pdb	BEN-DND-02317c5c-8_1		sdf	pdb	1.9 ± 0.2
RUN1341	ADA-UCB-6c2cb422-1_1		sdf	pdb	JOH-UNI-ee5ed7c8-7_2		sdf	pdb	1.9 ± 0.3
RUN1338	ADA-UCB-6c2cb422-1_1		sdf	pdb	DAR-DIA-56cf811e-5_1		sdf	pdb	2.0 ± 0.5
RUN1443	ADA-UCB-6c2cb422-1_1		sdf	pdb	JIN-POS-6dc588a4-23_1		sdf	pdb	2.0 ± 0.2
RUN862	ADA-UCB-6c2cb422-1_1		sdf	pdb	JAN-GHE-5a013bed-7_1		sdf	pdb	2.0 ± 0.2
RUN1274	ADA-UCB-6c2cb422-1_1		sdf	pdb	DAR-DIA-076fb6ea-10_1		sdf	pdb	2.0 ± 0.3
RUN1433	ADA-UCB-6c2cb422-1_1		sdf	pdb	JIN-POS-6dc588a4-14_1		sdf	pdb	2.0 ± 0.2
RUN1088	ADA-UCB-6c2cb422-1_1		sdf	pdb	VLA-UCB-05e51b3f-17_1		sdf	pdb	2.0 ± 0.2
RUN854	ADA-UCB-6c2cb422-1_1		sdf	pdb	JAN-GHE-5a013bed-8_1		sdf	pdb	2.0 ± 0.4
RUN1302	ADA-UCB-6c2cb422-1_1		sdf	pdb	JOH-UNI-ee5ed7c8-1_1		sdf	pdb	2.0 ± 0.4
RUN937	ADA-UCB-6c2cb422-1_1		sdf	pdb	SAM-UNK-2684b532-6_1		sdf	pdb	2.0 ± 0.2
RUN929	ADA-UCB-6c2cb422-1_1		sdf	pdb	MAK-UNK-6ca90168-24_1		sdf	pdb	2.0 ± 0.2
RUN1491	ADA-UCB-6c2cb422-1_1		sdf	pdb	PET-UNK-f92d7c0c-5_1		sdf	pdb	2.1 ± 0.3
RUN1364	ADA-UCB-6c2cb422-1_1		sdf	pdb	JOH-UNI-50ce7ec3-4_1		sdf	pdb	2.1 ± 0.8
RUN985	ADA-UCB-6c2cb422-1_1		sdf	pdb	NAU-LAT-e1818702-4_1		sdf	pdb	2.1 ± 0.2
RUN820	ADA-UCB-6c2cb422-1_1		sdf	pdb	JAN-GHE-83b26c96-6_1		sdf	pdb	2.1 ± 0.2
RUN1344	ADA-UCB-6c2cb422-1_1		sdf	pdb	JOH-UNI-3fc3434e-13_1		sdf	pdb	2.1 ± 0.2
RUN875	ADA-UCB-6c2cb422-1_1		sdf	pdb	EDG-MED-0da5ad92-21_1		sdf	pdb	2.1 ± 0.2
RUN936	ADA-UCB-6c2cb422-1_1		sdf	pdb	SAM-UNK-2684b532-5_2		sdf	pdb	2.1 ± 0.4
RUN1034	ADA-UCB-6c2cb422-1_1		sdf	pdb	MIC-UNK-8373f97b-5_7		sdf	pdb	2.1 ± 0.3
RUN1051	ADA-UCB-6c2cb422-1_1		sdf	pdb	ALP-POS-90e38439-1_1		sdf	pdb	2.1 ± 0.3
RUN1022	ADA-UCB-6c2cb422-1_1		sdf	pdb	MIC-UNK-8373f97b-4_1		sdf	pdb	2.1 ± 0.2
RUN1196	ADA-UCB-6c2cb422-1_1		sdf	pdb	MAK-UNK-ffc90da7-9_8		sdf	pdb	2.1 ± 0.2
RUN952	ADA-UCB-6c2cb422-1_1		sdf	pdb	VLA-UCB-00f2c2b3-7_1		sdf	pdb	2.1 ± 0.2
RUN1205	ADA-UCB-6c2cb422-1_1		sdf	pdb	MAK-UNK-ffc90da7-9_7		sdf	pdb	2.1 ± 0.3
RUN1055	ADA-UCB-6c2cb422-1_1		sdf	pdb	MAT-POS-bb423b95-3_1		sdf	pdb	2.1 ± 0.4
RUN887	ADA-UCB-6c2cb422-1_1		sdf	pdb	EDG-MED-0da5ad92-5_1		sdf	pdb	2.2 ± 0.4
RUN1099	ADA-UCB-6c2cb422-1_1		sdf	pdb	EDJ-MED-c8e7a002-4_1		sdf	pdb	2.2 ± 0.3
RUN1138	ADA-UCB-6c2cb422-1_1		sdf	pdb	MIC-UNK-50cce87d-4_1		sdf	pdb	2.2 ± 0.3
RUN1359	ADA-UCB-6c2cb422-1_1		sdf	pdb	MAT-POS-fce787c2-1_1		sdf	pdb	2.2 ± 0.3
RUN1413	ADA-UCB-6c2cb422-1_1		sdf	pdb	EDJ-MED-ee07cf00-4_1		sdf	pdb	2.2 ± 0.4
RUN1200	ADA-UCB-6c2cb422-1_1		sdf	pdb	MIC-UNK-5a93dd5f-3_15		sdf	pdb	2.2 ± 0.3
RUN969	ADA-UCB-6c2cb422-1_1		sdf	pdb	NAU-LAT-e1818702-8_1		sdf	pdb	2.2 ± 0.3
RUN892	ADA-UCB-6c2cb422-1_1		sdf	pdb	JAG-UCB-a3ef7265-2_1		sdf	pdb	2.2 ± 0.3
RUN883	ADA-UCB-6c2cb422-1_1		sdf	pdb	EDG-MED-0da5ad92-5_2		sdf	pdb	2.2 ± 0.3
RUN799	ADA-UCB-6c2cb422-1_1		sdf	pdb	TRY-UNI-714a760b-15_1		sdf	pdb	2.3 ± 0.1
RUN1333	ADA-UCB-6c2cb422-1_1		sdf	pdb	JOH-UNI-3fc3434e-2_1		sdf	pdb	2.3 ± 0.4
RUN1211	ADA-UCB-6c2cb422-1_1		sdf	pdb	MIC-UNK-5a93dd5f-5_8		sdf	pdb	2.3 ± 0.7
RUN1500	ADA-UCB-6c2cb422-1_1		sdf	pdb	PET-UNK-f92d7c0c-8_1		sdf	pdb	2.3 ± 0.2
RUN867	ADA-UCB-6c2cb422-1_1		sdf	pdb	JAN-GHE-d851b096-1_1		sdf	pdb	2.3 ± 0.2
RUN800	ADA-UCB-6c2cb422-1_1		sdf	pdb	TRY-UNI-714a760b-18_1		sdf	pdb	2.3 ± 0.1
RUN881	ADA-UCB-6c2cb422-1_1		sdf	pdb	BAR-COM-ebf5acce-10_1		sdf	pdb	2.3 ± 0.5
RUN1052	ADA-UCB-6c2cb422-1_1		sdf	pdb	ALP-POS-90e38439-3_2		sdf	pdb	2.3 ± 0.3
