PDB-9zao: Crystal structure of a glyceraldehyde-3-phosphate dehydrogenase f...

Basic information

• Entry: Database: PDB / ID: 9zao
• Title: Crystal structure of a glyceraldehyde-3-phosphate dehydrogenase from Neisseria gonorrhoeae in complex with NAD (P1 form2)
• Components: Glyceraldehyde-3-phosphate dehydrogenase
• Keywords: OXIDOREDUCTASE / SSGCID / STRUCTURAL GENOMICS / SEATTLE STRUCTURAL GENOMICS CENTER FOR INFECTIOUS DISEASE / glyceraldehyde-3-phosphate dehydrogenase

Function / homology

Function:

Oxidoreductases; Acting on the aldehyde or oxo group of donors; With NAD+ or NADP+ as acceptor / oxidoreductase activity, acting on the aldehyde or oxo group of donors, NAD or NADP as acceptor / glucose metabolic process / NAD binding / NADP binding

Domain/homology:

Glyceraldehyde 3-phosphate dehydrogenase, active site / Glyceraldehyde 3-phosphate dehydrogenase active site. / Glyceraldehyde-3-phosphate dehydrogenase, type I / Glyceraldehyde 3-phosphate dehydrogenase, NAD binding domain / Glyceraldehyde 3-phosphate dehydrogenase, NAD(P) binding domain / Glyceraldehyde 3-phosphate dehydrogenase, catalytic domain / Glyceraldehyde/Erythrose phosphate dehydrogenase family / Glyceraldehyde 3-phosphate dehydrogenase, C-terminal domain / Glyceraldehyde 3-phosphate dehydrogenase, NAD binding domain / NAD(P)-binding domain superfamily

Component:

NICOTINAMIDE-ADENINE-DINUCLEOTIDE / Glyceraldehyde-3-phosphate dehydrogenase

• Biological species: Neisseria gonorrhoeae NCCP11945 (bacteria)
• Method: X-RAY DIFFRACTION / SYNCHROTRON / MOLECULAR REPLACEMENT / Resolution: 3.09 Å
• Authors: Seattle Structural Genomics Center for Infectious Disease / Seattle Structural Genomics Center for Infectious Disease (SSGCID)

Funding support

United States, 2items

Organization	Grant number	Country
National Institutes of Health/National Institute Of Allergy and Infectious Diseases (NIH/NIAID)	75N93022C00036	United States
National Institutes of Health/Office of the Director	S10OD030394	United States

• Citation: Journal: To be published; Title: Crystal structure of a glyceraldehyde-3-phosphate dehydrogenase from Neisseria gonorrhoeae in complex with NAD (P1 form2); Authors: Liu, L. / Lovell, S. / Seibold, S. / Battaile, K.P.

History

Deposition	Nov 19, 2025	Deposition site: RCSB / Processing site: RCSB
Revision 1.0	Dec 24, 2025	Provider: repository / Type: Initial release

Assembly

Deposited unit

A: Glyceraldehyde-3-phosphate dehydrogenase

B: Glyceraldehyde-3-phosphate dehydrogenase

C: Glyceraldehyde-3-phosphate dehydrogenase

D: Glyceraldehyde-3-phosphate dehydrogenase

E: Glyceraldehyde-3-phosphate dehydrogenase

F: Glyceraldehyde-3-phosphate dehydrogenase

G: Glyceraldehyde-3-phosphate dehydrogenase

H: Glyceraldehyde-3-phosphate dehydrogenase

I: Glyceraldehyde-3-phosphate dehydrogenase

J: Glyceraldehyde-3-phosphate dehydrogenase

K: Glyceraldehyde-3-phosphate dehydrogenase

L: Glyceraldehyde-3-phosphate dehydrogenase

M: Glyceraldehyde-3-phosphate dehydrogenase

N: Glyceraldehyde-3-phosphate dehydrogenase

O: Glyceraldehyde-3-phosphate dehydrogenase

P: Glyceraldehyde-3-phosphate dehydrogenase

Q: Glyceraldehyde-3-phosphate dehydrogenase

R: Glyceraldehyde-3-phosphate dehydrogenase

S: Glyceraldehyde-3-phosphate dehydrogenase

T: Glyceraldehyde-3-phosphate dehydrogenase

hetero molecules

Summary:

• 745 kDa, 20 polymers

Component details:

	Theoretical mass	Number of molelcules
Total (without water)	745,312	37
Polymers	736,596	20
Non-polymers	8,716	17
Water	0	0

1

A: Glyceraldehyde-3-phosphate dehydrogenase

B: Glyceraldehyde-3-phosphate dehydrogenase

C: Glyceraldehyde-3-phosphate dehydrogenase

D: Glyceraldehyde-3-phosphate dehydrogenase

hetero molecules

Summary:

• defined by author&software
• Evidence: gel filtration
• 149 kDa, 4 polymers

Component details:

	Theoretical mass	Number of molelcules
Total (without water)	149,355	9
Polymers	147,319	4
Non-polymers	2,036	5
Water	0

Symmetry operations:

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

Calculated values:

Buried area	18780 Å2
ΔGint	-127 kcal/mol
Surface area	42450 Å2
Method	PISA

2

E: Glyceraldehyde-3-phosphate dehydrogenase

F: Glyceraldehyde-3-phosphate dehydrogenase

G: Glyceraldehyde-3-phosphate dehydrogenase

H: Glyceraldehyde-3-phosphate dehydrogenase

hetero molecules

Summary:

• defined by author&software
• 149 kDa, 4 polymers

Component details:

	Theoretical mass	Number of molelcules
Total (without water)	149,332	8
Polymers	147,319	4
Non-polymers	2,013	4
Water	0

Symmetry operations:

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

Calculated values:

Buried area	18660 Å2
ΔGint	-113 kcal/mol
Surface area	42430 Å2
Method	PISA

3

I: Glyceraldehyde-3-phosphate dehydrogenase

J: Glyceraldehyde-3-phosphate dehydrogenase

K: Glyceraldehyde-3-phosphate dehydrogenase

L: Glyceraldehyde-3-phosphate dehydrogenase

hetero molecules

Summary:

• defined by author&software
• 150 kDa, 4 polymers

Component details:

	Theoretical mass	Number of molelcules
Total (without water)	149,973	8
Polymers	147,319	4
Non-polymers	2,654	4
Water	0

Symmetry operations:

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

Calculated values:

Buried area	19720 Å2
ΔGint	-121 kcal/mol
Surface area	41720 Å2
Method	PISA

4

M: Glyceraldehyde-3-phosphate dehydrogenase

N: Glyceraldehyde-3-phosphate dehydrogenase

O: Glyceraldehyde-3-phosphate dehydrogenase

P: Glyceraldehyde-3-phosphate dehydrogenase

hetero molecules

Summary:

