PDB-5gm1: Crystal structure of methyltransferase TleD complexed with SAH

Basic information

• Entry: Database: PDB / ID: 5gm1
• Title: Crystal structure of methyltransferase TleD complexed with SAH
• Components: O-methylransferase
• Keywords: TRANSFERASE / TleD / Teleocidin / methyltransferases / terpene cyclization

Function / homology

Function:

methyltransferase activity

Domain/homology:

Methyltransferase type 11 / Methyltransferase domain / Vaccinia Virus protein VP39 / S-adenosyl-L-methionine-dependent methyltransferase superfamily / Rossmann fold / 3-Layer(aba) Sandwich / Alpha Beta

Component:

S-ADENOSYL-L-HOMOCYSTEINE / O-methylransferase

• Biological species: Streptomyces blastmyceticus (bacteria)
• Method: X-RAY DIFFRACTION / SYNCHROTRON / MOLECULAR REPLACEMENT / Resolution: 2.501 Å
• Authors: Yu, F. / Li, M.J. / Xu, C.Y. / Zhou, H. / Sun, B. / Wang, Z.J. / Xu, Q. / Xie, M.Y. / Zuo, G. / Huang, P. / Wang, Q.S. / He, J.H.

Funding support

China, 1items

Organization	Grant number	Country
National Natural Science Foundation	31570740	China

• Citation: Journal: Biochem.J. / Year: 2016; Title: Crystal structure and enantioselectivity of terpene cyclization in SAM-dependent methyltransferase TleD; Authors: Yu, F. / Li, M.J. / Xu, C.Y. / Sun, B. / Zhou, H. / Wang, Z.J. / Xu, Q. / Xie, M.Y. / Zuo, G. / Huang, P. / Guo, H. / Wang, Q.S. / He, J.H.

History

Deposition	Jul 12, 2016	Deposition site: PDBJ / Processing site: PDBJ
Revision 1.0	Sep 28, 2016	Provider: repository / Type: Initial release
Revision 1.1	Dec 7, 2016	Group: Database references
Revision 1.2	Mar 20, 2024	Group: Data collection / Database references Category: chem_comp_atom / chem_comp_bond / citation / database_2 Item: _citation.journal_id_CSD / _database_2.pdbx_DOI / _database_2.pdbx_database_accession

Assembly

Deposited unit

A: O-methylransferase

B: O-methylransferase

C: O-methylransferase

D: O-methylransferase

E: O-methylransferase

F: O-methylransferase

G: O-methylransferase

H: O-methylransferase

I: O-methylransferase

J: O-methylransferase

K: O-methylransferase

L: O-methylransferase

M: O-methylransferase

N: O-methylransferase

O: O-methylransferase

P: O-methylransferase

Q: O-methylransferase

R: O-methylransferase

hetero molecules

Summary:

• 598 kDa, 18 polymers

Component details:

	Theoretical mass	Number of molelcules
Total (without water)	598,120	37
Polymers	590,816	18
Non-polymers	7,304	19
Water	12,538	696

1

A: O-methylransferase

B: O-methylransferase

C: O-methylransferase

D: O-methylransferase

E: O-methylransferase

F: O-methylransferase

hetero molecules

Summary:

• defined by author
• 200 kDa, 6 polymers

Component details:

	Theoretical mass	Number of molelcules
Total (without water)	199,629	13
Polymers	196,939	6
Non-polymers	2,691	7
Water	108	6

Symmetry operations:

Type	Name	Symmetry operation	Number
identity operation	1_555	x,y,z	1

2

G: O-methylransferase

H: O-methylransferase

I: O-methylransferase

J: O-methylransferase

K: O-methylransferase

L: O-methylransferase

hetero molecules

Summary:

• defined by author
• 199 kDa, 6 polymers

Component details:

	Theoretical mass	Number of molelcules
Total (without water)	199,245	12
Polymers	196,939	6
Non-polymers	2,306	6
Water	108	6

Symmetry operations:

Type	Name	Symmetry operation	Number
identity operation	1_555	x,y,z	1

3

M: O-methylransferase

N: O-methylransferase

O: O-methylransferase

P: O-methylransferase

Q: O-methylransferase

R: O-methylransferase

hetero molecules

Summary:

• defined by author
• 199 kDa, 6 polymers

Component details:

	Theoretical mass	Number of molelcules
Total (without water)	199,245	12
Polymers	196,939	6
Non-polymers	2,306	6
Water	108	6

Symmetry operations:

Type	Name	Symmetry operation	Number
identity operation	1_555	x,y,z	1

Unit cell

Length a, b, c (Å)	259.621, 152.902, 154.793
Angle α, β, γ (deg.)	90.00, 93.33, 90.00
Int Tables number	5
Space group name H-M	C121

Components on special symmetry positions

ID	Model	Components
1	1	H-404- HOH

Components

#1: Protein

A B C D E F G H I J K L M N O P Q R
O-methylransferase / Methyltransferase TleD

Details:

Mass: 32823.102 Da / Num. of mol.: 18
Source method: isolated from a genetically manipulated source
Source: (gene. exp.) Streptomyces blastmyceticus (bacteria) / Gene: tleD / Production host: Escherichia coli (E. coli) / References: UniProt: A0A077K7L1

#2: Chemical

A-301 B-301 B-302 C-301 D-301 E-301 F-301 G-301 H-301 I-301 J-301 K-301 L-301 M-301 N-301 O-301 P-301 Q-301 R-301
ChemComp-SAH / S-ADENOSYL-L-HOMOCYSTEINE / S-Adenosyl-L-homocysteine

Details:

Type: L-peptide linking / Mass: 384.411 Da / Num. of mol.: 19
Source method: isolated from a genetically manipulated source
Formula: C₁₄H₂₀N₆O₅S

#3: Water

ChemComp-HOH / water / Water

Details:

Mass: 18.015 Da / Num. of mol.: 696 / Source method: isolated from a natural source / Formula: H₂O

Experimental details

Experiment

• Experiment: Method: X-RAY DIFFRACTION / Number of used crystals: 1

Sample preparation

• Crystal: Density Matthews: 2.46 ų/Da / Density % sol: 50.08 %
• Crystal grow: Temperature: 291 K / Method: vapor diffusion, hanging drop / pH: 8 ; Details: 100 mM Tris-HCl, 18% PEG400, 14% PEG3350, 100 mM MgCl2, 2mM TCEP

Data collection

• Diffraction: Mean temperature: 100 K
• Diffraction source: Source: SYNCHROTRON / Site: SSRF / Beamline: BL17U / Wavelength: 0.97908 Å
• Detector: Type: ADSC QUANTUM 315r / Detector: CCD / Date: Dec 25, 2014
• Radiation: Protocol: SINGLE WAVELENGTH / Monochromatic (M) / Laue (L): M / Scattering type: x-ray
• Radiation wavelength: Wavelength: 0.97908 Å / Relative weight: 1
• Reflection: Resolution: 2.5→154.53 Å / Num. obs: 205755 / % possible obs: 99 % / Redundancy: 5.4 % / CC_1/2: 0.998 / R_merge(I) obs: 0.08 / Net I/σ(I): 14.5
• Reflection shell: Resolution: 2.5→2.64 Å / % possible all: 96.3

Processing

Software

Name	Version	Classification
PHENIX	(1.10.1_2155: ???)	refinement
XDS		data reduction
Aimless		data scaling
PHASER		phasing