RUN1520	ADA-UCB-6c2cb422-1_1		sdf	pdb	MIC-UNK-7574fcc6-1_1		sdf	pdb	2.3 ± 0.4
RUN917	ADA-UCB-6c2cb422-1_1		sdf	pdb	MAK-UNK-f203cb68-14_1		sdf	pdb	2.3 ± 0.7
RUN1185	ADA-UCB-6c2cb422-1_1		sdf	pdb	MIC-UNK-5a93dd5f-4_2		sdf	pdb	2.3 ± 0.4
RUN1106	ADA-UCB-6c2cb422-1_1		sdf	pdb	EDJ-MED-c8e7a002-9_1		sdf	pdb	2.3 ± 0.2
RUN1435	ADA-UCB-6c2cb422-1_1		sdf	pdb	JIN-POS-6dc588a4-12_1		sdf	pdb	2.3 ± 0.2
RUN1459	ADA-UCB-6c2cb422-1_1		sdf	pdb	RUB-POS-1325a9ea-9_1		sdf	pdb	2.3 ± 0.3
RUN1499	ADA-UCB-6c2cb422-1_1		sdf	pdb	PET-UNK-6314f867-2_1		sdf	pdb	2.3 ± 0.5
RUN879	ADA-UCB-6c2cb422-1_1		sdf	pdb	EDG-MED-0da5ad92-16_1		sdf	pdb	2.3 ± 0.1
RUN1487	ADA-UCB-6c2cb422-1_1		sdf	pdb	VLA-UNK-411a133b-2_1		sdf	pdb	2.4 ± 0.3
RUN1485	ADA-UCB-6c2cb422-1_1		sdf	pdb	PET-UNK-f92d7c0c-3_1		sdf	pdb	2.4 ± 0.4
RUN1372	ADA-UCB-6c2cb422-1_1		sdf	pdb	EDJ-MED-ee07cf00-7_1		sdf	pdb	2.4 ± 0.3
RUN1160	ADA-UCB-6c2cb422-1_1		sdf	pdb	MAK-UNK-ffc90da7-5_2		sdf	pdb	2.4 ± 0.4
RUN1014	ADA-UCB-6c2cb422-1_1		sdf	pdb	PET-UNK-8df914d1-4_1		sdf	pdb	2.4 ± 0.6
RUN1289	ADA-UCB-6c2cb422-1_1		sdf	pdb	JOH-UNI-a38a7bdd-9_3		sdf	pdb	2.4 ± 0.2
RUN837	ADA-UCB-6c2cb422-1_1		sdf	pdb	JAN-GHE-83b26c96-10_2		sdf	pdb	2.4 ± 0.2
RUN1496	ADA-UCB-6c2cb422-1_1		sdf	pdb	PET-UNK-f92d7c0c-7_1		sdf	pdb	2.4 ± 0.3
RUN1357	ADA-UCB-6c2cb422-1_1		sdf	pdb	JOH-UNI-abfda500-5_1		sdf	pdb	2.4 ± 0.2
RUN1508	ADA-UCB-6c2cb422-1_1		sdf	pdb	PET-UNK-e274cad4-6_1		sdf	pdb	2.4 ± 0.2
RUN989	ADA-UCB-6c2cb422-1_1		sdf	pdb	MAT-POS-e1b5ac6b-1_1		sdf	pdb	2.5 ± 0.2
RUN933	ADA-UCB-6c2cb422-1_1		sdf	pdb	SAM-UNK-2684b532-7_1		sdf	pdb	2.5 ± 0.2
RUN1342	ADA-UCB-6c2cb422-1_1		sdf	pdb	JOH-UNI-3fc3434e-4_1		sdf	pdb	2.5 ± 0.7
RUN829	ADA-UCB-6c2cb422-1_1		sdf	pdb	JAN-GHE-83b26c96-9_2		sdf	pdb	2.5 ± 0.3
RUN1073	ADA-UCB-6c2cb422-1_1		sdf	pdb	MIC-UNK-6ab519a7-1_2		sdf	pdb	2.5 ± 0.3
RUN1497	ADA-UCB-6c2cb422-1_1		sdf	pdb	PET-UNK-f92d7c0c-6_1		sdf	pdb	2.5 ± 0.3
RUN900	ADA-UCB-6c2cb422-1_1		sdf	pdb	BAR-COM-ebf5acce-12_1		sdf	pdb	2.5 ± 0.2
RUN1265	ADA-UCB-6c2cb422-1_1		sdf	pdb	DAR-DIA-076fb6ea-2_1		sdf	pdb	2.5 ± 0.4
RUN834	ADA-UCB-6c2cb422-1_1		sdf	pdb	JAN-GHE-83b26c96-3_2		sdf	pdb	2.5 ± 0.2
RUN813	ADA-UCB-6c2cb422-1_1		sdf	pdb	JAN-GHE-83b26c96-1_2		sdf	pdb	2.5 ± 0.2
RUN885	ADA-UCB-6c2cb422-1_1		sdf	pdb	EDJ-MED-49816e9b-5_1		sdf	pdb	2.5 ± 0.2
RUN967	ADA-UCB-6c2cb422-1_1		sdf	pdb	ADA-UCB-6c2cb422-8_1		sdf	pdb	2.5 ± 0.5
RUN877	ADA-UCB-6c2cb422-1_1		sdf	pdb	EDG-MED-0da5ad92-17_1		sdf	pdb	2.5 ± 0.2
RUN998	ADA-UCB-6c2cb422-1_1		sdf	pdb	EDJ-MED-976da9a6-1_1		sdf	pdb	2.6 ± 0.2
RUN1337	ADA-UCB-6c2cb422-1_1		sdf	pdb	DAR-DIA-56cf811e-6_1		sdf	pdb	2.6 ± 0.5
RUN1235	ADA-UCB-6c2cb422-1_1		sdf	pdb	MIC-UNK-5a93dd5f-10_2		sdf	pdb	2.6 ± 0.3
RUN903	ADA-UCB-6c2cb422-1_1		sdf	pdb	MAK-UNK-f203cb68-9_1		sdf	pdb	2.6 ± 0.2
RUN987	ADA-UCB-6c2cb422-1_1		sdf	pdb	WIL-UNI-2e73223c-4_1		sdf	pdb	2.7 ± 0.4
RUN1135	ADA-UCB-6c2cb422-1_1		sdf	pdb	NAU-LAT-a5c7d7cb-6_1		sdf	pdb	2.7 ± 0.4
RUN1093	ADA-UCB-6c2cb422-1_1		sdf	pdb	ALP-POS-8b8a49e1-8_2		sdf	pdb	2.7 ± 0.7
RUN923	ADA-UCB-6c2cb422-1_1		sdf	pdb	MAK-UNK-f203cb68-20_2		sdf	pdb	2.7 ± 0.3
RUN981	ADA-UCB-6c2cb422-1_1		sdf	pdb	ALP-POS-ddb41b15-9_2		sdf	pdb	2.7 ± 0.6
RUN1480	ADA-UCB-6c2cb422-1_1		sdf	pdb	ROB-UNI-daaf9793-2_1		sdf	pdb	2.7 ± 0.7
RUN1040	ADA-UCB-6c2cb422-1_1		sdf	pdb	VLA-UCB-1dbca3b4-1_1		sdf	pdb	2.7 ± 0.4
