FMO DATABASE

FMODB ID: LZY39

Calculation Name: 6XKI-A-MD433-100ns

Preferred Name:

Target Type:

Ligand Name: (3s,6z,8e,11s,15r)-15-amino-3-[(1e,3e,5e)-7-(dimethylamino)-2,5-dimethylhepta-1,3,5-trien-1-yl]-9,11-dimethyl-4,12-dioxa-20-thia-21-azabicyclo[16.2.1]henicosa-1(21),6,8,18-tetraene-5,13-dione

ligand 3-letter code: V6D

PDB ID: 6XKI

Chain ID: A

ChEMBL ID:

UniProt ID:

Base Structure: MD

Registration Date: 2023-09-19

Reference: Hironori Saito, Yuma Handa, Mingming Chen, Tilman Schneider-Poetsch, Yuichi Shichino, Mari Takahashi, Daniel Romo, Minoru Yoshida, Alois F�rstner, Takuhiro Ito, Kaori Fukuzawa, Shintaro Iwasaki Pateamine A mediates RNA sequence-selective translation repression by anchoring eIF4A and DDX3 to GNG motifs, To be published.

DOI:

IFIE MAP

IFIE Diagram

Modeling method

Optimization	AMBER14SB
Restraint	OptAll(Heavy atoms were optimized with constraints.)
Protonation	BaseStructure_original
Complement	MOE:Structure Preparation
Water	No
Procedure	Manual calculation

FMO calculation

FMO method	FMO2-MP2/6-31G(d)
Fragmentation	Manual
Number of fragment	400
LigandCharge
Software	ABINIT-MP - Open Ver. 1 Rev. 23Q2 / 20200603(SMP)

Total energy (hartree)

FMO2-HF: Electronic energy	-7607387.20221
FMO2-HF: Nuclear repulsion	7438182.83269
FMO2-HF: Total energy	-169204.36952
FMO2-MP2: Total energy	-169682.081636

3D Structure

Snapshot

Ligand structure

V6D

Ligand Interaction

Ligand binding energy (frag 399-400 : frag 1-398)

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.
-281.206417	-234.581350	41.132489	-17.857850	-69.899706	0.061720

Interactive mode: IFIE and PIEDA for fragment #399(:389:V6D)

Summations of interaction energy for fragment #399(:389:V6D)

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.
-44.122	-12.894	28.612	-12.677	-47.166	-0.04

Interaction energy analysis for fragmet #399(:389:V6D)