Refinement

Method to determine structure: MOLECULAR REPLACEMENT / Resolution: 2.501→102.265 Å / SU ML: 0.35 / Cross valid method: FREE R-VALUE / σ(F): 1.35 / Phase error: 26.1

	Rfactor	Num. reflection	% reflection
Rfree	0.2481	10313	5.01 %
Rwork	0.2075	-	-
obs	0.2095	205755	98.95 %

• Solvent computation: Shrinkage radii: 0.9 Å / VDW probe radii: 1.11 Å

Refinement step

Cycle: LAST / Resolution: 2.501→102.265 Å

	Protein	Nucleic acid	Ligand	Solvent	Total
Num. atoms	39381	0	0	696	40077

Refine LS restraints

Refine-ID	Type	Dev ideal	Number
X-RAY DIFFRACTION	f_bond_d	0.003	40346
X-RAY DIFFRACTION	f_angle_d	0.592	54810
X-RAY DIFFRACTION	f_dihedral_angle_d	13.92	23888
X-RAY DIFFRACTION	f_chiral_restr	0.04	6180
X-RAY DIFFRACTION	f_plane_restr	0.003	7097

Refinement TLS params.

Method: refined / Refine-ID: X-RAY DIFFRACTION

ID	L11 (°2)	L12 (°2)	L13 (°2)	L22 (°2)	L23 (°2)	L33 (°2)	S11 (Å °)	S12 (Å °)	S13 (Å °)	S21 (Å °)	S22 (Å °)	S23 (Å °)	S31 (Å °)	S32 (Å °)	S33 (Å °)	T11 (Å2)	T12 (Å2)	T13 (Å2)	T22 (Å2)	T23 (Å2)	T33 (Å2)	Origin x (Å)	Origin y (Å)	Origin z (Å)
1	0.9134	1.343	0.6296	2.9178	1.6333	1.5326	0.1552	-0.0247	-0.2866	-0.0115	-0.125	0.1447	0.0742	-0.3443	0.0225	0.4378	0.0821	-0.1001	0.29	0.0453	0.6795	33.2427	-39.1562	73.2678
2	1.2874	0.2324	0.0718	0.9006	0.2499	0.6948	-0.0575	-0.1754	-0.25	0.2048	0.0666	-0.1405	-0.0876	0.0801	-0.0261	0.4007	0.0472	0.0057	0.2168	-0.0068	0.404	45.6752	-7.4572	75.745
3	1.0984	-0.399	-0.8602	1.0076	-0.0452	1.1968	0.1793	0.0122	0.2001	-0.3127	-0.1607	-0.0039	-0.2318	0.014	-0.0302	0.4786	0.0702	-0.0149	0.2195	-0.0199	0.4138	43.579	2.4972	69.383
4	6.0753	-0.413	-1.9197	2.4838	1.7853	6.8989	0.1334	0.6428	0.2109	-0.4823	-0.1795	0.1956	-0.2969	-0.1225	0.0355	0.7031	0.1219	-0.2756	0.4818	-0.012	0.8262	28.4591	-10.4002	52.6871
5	1.9779	-0.3927	-0.2984	1.7977	0.0738	0.8409	0.15	0.4957	-0.1712	-0.429	-0.147	0.3929	0.0187	-0.2402	0.0077	0.5738	0.1046	-0.1265	0.2571	-0.0438	0.5053	35.6463	-12.0611	61.629
6	1.9456	0.112	-0.2399	3.1526	-0.1774	1.7284	-0.0278	0.2118	-0.05	-0.3316	0.0261	0.1373	-0.1169	-0.3894	-0.0649	0.5583	0.1106	-0.1416	0.3004	0.0097	0.5867	27.6645	-2.977	67.821
7	2.1568	-0.6289	-0.8477	2.9545	1.7558	2.4353	0.256	-0.0514	-0.3794	-0.3536	-0.1005	0.214	0.427	0.1837	-0.2411	0.4973	0.0885	-0.0453	0.2323	0.0056	0.5008	41.2499	-20.8541	66.7306
8	1.5122	-1.4913	1.8273	1.4604	-1.7727	2.4201	-0.1573	-0.0035	0.0928	-0.0775	-0.146	-0.0522	-0.4003	0.0146	0.2988	0.5357	0.021	-0.0871	0.241	-0.0375	0.6097	44.7706	-34.8436	69.2339
9	1.747	-0.1017	0.1237	0.8024	0.036	0.7953	-0.2071	0.1712	-0.2096	0.0012	0.1481	-0.0815	-0.0129	0.2354	0.0283	0.4212	0.0282	-0.044	0.2899	-0.0554	0.6459	48.8685	-48.2362	68.7645
10	1.5958	0.4834	0.1421	1.8625	-0.1923	2.3192	0.0459	0.3276	-0.516	0.0218	-0.0156	-0.1956	0.2504	0.001	0.0117	0.5803	0.0303	-0.0826	0.3225	-0.0845	0.6242	44.0999	-55.598	66.8408
11	0.1013	-0.4833	-0.0518	2.1974	0.1355	0.6674	0.1811	-0.124	-0.2551	0.2399	-0.0307	0.1622	0.0026	-0.2822	-0.1083	0.4652	-0.009	-0.0334	0.334	0.0478	0.6896	42.3982	-50.3662	81.1731
12	3.8531	0.3834	0.9883	1.6097	1.7173	4.6182	0.2521	-0.3284	-0.2352	0.3596	0.0178	0.3661	0.4442	-0.6362	-0.1919	0.6222	-0.0216	0.0044	0.5198	0.1211	1.1278	22.8042	-40.7348	83.9069
13	1.1063	-0.1126	0.1802	0.722	0.2468	1.0103	0.0261	-0.3985	-0.3586	0.2024	-0.2041	0.0291	0.2751	-0.3538	0.0893	0.5997	0.0321	0.0762	0.3129	0.1534	0.6906	40.1822	-45.0129	88.727
14	2.5024	0.7726	1.383	1.9222	0.5687	2.0192	0.0865	0.0585	0.0713	-0.3728	-0.0254	0.4707	-0.0452	-0.3889	0.1825	0.4983	0.0416	-0.1506	0.352	0.0251	0.8324	26.4259	-33.5426	66.7314
15	1.9786	-0.2811	1.1503	1.1893	0.0581	1.9413	0.0415	-0.1432	-0.0976	0.0695	-0.1319	0.4809	0.0001	-0.4086	0.0843	0.5112	0.0705	0.0316	0.3448	0.1281	0.7911	31.908	-38.5914	79.9586
16	1.1093	-0.2323	0.3244	1.4604	0.0415	1.4207	0.0852	0.2281	0.3006	-0.1107	-0.0773	-0.3816	0.0733	0.0151	0.0485	0.4805	0.0452	0.1319	0.2299	0.0694	0.6461	74.0019	-10.7438	65.3181
17	1.1605	0.2738	-0.2894	3.0327	-1.2336	3.0364	0.014	-0.1401	0.4837	0.6585	0.1448	-0.1369	-0.6768	-0.0644	-0.1097	0.764	0.0445	-0.1561	0.3651	-0.1419	1.0917	81.4688	2.3584	87.6295
18	0.5061	0.0791	0.0412	1.235	-0.3411	1.4379	-0.1849	-0.055	0.4435	0.0777	-0	-1.0869	-0.2713	0.6321	0.0033	0.6048	0.0178	-0.1225	0.1529	-0.186	1.4803	93.5454	-12.4031	80.0732
19	1.5004	0.0384	-0.0817	1.6141	-0.5507	1.4869	-0.1505	0.2583	0.3924	0.1146	0.0052	-0.8695	-0.2159	0.1307	0.0573	0.5092	0.0336	0.0597	0.2865	-0.0201	0.9557	88.1636	-9.6036	68.4639