• defined by author&software
• 148 kDa, 4 polymers

Component details:

	Theoretical mass	Number of molelcules
Total (without water)	148,006	6
Polymers	147,319	4
Non-polymers	686	2
Water	0

Symmetry operations:

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

Calculated values:

Buried area	16110 Å2
ΔGint	-100 kcal/mol
Surface area	42570 Å2
Method	PISA

5

Q: Glyceraldehyde-3-phosphate dehydrogenase

R: Glyceraldehyde-3-phosphate dehydrogenase

S: Glyceraldehyde-3-phosphate dehydrogenase

T: Glyceraldehyde-3-phosphate dehydrogenase

hetero molecules

Summary:

• defined by author&software
• 149 kDa, 4 polymers

Component details:

	Theoretical mass	Number of molelcules
Total (without water)	148,646	6
Polymers	147,319	4
Non-polymers	1,327	2
Water	0

Symmetry operations:

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

Calculated values:

Buried area	17330 Å2
ΔGint	-96 kcal/mol
Surface area	42300 Å2
Method	PISA

Unit cell

Length a, b, c (Å)	76.358, 139.715, 222.702
Angle α, β, γ (deg.)	76.30, 87.32, 88.12
Int Tables number	1
Space group name H-M	P1

Components

#1: Protein

A B C D E F G H I J K L M N O P Q R S T
Glyceraldehyde-3-phosphate dehydrogenase

Details:

Mass: 36829.789 Da / Num. of mol.: 20
Source method: isolated from a genetically manipulated source
Source: (gene. exp.) Neisseria gonorrhoeae NCCP11945 (bacteria)
Gene: NGK_2321 / Plasmid: NegoA.00617.a.B1 / Production host: Escherichia coli BL21(DE3) (bacteria)
References: UniProt: B4RPP8, Oxidoreductases; Acting on the aldehyde or oxo group of donors; With NAD+ or NADP+ as acceptor

#2: Chemical

A-401 B-401 D-401 E-401 F-401 H-401 I-401 J-401 K-401 L-401 N-401 Q-401 T-401
ChemComp-NAD / NICOTINAMIDE-ADENINE-DINUCLEOTIDE

Details:

Mass: 663.425 Da / Num. of mol.: 13 / Source method: obtained synthetically / Formula: C₂₁H₂₇N₇O₁₄P₂ / Feature type: SUBJECT OF INVESTIGATION / Comment: NAD*YM

#3: Chemical

A-402 C-401 G-401 O-401
ChemComp-NA / SODIUM ION

Details:

Mass: 22.990 Da / Num. of mol.: 4 / Source method: obtained synthetically / Formula: Na

• Has ligand of interest: Y
• Has protein modification: N

Experimental details

Experiment

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

Sample preparation

• Crystal: Density Matthews: 3.13 ų/Da / Density % sol: 60.7 %
• Crystal grow: Temperature: 291 K / Method: vapor diffusion, sitting drop / pH: 6.5 ; Details: Morpheus Fusion, B4 : 20 mM Sodium formate, 20 mM Ammonium acetate, 20 mM Sodium citrate tribasic dihydrate, 20 mM Potassium sodium tartrate tetrahydrate, 20 mM Sodium oxamate, 0.12 M Ethyleneglycol 40 mM Imidazole, 60 mM MES monohydrate (acid), pH 6.5, 20% v/v PEG 500 MME, 10 % w/v PEG 20000, 10% iso-Propanol. NegoA.00617.a.B1.PS38018 at 8 mg/mL. cocrystallization with NAD, plate 20064 B4 drop 1, Puck: PSL-2206, Cryo: direct

Data collection

• Diffraction: Mean temperature: 100 K / Serial crystal experiment: N
• Diffraction source: Source: SYNCHROTRON / Site: NSLS-II / Beamline: 19-ID / Wavelength: 0.9786 Å
• Detector: Type: DECTRIS EIGER2 XE 9M / Detector: PIXEL / Date: Jun 28, 2025
• Radiation: Monochromator: Double Crystal Si 111 / Protocol: SINGLE WAVELENGTH / Monochromatic (M) / Laue (L): M / Scattering type: x-ray
• Radiation wavelength: Wavelength: 0.9786 Å / Relative weight: 1
• Reflection: Resolution: 3.09→48.29 Å / Num. obs: 159633 / % possible obs: 97.5 % / Redundancy: 3.5 % / CC_1/2: 0.995 / R_merge(I) obs: 0.102 / R_pim(I) all: 0.064 / R_rim(I) all: 0.121 / Χ²: 1.14 / Net I/σ(I): 10 / Num. measured all: 563752
• Reflection shell: Resolution: 3.09→3.17 Å / % possible obs: 97.7 % / Redundancy: 3.7 % / R_merge(I) obs: 1.004 / Num. measured all: 44015 / Num. unique obs: 11904 / CC_1/2: 0.689 / R_pim(I) all: 0.606 / R_rim(I) all: 1.175 / Χ²: 1.02 / Net I/σ(I) obs: 1.4

Processing

Software

Name	Version	Classification
PHENIX	(dev_5438: ???)	refinement
Aimless		data scaling
XDS		data reduction
PHASER		phasing
PDB_EXTRACT		data extraction

Refinement

Method to determine structure: MOLECULAR REPLACEMENT / Resolution: 3.09→48.29 Å / SU ML: 0.45 / Cross valid method: FREE R-VALUE / σ(F): 1.96 / Phase error: 27.26 / Stereochemistry target values: ML

	Rfactor	Num. reflection	% reflection
Rfree	0.2335	7914	4.96 %
Rwork	0.1809	-	-
obs	0.1834	159519	97.5 %

• Solvent computation: Shrinkage radii: 0.9 Å / VDW probe radii: 1.1 Å / Solvent model: FLAT BULK SOLVENT MODEL

Refinement step

Cycle: LAST / Resolution: 3.09→48.29 Å

	Protein	Nucleic acid	Ligand	Solvent	Total
Num. atoms	49281	0	576	0	49857

Refine LS restraints

Refine-ID	Type	Dev ideal	Number
X-RAY DIFFRACTION	f_bond_d	0.005	50635
X-RAY DIFFRACTION	f_angle_d	0.766	68889
X-RAY DIFFRACTION	f_dihedral_angle_d	14.397	18667
X-RAY DIFFRACTION	f_chiral_restr	0.049	8162
X-RAY DIFFRACTION	f_plane_restr	0.007	8922