RUN1130	ADA-UCB-6c2cb422-1_1		sdf	pdb	NAU-LAT-a5c7d7cb-3_1		sdf	pdb	2.8 ± 0.4
RUN1320	ADA-UCB-6c2cb422-1_1		sdf	pdb	DAR-DIA-56cf811e-3_1		sdf	pdb	2.8 ± 0.6
RUN1136	ADA-UCB-6c2cb422-1_1		sdf	pdb	MIC-UNK-d935700b-1_1		sdf	pdb	2.8 ± 0.3
RUN1108	ADA-UCB-6c2cb422-1_1		sdf	pdb	EDJ-MED-c8e7a002-14_1		sdf	pdb	2.8 ± 0.2
RUN1295	ADA-UCB-6c2cb422-1_1		sdf	pdb	JOH-UNI-a38a7bdd-5_2		sdf	pdb	2.8 ± 0.5
RUN1145	ADA-UCB-6c2cb422-1_1		sdf	pdb	MAK-UNK-ffc90da7-3_2		sdf	pdb	2.8 ± 0.4
RUN1042	ADA-UCB-6c2cb422-1_1		sdf	pdb	MIC-UNK-d36ab305-4_1		sdf	pdb	2.8 ± 0.3
RUN1016	ADA-UCB-6c2cb422-1_1		sdf	pdb	MAT-POS-0bc33984-2_2		sdf	pdb	2.8 ± 0.4
RUN902	ADA-UCB-6c2cb422-1_1		sdf	pdb	MAK-UNK-f203cb68-5_2		sdf	pdb	2.8 ± 0.9
RUN893	ADA-UCB-6c2cb422-1_1		sdf	pdb	JAG-UCB-a3ef7265-5_1		sdf	pdb	2.8 ± 0.2
RUN1091	ADA-UCB-6c2cb422-1_1		sdf	pdb	ALP-POS-8b8a49e1-6_2		sdf	pdb	2.8 ± 0.3
RUN1128	ADA-UCB-6c2cb422-1_1		sdf	pdb	NAU-LAT-a5c7d7cb-12_1		sdf	pdb	2.9 ± 0.2
RUN1028	ADA-UCB-6c2cb422-1_1		sdf	pdb	MIC-UNK-8373f97b-5_1		sdf	pdb	2.9 ± 0.1
RUN954	ADA-UCB-6c2cb422-1_1		sdf	pdb	BRU-CON-67e07230-1_2		sdf	pdb	2.9 ± 0.2
RUN899	ADA-UCB-6c2cb422-1_1		sdf	pdb	MAK-UNK-f203cb68-1_2		sdf	pdb	2.9 ± 0.4
RUN1431	ADA-UCB-6c2cb422-1_1		sdf	pdb	JIN-POS-6dc588a4-6_1		sdf	pdb	2.9 ± 0.2
RUN898	ADA-UCB-6c2cb422-1_1		sdf	pdb	JAG-UCB-a3ef7265-17_1		sdf	pdb	2.9 ± 0.2
RUN1161	ADA-UCB-6c2cb422-1_1		sdf	pdb	MAK-UNK-ffc90da7-5_1		sdf	pdb	3.0 ± 0.3
RUN1518	ADA-UCB-6c2cb422-1_1		sdf	pdb	PET-UNK-158bee2a-2_1		sdf	pdb	3.0 ± 0.2
RUN1425	ADA-UCB-6c2cb422-1_1		sdf	pdb	JIN-POS-6dc588a4-2_1		sdf	pdb	3.0 ± 0.3
RUN1517	ADA-UCB-6c2cb422-1_1		sdf	pdb	PET-UNK-158bee2a-3_1		sdf	pdb	3.0 ± 0.2
RUN1133	ADA-UCB-6c2cb422-1_1		sdf	pdb	NAU-LAT-a5c7d7cb-6_2		sdf	pdb	3.0 ± 0.4
RUN894	ADA-UCB-6c2cb422-1_1		sdf	pdb	MAK-UNK-f203cb68-1_1		sdf	pdb	3.0 ± 0.4
RUN966	ADA-UCB-6c2cb422-1_1		sdf	pdb	NAU-LAT-e1818702-7_1		sdf	pdb	3.0 ± 0.3
RUN913	ADA-UCB-6c2cb422-1_1		sdf	pdb	MAK-UNK-f203cb68-4_1		sdf	pdb	3.0 ± 0.4
RUN934	ADA-UCB-6c2cb422-1_1		sdf	pdb	SAD-SAT-1b030f84-3_1		sdf	pdb	3.0 ± 0.4
RUN1037	ADA-UCB-6c2cb422-1_1		sdf	pdb	MIC-UNK-8373f97b-4_8		sdf	pdb	3.0 ± 0.3
RUN1505	ADA-UCB-6c2cb422-1_1		sdf	pdb	VLA-UNK-4cf5aa07-1_1		sdf	pdb	3.0 ± 0.2
RUN1315	ADA-UCB-6c2cb422-1_1		sdf	pdb	JOH-UNI-ee5ed7c8-8_1		sdf	pdb	3.1 ± 0.2
RUN1271	ADA-UCB-6c2cb422-1_1		sdf	pdb	MAK-UNK-c749d764-22_3		sdf	pdb	3.1 ± 0.8
RUN1258	ADA-UCB-6c2cb422-1_1		sdf	pdb	JOH-UNI-6fede743-5_1		sdf	pdb	3.1 ± 0.3
RUN1294	ADA-UCB-6c2cb422-1_1		sdf	pdb	JOH-UNI-a38a7bdd-8_2		sdf	pdb	3.1 ± 0.2
RUN1131	ADA-UCB-6c2cb422-1_1		sdf	pdb	ALP-UNI-44c99a80-1_1		sdf	pdb	3.1 ± 0.2
RUN1313	ADA-UCB-6c2cb422-1_1		sdf	pdb	DAR-DIA-076fb6ea-11_1		sdf	pdb	3.1 ± 0.5
RUN1031	ADA-UCB-6c2cb422-1_1		sdf	pdb	MIC-UNK-8373f97b-5_4		sdf	pdb	3.1 ± 0.7
RUN1245	ADA-UCB-6c2cb422-1_1		sdf	pdb	MIC-UNK-5a93dd5f-12_6		sdf	pdb	3.1 ± 0.3
RUN910	ADA-UCB-6c2cb422-1_1		sdf	pdb	MAK-UNK-f203cb68-12_1		sdf	pdb	3.1 ± 0.5
RUN1029	ADA-UCB-6c2cb422-1_1		sdf	pdb	MIC-UNK-8373f97b-5_2		sdf	pdb	3.2 ± 0.2
RUN1292	ADA-UCB-6c2cb422-1_1		sdf	pdb	JOH-UNI-a38a7bdd-5_1		sdf	pdb	3.2 ± 0.3
RUN808	ADA-UCB-6c2cb422-1_1		sdf	pdb	AGN-NEW-c7b24fe3-4_1		sdf	pdb	3.2 ± 0.2
RUN853	ADA-UCB-6c2cb422-1_1		sdf	pdb	BAR-COM-ebf5acce-3_1		sdf	pdb	3.2 ± 0.2
RUN1227	ADA-UCB-6c2cb422-1_1		sdf	pdb	MIC-UNK-5a93dd5f-9_6		sdf	pdb	3.2 ± 0.6
