FMO DATABASE

FMODB ID: 98Y92

Calculation Name: 4H8S-A-Xray372

Preferred Name:

Target Type:

Ligand Name:

ligand 3-letter code:

PDB ID: 4H8S

Chain ID: A

ChEMBL ID:

UniProt ID: Q8NEU8

Base Structure: X-ray

Registration Date: 2023-09-20

Reference: C. Watanabe, N. Tani, K. Kamisaka, T. Honma et al., Interaction energy analysis of Apo structure dataset on FMODB, To be published.

DOI:

IFIE MAP

IFIE Diagram

Modeling method

Optimization	MOE:Amber10:EHT
Restraint	OptH
Protonation	MOE:Protonate 3D
Complement	MOE:Structure Preparation
Water	No
Procedure	Auto-FMO protocol ver. 2.20220422

FMO calculation

FMO method	FMO2-MP2/6-31G(d)
Fragmentation	Auto
Number of fragment	382
LigandResidueName
LigandFragmentNumber	0
LigandCharge
Software	ABINIT-MP - Open Ver. 1 Rev. 22 / 20200603(SMP)

Total energy (hartree)

FMO2-HF: Electronic energy	-4456422.728918
FMO2-HF: Nuclear repulsion	4302086.124092
FMO2-HF: Total energy	-154336.604826
FMO2-MP2: Total energy	-154776.860439

3D Structure

Snapshot

Ligand structure

Ligand Interaction

Ligand binding energy

IFIE [kcal/mol]	PIEDA [kcal/mol]				Charge transfer value [e]
IFIE SUMIFIE SUM at MP2 level.	ESElectro static interaction energy.	EXExchange-repulsion energy.	CT+mixCharge transfer and mixing terms energy.	DI(MP2)Dispersion energy.	q(I=>J)Charge transfer value from I to J fragments.
N/A	N/A	N/A	N/A	N/A	N/A

Interactive mode: IFIE and PIEDA for fragment #1(A:-4:TYR)

Summations of interaction energy for fragment #1(A:-4:TYR)

IFIE [kcal/mol]	PIEDA [kcal/mol]				Charge transfer value [e]
IFIE SUMIFIE SUM at MP2 level.	ESElectro static interaction energy.	EXExchange-repulsion energy.	CT+mixCharge transfer and mixing terms energy.	DI(MP2)Dispersion energy.	q(I=>J)Charge transfer value from I to J fragments.
-1.876	0.227	-0.003	-0.98	-1.12	-0.001

Interaction energy analysis for fragmet #1(A:-4:TYR)

Snapshot

IFIE Diagram

Base fragment(s) of PIEDA/IFIE

Single fragment	Multi fragments
	Fragment list

Charge [e] FCHARGE : 0 / q_Mulliken : -0.022 / q_NPA : -0.029

Distance from base fragment(s) [Å]

Dist

Interaction energy by IFIE and PIEDA
[kcal/mol]

| Total | > | ES | > | EX | >
| CT+mix | > | DI(MP2) | >

Fragment charge [e]

FCHARGE q_Mulliken
q_NPA q(I=>J)

Residue

Res # RES

Sort

Graph Options

X Axis Label
Y Axis Max Y Axis Min
Display ES EX CT+mix DI(MP2)