LS refinement shell

Resolution (Å)	Rfactor Rfree	Num. reflection Rfree	Rfactor Rwork	Num. reflection Rwork	Refine-ID	% reflection obs (%)
3.09-3.13	0.4148	241	0.3579	5032	X-RAY DIFFRACTION	98
3.13-3.16	0.3484	243	0.3315	5132	X-RAY DIFFRACTION	98
3.16-3.2	0.3709	247	0.3247	5098	X-RAY DIFFRACTION	98
3.2-3.24	0.3797	239	0.3005	5066	X-RAY DIFFRACTION	98
3.24-3.28	0.321	277	0.2806	5084	X-RAY DIFFRACTION	98
3.28-3.33	0.3333	220	0.2681	5136	X-RAY DIFFRACTION	98
3.33-3.38	0.3455	266	0.2637	4952	X-RAY DIFFRACTION	98
3.38-3.43	0.3222	249	0.255	5105	X-RAY DIFFRACTION	98
3.43-3.48	0.3203	261	0.2558	5166	X-RAY DIFFRACTION	98
3.48-3.54	0.2845	254	0.253	4967	X-RAY DIFFRACTION	98
3.54-3.6	0.3267	271	0.246	5091	X-RAY DIFFRACTION	98
3.6-3.66	0.288	297	0.2365	5030	X-RAY DIFFRACTION	97
3.66-3.73	0.2823	291	0.2277	4951	X-RAY DIFFRACTION	97
3.73-3.81	0.2749	310	0.2185	5047	X-RAY DIFFRACTION	97
3.81-3.89	0.2383	282	0.1921	5029	X-RAY DIFFRACTION	98
3.89-3.98	0.2358	257	0.1805	5088	X-RAY DIFFRACTION	98
3.98-4.08	0.2289	258	0.1702	5014	X-RAY DIFFRACTION	98
4.08-4.19	0.2262	289	0.1681	5080	X-RAY DIFFRACTION	97
4.19-4.32	0.2145	306	0.1616	4960	X-RAY DIFFRACTION	97
4.32-4.46	0.182	278	0.1473	5079	X-RAY DIFFRACTION	97
4.46-4.61	0.1752	296	0.131	5005	X-RAY DIFFRACTION	97
4.61-4.8	0.196	262	0.1364	5079	X-RAY DIFFRACTION	97
4.8-5.02	0.2061	273	0.1407	4955	X-RAY DIFFRACTION	97
5.02-5.28	0.1995	231	0.1409	4979	X-RAY DIFFRACTION	96
5.28-5.61	0.2074	265	0.1531	5041	X-RAY DIFFRACTION	97
5.61-6.04	0.217	249	0.1576	5125	X-RAY DIFFRACTION	99
6.05-6.65	0.2417	284	0.1763	5096	X-RAY DIFFRACTION	99
6.65-7.61	0.1687	283	0.1433	5109	X-RAY DIFFRACTION	98
7.61-9.58	0.1769	215	0.1267	5104	X-RAY DIFFRACTION	98
9.58-48.29	0.2156	220	0.1705	5005	X-RAY DIFFRACTION	96