Snapshot

IFIE Diagram

Base fragment(s) of PIEDA/IFIE

Single fragment	Multi fragments
	Fragment list

Charge [e] FCHARGE : 0 / q_Mulliken : -0.080 / q_NPA : -0.024

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.	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].
131	131	PRO	0	0.013	-0.002	3.827	-0.608	-0.070	0.020	-0.105	-0.453	0.000
132	132	GLY	0	0.059	0.030	2.329	-2.997	-0.135	3.204	-2.864	-3.202	0.000
133	133	ARG	1	0.852	0.899	2.564	-1.077	-0.771	0.985	1.051	-2.342	-0.019
134	134	VAL	0	-0.013	-0.007	5.063	-0.464	-0.324	-0.001	-0.009	-0.129	0.000
135	135	PHE	0	0.063	0.019	2.451	-12.376	-4.558	7.229	-3.723	-11.323	0.006
136	136	ASP	-1	-0.891	-0.902	2.354	-7.367	-4.462	1.415	-1.739	-2.582	-0.001
137	137	MET	0	-0.019	-0.018	3.070	1.177	0.834	0.054	0.737	-0.449	0.000
139	139	ASN	0	-0.098	-0.065	2.753	-0.234	0.987	0.954	-0.555	-1.620	-0.004
140	140	ARG	1	0.904	0.964	4.738	1.466	1.546	-0.001	-0.011	-0.067	0.000
167	167	GLN	0	-0.029	-0.020	2.610	-5.753	-2.760	4.681	-2.079	-5.595	0.005
168	168	ILE	0	0.002	-0.006	3.818	-1.939	-2.151	0.041	1.093	-0.923	-0.004
170	170	ASP	-1	-0.865	-0.942	2.582	-3.026	-0.741	0.439	-1.039	-1.685	-0.008
171	171	ILE	0	-0.075	-0.027	3.979	-0.284	0.341	0.010	-0.070	-0.565	0.000
391	385	G	0	-0.341	-0.297	2.090	-2.077	-1.131	1.212	-0.597	-1.561	-0.005
392	385	G	-1	-0.451	-0.584	3.055	-2.151	-1.141	0.035	-0.311	-0.735	-0.001
393	386	A	0	-0.353	-0.298	2.804	-7.920	-0.834	7.206	-1.744	-12.549	-0.012
394	386	A	-1	-0.559	-0.675	2.405	-1.203	-0.235	1.129	-0.712	-1.386	0.003
1	1	GLU	0	-0.103	-0.068	34.116	0.001	0.001	0.000	0.000	0.000	0.000
2	2	ILE	0	0.011	0.006	35.121	-0.001	-0.001	0.000	0.000	0.000	0.000
3	3	VAL	0	0.027	0.019	35.828	0.001	0.001	0.000	0.000	0.000	0.000
4	4	ASP	-1	-0.880	-0.940	37.206	-0.015	-0.015	0.000	0.000	0.000	0.000
5	5	SER	0	-0.030	-0.019	38.945	-0.003	-0.003	0.000	0.000	0.000	0.000
6	6	PHE	0	0.029	-0.012	32.654	0.001	0.001	0.000	0.000	0.000	0.000
7	7	ASP	-1	-0.932	-0.964	36.651	-0.031	-0.031	0.000	0.000	0.000	0.000
8	8	ASP	-1	-0.863	-0.927	39.423	-0.019	-0.019	0.000	0.000	0.000	0.000
9	9	MET	0	-0.165	-0.071	33.170	0.000	0.000	0.000	0.000	0.000	0.000
10	10	ASN	0	-0.042	-0.020	34.700	-0.001	-0.001	0.000	0.000	0.000	0.000
11	11	LEU	0	-0.047	-0.017	31.493	-0.003	-0.003	0.000	0.000	0.000	0.000
12	12	SER	0	0.057	0.033	32.991	0.001	0.001	0.000	0.000	0.000	0.000
13	13	GLU	-1	-0.868	-0.938	34.903	-0.048	-0.048	0.000	0.000	0.000	0.000
14	14	SER	0	-0.023	-0.028	34.131	-0.001	-0.001	0.000	0.000	0.000	0.000
15	15	LEU	0	0.012	0.014	28.938	-0.005	-0.005	0.000	0.000	0.000	0.000
16	16	LEU	0	-0.009	-0.006	32.237	-0.001	-0.001	0.000	0.000	0.000	0.000
17	17	ARG	1	0.881	0.936	35.072	0.052	0.052	0.000	0.000	0.000	0.000
18	18	GLY	0	0.087	0.057	31.692	-0.001	-0.001	0.000	0.000	0.000	0.000
19	19	ILE	0	-0.040	-0.020	31.106	-0.002	-0.002	0.000	0.000	0.000	0.000
20	20	TYR	0	-0.002	-0.017	32.815	0.002	0.002	0.000	0.000	0.000	0.000
21	21	ALA	0	-0.019	0.012	33.150	0.001	0.001	0.000	0.000	0.000	0.000
22	22	TYR	0	-0.072	-0.046	28.509	-0.002	-0.002	0.000	0.000	0.000	0.000