frag_NumFragment number.	ChainChain species.	Res #Residue number.	RES3-letter code of amino acid residue, ligand and solvent molecule.	FCHARGEFormal charge [e].	q_MullikenFragment charge evaluated by Mulliken charge [e].	q_NPAFragment charge evaluated by natural population analysis(NPA) charge [e].	DISTDistance from Ligand [Å].	TotalIFIE at MP2 level [kcal/mol].	ESElectro static interaction energy by PIEDA [kcal/mol].	EXExchange-repulsion energy by PIEDA [kcal/mol].	CT+mixCharge transfer and mixing terms energy by PIEDA [kcal/mol].	DI(MP2)Dispersion energy by PIEDA [kcal/mol].	q(I=>J)Charge transfer value from I to J fragmens [e].
3	A	-2	GLN	0	0.019	0.002	3.676	-1.768	0.335	-0.003	-0.980	-1.120	-0.001
4	A	-1	SER	0	-0.022	-0.016	6.074	0.258	0.258	0.000	0.000	0.000	0.000
5	A	0	ASN	0	0.038	0.016	9.523	-0.108	-0.108	0.000	0.000	0.000	0.000
6	A	1	ALA	0	-0.020	-0.001	12.322	0.094	0.094	0.000	0.000	0.000	0.000
7	A	2	PRO	0	-0.048	-0.034	16.102	-0.003	-0.003	0.000	0.000	0.000	0.000
8	A	3	ALA	0	0.019	0.010	17.650	0.005	0.005	0.000	0.000	0.000	0.000
9	A	4	VAL	0	-0.010	0.011	20.342	0.004	0.004	0.000	0.000	0.000	0.000
10	A	5	ASP	-1	-0.899	-0.941	22.375	-0.243	-0.243	0.000	0.000	0.000	0.000
11	A	6	LYS	1	0.931	0.953	25.002	0.167	0.167	0.000	0.000	0.000	0.000
12	A	7	LEU	0	-0.001	0.010	28.007	-0.005	-0.005	0.000	0.000	0.000	0.000
13	A	8	LEU	0	0.027	-0.012	28.202	0.004	0.004	0.000	0.000	0.000	0.000
14	A	9	LEU	0	-0.019	0.009	31.491	0.004	0.004	0.000	0.000	0.000	0.000
15	A	10	GLU	-1	-0.963	-0.998	33.019	-0.127	-0.127	0.000	0.000	0.000	0.000
16	A	11	GLU	-1	-0.973	-0.987	30.591	-0.134	-0.134	0.000	0.000	0.000	0.000
17	A	12	ALA	0	0.004	0.005	35.345	0.001	0.001	0.000	0.000	0.000	0.000
18	A	13	LEU	0	-0.052	-0.035	37.784	0.005	0.005	0.000	0.000	0.000	0.000
19	A	14	GLN	0	-0.074	-0.043	36.909	0.003	0.003	0.000	0.000	0.000	0.000
20	A	15	ASP	-1	-0.821	-0.893	37.250	-0.074	-0.074	0.000	0.000	0.000	0.000
21	A	16	SER	0	0.041	0.039	32.975	0.003	0.003	0.000	0.000	0.000	0.000
22	A	17	PRO	0	0.039	0.008	33.817	-0.003	-0.003	0.000	0.000	0.000	0.000
23	A	18	GLN	0	0.021	-0.018	29.262	0.002	0.002	0.000	0.000	0.000	0.000
24	A	19	THR	0	0.054	0.058	29.665	-0.011	-0.011	0.000	0.000	0.000	0.000
25	A	20	ARG	1	0.871	0.922	31.591	0.071	0.071	0.000	0.000	0.000	0.000
26	A	21	SER	0	-0.065	-0.039	29.105	0.000	0.000	0.000	0.000	0.000	0.000
27	A	22	LEU	0	0.045	0.025	25.865	0.001	0.001	0.000	0.000	0.000	0.000
28	A	23	LEU	0	-0.014	-0.010	28.691	-0.001	-0.001	0.000	0.000	0.000	0.000
29	A	24	SER	0	0.007	0.004	31.220	0.005	0.005	0.000	0.000	0.000	0.000
30	A	25	VAL	0	-0.004	0.007	25.746	0.004	0.004	0.000	0.000	0.000	0.000
31	A	26	PHE	0	-0.027	-0.023	27.886	-0.001	-0.001	0.000	0.000	0.000	0.000
32	A	27	GLU	-1	-0.894	-0.945	29.706	-0.078	-0.078	0.000	0.000	0.000	0.000
33	A	28	GLU	-1	-0.929	-0.960	28.903	-0.070	-0.070	0.000	0.000	0.000	0.000
34	A	29	ASP	-1	-0.976	-0.978	26.270	-0.129	-0.129	0.000	0.000	0.000	0.000
35	A	30	ALA	0	0.023	-0.005	28.682	0.004	0.004	0.000	0.000	0.000	0.000
36	A	31	GLY	0	-0.003	0.006	31.960	0.005	0.005	0.000	0.000	0.000	0.000
37	A	32	THR	0	0.031	0.022	28.651	0.002	0.002	0.000	0.000	0.000	0.000
38	A	33	LEU	0	0.001	0.011	29.382	0.003	0.003	0.000	0.000	0.000	0.000
39	A	34	THR	0	-0.070	-0.060	31.448	0.006	0.006	0.000	0.000	0.000	0.000
40	A	35	ASP	-1	-0.880	-0.931	33.387	-0.053	-0.053	0.000	0.000	0.000	0.000
41	A	36	TYR	0	-0.037	-0.020	30.282	0.003	0.003	0.000	0.000	0.000	0.000
42	A	37	THR	0	-0.025	-0.033	33.177	0.004	0.004	0.000	0.000	0.000	0.000
43	A	38	ASN	0	0.040	0.029	35.265	0.003	0.003	0.000	0.000	0.000	0.000
44	A	39	GLN	0	-0.001	0.006	34.773	0.003	0.003	0.000	0.000	0.000	0.000
45	A	40	LEU	0	-0.028	-0.014	33.121	0.003	0.003	0.000	0.000	0.000	0.000
46	A	41	LEU	0	0.021	0.009	36.184	0.003	0.003	0.000	0.000	0.000	0.000
47	A	42	GLN	0	0.014	0.006	39.349	0.002	0.002	0.000	0.000	0.000	0.000
48	A	43	ALA	0	-0.031	-0.020	37.724	0.003	0.003	0.000	0.000	0.000	0.000
49	A	44	MET	0	-0.025	-0.021	37.541	0.002	0.002	0.000	0.000	0.000	0.000
50	A	45	GLN	0	0.040	0.013	40.515	0.002	0.002	0.000	0.000	0.000	0.000