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	1.1044	-0.2293	-0.3223	0.9544	-0.6301	0.5634	0.1349	0.324	-0.2177	-0.0579	-0.0756	-0.1105	-0.5801	-0.609	-0.0009	0.8021	0.2823	0.0249	0.8257	0.0215	0.7257	10.0334	60.6524	34.3044
2	0.8315	0.6152	0.2962	1.1211	0.389	0.1202	-0.1226	0.2852	-0.1926	-0.4294	0.0312	-0.2745	-0.6876	-0.32	0.0407	0.9512	0.1675	-0.0007	0.8133	0.0914	0.4951	25.2442	60.1634	16.7725
3	0.1179	0.0808	-0.0131	0.1253	-0.0816	0.0608	-0.494	-0.1858	-0.3164	-0.6162	0.1121	-0.0537	-0.6308	-0.5568	-0	0.6714	-0.0059	0.0853	0.7331	-0.0555	0.7755	24.4485	39.4693	32.7993
4	-0.0245	-0.0067	0.0368	0.0052	-0.0802	0.1141	-0.2454	0.1509	-0.2942	-0.2596	-0.1184	-0.3498	-0.2442	-0.1005	-0	0.8014	-0.0046	-0.0158	0.6764	0.0451	0.6703	30.4103	49.349	19.9347
5	0.5301	-0.4437	0.1943	0.3832	-0.2405	0.1666	0.1698	0.1338	-0.2069	-0.0923	0.0523	0.1269	-0.2798	-0.0853	-0	0.683	-0.0267	0.1524	0.5181	0.046	0.5275	38.7074	53.3852	20.8069
6	0.103	0.0192	0.0917	0.0152	0.0454	0.1052	-0.3292	-0.0348	0.4923	-0.2229	0.1943	-0.1257	-0.5894	0.0086	-0.0005	1.1899	-0.1067	0.1204	0.6584	0.1648	0.7632	42.1414	67.3417	23.8834
7	0.6582	-0.1091	-0.0795	-0.0401	0.0172	0.7827	-0.319	0.1331	0.0945	-0.029	0.2258	-0.1576	-0.4437	-0.1321	0.1211	0.9393	0.0087	0.1347	0.5144	0.1597	0.5964	33.814	61.8526	24.5164
8	0.236	-0.0715	-0.1381	0.2135	0.146	0.9726	0.1082	-0.3467	-0.1437	0.0761	-0.1482	0.3779	0.7259	0.3005	-0.0096	0.6574	0.2227	-0.0186	0.757	0.1083	0.7749	57.9073	30.0939	50.64
9	0.6546	-0.3042	-0.4609	0.2915	0.3541	0.4367	0.0302	-0.4763	0.5862	-0.0847	0.3	-0.7484	-0.1667	1.4384	0.8807	-0.0378	0.1247	0.1297	1.8498	-0.0425	1.0415	69.9197	37.2926	40.7187
10	0.2371	0.5622	0.2641	1.4863	0.8168	0.4811	-0.3487	-0.1328	-0.2464	-0.4141	0.2823	-0.2803	-0.3856	1.1056	-0.1919	0.3263	0.0318	0.2437	1.0216	0.0258	0.8798	56.9064	36.7208	23.4691
11	0.0302	0.0073	-0.0176	0.1401	0.1325	0.0953	-0.1365	-0.1908	-0.4035	0.0721	0.0553	-0.2869	-0.677	0.6705	0	0.8144	-0.23	0.131	0.6947	0.0881	0.8686	49.4758	54.1107	42.6183
12	0.3759	-0.4922	0.0794	0.6161	-0.2206	0.2093	-0.375	-0.3312	0.005	-0.0185	0.3069	-0.4822	-0.1514	0.6843	-0.1484	0.4827	-0.1302	0.2278	0.7745	-0.0432	0.904	52.9222	47.2823	27.2834
13	0.2447	-0.0938	0.0178	0.4229	-0.0187	0.0858	0.0248	-0.0162	-0.0351	0.0934	0.1817	-0.0149	0.3864	0.1716	-0	0.5778	0.0809	0.2144	0.5374	0.0204	0.6175	46.0706	43.6645	22.3461
14	0.0169	-0.0389	0.0363	0.0293	-0.0533	0.0406	-0.3374	0.4512	-0.9264	-0.2741	0.3391	-0.1867	0.2456	0.2303	0	0.6325	0.0029	0.128	0.8644	-0.133	0.9798	42.3752	29.5772	20.0622
15	0.9541	0.2419	-0.3339	0.4835	0.4579	0.8306	-0.0719	0.1195	-0.5034	-0.5624	0.2129	0.0094	0.0549	0.1401	-0.0173	0.4897	-0.0063	0.1697	0.639	-0.0077	0.7926	48.3079	34.3102	26.5937
16	0.3455	0.4849	-0.1838	0.7104	0.3089	1.0243	0.0382	0.1693	0.0505	0.2233	-0.1145	0.0387	-0.0132	-0.1056	0	0.5657	0.0387	0.0757	0.5321	0.0627	0.8968	22.9864	19.8877	37.4726
17	0.2859	0.1575	-0.0727	0.0966	-0.1735	0.6687	0.0372	-0.1984	-0.2591	0.2788	-0.0881	0.3824	-0.0083	-0.5989	-0.004	0.5995	-0.1299	0.1486	0.7347	0.0803	1.0174	11.4798	18.0698	52.1962
18	0.6321	0.104	-0.5768	1.4025	0.3403	0.9277	0.0262	-0.0922	-0.1949	0.2506	-0.1254	0.1046	-0.031	-0.2252	-0.0105	0.4989	-0.0185	0.0506	0.4498	0.1886	0.6233	26.3855	33.5489	62.0292
19	0.9591	0.3809	-0.5707	1.0794	-0.4536	0.9984	0.1915	-0.0406	-0.2555	0.062	-0.0514	-0.2542	-1.079	0.5071	0.0268	1.0171	-0.2495	0.0544	0.6166	0.1165	0.7329	49.249	70.7937	54.3978
20	0.0851	0.1852	0.2528	0.8051	0.0958	1.2641	-0.1183	-0.2818	0.0646	0.2604	-0.0233	0.0628	-0.5333	0.0038	-0.0001	0.7806	-0.0114	0.0492	0.6321	0.0727	0.6309	32.218	56.8688	66.4867
21	0.9069	-0.1874	0.271	0.9439	1.1474	1.5425	0.1972	0.0597	0.1268	-0.0275	-0.3402	0.4519	-0.0912	-0.1192	-0.0092	0.4685	-0.0069	0.0217	0.609	-0.0596	1.1075	29.9277	131.5135	29.2797
22	1.8494	-0.1258	0.8447	1.1765	0.1341	0.751	0.0614	0.0489	0.1182	-0.376	-0.2745	0.2262	0.1389	-0.2776	-0.0299	0.4661	0.0065	-0.0451	0.5799	-0.0989	0.7918	35.9149	113.4235	13.5371
23	0.2687	-0.0793	0.0958	0.0528	0.0572	0.1325	0.2617	0.0142	-0.2841	-0.0529	0.351	0.1856	0.6712	0.3125	-0	0.8576	0.2854	-0.172	1.0143	-0.2749	1.3472	72.9163	89.9811	18.8248