RUN1030	ADA-UCB-6c2cb422-1_1		sdf	pdb	MIC-UNK-8373f97b-5_5		sdf	pdb	3.2 ± 0.3
RUN1243	ADA-UCB-6c2cb422-1_1		sdf	pdb	MIC-UNK-5a93dd5f-12_8		sdf	pdb	3.2 ± 0.5
RUN1481	ADA-UCB-6c2cb422-1_1		sdf	pdb	ROB-UNI-daaf9793-2_2		sdf	pdb	3.2 ± 0.4
RUN907	ADA-UCB-6c2cb422-1_1		sdf	pdb	BAR-COM-ebf5acce-7_1		sdf	pdb	3.2 ± 0.3
RUN897	ADA-UCB-6c2cb422-1_1		sdf	pdb	JAG-UCB-a3ef7265-15_1		sdf	pdb	3.2 ± 0.2
RUN1285	ADA-UCB-6c2cb422-1_1		sdf	pdb	JOH-UNI-a38a7bdd-8_4		sdf	pdb	3.2 ± 0.2
RUN1412	ADA-UCB-6c2cb422-1_1		sdf	pdb	EDJ-MED-ee07cf00-4_2		sdf	pdb	3.2 ± 0.3
RUN1358	ADA-UCB-6c2cb422-1_1		sdf	pdb	JOH-UNI-abfda500-4_1		sdf	pdb	3.3 ± 0.2
RUN1012	ADA-UCB-6c2cb422-1_1		sdf	pdb	MAT-POS-0bc33984-2_1		sdf	pdb	3.3 ± 0.3
RUN1387	ADA-UCB-6c2cb422-1_1		sdf	pdb	VLA-UNK-9a7dc93f-7_2		sdf	pdb	3.3 ± 0.2
RUN955	ADA-UCB-6c2cb422-1_1		sdf	pdb	BRU-CON-67e07230-1_1		sdf	pdb	3.3 ± 0.2
RUN1461	ADA-UCB-6c2cb422-1_1		sdf	pdb	RUB-POS-1325a9ea-16_2		sdf	pdb	3.3 ± 0.2
RUN1261	ADA-UCB-6c2cb422-1_1		sdf	pdb	NAU-LAT-4ce8bf23-2_1		sdf	pdb	3.3 ± 0.4
RUN1062	ADA-UCB-6c2cb422-1_1		sdf	pdb	MAT-POS-3cc264b0-1_1		sdf	pdb	3.3 ± 0.2
RUN1132	ADA-UCB-6c2cb422-1_1		sdf	pdb	NAU-LAT-a5c7d7cb-11_1		sdf	pdb	3.4 ± 0.2
RUN814	ADA-UCB-6c2cb422-1_1		sdf	pdb	JAN-GHE-83b26c96-2_1		sdf	pdb	3.4 ± 0.1
RUN1086	ADA-UCB-6c2cb422-1_1		sdf	pdb	ALP-POS-8b8a49e1-8_1		sdf	pdb	3.4 ± 0.7
RUN1456	ADA-UCB-6c2cb422-1_1		sdf	pdb	RUB-POS-1325a9ea-7_1		sdf	pdb	3.4 ± 0.2
RUN1124	ADA-UCB-6c2cb422-1_1		sdf	pdb	NAU-LAT-a5c7d7cb-14_2		sdf	pdb	3.4 ± 0.4
RUN1310	ADA-UCB-6c2cb422-1_1		sdf	pdb	DAR-DIA-56cf811e-2_1		sdf	pdb	3.4 ± 0.4
RUN1180	ADA-UCB-6c2cb422-1_1		sdf	pdb	MAK-UNK-ffc90da7-7_3		sdf	pdb	3.4 ± 0.8
RUN965	ADA-UCB-6c2cb422-1_1		sdf	pdb	MIC-UNK-42806bd5-1_1		sdf	pdb	3.4 ± 0.2
RUN1403	ADA-UCB-6c2cb422-1_1		sdf	pdb	EDJ-MED-ee07cf00-15_2		sdf	pdb	3.5 ± 0.4
RUN1024	ADA-UCB-6c2cb422-1_1		sdf	pdb	MIC-UNK-8373f97b-4_4		sdf	pdb	3.5 ± 0.3
RUN1307	ADA-UCB-6c2cb422-1_1		sdf	pdb	JOH-UNI-a38a7bdd-6_2		sdf	pdb	3.5 ± 0.6
RUN845	ADA-UCB-6c2cb422-1_1		sdf	pdb	JAN-GHE-5a013bed-11_1		sdf	pdb	3.5 ± 0.2
RUN1260	ADA-UCB-6c2cb422-1_1		sdf	pdb	DAR-DIA-076fb6ea-5_1		sdf	pdb	3.5 ± 0.4
RUN1032	ADA-UCB-6c2cb422-1_1		sdf	pdb	MIC-UNK-8373f97b-5_3		sdf	pdb	3.5 ± 0.2
RUN1486	ADA-UCB-6c2cb422-1_1		sdf	pdb	ROB-UNI-daaf9793-4_2		sdf	pdb	3.5 ± 0.6
RUN1027	ADA-UCB-6c2cb422-1_1		sdf	pdb	MIC-UNK-8373f97b-4_6		sdf	pdb	3.5 ± 0.3
RUN1127	ADA-UCB-6c2cb422-1_1		sdf	pdb	NAU-LAT-a5c7d7cb-3_2		sdf	pdb	3.5 ± 0.3
RUN1301	ADA-UCB-6c2cb422-1_1		sdf	pdb	JOH-UNI-a38a7bdd-6_4		sdf	pdb	3.5 ± 0.5
RUN1101	ADA-UCB-6c2cb422-1_1		sdf	pdb	EDJ-MED-c8e7a002-12_1		sdf	pdb	3.5 ± 0.1
RUN1455	ADA-UCB-6c2cb422-1_1		sdf	pdb	RUB-POS-1325a9ea-5_1		sdf	pdb	3.55 ± 0.06
RUN979	ADA-UCB-6c2cb422-1_1		sdf	pdb	MAR-TRE-f6f5f473-93_1		sdf	pdb	3.6 ± 0.4
RUN866	ADA-UCB-6c2cb422-1_1		sdf	pdb	EDG-MED-0da5ad92-2_1		sdf	pdb	3.6 ± 0.1
RUN1404	ADA-UCB-6c2cb422-1_1		sdf	pdb	EDJ-MED-ee07cf00-5_2		sdf	pdb	3.6 ± 0.5
RUN1470	ADA-UCB-6c2cb422-1_1		sdf	pdb	RUB-POS-1325a9ea-23_1		sdf	pdb	3.6 ± 0.3
RUN1360	ADA-UCB-6c2cb422-1_1		sdf	pdb	JOH-UNI-50ce7ec3-2_1		sdf	pdb	3.6 ± 0.7
RUN1033	ADA-UCB-6c2cb422-1_1		sdf	pdb	MIC-UNK-8373f97b-4_7		sdf	pdb	3.6 ± 0.2
RUN1081	ADA-UCB-6c2cb422-1_1		sdf	pdb	VLA-UCB-05e51b3f-2_1		sdf	pdb	3.6 ± 0.4
RUN1058	ADA-UCB-6c2cb422-1_1		sdf	pdb	MAT-POS-bb423b95-6_1		sdf	pdb	3.6 ± 0.3