20	1.6119	0.8602	0.986	2.0518	0.5558	2.0079	0.2954	-0.0324	0.1682	0.3886	0.1509	-0.8474	0.1242	0.1678	-0.2456	0.7798	-0.1376	0.1608	0.2985	-0.018	1.3842	91.9622	2.286	72.6592
21	0.6862	0.1719	0.5743	5.9214	0.4094	1.2968	-0.1573	0.1645	0.3918	-0.5751	0.1873	-0.2471	0.1335	0.055	0.0015	0.4804	0.0167	0.1633	0.3508	0.0762	0.6687	79.9016	-15.8584	66.6331
22	5.7761	1.7699	-0.4285	1.5854	-0.0636	0.6954	-0.06	-0.2818	-0.2505	0.0163	-0.1709	-0.1855	0.0401	-0.1329	0.257	0.5475	0.0581	0.1312	0.3287	0.0322	0.5122	70.7824	-23.0472	57.4958
23	0.8043	0.5492	0.1137	1.8976	-0.3521	0.5945	0.1537	0.441	-0.2859	-0.1776	-0.2362	0.1106	0.1831	-0.0585	0.1057	0.8012	0.1536	0.0525	0.4319	-0.073	0.5656	63.975	-31.9268	48.9198
24	2.0987	-1.0311	0.2164	2.3756	-0.3371	2.1198	0.3296	0.6204	-0.4926	-0.6251	-0.2156	0.1513	0.1737	-0.0315	0.0867	0.9531	0.2062	0.1082	0.5471	-0.119	0.5987	69.2406	-33.4483	40.3722
25	1.7103	0.3582	0.0306	1.0561	0.2683	1.2757	0.1955	0.7102	-0.3497	-0.676	-0.3389	0.1407	-0.0498	-0.0597	0.0905	0.8936	0.2665	0.0069	0.5283	-0.1166	0.5153	55.931	-23.5622	42.6819
26	4.2214	-0.4605	-2.3747	3.0511	-0.1156	3.8763	0.0891	0.4962	0.1596	-0.4168	-0.1234	-0.0125	-0.2307	-0.3253	-0.0029	1.1088	0.1767	0.1775	0.7604	0.1453	0.6391	67.3863	-1.4994	39.8163
27	1.1691	0.3009	-0.3487	1.0075	-0.0362	0.7414	0.2748	0.5196	-0.0116	-0.5946	-0.3048	-0.3057	-0.1588	0.047	0.0355	0.8197	0.1385	0.1398	0.4725	0.0844	0.5435	68.4115	-12.3214	47.1295
28	3.5351	1.0465	-0.9793	1.8229	-0.382	1.4171	0.0702	0.2934	0.2214	-0.5451	-0.1606	-0.1762	-0.0869	0.2672	0.114	0.7746	0.123	0.1386	0.4175	0.0979	0.4552	66.3967	-10.4458	47.1622
29	5.0454	0.6778	-1.3309	1.4699	-0.7971	2.1563	0.1461	-0.0313	-0.1815	0.121	0.2085	-0.6247	0.0038	0.1111	-0.2695	0.5178	0.1463	-0.1097	0.2894	-0.0684	0.6811	88.7705	-53.1207	89.96
30	1.4568	-0.3706	-0.4872	5.1807	0.2977	1.6098	-0.2407	-0.4435	0.2449	0.1207	0.3232	-0.3161	-0.3969	-0.3672	-0.0798	0.4108	0.1516	-0.0497	0.3229	-0.0339	0.4246	75.5303	-34.9109	90.6526
31	4.0326	-1.1506	1.0335	0.4045	-0.4019	0.4112	0.1732	0.3136	0.0726	0.3238	0.0723	-0.0346	-0.1307	0.0713	-0.2055	0.6518	0.2114	-0.0239	0.3498	-0.0532	0.4196	63.6071	-27.7966	95.7501
32	1.1602	-0.1066	0.0687	1.0238	-0.3715	1.0768	-0.1018	-0.4182	0.4323	0.1066	0.1047	-0.0398	-0.0863	-0.0837	0.0099	0.8986	0.2554	-0.0572	0.4346	-0.0494	0.5189	53.882	-19.1509	101.2315
33	4.0276	1.5413	-0.3371	3.0017	0.2413	2.3551	-0.4383	-0.4714	0.636	0.5308	0.3001	0.136	-0.3516	-0.0734	0.056	1.0795	0.2983	-0.0843	0.5482	-0.1081	0.5125	55.4041	-17.8533	111.1489
34	1.7786	-0.5761	0.3031	2.1463	-0.858	2.3184	0.0213	-0.102	0.2052	-0.0375	-0.0912	-0.1088	-0.1719	-0.5279	0.0496	0.7239	0.2381	0.0392	0.5695	-0.0009	0.4388	45.5893	-25.4151	105.4816
35	1.2153	-1.1431	-0.0485	4.1034	-0.3443	0.7194	0.149	0.0122	-0.0823	0.1394	-0.4348	-0.0137	-0.137	-0.3358	0.1433	0.7187	0.1892	0.0836	0.4368	0.0189	0.3974	42.6932	-29.8379	101.9826
36	1.8964	0.3412	1.9662	1.9667	0.2536	4.0021	-0.0848	-0.1441	-0.0615	0.4633	-0.1232	0.3028	0.0584	-0.2334	0.1073	1.0468	0.1835	0.123	0.7919	0.2408	0.5847	54.2366	-48.8183	110.3947
37	2.2235	-0.0427	0.8295	0.8771	0.1505	1.1651	0.1004	-0.3072	-0.0949	0.4997	0.0956	0.0684	0.1523	-0.0765	-0.1869	0.7306	0.204	0.0676	0.4431	0.1158	0.4564	57.0031	-39.6909	103.9467
38	6.4279	0.5288	-1.4678	1.339	-0.3979	2.4201	0.3063	-0.476	-0.0096	0.3658	-0.0708	0.0345	0.3009	-0.2046	-0.2307	1.097	0.2835	-0.0924	0.61	0.0183	0.4766	58.5578	-33.5612	115.9347
39	1.8813	0.8619	0.8807	2.8383	2.1127	3.5155	-0.2079	-0.3459	-0.1586	0.5319	0.1806	-0.0891	-0.3515	-0.1803	0.0591	0.5745	0.1645	0.0185	0.3794	0.0453	0.3705	63.3099	-37.6755	94.296
40	0.5026	0.1822	-0.1611	0.9039	-0.3987	2.2972	-0.0021	0.1595	0.1109	-0.2961	0.1714	0.0922	-0.0801	-0.3932	-0.1228	0.3814	0.0338	0.0432	0.1614	-0.0033	0.4519	76.8194	-44.2267	76.6723
41	4.6365	1.1848	0.644	3.3365	0.1132	2.2374	-0.1675	0.0796	-0.3077	-0.3907	0.2332	-0.3294	0.2945	-0.0559	-0.0881	0.474	0.0516	0.0556	0.1343	-0.0471	0.4803	83.4067	-55.5006	74.594
42	1.6416	0.0609	-0.0854	0.9799	-0.4734	2.1651	-0.0024	-0.0087	0.1778	-0.3077	0.0488	-0.989	0.0509	0.2219	-0.0203	0.4372	0.0271	0.0684	0.2111	-0.0479	0.7825	91.3448	-40.7007	74.1032
43	0.8732	0.2916	0.6509	3.5839	-0.9082	1.9292	0.1553	0.0961	0.0315	0.0125	0.0306	-0.4249	-0.083	0.3568	-0.2291	0.684	0.1939	-0.356	0.5496	-0.2192	1.1114	95.1649	-39.1347	98.1938
44	0.2563	-0.0673	-0.2081	0.0754	-0.1104	0.8153	-0.1	-0.1313	0.3439	0.1638	-0.0274	-0.8625	-0.2995	0.4904	0.0471	0.4387	-0.0063	-0.0334	0.2968	-0.1023	0.9954	92.6814	-31.4078	81.528
45	0.7016	-0.8745	0.0926	4.4304	-1.4457	1.3311	-0.1907	-0.2555	-0.1522	0.2555	-0.0138	-0.378	0.3374	-0.0757	0.1869	0.5694	0.1297	-0.0455	0.4034	-0.0057	0.3979	78.7115	-48.7922	98.9997