51	A	46	ARG	1	0.963	0.998	42.841	0.028	0.028	0.000	0.000	0.000	0.000
52	A	47	VAL	0	-0.029	-0.005	40.651	0.002	0.002	0.000	0.000	0.000	0.000
53	A	48	TYR	0	0.011	0.007	43.856	0.001	0.001	0.000	0.000	0.000	0.000
54	A	49	GLY	0	-0.001	0.002	46.248	0.001	0.001	0.000	0.000	0.000	0.000
55	A	50	ALA	0	-0.014	-0.021	46.467	0.001	0.001	0.000	0.000	0.000	0.000
56	A	51	GLN	0	-0.004	0.009	46.734	0.002	0.002	0.000	0.000	0.000	0.000
57	A	52	ASN	0	-0.016	-0.027	49.088	0.002	0.002	0.000	0.000	0.000	0.000
58	A	53	GLU	-1	-0.901	-0.952	51.561	-0.018	-0.018	0.000	0.000	0.000	0.000
59	A	54	MET	0	0.045	0.035	51.278	0.002	0.002	0.000	0.000	0.000	0.000
60	A	55	CYS	0	-0.077	-0.021	52.682	0.001	0.001	0.000	0.000	0.000	0.000
61	A	56	LEU	0	0.019	0.003	55.286	0.001	0.001	0.000	0.000	0.000	0.000
62	A	57	ALA	0	0.016	0.014	55.941	0.001	0.001	0.000	0.000	0.000	0.000
63	A	58	THR	0	-0.005	-0.008	55.921	0.001	0.001	0.000	0.000	0.000	0.000
64	A	59	GLN	0	0.009	0.006	58.714	0.000	0.000	0.000	0.000	0.000	0.000
65	A	60	GLN	0	-0.076	-0.041	61.104	0.001	0.001	0.000	0.000	0.000	0.000
66	A	61	LEU	0	0.006	0.008	60.037	0.001	0.001	0.000	0.000	0.000	0.000
67	A	62	SER	0	0.016	0.007	62.951	0.001	0.001	0.000	0.000	0.000	0.000
68	A	63	LYS	1	0.978	0.993	64.856	0.014	0.014	0.000	0.000	0.000	0.000
69	A	64	GLN	0	-0.034	-0.029	66.321	0.001	0.001	0.000	0.000	0.000	0.000
70	A	65	LEU	0	-0.019	0.005	63.891	0.001	0.001	0.000	0.000	0.000	0.000
71	A	66	LEU	0	0.000	-0.006	68.169	0.000	0.000	0.000	0.000	0.000	0.000
72	A	67	ALA	0	-0.056	-0.024	70.800	0.000	0.000	0.000	0.000	0.000	0.000
73	A	68	TYR	0	0.029	0.014	72.259	0.000	0.000	0.000	0.000	0.000	0.000
74	A	69	GLU	-1	-0.883	-0.952	73.986	-0.009	-0.009	0.000	0.000	0.000	0.000
75	A	70	LYS	1	0.864	0.938	74.630	0.010	0.010	0.000	0.000	0.000	0.000
76	A	71	GLN	0	-0.016	0.005	76.139	0.000	0.000	0.000	0.000	0.000	0.000
77	A	72	ASN	0	-0.039	-0.007	79.206	0.000	0.000	0.000	0.000	0.000	0.000
78	A	73	PHE	0	0.012	-0.007	77.041	0.000	0.000	0.000	0.000	0.000	0.000
79	A	74	ALA	0	-0.007	-0.001	82.744	0.000	0.000	0.000	0.000	0.000	0.000
80	A	75	LEU	0	0.023	0.009	84.096	0.000	0.000	0.000	0.000	0.000	0.000
81	A	76	GLY	0	-0.009	-0.019	85.392	0.000	0.000	0.000	0.000	0.000	0.000
82	A	77	LYS	1	0.741	0.855	78.276	0.006	0.006	0.000	0.000	0.000	0.000
83	A	78	GLY	0	0.146	0.092	79.516	0.000	0.000	0.000	0.000	0.000	0.000
84	A	79	ASP	-1	-0.950	-0.975	76.950	-0.006	-0.006	0.000	0.000	0.000	0.000
85	A	80	GLU	-1	-0.834	-0.913	77.503	-0.005	-0.005	0.000	0.000	0.000	0.000
86	A	81	GLU	-1	-0.863	-0.946	74.511	-0.005	-0.005	0.000	0.000	0.000	0.000
87	A	82	VAL	0	0.003	0.012	72.294	0.000	0.000	0.000	0.000	0.000	0.000
88	A	83	ILE	0	0.023	0.016	72.178	-0.001	-0.001	0.000	0.000	0.000	0.000
89	A	84	SER	0	-0.063	-0.034	72.599	0.000	0.000	0.000	0.000	0.000	0.000
90	A	85	THR	0	-0.007	0.000	68.517	0.000	0.000	0.000	0.000	0.000	0.000
91	A	86	LEU	0	0.013	0.002	68.115	-0.001	-0.001	0.000	0.000	0.000	0.000
92	A	87	HIS	0	-0.016	0.003	68.087	-0.001	-0.001	0.000	0.000	0.000	0.000
93	A	88	TYR	0	-0.025	-0.005	62.680	-0.001	-0.001	0.000	0.000	0.000	0.000
94	A	89	PHE	0	0.018	-0.028	62.160	-0.001	-0.001	0.000	0.000	0.000	0.000
95	A	90	SER	0	-0.004	0.008	63.222	-0.001	-0.001	0.000	0.000	0.000	0.000
96	A	91	LYS	1	0.937	0.975	63.649	0.012	0.012	0.000	0.000	0.000	0.000
97	A	92	VAL	0	0.004	0.009	58.895	-0.001	-0.001	0.000	0.000	0.000	0.000
98	A	93	VAL	0	0.001	0.005	59.137	-0.001	-0.001	0.000	0.000	0.000	0.000
99	A	94	ASP	-1	-0.844	-0.937	59.413	-0.015	-0.015	0.000	0.000	0.000	0.000
100	A	95	GLU	-1	-0.954	-0.979	58.600	-0.018	-0.018	0.000	0.000	0.000	0.000
101	A	96	LEU	0	-0.016	-0.022	53.138	-0.001	-0.001	0.000	0.000	0.000	0.000
102	A	97	ASN	0	-0.031	-0.009	54.978	-0.002	-0.002	0.000	0.000	0.000	0.000
103	A	98	LEU	0	0.032	0.043	55.482	-0.002	-0.002	0.000	0.000	0.000	0.000
104	A	99	LEU	0	-0.006	-0.010	51.798	-0.002	-0.002	0.000	0.000	0.000	0.000
105	A	100	HIS	0	0.011	0.002	50.521	-0.001	-0.001	0.000	0.000	0.000	0.000
106	A	101	THR	0	-0.017	-0.047	51.370	-0.001	-0.001	0.000	0.000	0.000	0.000
107	A	102	GLU	-1	-1.028	-1.021	50.155	-0.033	-0.033	0.000	0.000	0.000	0.000