RUN1288	ADA-UCB-6c2cb422-1_1		sdf	pdb	JOH-UNI-a38a7bdd-9_2		sdf	pdb	3.6 ± 0.2
RUN1177	ADA-UCB-6c2cb422-1_1		sdf	pdb	MIC-UNK-5a93dd5f-3_8		sdf	pdb	3.6 ± 0.3
RUN1102	ADA-UCB-6c2cb422-1_1		sdf	pdb	EDJ-MED-c8e7a002-6_1		sdf	pdb	3.7 ± 0.4
RUN827	ADA-UCB-6c2cb422-1_1		sdf	pdb	ADA-UNI-f8e79267-8_1		sdf	pdb	3.7 ± 0.2
RUN1467	ADA-UCB-6c2cb422-1_1		sdf	pdb	RUB-POS-1325a9ea-22_1		sdf	pdb	3.7 ± 0.3
RUN971	ADA-UCB-6c2cb422-1_1		sdf	pdb	MIC-UNK-42806bd5-2_2		sdf	pdb	3.7 ± 0.5
RUN1299	ADA-UCB-6c2cb422-1_1		sdf	pdb	JOH-UNI-a38a7bdd-7_1		sdf	pdb	3.7 ± 0.4
RUN1021	ADA-UCB-6c2cb422-1_1		sdf	pdb	PET-UNK-8df914d1-5_1		sdf	pdb	3.7 ± 0.5
RUN1045	ADA-UCB-6c2cb422-1_1		sdf	pdb	MIC-UNK-c66144cb-1_1		sdf	pdb	3.7 ± 0.3
RUN896	ADA-UCB-6c2cb422-1_1		sdf	pdb	JAG-UCB-a3ef7265-4_1		sdf	pdb	3.7 ± 0.2
RUN1516	ADA-UCB-6c2cb422-1_1		sdf	pdb	PET-UNK-158bee2a-1_1		sdf	pdb	3.7 ± 0.2
RUN1465	ADA-UCB-6c2cb422-1_1		sdf	pdb	RUB-POS-1325a9ea-19_1		sdf	pdb	3.7 ± 0.2
RUN1255	ADA-UCB-6c2cb422-1_1		sdf	pdb	JOH-UNI-6fede743-4_1		sdf	pdb	3.8 ± 0.2
RUN857	ADA-UCB-6c2cb422-1_1		sdf	pdb	BAR-COM-ebf5acce-1_1		sdf	pdb	3.8 ± 0.2
RUN1362	ADA-UCB-6c2cb422-1_1		sdf	pdb	JOH-UNI-50ce7ec3-6_1		sdf	pdb	3.8 ± 0.6
RUN960	ADA-UCB-6c2cb422-1_1		sdf	pdb	NAU-LAT-e1818702-1_1		sdf	pdb	3.8 ± 0.2
RUN1429	ADA-UCB-6c2cb422-1_1		sdf	pdb	JIN-POS-6dc588a4-10_1		sdf	pdb	3.8 ± 0.2
RUN1218	ADA-UCB-6c2cb422-1_1		sdf	pdb	MIC-UNK-5a93dd5f-8_2		sdf	pdb	3.8 ± 0.4
RUN1076	ADA-UCB-6c2cb422-1_1		sdf	pdb	MAT-POS-14ad9fe9-1_1		sdf	pdb	3.8 ± 0.5
RUN1434	ADA-UCB-6c2cb422-1_1		sdf	pdb	JIN-POS-6dc588a4-15_1		sdf	pdb	3.9 ± 0.2
RUN1442	ADA-UCB-6c2cb422-1_1		sdf	pdb	JIN-POS-6dc588a4-24_1		sdf	pdb	3.9 ± 0.3
RUN1035	ADA-UCB-6c2cb422-1_1		sdf	pdb	MIC-UNK-8373f97b-5_6		sdf	pdb	3.9 ± 0.3
RUN921	ADA-UCB-6c2cb422-1_1		sdf	pdb	MAK-UNK-f203cb68-21_2		sdf	pdb	3.9 ± 0.4
RUN1441	ADA-UCB-6c2cb422-1_1		sdf	pdb	EDJ-MED-cf4b0d25-2_2		sdf	pdb	3.9 ± 0.7
RUN1057	ADA-UCB-6c2cb422-1_1		sdf	pdb	MAT-POS-bb423b95-5_1		sdf	pdb	3.9 ± 0.2
RUN872	ADA-UCB-6c2cb422-1_1		sdf	pdb	EDG-MED-0da5ad92-14_1		sdf	pdb	3.9 ± 0.2
RUN961	ADA-UCB-6c2cb422-1_1		sdf	pdb	MIC-UNK-42806bd5-1_2		sdf	pdb	3.9 ± 0.3
RUN1147	ADA-UCB-6c2cb422-1_1		sdf	pdb	MAK-UNK-ffc90da7-3_1		sdf	pdb	4.0 ± 0.3
RUN1323	ADA-UCB-6c2cb422-1_1		sdf	pdb	DAR-DIA-56cf811e-4_1		sdf	pdb	4.0 ± 0.5
RUN1053	ADA-UCB-6c2cb422-1_1		sdf	pdb	ALP-POS-90e38439-2_2		sdf	pdb	4.0 ± 0.3
RUN1444	ADA-UCB-6c2cb422-1_1		sdf	pdb	JIN-POS-6dc588a4-20_1		sdf	pdb	4.0 ± 0.5
RUN850	ADA-UCB-6c2cb422-1_1		sdf	pdb	BAR-COM-ebf5acce-13_1		sdf	pdb	4.1 ± 0.2
RUN912	ADA-UCB-6c2cb422-1_1		sdf	pdb	MAK-UNK-f203cb68-12_2		sdf	pdb	4.1 ± 0.6
RUN1049	ADA-UCB-6c2cb422-1_1		sdf	pdb	ALP-POS-90e38439-3_1		sdf	pdb	4.1 ± 0.4
RUN963	ADA-UCB-6c2cb422-1_1		sdf	pdb	MIC-UNK-42806bd5-2_1		sdf	pdb	4.1 ± 0.3
RUN1361	ADA-UCB-6c2cb422-1_1		sdf	pdb	JOH-UNI-50ce7ec3-1_1		sdf	pdb	4.1 ± 0.5
RUN1458	ADA-UCB-6c2cb422-1_1		sdf	pdb	RUB-POS-1325a9ea-7_2		sdf	pdb	4.1 ± 0.2
RUN1025	ADA-UCB-6c2cb422-1_1		sdf	pdb	MIC-UNK-8373f97b-4_5		sdf	pdb	4.2 ± 0.3
RUN1348	ADA-UCB-6c2cb422-1_1		sdf	pdb	JOH-UNI-3fc3434e-6_1		sdf	pdb	4.3 ± 0.2
RUN1046	ADA-UCB-6c2cb422-1_1		sdf	pdb	MIC-UNK-c66144cb-2_1		sdf	pdb	4.3 ± 0.3
RUN1090	ADA-UCB-6c2cb422-1_1		sdf	pdb	ALP-POS-8b8a49e1-7_2		sdf	pdb	4.3 ± 0.3
RUN1038	ADA-UCB-6c2cb422-1_1		sdf	pdb	VLA-UCB-1dbca3b4-1_2		sdf	pdb	4.3 ± 0.2