46	1.2887	-0.1553	-0.21	1.9796	-1.3	2.7037	-0.138	-0.3516	0.2597	0.4798	0.1437	-0.777	-0.2569	0.4005	-0.1295	0.5683	0.0982	-0.1308	0.3323	-0.1653	0.6263	87.1941	-38.4463	91.7787
47	0.354	-0.1179	-0.5666	0.6795	-0.4577	1.6147	-0.3651	0.6156	-0.1376	-0.9156	0.5424	-0.1877	-0.3735	-0.1129	-0.1269	0.9984	-0.5953	0.2013	1.8312	0.1127	0.5921	104.4681	-60.8849	0.418
48	1.4192	0.0416	0.8378	0.6119	0.2433	1.9628	-0.3195	0.2662	0.2856	0.0604	0.2939	0.2714	-0.959	-0.836	0.0363	0.6808	0.2038	0.03	1.1021	0.346	0.5936	88.5224	-44.7864	32.329
49	0.5244	-0.5223	0.4796	0.5372	-0.4346	0.5728	-0.3134	0.7206	0.7764	-0.3264	0.2871	0.0892	-1.3229	-0.3739	0.2344	1.2779	-0.0794	-0.0661	1.2861	0.6201	0.7005	97.8935	-37.1157	18.3897
50	1.1875	-0.5378	-0.1836	1.3638	0.9844	1.0528	-0.1004	0.3927	0.4393	-0.3791	0.2361	0.0594	-0.3682	0.224	-0.0909	0.853	-0.1248	0.1082	0.9047	0.2772	0.5737	104.5716	-40.0387	30.6487
51	0.6253	-0.2195	0.9521	1.4769	-0.049	1.5404	-0.2121	-0.042	0.3432	-0.1408	0.1545	0.2077	-0.729	-0.3271	0.1449	1.3657	0.3576	-0.0631	1.6713	0.7061	0.876	84.7641	-35.6804	18.3395
52	2.5433	-0.7344	-0.4145	0.9353	0.401	1.4711	-0.0969	0.2735	0.2613	-0.512	0.4058	0.0794	-0.3648	0.0357	-0.1896	0.7525	-0.1508	0.0413	1.3168	0.3329	0.5404	102.4053	-49.7384	17.9248
53	0.199	-0.3071	-0.0248	0.4531	0.0458	0.134	0.0159	0.1617	0.0839	0.0693	0.1689	0.0538	-0.2631	0.2127	-0.1511	0.4059	-0.5064	0.4104	1.8167	0.0293	0.4398	109.9299	-60.7438	11.8205
54	0.9879	-0.196	-0.1651	0.7055	0.016	0.2752	0.0266	0.3359	0.063	-0.5886	0.6328	-0.751	0.0495	0.1494	0.2536	0.4912	-0.5166	0.4944	2.6044	-0.5792	0.7369	119.2282	-70.2755	1.5862
55	0.2383	0.2182	-0.3068	0.2406	-0.2655	0.4061	-0.2726	0.5076	-0.1278	-0.4228	0.4922	-0.3037	0.4529	0.4685	-0.0679	0.6898	-0.3083	0.2144	1.9306	-0.3282	0.6536	109.2116	-79.7525	0.9883
56	1.9023	1.1373	0.674	4.9286	-3.6742	4.7784	0.0884	0.3457	-0.0402	-0.4487	0.1338	0.0334	-0.1479	-0.1465	-0.1552	0.8456	-0.2988	-0.0021	2.1568	0.2547	0.7715	91.176	-66.3563	-8.6682
57	0.814	-0.1616	-0.0749	0.4683	0.0139	1.0837	-0.228	0.8555	0.0696	-0.7108	0.4918	-0.3061	-0.3893	-0.1063	-0.165	0.9246	-0.5002	0.0695	1.6867	0.1033	0.5478	101.008	-64.1514	0.0879
58	0.9824	0.5219	-0.2683	1.8421	-0.4246	1.9751	-0.1212	0.592	0.1594	-0.6472	0.5296	0.1508	-0.5071	0.2351	-0.2835	0.8093	-0.3538	0.0269	1.6804	0.0613	0.5137	98.5842	-65.2538	-0.1583
59	3.3538	-1.1239	0.9974	2.8642	-0.3035	1.6511	-0.0851	0.1105	0.4328	-0.0459	0.0318	-0.5786	-0.332	0.1401	0.0782	0.9384	-0.6503	-0.0945	1.5216	-0.0176	1.0441	137.2661	-35.8637	43.4569
60	4.8154	-0.0403	0.2383	1.9081	0.2934	2.0613	-0.0493	0.4448	-0.0667	0.2225	0.249	-0.4213	-0.5005	0.8009	-0.2077	0.4993	-0.1937	-0.023	0.6715	0.0007	0.4793	121.372	-51.0332	46.0177
61	1.8305	2.3948	0.6497	6.8154	1.2294	0.8904	-0.0463	0.3671	0.0313	-0.455	0.1806	-0.1741	-0.1164	0.0901	-0.1305	0.2295	-0.004	0.0189	0.3948	-0.0187	0.3701	107.6104	-61.3773	50.7
62	0.9583	0.4562	0.4488	1.0921	0.3088	2.0456	0.0272	0.305	0.0702	0.0096	0.006	0.1832	0.1878	-0.2629	-0.0049	0.2027	0.0063	-0.0416	0.3794	-0.0694	0.3481	96.8658	-68.8732	55.843
63	3.726	-2.0378	1.0163	4.7187	-0.7656	2.9731	0.1606	-0.2712	0.1193	0.2865	-0.0803	0.654	-0.0489	-0.4789	-0.0246	0.2486	0.0424	0.0972	0.3055	-0.0899	0.3607	93.8286	-64.7818	64.8457
64	3.4743	0.3887	0.8623	2.1964	0.6583	4.3676	0.0299	-0.0515	-0.1501	0.3459	0.0041	-0.1831	0.61	0.0818	-0.0168	0.3199	0.0604	-0.0201	0.2565	-0.0164	0.3921	101.0496	-76.617	62.7534
65	1.8481	0.3612	0.0676	1.6185	-0.5073	1.6117	0.0146	0.2655	-0.4264	0.328	0.1503	-0.021	0.5349	0.2326	-0.0605	0.4201	0.0731	-0.0095	0.3219	-0.1068	0.4086	105.5821	-80.6305	60.7622
66	2.6443	1.2714	0.6951	1.8718	0.7939	5.7683	0.1226	-0.0117	-0.2981	0.3157	-0.0078	-0.2454	0.6149	0.8801	-0.1272	0.4801	0.0106	-0.1884	0.7132	-0.0849	0.5248	124.1086	-69.5897	70.723
67	0.1117	-0.1176	-0.3502	0.6207	0.5792	1.2773	0.1042	0.132	-0.4783	0.3063	-0.0015	-0.4049	0.5741	0.5814	-0.1639	0.4524	0.1691	-0.1053	0.5273	-0.0437	0.5098	114.9951	-80.6605	59.2896
68	0.9721	0.1574	-0.8927	4.6157	2.5406	4.8725	0.056	0.0976	0.4291	0.4345	-0.0747	0.2733	-0.6155	0.5108	0.0231	0.3581	-0.14	-0.1061	0.5774	-0.0633	0.4666	116.7375	-53.169	64.5569
69	1.4984	1.1933	0.7634	3.7243	2.0016	2.7447	0.126	-0.1277	-0.2235	0.2667	-0.0542	-0.4675	-0.0198	0.5861	-0.0434	0.3437	0.0411	-0.1357	0.5944	-0.0299	0.4559	118.2303	-68.0885	62.4687
70	1.3346	0.9927	-0.3329	4.7932	-2.8541	4.1132	0.0143	-0.5333	0.0039	0.3558	-0.1925	-0.0975	-0.2886	0.0132	0.1319	0.3862	0.0159	-0.0781	0.5682	-0.0605	0.3052	108.9739	-63.4804	72.3415