108	A	103	LEU	0	0.004	0.019	44.858	-0.002	-0.002	0.000	0.000	0.000	0.000
109	A	104	ALA	0	-0.015	-0.005	47.810	-0.002	-0.002	0.000	0.000	0.000	0.000
110	A	105	LYS	1	0.915	0.967	48.370	0.032	0.032	0.000	0.000	0.000	0.000
111	A	106	GLN	0	0.054	0.023	44.767	-0.004	-0.004	0.000	0.000	0.000	0.000
112	A	107	LEU	0	0.005	-0.009	43.057	-0.003	-0.003	0.000	0.000	0.000	0.000
113	A	108	ALA	0	-0.002	-0.006	43.854	-0.003	-0.003	0.000	0.000	0.000	0.000
114	A	109	ASP	-1	-0.893	-0.956	45.297	-0.041	-0.041	0.000	0.000	0.000	0.000
115	A	110	THR	0	-0.093	-0.049	41.894	-0.003	-0.003	0.000	0.000	0.000	0.000
116	A	111	MET	0	-0.018	0.000	38.887	-0.003	-0.003	0.000	0.000	0.000	0.000
117	A	112	VAL	0	-0.002	-0.011	39.947	-0.002	-0.002	0.000	0.000	0.000	0.000
118	A	113	LEU	0	-0.007	0.013	42.124	-0.002	-0.002	0.000	0.000	0.000	0.000
119	A	114	PRO	0	0.004	0.001	38.185	-0.001	-0.001	0.000	0.000	0.000	0.000
120	A	115	ILE	0	0.034	0.014	35.205	-0.004	-0.004	0.000	0.000	0.000	0.000
121	A	116	ILE	0	0.005	0.017	38.964	-0.001	-0.001	0.000	0.000	0.000	0.000
122	A	117	GLN	0	0.008	-0.009	42.029	-0.002	-0.002	0.000	0.000	0.000	0.000
123	A	118	PHE	0	0.000	0.014	33.139	-0.001	-0.001	0.000	0.000	0.000	0.000
124	A	119	ARG	1	0.900	0.944	38.722	0.054	0.054	0.000	0.000	0.000	0.000
125	A	120	GLU	-1	-0.939	-0.992	39.866	-0.045	-0.045	0.000	0.000	0.000	0.000
126	A	121	LYS	1	0.865	0.938	42.024	0.056	0.056	0.000	0.000	0.000	0.000
127	A	122	ASP	-1	-0.791	-0.894	37.393	-0.078	-0.078	0.000	0.000	0.000	0.000
128	A	123	LEU	0	-0.014	-0.019	34.517	-0.002	-0.002	0.000	0.000	0.000	0.000
129	A	124	THR	0	-0.024	-0.009	38.324	0.000	0.000	0.000	0.000	0.000	0.000
130	A	125	GLU	-1	-0.925	-0.952	40.690	-0.071	-0.071	0.000	0.000	0.000	0.000
131	A	126	VAL	0	0.028	0.014	35.975	0.000	0.000	0.000	0.000	0.000	0.000
132	A	127	SER	0	-0.001	-0.001	39.110	0.001	0.001	0.000	0.000	0.000	0.000
133	A	128	THR	0	-0.046	-0.013	41.068	0.003	0.003	0.000	0.000	0.000	0.000
134	A	129	LEU	0	-0.034	-0.031	40.417	0.002	0.002	0.000	0.000	0.000	0.000
135	A	130	LYS	1	0.939	0.993	37.741	0.063	0.063	0.000	0.000	0.000	0.000
136	A	131	ASP	-1	-0.886	-0.949	40.970	-0.053	-0.053	0.000	0.000	0.000	0.000
137	A	132	LEU	0	-0.069	-0.028	44.248	0.002	0.002	0.000	0.000	0.000	0.000
138	A	133	PHE	0	0.002	-0.013	39.191	0.001	0.001	0.000	0.000	0.000	0.000
139	A	134	GLY	0	0.021	0.003	42.859	0.001	0.001	0.000	0.000	0.000	0.000
140	A	135	LEU	0	-0.018	0.006	43.487	0.002	0.002	0.000	0.000	0.000	0.000
141	A	136	ALA	0	0.002	-0.011	46.143	0.002	0.002	0.000	0.000	0.000	0.000
142	A	137	SER	0	-0.018	-0.004	43.170	0.000	0.000	0.000	0.000	0.000	0.000
143	A	138	ASN	0	0.011	0.014	45.221	0.002	0.002	0.000	0.000	0.000	0.000
144	A	139	GLU	-1	-0.897	-0.953	47.414	-0.043	-0.043	0.000	0.000	0.000	0.000
145	A	140	HIS	0	0.004	-0.006	45.907	0.002	0.002	0.000	0.000	0.000	0.000
146	A	141	ASP	-1	-0.881	-0.936	45.267	-0.051	-0.051	0.000	0.000	0.000	0.000
147	A	142	LEU	0	-0.030	-0.026	48.194	0.002	0.002	0.000	0.000	0.000	0.000
148	A	143	SER	0	-0.052	-0.019	51.308	0.002	0.002	0.000	0.000	0.000	0.000
149	A	144	MET	0	0.026	0.005	47.660	0.001	0.001	0.000	0.000	0.000	0.000
150	A	145	ALA	0	-0.012	0.016	51.068	0.002	0.002	0.000	0.000	0.000	0.000
151	A	146	LYS	1	0.850	0.909	53.066	0.035	0.035	0.000	0.000	0.000	0.000
152	A	147	TYR	0	0.016	0.004	53.236	0.001	0.001	0.000	0.000	0.000	0.000
153	A	148	SER	0	-0.038	-0.032	52.104	0.000	0.000	0.000	0.000	0.000	0.000
154	A	149	ARG	1	0.897	0.954	54.464	0.033	0.033	0.000	0.000	0.000	0.000
155	A	150	LEU	0	-0.035	0.008	57.785	0.002	0.002	0.000	0.000	0.000	0.000
156	A	151	PRO	0	0.010	0.022	59.389	0.000	0.000	0.000	0.000	0.000	0.000
157	A	152	LYS	1	1.003	0.995	58.734	0.029	0.029	0.000	0.000	0.000	0.000
158	A	153	LYS	1	0.923	0.970	61.616	0.023	0.023	0.000	0.000	0.000	0.000
159	A	154	LYS	1	0.935	0.957	65.392	0.021	0.021	0.000	0.000	0.000	0.000
160	A	155	GLU	-1	-0.799	-0.912	62.444	-0.030	-0.030	0.000	0.000	0.000	0.000
161	A	156	ASN	0	-0.057	-0.027	65.131	0.001	0.001	0.000	0.000	0.000	0.000
162	A	157	GLU	-1	-0.813	-0.919	64.271	-0.031	-0.031	0.000	0.000	0.000	0.000