RUN1436	ADA-UCB-6c2cb422-1_1		sdf	pdb	JIN-POS-6dc588a4-19_1		sdf	pdb	4.3 ± 0.3
RUN925	ADA-UCB-6c2cb422-1_1		sdf	pdb	MAK-UNK-f203cb68-22_2		sdf	pdb	4.3 ± 0.3
RUN1256	ADA-UCB-6c2cb422-1_1		sdf	pdb	JOH-UNI-6fede743-1_1		sdf	pdb	4.4 ± 0.5
RUN1325	ADA-UCB-6c2cb422-1_1		sdf	pdb	JOH-UNI-ee5ed7c8-11_1		sdf	pdb	4.4 ± 0.4
RUN1048	ADA-UCB-6c2cb422-1_1		sdf	pdb	ALP-POS-90e38439-2_1		sdf	pdb	4.4 ± 0.2
RUN812	ADA-UCB-6c2cb422-1_1		sdf	pdb	AGN-NEW-c7b24fe3-5_1		sdf	pdb	4.4 ± 0.2
RUN1065	ADA-UCB-6c2cb422-1_1		sdf	pdb	MAT-POS-4211dce8-1_1		sdf	pdb	4.5 ± 0.2
RUN1197	ADA-UCB-6c2cb422-1_1		sdf	pdb	MIC-UNK-5a93dd5f-3_16		sdf	pdb	4.5 ± 0.5
RUN1170	ADA-UCB-6c2cb422-1_1		sdf	pdb	MIC-UNK-5a93dd5f-3_4		sdf	pdb	4.5 ± 0.2
RUN1248	ADA-UCB-6c2cb422-1_1		sdf	pdb	MAK-UNK-c749d764-6_2		sdf	pdb	4.6 ± 0.5
RUN1084	ADA-UCB-6c2cb422-1_1		sdf	pdb	VLA-UCB-05e51b3f-2_2		sdf	pdb	4.6 ± 0.4
RUN1155	ADA-UCB-6c2cb422-1_1		sdf	pdb	MIC-UNK-5a93dd5f-2_3		sdf	pdb	4.6 ± 0.5
RUN1430	ADA-UCB-6c2cb422-1_1		sdf	pdb	JIN-POS-6dc588a4-8_1		sdf	pdb	4.6 ± 0.2
RUN1104	ADA-UCB-6c2cb422-1_1		sdf	pdb	EDJ-MED-c8e7a002-11_1		sdf	pdb	4.7 ± 0.2
RUN1240	ADA-UCB-6c2cb422-1_1		sdf	pdb	MIC-UNK-5a93dd5f-12_2		sdf	pdb	4.8 ± 0.3
RUN1007	ADA-UCB-6c2cb422-1_1		sdf	pdb	MAT-POS-0bc33984-1_2		sdf	pdb	4.8 ± 0.2
RUN1251	ADA-UCB-6c2cb422-1_1		sdf	pdb	MAK-UNK-c749d764-32_1		sdf	pdb	4.8 ± 0.2
RUN976	ADA-UCB-6c2cb422-1_1		sdf	pdb	MIC-UNK-fc94cdb5-1_1		sdf	pdb	4.8 ± 0.2
RUN968	ADA-UCB-6c2cb422-1_1		sdf	pdb	NAU-LAT-e1818702-9_1		sdf	pdb	4.8 ± 0.3
RUN1019	ADA-UCB-6c2cb422-1_1		sdf	pdb	MIC-UNK-8373f97b-2_2		sdf	pdb	4.8 ± 0.5
RUN1010	ADA-UCB-6c2cb422-1_1		sdf	pdb	MAT-POS-0bc33984-1_3		sdf	pdb	4.8 ± 0.2
RUN1417	ADA-UCB-6c2cb422-1_1		sdf	pdb	MAT-POS-a13804f0-1_2		sdf	pdb	4.9 ± 0.6
RUN1331	ADA-UCB-6c2cb422-1_1		sdf	pdb	JOH-UNI-ee5ed7c8-6_1		sdf	pdb	4.9 ± 0.2
RUN1050	ADA-UCB-6c2cb422-1_1		sdf	pdb	ALP-POS-90e38439-1_2		sdf	pdb	4.9 ± 0.2
RUN1476	ADA-UCB-6c2cb422-1_1		sdf	pdb	RUB-POS-1325a9ea-15_1		sdf	pdb	4.9 ± 0.3
RUN949	ADA-UCB-6c2cb422-1_1		sdf	pdb	MAK-UNK-f203cb68-3_1		sdf	pdb	4.9 ± 0.3
RUN922	ADA-UCB-6c2cb422-1_1		sdf	pdb	MAK-UNK-f203cb68-20_1		sdf	pdb	5.0 ± 0.5
RUN831	ADA-UCB-6c2cb422-1_1		sdf	pdb	JAN-GHE-83b26c96-16_1		sdf	pdb	5.0 ± 0.2
RUN926	ADA-UCB-6c2cb422-1_1		sdf	pdb	BAR-COM-0f94fc3d-38_1		sdf	pdb	5.0 ± 0.3
RUN1181	ADA-UCB-6c2cb422-1_1		sdf	pdb	MAK-UNK-ffc90da7-7_4		sdf	pdb	5.0 ± 0.9
RUN904	ADA-UCB-6c2cb422-1_1		sdf	pdb	MAK-UNK-f203cb68-2_1		sdf	pdb	5.0 ± 0.4
RUN809	ADA-UCB-6c2cb422-1_1		sdf	pdb	AGN-NEW-cce853d0-2_1		sdf	pdb	5.1 ± 0.2
RUN1094	ADA-UCB-6c2cb422-1_1		sdf	pdb	ALP-POS-8b8a49e1-7_1		sdf	pdb	5.1 ± 0.3
RUN1328	ADA-UCB-6c2cb422-1_1		sdf	pdb	DAR-DIA-076fb6ea-14_1		sdf	pdb	5.1 ± 0.4
RUN1156	ADA-UCB-6c2cb422-1_1		sdf	pdb	MIC-UNK-5a93dd5f-1_6		sdf	pdb	5.1 ± 0.4
RUN974	ADA-UCB-6c2cb422-1_1		sdf	pdb	MIC-UNK-4c7b8ba7-1_2		sdf	pdb	5.1 ± 0.3
RUN1018	ADA-UCB-6c2cb422-1_1		sdf	pdb	MIC-UNK-8373f97b-2_1		sdf	pdb	5.1 ± 0.7
RUN1254	ADA-UCB-6c2cb422-1_1		sdf	pdb	JOH-UNI-6fede743-3_1		sdf	pdb	5.1 ± 0.3
RUN973	ADA-UCB-6c2cb422-1_1		sdf	pdb	MIC-UNK-4c7b8ba7-1_1		sdf	pdb	5.1 ± 0.2
RUN806	ADA-UCB-6c2cb422-1_1		sdf	pdb	AGN-NEW-c7b24fe3-1_1		sdf	pdb	5.2 ± 0.2
RUN1262	ADA-UCB-6c2cb422-1_1		sdf	pdb	MAK-UNK-c749d764-22_2		sdf	pdb	5.2 ± 0.5
RUN991	ADA-UCB-6c2cb422-1_1		sdf	pdb	ALP-POS-3b848b35-4_1		sdf	pdb	5.3 ± 0.4