71	2.7326	-0.8442	-1.4895	1.1888	0.7831	1.5739	-0.0945	0.5288	0.0861	-0.1393	0.1341	-0.1755	-0.1631	0.7098	0.0141	0.2765	-0.0359	-0.0482	0.7391	-0.0718	0.4343	117.4197	-62.9301	51.3167
72	0.2374	-0.2609	-0.1505	0.2789	0.093	1.4793	-0.1064	0.6205	0.0669	-0.2807	0.1251	-0.5303	-0.3183	0.6337	-0.0002	0.2317	-0.4619	0.106	1.6116	-0.0049	0.646	128.4826	-54.0115	33.1012
73	0.5203	0.132	-0.0564	0.6909	-0.3251	1.1016	-0.0923	0.4344	0.6359	-0.1685	0.218	-0.5838	-0.8432	0.9521	-0.1508	0.9062	-0.5643	-0.0043	1.4534	0.2088	1.0096	128.8535	-39.9021	33.2906
74	0.5468	-0.491	-0.4758	1.4784	-0.4875	1.6321	-0.1921	0.2896	0.728	-0.1812	-0.0008	-0.4808	-0.3197	0.4004	0.1256	0.6471	-0.3412	-0.0745	0.7698	0.1443	0.6242	120.6321	-46.171	44.1196
75	1.0841	-0.2356	0.2525	0.8938	0.0603	2.8128	0.0688	0.1056	0.4292	-0.0674	0.4074	-0.3754	-0.2139	0.4722	-0.4872	0.7987	-0.376	-0.0573	0.9058	0.0198	0.7186	125.8542	-41.8825	48.0534
76	1.8201	-0.1562	0.1042	1.458	0.575	0.9011	-0.0669	0.1103	-0.3841	-0.2764	-0.0497	-0.3025	0.2297	-0.0771	0.0835	1.5174	0.6412	0.1736	1.352	-0.5177	1.3997	129.9883	-104.7181	39.4494
77	2.0225	-1.0103	-1.4131	2.3467	0.4595	1.0238	0.0145	0.6337	-0.3621	-0.5206	0.359	-0.4207	0.8481	0.5617	-0.0062	0.8762	0.1698	-0.0509	0.9846	-0.4618	0.6835	112.8476	-91.8531	34.266
78	2.8818	-2.5645	1.9242	7.2952	-4.9439	5.7126	-0.267	0.4581	0.1486	0.0318	0.1937	-0.5112	0.3757	0.4467	0.0512	0.4726	-0.1226	0.0107	0.7637	-0.1805	0.3819	97.0244	-83.9401	31.7259
79	1.4838	0.078	0.3859	1.0765	0.5011	1.2928	-0.103	0.5041	0.2274	-0.0531	0.0845	0.2567	0.4672	-0.6721	0.0738	0.513	-0.2831	0.1046	1.0318	0.0453	0.4803	83.8324	-79.1997	29.865
80	1.5919	0.1475	-0.1464	2.2156	0.4615	3.6634	-0.2894	0.383	-0.1975	-0.0193	0.279	0.3438	0.1926	-0.7001	0.0339	0.7496	-0.4811	0.0957	1.1734	-0.012	0.5619	77.0041	-86.3151	32.3116
81	0.9169	0.1971	0.0462	1.472	0.0061	0.6869	-0.1667	0.5095	-0.0064	-0.194	0.2875	0.5023	0.4295	-0.5342	-0.0401	0.5132	-0.4306	0.0136	1.5512	0.0019	0.5458	82.1697	-81.8113	17.0664
82	1.7726	0.6985	-1.2881	4.4221	-0.5	3.0296	0.1067	0.4777	-0.2399	-0.5335	0.1321	-0.1639	0.402	-0.0902	-0.1254	1.4468	-0.2815	0.1959	1.451	-0.4567	0.8601	94.5925	-102.713	10.5669
83	0.8493	-0.0595	-0.2893	0.2824	-0.0868	1.5515	-0.0817	0.3756	-0.1023	0.1436	-0.191	0.0303	0.4547	0.2633	-0.0301	0.8929	-0.5479	-0.0999	1.419	-0.2181	0.5509	90.2865	-89.8763	9.6538
84	1.5349	0.1736	0.0639	2.309	-0.4665	2.4903	-0.0982	0.7865	-0.4478	0.0618	0.2627	-0.1702	1.0209	-0.0339	-0.1651	0.8679	-0.1619	0.0041	0.9766	-0.3104	0.5576	95.7236	-94.7506	22.187
85	0.7997	0.0663	0.2351	1.4471	-0.2007	1.4603	0.0709	0.4699	-0.2505	0.1416	0.2587	0.0733	1.1779	-0.3262	-0.255	1.04	-0.307	0.0261	1.0185	-0.3294	0.5626	93.2858	-94.2254	25.2167
86	1.2138	1.6588	1.763	2.6896	2.2041	2.6743	-0.2289	0.2999	0.1834	-0.3581	-0.2234	0.2305	0.3003	-0.1747	0.2728	0.5993	0.2026	0.1044	1.1809	-0.5	0.7647	117.0113	-85.5879	29.9201
87	0.6274	0.1502	0.0979	0.2574	-0.2438	0.4612	-0.3363	0.6024	-0.5347	-0.2541	0.211	-0.685	0.7312	1.089	0.0329	0.1924	1.0078	0.3476	1.6523	-0.8368	0.8293	132.7563	-86.6146	36.5367
88	1.0311	1.1057	0.232	2.5519	0.7844	1.6555	-0.1113	-0.0126	-0.4892	-0.0003	-0.0928	-0.1517	0.9928	0.3659	0.2162	1.1648	0.5862	-0.1598	0.9618	-0.214	0.9929	119.8355	-98.5425	51.3219
89	1.0802	0.5676	-0.167	1.2829	-0.0058	1.5345	-0.1167	0.312	-0.6387	-0.1294	0.0986	-0.366	1.2369	0.4767	0.0897	0.9977	0.3753	-0.0083	0.8846	-0.3629	0.8332	116.4046	-97.006	39.1285
90	0.3702	0.4678	-0.307	0.6739	-0.1738	0.7425	0.1412	0.1419	0.2067	0.2892	-0.0811	0.3373	0.0133	-0.1682	-0.0631	1.8998	1.1722	-0.1706	2.3458	0.0194	1.1922	10.2341	-26.2823	12.6153
91	1.206	0.0973	1.5249	1.3549	-0.8747	2.7038	0.0479	0.6641	0.5819	-0.3821	-0.2154	0.1992	-0.7573	-0.8277	0.0767	0.837	0.5399	0.0269	1.2783	0.1274	0.5865	28.3241	-39.0153	15.2841
92	1.4376	-0.9709	0.0842	2.2927	0.253	1.5895	0.06	-0.1049	0.0533	0.1168	0.1265	-0.0722	-0.2869	-0.3845	-0.2066	0.4753	0.1164	-0.0434	0.4023	0.0798	0.4389	51.2509	-49.9102	21.6266
93	2.3571	-0.3322	-0.5937	2.5046	1.0653	2.3242	0.023	-0.1418	0.4489	0.4224	0.125	-0.6046	-0.5068	0.2403	-0.1077	0.5218	0.0696	-0.0624	0.374	-0.0478	0.5357	62.5179	-46.581	21.802
94	1.6725	0.0368	0.3856	1.1315	0.4926	1.0343	0.301	0.5225	0.479	-0.3939	0.0916	-0.1712	-0.9095	-0.039	-0.3389	0.7123	0.1713	0.1855	0.5902	0.1375	0.504	58.0915	-45.0828	3.7866
95	1.1078	0.3491	0.2239	4.6317	2.7264	2.3086	0.1585	0.226	0.3193	0.2156	0.2951	-0.0664	-0.7772	-0.1106	-0.3744	1.0938	0.3755	0.1426	0.6877	0.1316	0.6042	44.275	-28.7186	16.6256