163	A	158	LYS	1	0.877	0.948	64.925	0.028	0.028	0.000	0.000	0.000	0.000
164	A	159	VAL	0	0.102	0.042	63.012	-0.001	-0.001	0.000	0.000	0.000	0.000
165	A	160	LYS	1	0.917	0.966	58.990	0.033	0.033	0.000	0.000	0.000	0.000
166	A	161	THR	0	-0.030	-0.022	59.912	-0.002	-0.002	0.000	0.000	0.000	0.000
167	A	162	GLU	-1	-0.950	-0.975	60.411	-0.031	-0.031	0.000	0.000	0.000	0.000
168	A	163	VAL	0	0.040	0.018	56.748	-0.001	-0.001	0.000	0.000	0.000	0.000
169	A	164	GLY	0	0.025	0.017	55.831	-0.002	-0.002	0.000	0.000	0.000	0.000
170	A	165	LYS	1	0.930	0.963	55.288	0.040	0.040	0.000	0.000	0.000	0.000
171	A	166	GLU	-1	-0.887	-0.954	56.126	-0.036	-0.036	0.000	0.000	0.000	0.000
172	A	167	VAL	0	-0.017	0.009	50.701	-0.001	-0.001	0.000	0.000	0.000	0.000
173	A	168	ALA	0	-0.018	-0.001	51.210	-0.002	-0.002	0.000	0.000	0.000	0.000
174	A	169	ALA	0	-0.011	-0.013	51.145	-0.003	-0.003	0.000	0.000	0.000	0.000
175	A	170	ALA	0	0.085	0.042	50.540	0.000	0.000	0.000	0.000	0.000	0.000
176	A	171	ARG	1	1.013	1.013	46.397	0.055	0.055	0.000	0.000	0.000	0.000
177	A	172	ARG	1	0.886	0.946	46.580	0.056	0.056	0.000	0.000	0.000	0.000
178	A	173	LYS	1	0.864	0.936	47.265	0.045	0.045	0.000	0.000	0.000	0.000
179	A	174	GLN	0	0.055	0.038	41.694	0.002	0.002	0.000	0.000	0.000	0.000
180	A	175	HIS	0	0.048	0.018	41.060	-0.003	-0.003	0.000	0.000	0.000	0.000
181	A	176	LEU	0	-0.040	-0.019	42.595	-0.003	-0.003	0.000	0.000	0.000	0.000
182	A	177	SER	0	0.005	-0.011	43.705	-0.003	-0.003	0.000	0.000	0.000	0.000
183	A	178	SER	0	0.001	-0.002	39.366	-0.003	-0.003	0.000	0.000	0.000	0.000
184	A	179	LEU	0	0.009	0.007	38.772	-0.005	-0.005	0.000	0.000	0.000	0.000
185	A	180	GLN	0	-0.007	-0.016	39.150	-0.003	-0.003	0.000	0.000	0.000	0.000
186	A	181	TYR	0	-0.005	-0.006	36.376	-0.002	-0.002	0.000	0.000	0.000	0.000
187	A	182	TYR	0	0.026	0.003	34.749	-0.004	-0.004	0.000	0.000	0.000	0.000
188	A	183	CYS	0	-0.056	-0.031	34.784	-0.006	-0.006	0.000	0.000	0.000	0.000
189	A	184	ALA	0	0.018	0.030	35.708	-0.004	-0.004	0.000	0.000	0.000	0.000
190	A	185	LEU	0	0.030	0.015	32.351	-0.003	-0.003	0.000	0.000	0.000	0.000
191	A	186	ASN	0	0.016	0.001	30.779	-0.011	-0.011	0.000	0.000	0.000	0.000
192	A	187	ALA	0	0.003	0.004	30.983	-0.008	-0.008	0.000	0.000	0.000	0.000
193	A	188	LEU	0	-0.003	-0.003	32.111	-0.001	-0.001	0.000	0.000	0.000	0.000
194	A	189	GLN	0	-0.016	0.003	26.679	-0.008	-0.008	0.000	0.000	0.000	0.000
195	A	190	TYR	0	-0.007	-0.007	27.796	-0.008	-0.008	0.000	0.000	0.000	0.000
196	A	191	ARG	1	0.913	0.948	30.082	0.087	0.087	0.000	0.000	0.000	0.000
197	A	192	LYS	1	0.965	1.002	25.683	0.150	0.150	0.000	0.000	0.000	0.000
198	A	193	GLN	0	-0.020	-0.010	23.962	0.006	0.006	0.000	0.000	0.000	0.000
199	A	194	MET	0	0.013	0.004	28.761	0.006	0.006	0.000	0.000	0.000	0.000
200	A	195	ALA	0	0.019	0.005	31.842	0.006	0.006	0.000	0.000	0.000	0.000
201	A	196	MET	0	-0.005	0.004	29.066	0.006	0.006	0.000	0.000	0.000	0.000
202	A	197	MET	0	-0.060	-0.030	27.177	0.002	0.002	0.000	0.000	0.000	0.000
203	A	198	GLU	-1	-0.948	-0.979	31.221	-0.073	-0.073	0.000	0.000	0.000	0.000
204	A	199	PRO	0	-0.028	-0.011	33.910	0.005	0.005	0.000	0.000	0.000	0.000
205	A	200	MET	0	0.021	-0.008	33.085	0.006	0.006	0.000	0.000	0.000	0.000
206	A	201	ILE	0	-0.011	0.012	32.703	0.004	0.004	0.000	0.000	0.000	0.000
207	A	202	GLY	0	0.033	0.016	35.952	0.004	0.004	0.000	0.000	0.000	0.000
208	A	203	PHE	0	0.015	0.002	37.162	0.004	0.004	0.000	0.000	0.000	0.000
209	A	204	ALA	0	-0.003	0.000	36.401	0.004	0.004	0.000	0.000	0.000	0.000
210	A	205	HIS	0	0.006	-0.005	37.891	0.004	0.004	0.000	0.000	0.000	0.000
211	A	206	GLY	0	0.023	0.021	40.926	0.003	0.003	0.000	0.000	0.000	0.000
212	A	207	GLN	0	0.020	-0.011	40.861	0.004	0.004	0.000	0.000	0.000	0.000
213	A	208	ILE	0	-0.009	0.013	38.524	0.002	0.002	0.000	0.000	0.000	0.000
214	A	209	ASN	0	-0.029	-0.027	42.818	0.003	0.003	0.000	0.000	0.000	0.000
215	A	210	PHE	0	-0.025	0.005	45.828	0.002	0.002	0.000	0.000	0.000	0.000
216	A	211	PHE	0	0.019	0.002	44.381	0.002	0.002	0.000	0.000	0.000	0.000
217	A	212	LYS	1	0.832	0.924	45.784	0.026	0.026	0.000	0.000	0.000	0.000
218	A	213	LYS	1	0.952	0.967	47.506	0.027	0.027	0.000	0.000	0.000	0.000