RUN1009	ADA-UCB-6c2cb422-1_1		sdf	pdb	MAT-POS-0bc33984-1_4		sdf	pdb	5.3 ± 0.2
RUN1339	ADA-UCB-6c2cb422-1_1		sdf	pdb	JOH-UNI-3fc3434e-9_1		sdf	pdb	5.4 ± 0.3
RUN1287	ADA-UCB-6c2cb422-1_1		sdf	pdb	JOH-UNI-a38a7bdd-8_3		sdf	pdb	5.4 ± 0.5
RUN1349	ADA-UCB-6c2cb422-1_1		sdf	pdb	JOH-UNI-3fc3434e-11_1		sdf	pdb	5.4 ± 0.3
RUN1120	ADA-UCB-6c2cb422-1_1		sdf	pdb	VLA-UCB-05e51b3f-3_1		sdf	pdb	5.5 ± 0.6
RUN1004	ADA-UCB-6c2cb422-1_1		sdf	pdb	EDJ-MED-976da9a6-2_1		sdf	pdb	5.5 ± 0.5
RUN1006	ADA-UCB-6c2cb422-1_1		sdf	pdb	MAT-POS-0bc33984-1_1		sdf	pdb	5.5 ± 0.2
RUN914	ADA-UCB-6c2cb422-1_1		sdf	pdb	MAK-UNK-f203cb68-14_2		sdf	pdb	5.5 ± 0.9
RUN1140	ADA-UCB-6c2cb422-1_1		sdf	pdb	MIC-UNK-d935700b-2_1		sdf	pdb	5.5 ± 0.4
RUN945	ADA-UCB-6c2cb422-1_1		sdf	pdb	PET-UNK-bbe8d7ff-2_1		sdf	pdb	5.5 ± 0.3
RUN1026	ADA-UCB-6c2cb422-1_1		sdf	pdb	MIC-UNK-8373f97b-4_2		sdf	pdb	5.6 ± 0.3
RUN1107	ADA-UCB-6c2cb422-1_1		sdf	pdb	EDJ-MED-c8e7a002-10_1		sdf	pdb	5.6 ± 0.2
RUN1158	ADA-UCB-6c2cb422-1_1		sdf	pdb	MAK-UNK-ffc90da7-4_4		sdf	pdb	5.7 ± 0.5
RUN986	ADA-UCB-6c2cb422-1_1		sdf	pdb	ALP-POS-ddb41b15-9_1		sdf	pdb	5.8 ± 0.5
RUN959	ADA-UCB-6c2cb422-1_1		sdf	pdb	JAN-GHE-f4ca5a00-12_1		sdf	pdb	5.8 ± 0.2
RUN1125	ADA-UCB-6c2cb422-1_1		sdf	pdb	NAU-LAT-a5c7d7cb-13_2		sdf	pdb	5.9 ± 0.2
RUN1011	ADA-UCB-6c2cb422-1_1		sdf	pdb	PET-UNK-8df914d1-2_1		sdf	pdb	5.9 ± 0.3
RUN1316	ADA-UCB-6c2cb422-1_1		sdf	pdb	DAR-DIA-076fb6ea-13_1		sdf	pdb	5.9 ± 0.5
RUN1347	ADA-UCB-6c2cb422-1_1		sdf	pdb	JOH-UNI-3fc3434e-7_1		sdf	pdb	6.0 ± 0.3
RUN1082	ADA-UCB-6c2cb422-1_1		sdf	pdb	MIC-UNK-13557a72-1_2		sdf	pdb	6.1 ± 0.6
RUN855	ADA-UCB-6c2cb422-1_1		sdf	pdb	BAR-COM-ebf5acce-9_1		sdf	pdb	6.1 ± 0.2
RUN1123	ADA-UCB-6c2cb422-1_1		sdf	pdb	NAU-LAT-a5c7d7cb-10_1		sdf	pdb	6.2 ± 0.2
RUN1257	ADA-UCB-6c2cb422-1_1		sdf	pdb	JOH-UNI-6fede743-2_1		sdf	pdb	6.3 ± 0.3
RUN1015	ADA-UCB-6c2cb422-1_1		sdf	pdb	MIC-UNK-c66144cb-3_1		sdf	pdb	6.3 ± 0.4
RUN1036	ADA-UCB-6c2cb422-1_1		sdf	pdb	MIC-UNK-8373f97b-5_8		sdf	pdb	6.4 ± 0.2
RUN911	ADA-UCB-6c2cb422-1_1		sdf	pdb	MAK-UNK-f203cb68-11_2		sdf	pdb	6.4 ± 0.4
RUN1345	ADA-UCB-6c2cb422-1_1		sdf	pdb	JOH-UNI-3fc3434e-10_1		sdf	pdb	6.4 ± 0.3
RUN918	ADA-UCB-6c2cb422-1_1		sdf	pdb	MAK-UNK-f203cb68-13_2		sdf	pdb	6.5 ± 0.5
RUN1264	ADA-UCB-6c2cb422-1_1		sdf	pdb	MAK-UNK-c749d764-22_1		sdf	pdb	6.6 ± 0.4
RUN927	ADA-UCB-6c2cb422-1_1		sdf	pdb	MAK-UNK-f203cb68-22_1		sdf	pdb	6.6 ± 0.3
RUN916	ADA-UCB-6c2cb422-1_1		sdf	pdb	MAK-UNK-f203cb68-13_1		sdf	pdb	6.6 ± 0.5
RUN1105	ADA-UCB-6c2cb422-1_1		sdf	pdb	EDJ-MED-c8e7a002-5_1		sdf	pdb	6.6 ± 0.3
RUN1494	ADA-UCB-6c2cb422-1_1		sdf	pdb	BEN-DND-02317c5c-9_1		sdf	pdb	6.7 ± 0.3
RUN1182	ADA-UCB-6c2cb422-1_1		sdf	pdb	MIC-UNK-5a93dd5f-5_3		sdf	pdb	6.7 ± 0.4
RUN1324	ADA-UCB-6c2cb422-1_1		sdf	pdb	JOH-UNI-ee5ed7c8-10_1		sdf	pdb	6.8 ± 0.3
RUN1117	ADA-UCB-6c2cb422-1_1		sdf	pdb	ALP-UNI-44c99a80-4_1		sdf	pdb	6.9 ± 0.3
RUN1427	ADA-UCB-6c2cb422-1_1		sdf	pdb	JIN-POS-6dc588a4-5_1		sdf	pdb	6.9 ± 0.2
RUN880	ADA-UCB-6c2cb422-1_1		sdf	pdb	BAR-COM-ebf5acce-6_1		sdf	pdb	6.9 ± 0.3
RUN1237	ADA-UCB-6c2cb422-1_1		sdf	pdb	MIC-UNK-5a93dd5f-11_1		sdf	pdb	6.9 ± 0.5
RUN1475	ADA-UCB-6c2cb422-1_1		sdf	pdb	RUB-POS-1325a9ea-24_2		sdf	pdb	6.9 ± 0.3
RUN905	ADA-UCB-6c2cb422-1_1		sdf	pdb	MAK-UNK-f203cb68-9_2		sdf	pdb	7.0 ± 0.3
RUN1072	ADA-UCB-6c2cb422-1_1		sdf	pdb	MAT-POS-1e5f28a7-1_2		sdf	pdb	7.0 ± 0.4