96	1.5411	-0.3742	0.1389	3.684	0.8557	1.4818	0.2302	0.4946	0.3381	-0.4482	-0.1432	0.2003	-0.8872	-0.3103	-0.0883	0.8725	0.302	0.1506	0.6886	0.171	0.5594	50.2793	-37.7823	6.4317
97	1.9334	0.2098	-0.2875	2.3744	0.233	1.9361	0.2579	0.2918	0.3969	-0.209	0.0801	-0.1753	-0.8284	-0.3162	-0.343	0.8399	0.233	0.0999	0.5375	0.1336	0.5835	50.0239	-37.5412	13.3044
98	1.0321	-0.0805	-0.4907	0.4043	-0.093	0.2556	0.1347	0.261	-0.1275	-0.46	-0.292	0.5447	-0.2546	-1.0493	-0.054	0.7131	0.5164	-0.2485	2.0048	-0.026	0.716	17.7614	-47.1056	7.7614
99	0.0855	-0.0516	0.0674	0.1207	-0.1258	0.6988	-0.0252	0.1838	0.3001	-0.4754	-0.3049	0.8181	-0.823	-1.2202	0.2502	0.9905	0.7864	-0.2677	2.4302	-0.1408	1.0144	10.2321	-39.6792	16.9494
100	0.8593	0.0883	-0.3531	0.9944	0.0502	1.7198	0.2986	0.1484	0.3658	-0.4254	-0.3724	0.0416	-1.0505	-0.9461	0.0122	1.2438	0.7669	0.0271	1.4098	0.1885	0.7866	24.9979	-30.7786	16.1004
101	0.6998	-0.0492	-0.2268	1.7076	0.2681	2.1666	0.1189	0.3932	-0.0361	-0.1928	-0.2082	0.0791	0.7625	-0.5325	0.0556	0.5271	-0.0182	-0.0946	0.653	-0.0579	0.3231	48.6645	-76.8431	7.6035
102	3.5736	1.0249	-1.226	2.4784	-2.0454	1.8971	0.0696	-0.5786	0.004	0.5316	-0.2818	-0.1974	1.3268	0.1455	0.2449	1.122	-0.0693	-0.0962	0.5807	-0.0382	0.3241	55.6471	-87.5379	31.7291
103	1.3294	-0.3345	0.1361	1.9613	0.6339	0.2821	0.0006	0.4808	-0.5221	-0.0492	-0.5742	0.2313	1.1502	-0.3565	-0.1984	1.8007	-0.6783	-0.0043	0.6141	-0.2939	0.4694	42.2297	-97.4939	19.7708
104	1.8201	-0.1971	-0.2705	1.18	-0.4514	1.0535	0.3404	0.2548	-0.1902	0.0175	-0.4463	0.0431	1.3113	-0.2905	0.1201	1.1512	-0.1891	-0.0641	0.7222	-0.165	0.378	48.3646	-91.3657	9.4467
105	1.4072	-0.294	-0.3092	1.77	0.0989	1.5975	0.0105	0.2261	-0.375	-0.028	-0.0096	0.0435	1.3696	-0.4233	-0.0382	1.1429	-0.0433	-0.0416	0.677	-0.1129	0.3751	51.0589	-89.7304	11.9959
106	0.4736	-0.6725	-0.0637	3.8283	0.0711	0.0969	-0.014	0.3169	0.013	0.0573	0.1284	0.2042	0.1061	-0.6732	-0.1037	0.699	0.0203	-0.1464	1.1068	-0.0632	0.4197	38.505	-72.229	-2.0871
107	0.9534	-0.0837	-0.3269	0.7256	0.442	0.8937	0.2866	0.4243	0.1591	-1.0231	-0.2515	0.467	0.0613	-0.685	0.0509	1.0609	0.3169	-0.3664	1.6391	-0.0549	0.5893	34.2595	-64.0043	-16.2132
108	0.9674	0.1384	0.8153	1.4146	-1.1257	2.9844	0.1363	0.8788	0.3445	-0.8242	-0.1804	0.0925	-0.5397	-0.5417	0.0943	1.0265	0.3542	-0.0431	1.0515	0.0598	0.4667	43.9291	-54.3728	-13.5067
109	2.4299	-1.189	-1.8082	3.5048	2.2453	4.9561	-0.2235	0.55	0.3188	-0.5652	0.3011	-0.2848	-0.1478	-0.1228	0.0292	0.955	0.2048	0.1849	0.9211	0.0429	0.5774	62.7401	-69.213	-14.2616
110	1.5551	-0.4276	-0.2626	0.7463	-0.3106	1.0573	0.092	0.63	0.0428	-1.0467	-0.1297	-0.2068	-0.0069	-0.1879	-0.0005	0.8704	0.1268	0.0084	0.8314	0.0719	0.3146	51.3159	-69.6238	-9.39
111	1.9504	-0.4031	0.3022	2.9993	0.4624	1.3028	0.0063	0.6632	0.0161	-0.7019	0.1307	-0.1262	0.1046	-0.2254	-0.0942	0.7207	0.1592	0.0387	0.8674	0.0463	0.2931	53.9007	-68.7244	-9.0121
112	0.7432	-0.349	0.0061	1.6207	-0.1242	0.0751	-0.0968	0.9162	-0.2466	0.3018	-0.141	0.2931	0.7532	-1.4188	0.196	0.7176	-0.6734	0.0823	1.4776	-0.2985	0.5369	20.9982	-73.9091	32.3499
113	2.3335	-0.7825	0.0981	3.8739	-0.25	2.9348	-0.0115	-0.0999	0.0258	0.7926	-0.054	-0.1291	0.6664	-0.4426	0.0701	0.6545	-0.0571	-0.0515	0.4782	-0.015	0.3463	30.2682	-57.8367	50.282
114	0.9926	-0.3277	-0.0305	0.7951	0.6401	0.6233	-0.0227	0.7128	0.1169	0.5246	-0.3518	0.7851	0.4199	-1.7709	0.0764	0.6041	-0.2794	0.207	1.6273	-0.139	0.7147	13.5221	-58.7776	42.1685
115	0.2645	-0.0645	0.2656	2.4561	0.4293	0.7709	-0.0774	0.4564	0.1662	0.9797	-0.4592	0.6694	0.2042	-0.849	0.0362	0.7326	-0.6022	0.2254	1.6097	-0.1262	0.7428	16.1296	-65.6921	43.4302
116	0.7218	0.1526	0.4233	0.4582	0.0048	1.4686	0.1617	0.0393	-0.1843	-0.1067	-0.2724	0.627	0.0629	-0.1091	-0.1571	0.4569	-0.4337	-0.5388	2.8491	-0.6838	0.5897	13.4967	-78.4382	11.4928
117	1.1294	-0.3352	-0.0406	3.1531	-0.4917	0.8648	-0.0511	0.3108	0.3899	-0.2321	0.0127	0.2552	0.1003	0.2053	0.0853	0.9551	-0.0656	-0.3385	1.7856	-0.2248	1.1832	1.7854	-81.1207	6.1681
118	1.637	1.4259	0.1732	1.7784	0.1033	0.023	0.1201	-0.0907	-0.3791	0.1866	-0.2486	0.0648	0.096	0.102	-0.178	1.3113	-0.5699	-0.1651	2.2335	-0.722	1.2261	15.0487	-94.1098	6.3819
119	0.1548	-0.2454	0.0621	0.4862	-0.1076	0.0127	0.1557	0.0067	-0.9565	0.4989	-0.2457	0.5314	0.6497	-0.1932	-0.0456	1.485	-1.0857	0.1373	1.7958	-0.6501	1.2944	19.9863	-96.0181	21.8199
120	0.7751	0.3402	0.6231	1.6052	-0.25	0.6964	0.4282	-0.4881	-0.2697	0.5573	-0.11	1.1211	0.1453	-0.6313	0.6021	1.3305	-1.3004	0.1993	2.1254	-0.7304	1.1138	10.154	-86.9248	28.9404