219	A	214	GLY	0	0.061	0.023	49.874	0.001	0.001	0.000	0.000	0.000	0.000
220	A	215	ALA	0	-0.040	-0.019	48.510	0.001	0.001	0.000	0.000	0.000	0.000
221	A	216	GLU	-1	-0.945	-0.961	50.623	-0.019	-0.019	0.000	0.000	0.000	0.000
222	A	217	MET	0	-0.038	0.007	53.369	0.001	0.001	0.000	0.000	0.000	0.000
223	A	218	PHE	0	0.009	0.001	53.465	0.001	0.001	0.000	0.000	0.000	0.000
224	A	219	SER	0	0.017	0.021	54.165	0.001	0.001	0.000	0.000	0.000	0.000
225	A	220	LYS	1	1.003	0.961	51.968	0.010	0.010	0.000	0.000	0.000	0.000
226	A	221	ARG	1	0.961	0.997	57.397	0.011	0.011	0.000	0.000	0.000	0.000
227	A	222	MET	0	0.007	0.010	58.678	0.000	0.000	0.000	0.000	0.000	0.000
228	A	223	ASP	-1	-0.916	-0.959	56.589	-0.007	-0.007	0.000	0.000	0.000	0.000
229	A	224	SER	0	-0.034	-0.017	59.497	0.001	0.001	0.000	0.000	0.000	0.000
230	A	225	PHE	0	0.009	0.004	62.519	0.000	0.000	0.000	0.000	0.000	0.000
231	A	226	LEU	0	0.026	0.004	59.393	0.000	0.000	0.000	0.000	0.000	0.000
232	A	227	SER	0	-0.008	0.009	62.990	0.001	0.001	0.000	0.000	0.000	0.000
233	A	228	SER	0	-0.035	-0.009	64.414	0.000	0.000	0.000	0.000	0.000	0.000
234	A	229	VAL	0	-0.002	-0.007	66.101	0.000	0.000	0.000	0.000	0.000	0.000
235	A	230	ALA	0	-0.006	-0.003	64.452	0.000	0.000	0.000	0.000	0.000	0.000
236	A	231	ASP	-1	-0.906	-0.958	66.582	-0.003	-0.003	0.000	0.000	0.000	0.000
237	A	232	MET	0	-0.039	-0.019	69.499	0.000	0.000	0.000	0.000	0.000	0.000
238	A	233	VAL	0	0.004	0.013	67.867	0.000	0.000	0.000	0.000	0.000	0.000
239	A	234	GLN	0	0.022	0.014	69.521	0.000	0.000	0.000	0.000	0.000	0.000
240	A	235	SER	0	-0.087	-0.061	71.204	0.000	0.000	0.000	0.000	0.000	0.000
241	A	236	ILE	0	0.065	0.042	73.298	0.000	0.000	0.000	0.000	0.000	0.000
242	A	237	GLN	0	-0.041	-0.022	70.649	0.000	0.000	0.000	0.000	0.000	0.000
243	A	238	VAL	0	-0.003	-0.006	73.851	0.000	0.000	0.000	0.000	0.000	0.000
244	A	239	GLU	-1	-0.932	-0.967	76.247	-0.002	-0.002	0.000	0.000	0.000	0.000
245	A	240	LEU	0	-0.052	-0.011	74.986	0.000	0.000	0.000	0.000	0.000	0.000
246	A	241	GLU	-1	-0.912	-0.976	73.466	0.000	0.000	0.000	0.000	0.000	0.000
247	A	242	ALA	0	-0.038	-0.005	78.100	0.000	0.000	0.000	0.000	0.000	0.000
248	A	243	GLU	-1	-0.888	-0.958	81.407	-0.001	-0.001	0.000	0.000	0.000	0.000
249	A	244	ALA	0	-0.026	-0.011	79.697	0.000	0.000	0.000	0.000	0.000	0.000
250	A	245	GLU	-1	-0.845	-0.918	81.634	0.001	0.001	0.000	0.000	0.000	0.000
251	A	246	LYS	1	0.900	0.957	82.973	0.001	0.001	0.000	0.000	0.000	0.000
252	A	247	MET	0	-0.029	-0.019	84.592	0.000	0.000	0.000	0.000	0.000	0.000
253	A	248	ARG	1	0.881	0.942	82.335	-0.001	-0.001	0.000	0.000	0.000	0.000
254	A	249	VAL	0	-0.017	0.001	85.616	0.000	0.000	0.000	0.000	0.000	0.000
255	A	250	SER	0	0.017	-0.002	88.447	0.000	0.000	0.000	0.000	0.000	0.000
256	A	251	GLN	0	-0.043	-0.017	86.254	0.000	0.000	0.000	0.000	0.000	0.000
257	A	252	GLN	0	-0.017	-0.015	89.005	0.000	0.000	0.000	0.000	0.000	0.000
258	A	253	GLU	-1	-0.943	-0.970	90.638	0.000	0.000	0.000	0.000	0.000	0.000
259	A	254	LEU	0	-0.054	-0.017	92.584	0.000	0.000	0.000	0.000	0.000	0.000
260	A	255	LEU	0	-0.053	-0.024	90.366	0.000	0.000	0.000	0.000	0.000	0.000
261	A	256	SER	0	-0.111	-0.057	94.610	0.000	0.000	0.000	0.000	0.000	0.000
262	A	257	VAL	0	-0.017	-0.006	96.345	0.000	0.000	0.000	0.000	0.000	0.000
263	A	258	ASP	-1	-0.861	-0.927	98.923	0.001	0.001	0.000	0.000	0.000	0.000
264	A	259	GLU	-1	-0.954	-0.999	100.750	0.001	0.001	0.000	0.000	0.000	0.000
265	A	260	SER	0	-0.021	-0.007	102.234	0.000	0.000	0.000	0.000	0.000	0.000
266	A	261	VAL	0	-0.030	-0.008	102.365	0.000	0.000	0.000	0.000	0.000	0.000
267	A	262	TYR	0	-0.033	-0.021	96.538	0.000	0.000	0.000	0.000	0.000	0.000
268	A	263	THR	0	-0.046	0.002	102.622	0.000	0.000	0.000	0.000	0.000	0.000
269	A	264	PRO	0	-0.018	-0.025	105.720	0.000	0.000	0.000	0.000	0.000	0.000
270	A	265	ASP	-1	-0.996	-1.018	108.515	0.000	0.000	0.000	0.000	0.000	0.000
271	A	266	SER	0	0.001	0.024	108.951	0.000	0.000	0.000	0.000	0.000	0.000
272	A	267	ASP	-1	-0.915	-0.941	111.372	0.000	0.000	0.000	0.000	0.000	0.000
273	A	268	VAL	0	-0.055	-0.042	115.037	0.000	0.000	0.000	0.000	0.000	0.000