24	0.0314	0.0949	0.0277	2.1436	0.6191	0.1604	0.3878	-0.0092	-0.0473	1.1358	0.1115	-0.0389	-0.0322	0.4261	0.0415	0.5309	0.1134	-0.0203	0.9176	-0.1766	0.9338	76.6668	100.0709	25.1094
25	0.1687	0.2182	0.1309	0.6398	-0.0588	0.1854	0.1721	0.8914	-0.7134	-0.6747	0.1788	-0.2543	-0.0338	0.5979	0.0014	0.8395	0.2338	0.0521	1.1847	-0.3505	1.1781	74.4978	91.4469	6.3488
26	0.2202	-0.0488	-0.0007	0.2955	-0.5042	0.798	0.4594	0.2872	-0.3751	-0.3104	-0.2429	0.2661	0.4229	0.1419	0	0.9193	0.108	-0.0702	0.8688	-0.2468	1.0697	51.4003	88.0965	9.506
27	0.0488	0.0684	0.0055	0.1007	-0.0123	-0.002	-0.0182	0.7042	-0.3985	-0.0738	0.1282	0.0159	0.0366	0.4555	-0	1.1008	-0.1306	0.213	0.9279	-0.1208	0.8745	60.443	113.6019	9.496
28	0.1884	-0.1853	0.1974	0.5831	-0.3611	0.2201	0.0632	0.7275	-0.2728	-0.6266	0.1125	-0.3694	0.4434	0.0544	0	0.7496	-0.0855	0.0659	0.7476	-0.0987	0.8627	47.1269	98.8388	9.8817
29	0.089	0.0199	-0.146	0.0831	0.1609	0.4314	0.2082	-0.0989	-0.2174	0.1683	-0.1388	0.1595	0.8125	-0.1435	0	0.8896	-0.0911	0.0384	0.6973	-0.078	0.9539	43.0575	91.3175	22.6264
30	0.1389	-0.0529	0.0496	0.1854	0.2175	0.106	0.0607	0.2106	-0.0803	-0.3245	0.1577	0.2741	0.6244	0.0261	-0	0.7384	0.04	-0.04	0.6736	-0.1647	0.8738	55.243	89.7217	15.6922
31	0.3749	-0.2304	0.5724	0.0761	-0.3036	0.6772	0.1425	0.1715	0.267	0.1917	-0.1557	-0.1111	0.5952	-0.2	0	0.9976	-0.1908	0.0571	0.6466	-0.0182	0.7824	49.8031	97.7406	48.3143
32	0.4448	0.1015	0.0342	0.2748	-0.3433	0.468	-0.056	-0.6514	0.6246	0.516	0.0271	-0.0964	0.3875	0.2136	0	0.9216	-0.0241	-0.0492	0.712	-0.0471	0.9002	56.8255	108.4757	61.8779
33	0.2643	-0.0134	-0.1773	1.3515	0.4964	0.7751	0.0495	-0.1093	0.1402	0.1799	0.1515	-0.2779	-0.0571	0.289	0.0028	0.3847	-0.0671	0.0478	0.691	-0.131	0.8691	69.4737	117.8248	44.5565
34	0.0518	-0.0724	0.1167	0.0782	-0.113	0.2959	0.1078	0.3479	-0.191	-0.3499	-0.1969	0.0896	0.0189	0.2939	0	1.0313	-0.2268	0.1755	0.9351	0.199	0.8845	62.9903	132.8676	4.3699
35	0.3737	0.3938	0.3161	0.3901	0.3115	0.24	0.4921	0.5636	-0.0264	0.4822	-0.2037	0.5663	0.0834	0.9165	-0.0012	0.8316	0.042	0.1314	1.1221	0.1125	0.8821	61.5976	130.623	0.4512
36	0.1297	0.536	0.5995	3.0514	3.1729	3.4617	0.285	0.8723	0.5849	0.2185	0.5877	-0.8745	-0.3521	1.635	0.8705	0.8018	-0.2967	0.3902	1.9443	0.2205	1.0533	78.8166	135.6033	5.4526
37	1.1028	0.247	0.5588	1.131	-0.4285	1.205	-0.1702	0.1567	0.3253	-0.1041	0.2024	-0.3107	-0.7073	0.5404	0.3382	0.4372	-0.3549	0.2594	0.7308	-0.0238	1.1781	70.593	134.7731	28.3124
38	0.119	-0.0354	0.0063	0.1515	0.1622	0.1722	-0.4051	-0.1013	0.2836	0.5467	-0.159	0.1388	-0.0951	-0.2393	0	1.1663	0.0973	-0.1732	0.8277	-0.0076	1.029	30.6743	150.5634	111.964
39	0.1011	-0.0944	0.0833	0.282	-0.3608	0.4942	0.1406	-0.7563	0.3976	-0.0332	-0.7155	-0.3126	-0.2178	-0.0416	-0.039	1.0706	0.0203	-0.1199	0.7123	-0.0947	0.968	30.659	150.9868	116.5701
40	0.2706	0.2867	-0.4133	0.3049	-0.4405	0.6651	-0.6808	-0.4147	-0.1038	-0.5553	0.1282	0.2214	-0.0113	-1.2888	-0.0216	0.9869	0.3366	-0.2728	1.3875	-0.278	1.1706	16.5063	152.1542	107.1708
41	0.0876	0.0797	-0.0581	0.0534	-0.057	0.1388	0.0561	0.3115	0.449	-0.5703	-0.4568	0.0925	0.2758	-0.2781	-0	1.2801	0.3945	-0.2267	0.9916	-0.0087	1.2161	19.8001	153.0635	94.6821
42	0.9321	-0.2907	0.5004	0.9821	0.0766	0.3185	-0.0968	-0.0862	0.1374	-0.1747	-0.0486	0.1158	-0.4331	-0.4675	-0	0.8114	0.1025	-0.1263	0.7201	0.1969	0.5777	30.0655	135.9233	88.7981
43	2.3074	-0.0744	0.2219	0.4001	-0.3341	0.3176	-0.1361	-0.3211	0.8225	-0.2882	0.2582	-0.3224	-0.053	-0.016	0.3715	1.1821	0.2423	-0.179	0.3374	0.5091	0.4719	34.7591	142.5843	89.4402
44	0.7627	-0.3527	0.7683	0.3986	-0.4368	0.8392	0.1105	-0.4068	0.032	-0.2158	-0.1323	-0.0172	0.7716	-0.2602	-0.0161	1.0183	-0.0087	-0.0897	0.5754	0.1284	0.732	50.7036	98.4786	98.5833
45	0.3337	-0.3635	-0.2473	1.3549	0.1315	2.3886	-0.0875	0.1389	-0.0636	-0.4742	0.0383	0.0015	0.4109	-0.211	0	0.7501	-0.077	-0.0549	0.7032	0.1027	0.5568	37.7089	112.6575	84.037
46	0.1459	-0.3447	-0.1147	1.0653	0.3341	0.1204	0.3295	-0.2746	0.1063	-0.3208	-0.2661	-0.3792	0.47	-0.8682	0.0059	0.6141	-0.2331	-0.0873	1.2398	0.1543	0.673	17.7092	110.1665	115.503