Refinement TLS group

ID	Refine-ID	Refine TLS-ID	Selection details
1	X-RAY DIFFRACTION	1	chain 'A' and (resid 9 through 53 )
2	X-RAY DIFFRACTION	2	chain 'A' and (resid 54 through 109 )
3	X-RAY DIFFRACTION	3	chain 'A' and (resid 110 through 184 )
4	X-RAY DIFFRACTION	4	chain 'A' and (resid 185 through 200 )
5	X-RAY DIFFRACTION	5	chain 'A' and (resid 201 through 289 )
6	X-RAY DIFFRACTION	6	chain 'B' and (resid 10 through 31 )
7	X-RAY DIFFRACTION	7	chain 'B' and (resid 32 through 53 )
8	X-RAY DIFFRACTION	8	chain 'B' and (resid 54 through 73 )
9	X-RAY DIFFRACTION	9	chain 'B' and (resid 74 through 109 )
10	X-RAY DIFFRACTION	10	chain 'B' and (resid 110 through 147 )
11	X-RAY DIFFRACTION	11	chain 'B' and (resid 148 through 184 )
12	X-RAY DIFFRACTION	12	chain 'B' and (resid 185 through 200 )
13	X-RAY DIFFRACTION	13	chain 'B' and (resid 201 through 228 )
14	X-RAY DIFFRACTION	14	chain 'B' and (resid 229 through 255 )
15	X-RAY DIFFRACTION	15	chain 'B' and (resid 256 through 289 )
16	X-RAY DIFFRACTION	16	chain 'C' and (resid 11 through 109 )
17	X-RAY DIFFRACTION	17	chain 'C' and (resid 110 through 147 )
18	X-RAY DIFFRACTION	18	chain 'C' and (resid 148 through 218 )
19	X-RAY DIFFRACTION	19	chain 'C' and (resid 219 through 290 )
20	X-RAY DIFFRACTION	20	chain 'D' and (resid 10 through 31 )
21	X-RAY DIFFRACTION	21	chain 'D' and (resid 32 through 53 )
22	X-RAY DIFFRACTION	22	chain 'D' and (resid 54 through 73 )
23	X-RAY DIFFRACTION	23	chain 'D' and (resid 74 through 109 )
24	X-RAY DIFFRACTION	24	chain 'D' and (resid 110 through 138 )
25	X-RAY DIFFRACTION	25	chain 'D' and (resid 139 through 184 )
26	X-RAY DIFFRACTION	26	chain 'D' and (resid 185 through 199 )
27	X-RAY DIFFRACTION	27	chain 'D' and (resid 200 through 255 )
28	X-RAY DIFFRACTION	28	chain 'D' and (resid 256 through 289 )
29	X-RAY DIFFRACTION	29	chain 'E' and (resid 11 through 31 )
30	X-RAY DIFFRACTION	30	chain 'E' and (resid 32 through 53 )
31	X-RAY DIFFRACTION	31	chain 'E' and (resid 54 through 73 )
32	X-RAY DIFFRACTION	32	chain 'E' and (resid 74 through 109 )
33	X-RAY DIFFRACTION	33	chain 'E' and (resid 110 through 138 )
34	X-RAY DIFFRACTION	34	chain 'E' and (resid 139 through 159 )
35	X-RAY DIFFRACTION	35	chain 'E' and (resid 160 through 184 )
36	X-RAY DIFFRACTION	36	chain 'E' and (resid 185 through 200 )
37	X-RAY DIFFRACTION	37	chain 'E' and (resid 201 through 289 )
38	X-RAY DIFFRACTION	38	chain 'F' and (resid 10 through 31 )
39	X-RAY DIFFRACTION	39	chain 'F' and (resid 32 through 53 )
40	X-RAY DIFFRACTION	40	chain 'F' and (resid 54 through 109 )
41	X-RAY DIFFRACTION	41	chain 'F' and (resid 110 through 138 )
42	X-RAY DIFFRACTION	42	chain 'F' and (resid 139 through 184 )
43	X-RAY DIFFRACTION	43	chain 'F' and (resid 185 through 200 )
44	X-RAY DIFFRACTION	44	chain 'F' and (resid 201 through 228 )
45	X-RAY DIFFRACTION	45	chain 'F' and (resid 229 through 255 )
46	X-RAY DIFFRACTION	46	chain 'F' and (resid 256 through 289 )
47	X-RAY DIFFRACTION	47	chain 'G' and (resid 10 through 53 )
48	X-RAY DIFFRACTION	48	chain 'G' and (resid 54 through 170 )
49	X-RAY DIFFRACTION	49	chain 'G' and (resid 171 through 274 )
50	X-RAY DIFFRACTION	50	chain 'G' and (resid 275 through 289 )
51	X-RAY DIFFRACTION	51	chain 'H' and (resid 11 through 31 )
52	X-RAY DIFFRACTION	52	chain 'H' and (resid 32 through 53 )
53	X-RAY DIFFRACTION	53	chain 'H' and (resid 54 through 73 )
54	X-RAY DIFFRACTION	54	chain 'H' and (resid 74 through 159 )
55	X-RAY DIFFRACTION	55	chain 'H' and (resid 160 through 184 )
56	X-RAY DIFFRACTION	56	chain 'H' and (resid 185 through 198 )
57	X-RAY DIFFRACTION	57	chain 'H' and (resid 199 through 255 )
58	X-RAY DIFFRACTION	58	chain 'H' and (resid 256 through 289 )
59	X-RAY DIFFRACTION	59	chain 'I' and (resid 10 through 24 )
60	X-RAY DIFFRACTION	60	chain 'I' and (resid 25 through 53 )