274	A	269	ALA	0	-0.045	-0.033	117.646	0.000	0.000	0.000	0.000	0.000	0.000
275	A	270	ALA	0	0.037	0.025	116.987	0.000	0.000	0.000	0.000	0.000	0.000
276	A	271	PRO	0	0.031	0.043	115.985	0.000	0.000	0.000	0.000	0.000	0.000
277	A	272	GLN	0	-0.030	-0.045	113.601	0.000	0.000	0.000	0.000	0.000	0.000
278	A	273	ILE	0	-0.029	-0.011	115.010	0.000	0.000	0.000	0.000	0.000	0.000
279	A	274	ASN	0	0.004	0.003	114.633	0.000	0.000	0.000	0.000	0.000	0.000
280	A	275	ARG	1	0.964	0.963	117.349	0.000	0.000	0.000	0.000	0.000	0.000
281	A	276	ASN	0	-0.030	-0.013	119.240	0.000	0.000	0.000	0.000	0.000	0.000
282	A	277	LEU	0	0.004	0.020	114.137	0.000	0.000	0.000	0.000	0.000	0.000
283	A	278	ILE	0	0.033	-0.008	115.898	0.000	0.000	0.000	0.000	0.000	0.000
284	A	279	GLN	0	0.012	0.014	107.777	0.000	0.000	0.000	0.000	0.000	0.000
285	A	280	LYS	1	0.897	0.958	111.205	0.001	0.001	0.000	0.000	0.000	0.000
286	A	281	ALA	0	0.041	0.020	107.736	0.000	0.000	0.000	0.000	0.000	0.000
287	A	282	GLY	0	0.011	0.018	106.753	0.000	0.000	0.000	0.000	0.000	0.000
288	A	283	TYR	0	-0.039	-0.008	100.330	0.000	0.000	0.000	0.000	0.000	0.000
289	A	284	LEU	0	-0.024	-0.002	107.028	0.000	0.000	0.000	0.000	0.000	0.000
290	A	285	ASN	0	-0.033	-0.023	108.682	0.000	0.000	0.000	0.000	0.000	0.000
291	A	286	LEU	0	0.019	0.010	110.521	0.000	0.000	0.000	0.000	0.000	0.000
292	A	287	ARG	1	0.862	0.950	112.271	0.002	0.002	0.000	0.000	0.000	0.000
293	A	288	ASN	0	0.018	0.006	110.533	0.000	0.000	0.000	0.000	0.000	0.000
294	A	289	LYS	1	0.904	0.959	114.330	0.002	0.002	0.000	0.000	0.000	0.000
295	A	290	THR	0	-0.004	0.000	111.440	0.000	0.000	0.000	0.000	0.000	0.000
296	A	291	GLY	0	0.055	0.026	114.398	0.000	0.000	0.000	0.000	0.000	0.000
297	A	292	LEU	0	-0.029	-0.031	117.256	0.000	0.000	0.000	0.000	0.000	0.000
298	A	293	VAL	0	-0.024	-0.007	119.423	0.000	0.000	0.000	0.000	0.000	0.000
299	A	294	THR	0	0.033	0.014	114.574	0.000	0.000	0.000	0.000	0.000	0.000
300	A	295	THR	0	-0.074	-0.042	115.099	0.000	0.000	0.000	0.000	0.000	0.000
301	A	296	THR	0	-0.003	0.003	109.927	0.000	0.000	0.000	0.000	0.000	0.000
302	A	297	TRP	0	0.001	-0.028	110.632	0.000	0.000	0.000	0.000	0.000	0.000
303	A	298	GLU	-1	-0.913	-0.953	104.635	-0.003	-0.003	0.000	0.000	0.000	0.000
304	A	299	ARG	1	0.932	0.974	102.024	0.002	0.002	0.000	0.000	0.000	0.000
305	A	300	LEU	0	-0.004	-0.006	104.896	0.000	0.000	0.000	0.000	0.000	0.000
306	A	301	TYR	0	-0.017	-0.013	103.938	0.000	0.000	0.000	0.000	0.000	0.000
307	A	302	PHE	0	0.034	0.006	106.029	0.000	0.000	0.000	0.000	0.000	0.000
308	A	303	PHE	0	-0.022	-0.022	106.202	0.000	0.000	0.000	0.000	0.000	0.000
309	A	304	THR	0	0.061	0.027	109.748	0.000	0.000	0.000	0.000	0.000	0.000
310	A	305	GLN	0	-0.021	-0.020	107.258	0.000	0.000	0.000	0.000	0.000	0.000
311	A	306	GLY	0	-0.027	-0.004	112.341	0.000	0.000	0.000	0.000	0.000	0.000
312	A	307	GLY	0	0.028	0.005	114.964	0.000	0.000	0.000	0.000	0.000	0.000
313	A	308	ASN	0	0.038	0.028	114.309	0.000	0.000	0.000	0.000	0.000	0.000
314	A	309	LEU	0	0.037	0.023	112.966	0.000	0.000	0.000	0.000	0.000	0.000
315	A	310	MET	0	-0.020	0.004	109.012	0.000	0.000	0.000	0.000	0.000	0.000
316	A	311	CYS	0	-0.011	-0.016	108.726	0.000	0.000	0.000	0.000	0.000	0.000
317	A	312	GLN	0	0.036	0.019	100.659	0.000	0.000	0.000	0.000	0.000	0.000
318	A	313	PRO	0	0.076	0.030	102.430	0.000	0.000	0.000	0.000	0.000	0.000
319	A	314	ARG	1	0.968	0.972	97.667	0.002	0.002	0.000	0.000	0.000	0.000
320	A	315	GLY	0	-0.010	-0.005	96.346	0.000	0.000	0.000	0.000	0.000	0.000
321	A	316	ALA	0	-0.026	0.006	96.947	0.000	0.000	0.000	0.000	0.000	0.000
322	A	317	VAL	0	-0.009	-0.003	96.820	0.000	0.000	0.000	0.000	0.000	0.000
323	A	318	ALA	0	0.023	0.008	98.688	0.000	0.000	0.000	0.000	0.000	0.000
324	A	319	GLY	0	-0.014	-0.009	102.027	0.000	0.000	0.000	0.000	0.000	0.000
325	A	320	GLY	0	-0.017	-0.036	105.609	0.000	0.000	0.000	0.000	0.000	0.000
326	A	321	LEU	0	-0.073	-0.029	108.335	0.000	0.000	0.000	0.000	0.000	0.000
327	A	322	ILE	0	-0.013	0.006	111.951	0.000	0.000	0.000	0.000	0.000	0.000
328	A	323	GLN	0	-0.048	-0.042	114.065	0.000	0.000	0.000	0.000	0.000	0.000
329	A	324	ASP	-1	-0.838	-0.882	117.138	-0.002	-0.002	0.000	0.000	0.000	0.000