47	0.8663	-0.1837	-0.2066	1.4434	0.1921	0.8735	-0.2014	-0.6895	0.0044	0.29	0.0212	0.07	0.1858	-0.8491	0.0093	0.7336	-0.1412	-0.016	1.4064	0.1455	0.6377	22.8407	112.2135	126.7297
48	0.036	-0.0572	0.0266	0.0776	-0.0423	0.0385	-0.0761	-0.5943	0.1025	1.0114	0.2091	0.0319	-0.6028	-0.7533	0	1.0044	0.1356	-0.0663	0.9756	0.0649	0.6596	31.5437	132.0164	118.2938
49	1.0968	0.3262	-0.3853	0.2869	-0.5477	0.8797	-0.0725	-0.4675	-0.0605	0.1947	0.1189	-0.0859	0.1457	-0.3491	0.1643	0.6359	-0.0072	-0.1281	0.6855	0.1752	0.4126	42.0128	111.761	127.2675
50	0.1141	-0.0395	0.2081	0.0268	0.103	0.864	0.0935	-0.0568	0.5824	-0.4466	-0.334	0.2607	-0.2401	-0.1183	-0.0001	0.9056	-0.1792	-0.0112	0.6784	0.1945	0.9414	64.2782	139.0204	97.8743
51	0.1185	-0.0134	0.132	0.1427	0.0452	0.119	0.3974	0.1355	0.2273	-0.3085	-0.5501	-0.216	0.4582	0.9381	-0	0.915	0.0726	-0.0354	1.362	0.2454	1.3115	76.2233	131.151	107.5403
52	1.3429	0.166	0.643	0.9694	-0.4498	1.8169	-0.0241	-0.2546	0.2278	0.3373	-0.0772	-0.3227	-0.2382	0.2631	0	0.7057	-0.1075	-0.2283	0.8129	0.0391	0.7681	57.5409	130.4417	122.8262
53	0.5904	0.4947	-0.3559	0.8062	0.2986	0.5009	0.3952	-0.2914	-0.4037	-0.327	-0.5085	0.6319	-0.3129	0.3401	-0.0003	1.4623	-0.104	-0.1539	1.0328	-0.1122	1.3881	30.6294	44.05	125.1239
54	0.7689	-0.1141	-0.2467	0.5405	0.0411	0.0398	0.3251	-0.1158	-0.1461	0.1585	-0.2588	0.337	0.5681	-0.6527	-0.0025	1.2677	-0.3524	-0.0366	0.8028	0.0056	0.8377	39.4304	57.521	135.9754
55	0.1542	0.018	0.0919	0.0425	0.0082	0.0328	0.6693	0.4737	-0.3305	-0.3558	0.0848	-0.31	0.3453	0.9378	-0	1.0569	0.1923	-0.1113	1.2595	-0.3614	1.0485	77.7085	73.4673	127.8602
56	0.3254	-0.0986	-0.1043	0.2	0.0849	0.0331	0.3855	0.454	-0.2849	-0.4506	0.204	0.0112	0.1717	0.599	-0	0.8526	0.1818	-0.0289	1.0823	-0.2643	1.094	81.5125	71.0418	126.4761
57	0.2754	0.3785	-0.0332	0.5249	-0.099	1.5617	0.7597	-0.8188	0.5005	0.5669	-0.4265	0.1344	0.0615	0.2817	-0	1.0987	-0.1124	-0.0544	1.1706	-0.3599	0.9983	65.7931	79.7639	141.362
58	0.0606	-0.0365	-0.0479	0.0667	0.0721	0.0811	-0.1356	-0.0393	-0.1846	0.3164	-0.184	-0.3882	-0.0702	-0.4449	-0.0069	2.2461	0.317	-0.5174	0.9368	0.037	1.0413	62.9432	55.5442	138.9725
59	0.3959	0.2777	0.1195	0.6187	-0.1724	0.1297	0.3624	-0.7463	0.166	0.7138	-0.1796	0.0612	0.4726	-0.164	0	1.3138	-0.1066	0.0435	1.0516	-0.1123	0.9577	50.8031	71.441	139.4644
60	0.0349	0.012	0.0836	0.0729	0.0176	0.1254	0.2332	-0.2265	0.4816	-0.136	-0.1299	0.1075	-0.4757	0.0314	0	1.1545	0.0683	0.04	0.8471	-0.1355	1.0343	46.58	79.378	126.9203
61	0.2909	-0.1931	0.0041	0.2281	0.2419	0.3798	0.3771	-0.5375	0.5917	0.4756	-0.1551	0.4172	-0.0586	0.0006	0	0.9957	0.0027	-0.0111	0.8666	-0.2049	1.0028	59.278	79.7723	133.0736
62	0.7123	-0.0069	-0.6257	0.2929	-0.2617	0.6806	-0.0488	-0.0837	-0.0877	-0.0375	0.1399	0.0157	0.0281	0.0962	0	1.2235	0.0354	-0.0803	0.711	-0.0271	0.8648	50.8675	72.1953	100.9102
63	0.3264	0.0072	0.1502	0.0428	-0.0189	0.4493	-0.0449	1.0678	-0.2948	-0.3988	0.2697	0.073	0.1699	0.3935	-0.0004	1.2416	0.0712	-0.0996	0.8036	-0.1418	0.8376	55.8386	60.7403	86.994
64	0.3723	0.3989	-0.0789	0.8719	0.2409	0.4698	0.4269	0.2754	-0.33	0.2071	0.0821	-0.1527	0.8936	0.4906	0.2113	1.2335	0.485	-0.324	0.996	-0.2892	0.8941	68.4655	51.1735	103.1622
65	0.0058	-0.0443	0.0552	0.1164	-0.127	0.1275	0.2587	-0.2342	-0.1743	-0.1856	0.0827	0.0651	0.7474	0.002	0	1.7588	0.1503	-0.3322	1.1422	0.0548	1.2961	64.4255	36.2717	143.8768
66	0.0664	-0.0949	-0.0811	0.0925	0.0856	0.0697	0.2287	-0.6364	0.2519	-1.2925	-0.2012	0.435	0.0137	-0.5456	0	1.5287	-0.0492	-0.2719	1.0944	0.0241	1.1164	56.3214	39.6626	144.8902
67	0.1293	-0.1261	-0.0077	0.1396	0.0446	0.0878	0.2274	-0.5707	0.1563	0.2515	0.5692	0.041	0.6094	0.6613	0.0074	1.6572	0.0783	-0.4448	1.9719	0.3961	1.4268	72.0413	35.734	152.0711
68	0.3726	0.0438	-0.4414	-0.0002	-0.0539	0.4619	0.1425	-0.6022	-0.9861	-0.7483	-0.2466	0.3531	0.2137	0.5554	0.0233	1.6788	0.4394	-0.5035	1.2703	0.253	1.5164	78.3624	27.7534	138.8848
69	0.863	0.729	0.118	0.5569	0.121	0.0118	0.1947	-0.1519	-0.1438	0.0645	-0.437	-0.0448	0.8302	0.5582	-0.2477	1.7766	0.7646	-0.5323	0.9657	-0.1147	1.1353	74.1505	40.6517	120.001
70	0.7357	0.0441	0.097	0.1104	-0.0947	0.1664	-0.2018	0.2599	-0.5096	-0.1238	0.0896	-0.1962	0.6709	0.103	-0.0171	1.9692	0.5	-0.291	0.7739	-0.0921	1.3128	65.7693	31.0998	117.0811