61	X-RAY DIFFRACTION	61	chain 'I' and (resid 54 through 73 )
62	X-RAY DIFFRACTION	62	chain 'I' and (resid 74 through 109 )
63	X-RAY DIFFRACTION	63	chain 'I' and (resid 110 through 138 )
64	X-RAY DIFFRACTION	64	chain 'I' and (resid 139 through 159 )
65	X-RAY DIFFRACTION	65	chain 'I' and (resid 160 through 184 )
66	X-RAY DIFFRACTION	66	chain 'I' and (resid 185 through 200 )
67	X-RAY DIFFRACTION	67	chain 'I' and (resid 201 through 228 )
68	X-RAY DIFFRACTION	68	chain 'I' and (resid 229 through 255 )
69	X-RAY DIFFRACTION	69	chain 'I' and (resid 256 through 289 )
70	X-RAY DIFFRACTION	70	chain 'J' and (resid 9 through 31 )
71	X-RAY DIFFRACTION	71	chain 'J' and (resid 32 through 53 )
72	X-RAY DIFFRACTION	72	chain 'J' and (resid 54 through 109 )
73	X-RAY DIFFRACTION	73	chain 'J' and (resid 110 through 217 )
74	X-RAY DIFFRACTION	74	chain 'J' and (resid 218 through 246 )
75	X-RAY DIFFRACTION	75	chain 'J' and (resid 247 through 289 )
76	X-RAY DIFFRACTION	76	chain 'K' and (resid 10 through 24 )
77	X-RAY DIFFRACTION	77	chain 'K' and (resid 25 through 53 )
78	X-RAY DIFFRACTION	78	chain 'K' and (resid 54 through 73 )
79	X-RAY DIFFRACTION	79	chain 'K' and (resid 74 through 109 )
80	X-RAY DIFFRACTION	80	chain 'K' and (resid 110 through 138 )
81	X-RAY DIFFRACTION	81	chain 'K' and (resid 139 through 184 )
82	X-RAY DIFFRACTION	82	chain 'K' and (resid 185 through 198 )
83	X-RAY DIFFRACTION	83	chain 'K' and (resid 199 through 218 )
84	X-RAY DIFFRACTION	84	chain 'K' and (resid 219 through 290 )
85	X-RAY DIFFRACTION	85	chain 'L' and (resid 10 through 53 )
86	X-RAY DIFFRACTION	86	chain 'L' and (resid 54 through 73 )
87	X-RAY DIFFRACTION	87	chain 'L' and (resid 74 through 184 )
88	X-RAY DIFFRACTION	88	chain 'L' and (resid 185 through 217 )
89	X-RAY DIFFRACTION	89	chain 'L' and (resid 218 through 289 )
90	X-RAY DIFFRACTION	90	chain 'M' and (resid 9 through 24 )
91	X-RAY DIFFRACTION	91	chain 'M' and (resid 25 through 53 )
92	X-RAY DIFFRACTION	92	chain 'M' and (resid 54 through 109 )
93	X-RAY DIFFRACTION	93	chain 'M' and (resid 110 through 159 )
94	X-RAY DIFFRACTION	94	chain 'M' and (resid 160 through 228 )
95	X-RAY DIFFRACTION	95	chain 'M' and (resid 229 through 255 )
96	X-RAY DIFFRACTION	96	chain 'M' and (resid 256 through 289 )
97	X-RAY DIFFRACTION	97	chain 'N' and (resid 9 through 53 )
98	X-RAY DIFFRACTION	98	chain 'N' and (resid 54 through 109 )
99	X-RAY DIFFRACTION	99	chain 'N' and (resid 110 through 228 )
100	X-RAY DIFFRACTION	100	chain 'N' and (resid 229 through 289 )
101	X-RAY DIFFRACTION	101	chain 'O' and (resid 10 through 109 )
102	X-RAY DIFFRACTION	102	chain 'O' and (resid 110 through 147 )
103	X-RAY DIFFRACTION	103	chain 'O' and (resid 148 through 218 )
104	X-RAY DIFFRACTION	104	chain 'O' and (resid 219 through 289 )
105	X-RAY DIFFRACTION	105	chain 'P' and (resid 10 through 53 )
106	X-RAY DIFFRACTION	106	chain 'P' and (resid 54 through 73 )
107	X-RAY DIFFRACTION	107	chain 'P' and (resid 74 through 159 )
108	X-RAY DIFFRACTION	108	chain 'P' and (resid 160 through 184 )
109	X-RAY DIFFRACTION	109	chain 'P' and (resid 185 through 200 )
110	X-RAY DIFFRACTION	110	chain 'P' and (resid 201 through 255 )
111	X-RAY DIFFRACTION	111	chain 'P' and (resid 256 through 289 )
112	X-RAY DIFFRACTION	112	chain 'Q' and (resid 9 through 109 )
113	X-RAY DIFFRACTION	113	chain 'Q' and (resid 110 through 159 )
114	X-RAY DIFFRACTION	114	chain 'Q' and (resid 160 through 289 )
115	X-RAY DIFFRACTION	115	chain 'R' and (resid 9 through 53 )
116	X-RAY DIFFRACTION	116	chain 'R' and (resid 54 through 109 )
117	X-RAY DIFFRACTION	117	chain 'R' and (resid 110 through 133 )
118	X-RAY DIFFRACTION	118	chain 'R' and (resid 134 through 175 )
119	X-RAY DIFFRACTION	119	chain 'R' and (resid 176 through 228 )
120	X-RAY DIFFRACTION	120	chain 'R' and (resid 229 through 289 )