330	A	325	LEU	0	-0.090	-0.085	118.699	0.000	0.000	0.000	0.000	0.000	0.000
331	A	326	ASP	-1	-0.974	-0.969	119.946	-0.002	-0.002	0.000	0.000	0.000	0.000
332	A	327	ASN	0	0.025	0.024	123.718	0.000	0.000	0.000	0.000	0.000	0.000
333	A	328	CYS	0	-0.013	-0.012	122.956	0.000	0.000	0.000	0.000	0.000	0.000
334	A	329	SER	0	-0.028	-0.001	125.374	0.000	0.000	0.000	0.000	0.000	0.000
335	A	330	VAL	0	-0.035	-0.004	120.711	0.000	0.000	0.000	0.000	0.000	0.000
336	A	331	MET	0	-0.015	-0.004	123.794	0.000	0.000	0.000	0.000	0.000	0.000
337	A	332	ALA	0	0.046	0.009	122.536	0.000	0.000	0.000	0.000	0.000	0.000
338	A	333	VAL	0	-0.072	-0.048	122.312	0.000	0.000	0.000	0.000	0.000	0.000
339	A	334	ASP	-1	-0.852	-0.906	122.303	-0.001	-0.001	0.000	0.000	0.000	0.000
340	A	335	CYS	0	-0.081	-0.055	120.177	0.000	0.000	0.000	0.000	0.000	0.000
341	A	336	GLU	-1	-0.788	-0.911	116.835	-0.002	-0.002	0.000	0.000	0.000	0.000
342	A	337	ASP	-1	-0.922	-0.948	119.011	-0.001	-0.001	0.000	0.000	0.000	0.000
343	A	338	ARG	1	0.882	0.972	111.606	0.001	0.001	0.000	0.000	0.000	0.000
344	A	339	ARG	1	0.997	0.995	113.396	0.000	0.000	0.000	0.000	0.000	0.000
345	A	340	TYR	0	-0.004	-0.013	114.486	0.000	0.000	0.000	0.000	0.000	0.000
346	A	341	CYS	0	-0.002	0.004	116.702	0.000	0.000	0.000	0.000	0.000	0.000
347	A	342	PHE	0	0.021	0.014	115.596	0.000	0.000	0.000	0.000	0.000	0.000
348	A	343	GLN	0	-0.021	-0.009	119.342	0.000	0.000	0.000	0.000	0.000	0.000
349	A	344	ILE	0	0.022	0.017	117.815	0.000	0.000	0.000	0.000	0.000	0.000
350	A	345	THR	0	-0.028	-0.021	121.864	0.000	0.000	0.000	0.000	0.000	0.000
351	A	346	THR	0	0.023	0.014	122.851	0.000	0.000	0.000	0.000	0.000	0.000
352	A	347	PRO	0	0.097	0.046	125.089	0.000	0.000	0.000	0.000	0.000	0.000
353	A	348	ASN	0	-0.068	-0.041	127.957	0.000	0.000	0.000	0.000	0.000	0.000
354	A	349	GLY	0	0.045	0.040	129.217	0.000	0.000	0.000	0.000	0.000	0.000
355	A	350	LYS	1	0.877	0.921	128.919	0.002	0.002	0.000	0.000	0.000	0.000
356	A	351	SER	0	-0.041	-0.031	124.566	0.000	0.000	0.000	0.000	0.000	0.000
357	A	352	GLY	0	0.066	0.057	122.710	0.000	0.000	0.000	0.000	0.000	0.000
358	A	353	ILE	0	-0.003	0.014	115.858	0.000	0.000	0.000	0.000	0.000	0.000
359	A	354	ILE	0	-0.018	-0.025	118.111	0.000	0.000	0.000	0.000	0.000	0.000
360	A	355	LEU	0	0.019	0.013	113.271	0.000	0.000	0.000	0.000	0.000	0.000
361	A	356	GLN	0	0.019	0.006	112.959	0.000	0.000	0.000	0.000	0.000	0.000
362	A	357	ALA	0	0.006	0.006	112.398	0.000	0.000	0.000	0.000	0.000	0.000
363	A	358	GLU	-1	-0.909	-0.974	107.034	-0.001	-0.001	0.000	0.000	0.000	0.000
364	A	359	SER	0	0.118	0.037	111.099	0.000	0.000	0.000	0.000	0.000	0.000
365	A	360	ARG	1	0.914	0.987	113.038	0.000	0.000	0.000	0.000	0.000	0.000
366	A	361	LYS	1	0.999	0.985	110.569	0.000	0.000	0.000	0.000	0.000	0.000
367	A	362	GLU	-1	-0.884	-0.945	110.405	-0.001	-0.001	0.000	0.000	0.000	0.000
368	A	363	ASN	0	-0.063	-0.030	113.952	0.000	0.000	0.000	0.000	0.000	0.000
369	A	364	GLU	-1	-0.891	-0.957	116.890	-0.001	-0.001	0.000	0.000	0.000	0.000
370	A	365	GLU	-1	-0.876	-0.943	113.591	-0.001	-0.001	0.000	0.000	0.000	0.000
371	A	366	TRP	0	0.001	-0.005	110.854	0.000	0.000	0.000	0.000	0.000	0.000
372	A	367	ILE	0	-0.013	0.002	116.717	0.000	0.000	0.000	0.000	0.000	0.000
373	A	368	CYS	0	-0.057	-0.035	120.348	0.000	0.000	0.000	0.000	0.000	0.000
374	A	369	ALA	0	0.031	0.035	116.940	0.000	0.000	0.000	0.000	0.000	0.000
375	A	370	ILE	0	0.050	0.018	117.492	0.000	0.000	0.000	0.000	0.000	0.000
376	A	371	ASN	0	-0.008	-0.010	119.979	0.000	0.000	0.000	0.000	0.000	0.000
377	A	372	ASN	0	-0.061	-0.032	120.527	0.000	0.000	0.000	0.000	0.000	0.000
378	A	373	ILE	0	-0.034	-0.008	117.157	0.000	0.000	0.000	0.000	0.000	0.000
379	A	374	SER	0	-0.042	-0.022	120.940	0.000	0.000	0.000	0.000	0.000	0.000
380	A	375	ARG	1	0.879	0.950	123.999	0.001	0.001	0.000	0.000	0.000	0.000
381	A	376	GLN	0	0.001	0.005	120.466	0.000	0.000	0.000	0.000	0.000	0.000
382	A	377	ILE	0	-0.010	0.010	123.782	0.000	0.000	0.000	0.000	0.000	0.000

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Interactive mode: IFIE and PIEDA for fragment #1(A:-4:TYR)