RUN1203	ADA-UCB-6c2cb422-1_1		sdf	pdb	MIC-UNK-5a93dd5f-4_1		sdf	pdb	7.1 ± 0.3
RUN1163	ADA-UCB-6c2cb422-1_1		sdf	pdb	MAK-UNK-ffc90da7-1_2		sdf	pdb	7.1 ± 0.3
RUN1153	ADA-UCB-6c2cb422-1_1		sdf	pdb	MIC-UNK-5a93dd5f-1_4		sdf	pdb	7.2 ± 0.3
RUN1477	ADA-UCB-6c2cb422-1_1		sdf	pdb	RUB-POS-1325a9ea-24_1		sdf	pdb	7.3 ± 0.3
RUN908	ADA-UCB-6c2cb422-1_1		sdf	pdb	MAK-UNK-f203cb68-2_2		sdf	pdb	7.4 ± 0.4
RUN1112	ADA-UCB-6c2cb422-1_1		sdf	pdb	RIT-UNK-fa3975ff-1_1		sdf	pdb	7.6 ± 0.3
RUN901	ADA-UCB-6c2cb422-1_1		sdf	pdb	MAK-UNK-f203cb68-5_1		sdf	pdb	7.6 ± 0.7
RUN964	ADA-UCB-6c2cb422-1_1		sdf	pdb	ADA-UCB-6c2cb422-10_1		sdf	pdb	7.6 ± 0.4
RUN1080	ADA-UCB-6c2cb422-1_1		sdf	pdb	MIC-UNK-13557a72-1_1		sdf	pdb	7.7 ± 0.6
RUN1183	ADA-UCB-6c2cb422-1_1		sdf	pdb	MAK-UNK-ffc90da7-4_3		sdf	pdb	7.8 ± 0.6
RUN992	ADA-UCB-6c2cb422-1_1		sdf	pdb	EDJ-MED-50fe53e8-4_1		sdf	pdb	7.8 ± 0.3
RUN909	ADA-UCB-6c2cb422-1_1		sdf	pdb	MAK-UNK-f203cb68-11_1		sdf	pdb	7.8 ± 0.4
RUN1179	ADA-UCB-6c2cb422-1_1		sdf	pdb	MIC-UNK-5a93dd5f-5_1		sdf	pdb	7.8 ± 0.4
RUN1165	ADA-UCB-6c2cb422-1_1		sdf	pdb	MAK-UNK-ffc90da7-1_1		sdf	pdb	8.0 ± 0.4
RUN1451	ADA-UCB-6c2cb422-1_1		sdf	pdb	RUB-POS-1325a9ea-6_1		sdf	pdb	8.0 ± 0.5
RUN1225	ADA-UCB-6c2cb422-1_1		sdf	pdb	MIC-UNK-5a93dd5f-7_3		sdf	pdb	8.0 ± 0.5
RUN1223	ADA-UCB-6c2cb422-1_1		sdf	pdb	MIC-UNK-5a93dd5f-9_4		sdf	pdb	8.1 ± 0.3
RUN1176	ADA-UCB-6c2cb422-1_1		sdf	pdb	MAK-UNK-ffc90da7-4_1		sdf	pdb	8.2 ± 0.4
RUN1222	ADA-UCB-6c2cb422-1_1		sdf	pdb	MIC-UNK-5a93dd5f-9_3		sdf	pdb	8.5 ± 0.3
RUN1330	ADA-UCB-6c2cb422-1_1		sdf	pdb	JOH-UNI-ee5ed7c8-7_1		sdf	pdb	8.6 ± 0.3
RUN1208	ADA-UCB-6c2cb422-1_1		sdf	pdb	MIC-UNK-5a93dd5f-5_4		sdf	pdb	8.6 ± 0.4
RUN1193	ADA-UCB-6c2cb422-1_1		sdf	pdb	MIC-UNK-5a93dd5f-5_2		sdf	pdb	8.7 ± 0.3
RUN1457	ADA-UCB-6c2cb422-1_1		sdf	pdb	RUB-POS-1325a9ea-6_2		sdf	pdb	8.7 ± 0.7
RUN1259	ADA-UCB-6c2cb422-1_1		sdf	pdb	MAK-UNK-c749d764-6_1		sdf	pdb	8.9 ± 0.5
RUN1213	ADA-UCB-6c2cb422-1_1		sdf	pdb	MIC-UNK-5a93dd5f-6_1		sdf	pdb	9.0 ± 0.4
RUN1173	ADA-UCB-6c2cb422-1_1		sdf	pdb	MAK-UNK-ffc90da7-7_1		sdf	pdb	9 ± 1
RUN1168	ADA-UCB-6c2cb422-1_1		sdf	pdb	MAK-UNK-ffc90da7-4_2		sdf	pdb	9.2 ± 0.4
RUN930	ADA-UCB-6c2cb422-1_1		sdf	pdb	MAK-UNK-f203cb68-21_1		sdf	pdb	9.4 ± 0.3
RUN1233	ADA-UCB-6c2cb422-1_1		sdf	pdb	MIC-UNK-5a93dd5f-7_4		sdf	pdb	9.6 ± 0.5
RUN1215	ADA-UCB-6c2cb422-1_1		sdf	pdb	MIC-UNK-5a93dd5f-7_1		sdf	pdb	10.0 ± 0.4
RUN1220	ADA-UCB-6c2cb422-1_1		sdf	pdb	MIC-UNK-5a93dd5f-9_2		sdf	pdb	10.0 ± 0.2
RUN1118	ADA-UCB-6c2cb422-1_1		sdf	pdb	NAU-LAT-a5c7d7cb-2_1		sdf	pdb	10.1 ± 0.4
RUN1351	ADA-UCB-6c2cb422-1_1		sdf	pdb	NIR-THE-590dedc7-1_1		sdf	pdb	10.3 ± 0.3
RUN1236	ADA-UCB-6c2cb422-1_1		sdf	pdb	MIC-UNK-5a93dd5f-10_1		sdf	pdb	10.5 ± 0.4
RUN1075	ADA-UCB-6c2cb422-1_1		sdf	pdb	MIC-UNK-6ab519a7-1_1		sdf	pdb	10.7 ± 0.4
RUN1219	ADA-UCB-6c2cb422-1_1		sdf	pdb	MIC-UNK-5a93dd5f-8_1		sdf	pdb	10.8 ± 0.4
RUN1172	ADA-UCB-6c2cb422-1_1		sdf	pdb	MIC-UNK-5a93dd5f-2_6		sdf	pdb	10.9 ± 0.4
RUN1267	ADA-UCB-6c2cb422-1_1		sdf	pdb	MAK-UNK-c749d764-22_4		sdf	pdb	11.1 ± 0.6
RUN1226	ADA-UCB-6c2cb422-1_1		sdf	pdb	MIC-UNK-5a93dd5f-11_2		sdf	pdb	11.3 ± 0.7
RUN1166	ADA-UCB-6c2cb422-1_1		sdf	pdb	MAK-UNK-ffc90da7-7_2		sdf	pdb	11.8 ± 0.9
RUN1154	ADA-UCB-6c2cb422-1_1		sdf	pdb	MIC-UNK-5a93dd5f-2_4		sdf	pdb	11.9 ± 0.4
RUN1221	ADA-UCB-6c2cb422-1_1		sdf	pdb	MIC-UNK-5a93dd5f-9_1		sdf	pdb	14.0 ± 0.3