71	0.2457	-0.0614	-0.0131	0.0302	0.0259	0.0046	-0.0095	0.2422	0.0897	0.0937	0.3789	0.0144	-0.0397	-0.1344	-0	1.2847	0.2439	-0.0123	1.7952	-0.0506	0.7977	23.8004	116.6592	202.5467
72	0.1413	-0.1043	-0.1556	0.4901	-0.065	0.1528	-0.0674	-0.0202	-0.2755	0.2631	0.1413	0.0558	-0.0953	-0.6105	0	1.0258	0.2868	0.0019	1.5993	-0.0769	0.7459	25.7216	113.9066	209.8035
73	0.2784	-0.2819	0.0137	0.2037	0.1264	0.2382	-0.1351	-0.0818	-0.1299	-0.4127	0.1239	0.4274	0.2702	-0.2126	0	1.392	-0.1631	0.0662	1.7666	-0.1529	0.9511	29.3283	91.2133	202.5454
74	0.1964	0.0258	-0.2203	0.0801	-0.0431	0.1596	0.4421	-0.1178	-0.2247	0.764	0.0361	-0.4451	0.0348	-0.0753	0	1.5591	-0.0564	-0.0928	1.5834	-0.1842	0.8225	44.2704	101.4834	200.244
75	0.5126	0.3994	-0.2726	0.7288	0.1309	0.2914	-0.1014	0.2529	-0.1669	-0.2606	0.1156	-0.0944	0.2175	-0.5324	0	1.1527	-0.0211	-0.0397	1.3433	-0.1553	0.6143	30.2248	92.1067	192.1588
76	0.0244	-0.0202	-0.0325	0.0735	-0.057	0.063	0.7302	-0.0745	-0.2528	0.0198	-0.0426	-0.1196	-0.056	-0.2849	0	1.5103	-0.0946	0.028	1.6137	-0.5122	1.1946	68.2048	100.159	166.8574
77	0.1792	0.0037	-0.1102	0.302	-0.2605	0.2693	-0.2187	-0.5669	0.1731	0.0023	-0.0403	0.0782	-0.7271	-0.4031	-0	1.19	-0.0747	-0.0478	1.5478	-0.4742	1.181	64.1454	107.3377	161.9732
78	0.1895	0.1203	-0.084	0.0796	-0.0198	0.0664	-0.0018	0.0891	-0.116	-0.1697	0.3587	-0.1827	0.6781	0.3877	-0	1.3979	0.0107	0.0012	1.4435	-0.5145	1.1646	63.4641	86.072	163.9729
79	0.3703	-0.1624	0.013	0.353	-0.4297	0.2916	-0.1597	-0.0709	0.0188	-0.1431	0.1553	-0.4009	0.0536	-0.1661	-0	1.3592	0.0192	-0.048	1.5155	-0.3858	0.8893	51.7561	90.1199	185.893
80	0.1583	0.0105	0.1652	0.1367	-0.081	0.1804	0.0773	-0.5167	0.1647	0.0645	0.4458	-0.3965	0.0891	0.618	-0	1.4289	0.0375	-0.0375	1.6691	-0.4417	1.1821	60.8661	90.4872	180.613
81	0.1031	0.052	0.0359	0.0147	0.0291	0.0347	0.2333	-0.1012	-0.112	-0.3014	-0.415	0.2686	-0.2545	-0.7255	0	1.3081	0.0714	0.0066	1.5762	-0.5696	1.1481	67.0668	118.3838	199.258
82	0.2813	0.394	-0.2008	0.4549	-0.267	0.1547	-0.1582	0.5779	0.0429	-0.198	0.3312	-0.6535	0.2037	0.169	-0	1.0132	0.1191	-0.0206	1.4652	-0.4885	1.0916	67.8346	115.1491	202.6971
83	0.1652	0.1369	0.0621	0.2116	-0.171	0.227	0.283	0.1338	0.1344	-0.0593	0.4283	0.095	0.0424	0.2019	0.0183	1.2175	-0.0014	0.0856	1.4621	-0.5087	1.2193	66.8038	135.6466	200.8658
84	0.6091	0.2282	0.0468	0.3486	-0.5624	0.588	0.0495	-0.0246	-0.0275	0.2389	0.1617	-0.1689	0.1047	0.3248	0	1.5728	0.1154	0.009	1.423	-0.2528	0.812	49.7288	133.486	183.9486
85	0.2572	0.2884	-0.055	0.2347	-0.0435	0.1029	-0.166	0.3392	0.0584	0.0924	0.1294	-0.3572	0.0934	-0.0907	0	1.7183	-0.0852	0.1178	1.6493	-0.2762	0.9644	59.6277	130.3596	171.2674
86	0.2249	0.1159	-0.0296	0.2009	-0.2305	0.3034	0.0284	0.9148	-0.5523	-0.1171	0.5103	-0.108	-0.2499	0.4193	0.0133	1.5179	0.022	0.158	1.5731	-0.4155	0.8276	62.8387	131.5111	184.7262
87	0.1256	-0.1739	0.0642	0.1679	-0.079	0.0443	-0.0771	-0.0294	-0.0384	0.6885	0.4399	-0.04	-0.0986	0.1299	-0	1.2912	-0.0018	0.0395	2.0536	-0.107	0.7385	21.8869	106.3269	167.5417
88	0.3265	-0.1584	-0.1022	0.316	-0.0066	0.0294	-0.5826	-0.1148	-0.1937	-0.3166	0.4064	-0.2863	-0.2898	-0.6188	-0.0016	1.1549	-0.0787	-0.0388	1.9779	0.0405	0.7423	24.59	113.1798	153.0256
89	0.2332	0.2107	-0.0539	0.1511	0.0606	0.179	0.1118	0.2684	0.0642	0.291	-0.0869	-0.044	-0.4174	0.093	0	1.3489	0.2361	-0.04	1.8266	-0.1139	0.8439	29.3663	132.8316	164.9601
90	0.069	-0.0511	-0.0271	0.0294	0.0129	0	-0.1061	0.3303	0.5075	0.1905	-0.1273	-0.0491	-0.1114	-0.6088	0	1.4694	0.1945	0.0863	1.4642	-0.1961	0.93	47.5522	112.9656	166.8301
91	0.1158	0.1994	0.0859	0.3454	0.1215	0.0334	-0.0399	0.1529	0.0064	-0.1509	0.4523	-0.2378	-0.5023	0.0637	0.0049	1.5738	0.0909	-0.036	1.7416	0.0524	0.5714	40.5137	128.6066	165.776
92	0.6337	-0.0641	0.4922	0.1866	-0.0461	0.2961	-0.1349	-0.333	0.1331	0.2494	0.3462	-0.2276	-0.0099	-0.0117	-0	1.3448	0.1985	0.0514	1.3458	-0.1167	0.6074	33.0246	134.1621	178.2362
93	0.0648	-0.0933	0.0611	0.1497	-0.0152	0.0212	0.3546	-0.3144	0.329	0.6357	-0.2636	0.2038	-0.3785	-1.535	0	1.4931	0.2374	0.0294	2.1523	-0.0421	0.8768	26.7444	127.1861	169.0755

Refinement TLS group

ID	Refine-ID	Refine TLS-ID	Selection details
1	X-RAY DIFFRACTION	1	chain 'A' and (resid 2 through 112 )
2	X-RAY DIFFRACTION	2	chain 'A' and (resid 113 through 179 )
3	X-RAY DIFFRACTION	3	chain 'A' and (resid 180 through 199 )
4	X-RAY DIFFRACTION	4	chain 'A' and (resid 200 through 227 )
5	X-RAY DIFFRACTION	5	chain 'A' and (resid 228 through 254 )
6	X-RAY DIFFRACTION	6	chain 'A' and (resid 255 through 278 )
7	X-RAY DIFFRACTION	7	chain 'A' and (resid 279 through 334 )
8	X-RAY DIFFRACTION	8	chain 'B' and (resid 1 through 82 )
9	X-RAY DIFFRACTION	9	chain 'B' and (resid 83 through 129 )
10	X-RAY DIFFRACTION	10	chain 'B' and (resid 130 through 179 )
11	X-RAY DIFFRACTION	11	chain 'B' and (resid 180 through 199 )
12	X-RAY DIFFRACTION	12	chain 'B' and (resid 200 through 227 )
13	X-RAY DIFFRACTION	13	chain 'B' and (resid 228 through 254 )
14	X-RAY DIFFRACTION	14	chain 'B' and (resid 255 through 278 )
15	X-RAY DIFFRACTION	15	chain 'B' and (resid 279 through 334 )
16	X-RAY DIFFRACTION	16	chain 'C' and (resid 2 through 84 )
17	X-RAY DIFFRACTION	17	chain 'C' and (resid 85 through 150 )
18	X-RAY DIFFRACTION	18	chain 'C' and (resid 151 through 333 )
19	X-RAY DIFFRACTION	19	chain 'D' and (resid 1 through 112 )
20	X-RAY DIFFRACTION	20	chain 'D' and (resid 113 through 334 )
21	X-RAY DIFFRACTION	21	chain 'E' and (resid 1 through 150 )
22	X-RAY DIFFRACTION	22	chain 'E' and (resid 151 through 334 )
23	X-RAY DIFFRACTION	23	chain 'F' and (resid 1 through 33 )
24	X-RAY DIFFRACTION	24	chain 'F' and (resid 34 through 67 )
25	X-RAY DIFFRACTION	25	chain 'F' and (resid 68 through 129 )
26	X-RAY DIFFRACTION	26	chain 'F' and (resid 130 through 179 )
27	X-RAY DIFFRACTION	27	chain 'F' and (resid 180 through 199 )
28	X-RAY DIFFRACTION	28	chain 'F' and (resid 200 through 254 )
29	X-RAY DIFFRACTION	29	chain 'F' and (resid 255 through 303 )
30	X-RAY DIFFRACTION	30	chain 'F' and (resid 304 through 334 )
31	X-RAY DIFFRACTION	31	chain 'G' and (resid 1 through 84 )
32	X-RAY DIFFRACTION	32	chain 'G' and (resid 85 through 150 )
33	X-RAY DIFFRACTION	33	chain 'G' and (resid 151 through 333 )
34	X-RAY DIFFRACTION	34	chain 'H' and (resid 2 through 46 )
35	X-RAY DIFFRACTION	35	chain 'H' and (resid 47 through 84 )
36	X-RAY DIFFRACTION	36	chain 'H' and (resid 85 through 129 )
37	X-RAY DIFFRACTION	37	chain 'H' and (resid 130 through 334 )
38	X-RAY DIFFRACTION	38	chain 'I' and (resid 3 through 46 )
39	X-RAY DIFFRACTION	39	chain 'I' and (resid 47 through 84 )
40	X-RAY DIFFRACTION	40	chain 'I' and (resid 85 through 112 )
41	X-RAY DIFFRACTION	41	chain 'I' and (resid 113 through 150 )
42	X-RAY DIFFRACTION	42	chain 'I' and (resid 151 through 278 )
43	X-RAY DIFFRACTION	43	chain 'I' and (resid 279 through 334 )
44	X-RAY DIFFRACTION	44	chain 'J' and (resid 1 through 84 )
45	X-RAY DIFFRACTION	45	chain 'J' and (resid 85 through 334 )
46	X-RAY DIFFRACTION	46	chain 'K' and (resid 2 through 46 )
47	X-RAY DIFFRACTION	47	chain 'K' and (resid 47 through 179 )
48	X-RAY DIFFRACTION	48	chain 'K' and (resid 180 through 199 )
49	X-RAY DIFFRACTION	49	chain 'K' and (resid 200 through 334 )
50	X-RAY DIFFRACTION	50	chain 'L' and (resid 2 through 84 )
51	X-RAY DIFFRACTION	51	chain 'L' and (resid 85 through 129 )
52	X-RAY DIFFRACTION	52	chain 'L' and (resid 130 through 334 )
53	X-RAY DIFFRACTION	53	chain 'M' and (resid 2 through 179 )
54	X-RAY DIFFRACTION	54	chain 'M' and (resid 180 through 331 )
55	X-RAY DIFFRACTION	55	chain 'N' and (resid 2 through 46 )
56	X-RAY DIFFRACTION	56	chain 'N' and (resid 47 through 84 )
57	X-RAY DIFFRACTION	57	chain 'N' and (resid 85 through 179 )
58	X-RAY DIFFRACTION	58	chain 'N' and (resid 180 through 199 )
59	X-RAY DIFFRACTION	59	chain 'N' and (resid 200 through 254 )
60	X-RAY DIFFRACTION	60	chain 'N' and (resid 255 through 303 )
61	X-RAY DIFFRACTION	61	chain 'N' and (resid 304 through 334 )
62	X-RAY DIFFRACTION	62	chain 'O' and (resid 1 through 84 )
63	X-RAY DIFFRACTION	63	chain 'O' and (resid 85 through 150 )
64	X-RAY DIFFRACTION	64	chain 'O' and (resid 151 through 334 )
65	X-RAY DIFFRACTION	65	chain 'P' and (resid 2 through 46 )
66	X-RAY DIFFRACTION	66	chain 'P' and (resid 47 through 67 )
67	X-RAY DIFFRACTION	67	chain 'P' and (resid 68 through 84 )
68	X-RAY DIFFRACTION	68	chain 'P' and (resid 85 through 150 )
69	X-RAY DIFFRACTION	69	chain 'P' and (resid 151 through 227 )
70	X-RAY DIFFRACTION	70	chain 'P' and (resid 228 through 334 )
71	X-RAY DIFFRACTION	71	chain 'Q' and (resid 2 through 46 )
72	X-RAY DIFFRACTION	72	chain 'Q' and (resid 47 through 129 )
73	X-RAY DIFFRACTION	73	chain 'Q' and (resid 130 through 179 )
74	X-RAY DIFFRACTION	74	chain 'Q' and (resid 180 through 227 )
75	X-RAY DIFFRACTION	75	chain 'Q' and (resid 228 through 334 )
76	X-RAY DIFFRACTION	76	chain 'R' and (resid 1 through 33 )
77	X-RAY DIFFRACTION	77	chain 'R' and (resid 34 through 84 )
78	X-RAY DIFFRACTION	78	chain 'R' and (resid 85 through 150 )
79	X-RAY DIFFRACTION	79	chain 'R' and (resid 151 through 303 )
80	X-RAY DIFFRACTION	80	chain 'R' and (resid 304 through 333 )
81	X-RAY DIFFRACTION	81	chain 'S' and (resid 2 through 46 )
82	X-RAY DIFFRACTION	82	chain 'S' and (resid 47 through 84 )
83	X-RAY DIFFRACTION	83	chain 'S' and (resid 85 through 150 )
84	X-RAY DIFFRACTION	84	chain 'S' and (resid 151 through 254 )
85	X-RAY DIFFRACTION	85	chain 'S' and (resid 255 through 303 )
86	X-RAY DIFFRACTION	86	chain 'S' and (resid 304 through 334 )
87	X-RAY DIFFRACTION	87	chain 'T' and (resid 1 through 67 )
88	X-RAY DIFFRACTION	88	chain 'T' and (resid 68 through 129 )
89	X-RAY DIFFRACTION	89	chain 'T' and (resid 130 through 179 )
90	X-RAY DIFFRACTION	90	chain 'T' and (resid 180 through 199 )
91	X-RAY DIFFRACTION	91	chain 'T' and (resid 200 through 227 )
92	X-RAY DIFFRACTION	92	chain 'T' and (resid 228 through 303 )
93	X-RAY DIFFRACTION	93	chain 'T' and (resid 304 through 334 )