23	23	GLY	0	0.003	0.004	31.680	0.001	0.001	0.000	0.000	0.000	0.000
24	24	PHE	0	-0.049	-0.019	31.675	0.004	0.004	0.000	0.000	0.000	0.000
25	25	GLU	-1	-0.903	-0.948	36.184	-0.036	-0.036	0.000	0.000	0.000	0.000
26	26	LYS	1	0.901	0.943	37.939	0.026	0.026	0.000	0.000	0.000	0.000
27	27	PRO	0	0.021	0.033	34.071	-0.002	-0.002	0.000	0.000	0.000	0.000
28	28	SER	0	0.008	-0.018	31.019	0.004	0.004	0.000	0.000	0.000	0.000
29	29	ALA	0	0.037	0.007	33.984	0.001	0.001	0.000	0.000	0.000	0.000
30	30	ILE	0	0.020	0.014	27.761	0.003	0.003	0.000	0.000	0.000	0.000
31	31	GLN	0	0.028	0.014	28.932	0.003	0.003	0.000	0.000	0.000	0.000
32	32	GLN	0	0.001	-0.014	30.934	0.003	0.003	0.000	0.000	0.000	0.000
33	33	ARG	1	0.889	0.940	32.086	0.006	0.006	0.000	0.000	0.000	0.000
34	34	ALA	0	0.002	0.003	27.101	0.003	0.003	0.000	0.000	0.000	0.000
35	35	ILE	0	0.034	0.023	27.485	0.001	0.001	0.000	0.000	0.000	0.000
36	36	LEU	0	0.034	0.022	28.449	-0.001	-0.001	0.000	0.000	0.000	0.000
37	37	PRO	0	-0.041	-0.020	27.489	0.000	0.000	0.000	0.000	0.000	0.000
38	38	CYS	0	0.000	0.007	24.186	0.003	0.003	0.000	0.000	0.000	0.000
39	39	ILE	0	0.043	0.028	24.960	-0.003	-0.003	0.000	0.000	0.000	0.000
40	40	LYS	1	0.868	0.926	27.222	0.013	0.013	0.000	0.000	0.000	0.000
41	41	GLY	0	0.042	0.030	24.206	0.005	0.005	0.000	0.000	0.000	0.000
42	42	TYR	0	-0.031	-0.004	23.820	0.005	0.005	0.000	0.000	0.000	0.000
43	43	ASP	-1	-0.712	-0.820	19.870	0.035	0.035	0.000	0.000	0.000	0.000
44	44	VAL	0	-0.039	-0.026	21.244	0.003	0.003	0.000	0.000	0.000	0.000
45	45	ILE	0	-0.009	-0.007	20.436	0.002	0.002	0.000	0.000	0.000	0.000
46	46	ALA	0	-0.010	-0.014	22.340	-0.002	-0.002	0.000	0.000	0.000	0.000
47	47	GLN	0	0.010	0.007	22.994	0.003	0.003	0.000	0.000	0.000	0.000
48	48	ALA	0	-0.027	-0.022	24.533	-0.003	-0.003	0.000	0.000	0.000	0.000
49	49	GLN	0	0.068	0.036	25.172	-0.005	-0.005	0.000	0.000	0.000	0.000
50	50	SER	0	0.017	0.001	27.135	-0.005	-0.005	0.000	0.000	0.000	0.000
51	51	GLY	0	0.014	0.024	28.290	-0.004	-0.004	0.000	0.000	0.000	0.000
52	52	THR	0	-0.079	-0.050	28.122	0.000	0.000	0.000	0.000	0.000	0.000
53	53	GLY	0	0.088	0.063	28.026	0.001	0.001	0.000	0.000	0.000	0.000
54	54	LYS	1	0.812	0.871	19.961	0.050	0.050	0.000	0.000	0.000	0.000
55	55	THR	0	0.012	-0.004	21.500	0.001	0.001	0.000	0.000	0.000	0.000
56	56	ALA	0	0.050	0.023	23.357	-0.004	-0.004	0.000	0.000	0.000	0.000
57	57	THR	0	-0.041	-0.018	24.617	0.003	0.003	0.000	0.000	0.000	0.000
58	58	PHE	0	0.055	0.027	19.163	0.004	0.004	0.000	0.000	0.000	0.000
59	59	ALA	0	0.010	0.012	22.397	-0.004	-0.004	0.000	0.000	0.000	0.000
60	60	ILE	0	0.019	0.001	23.346	-0.003	-0.003	0.000	0.000	0.000	0.000
61	61	SER	0	-0.010	-0.026	23.968	0.002	0.002	0.000	0.000	0.000	0.000
62	62	ILE	0	-0.018	0.009	19.033	0.003	0.003	0.000	0.000	0.000	0.000
63	63	LEU	0	0.005	-0.009	23.156	0.000	0.000	0.000	0.000	0.000	0.000
64	64	GLN	0	0.044	0.029	25.845	-0.004	-0.004	0.000	0.000	0.000	0.000
65	65	GLN	0	-0.070	-0.029	24.293	0.006	0.006	0.000	0.000	0.000	0.000
66	66	ILE	0	-0.036	-0.011	22.030	-0.004	-0.004	0.000	0.000	0.000	0.000
67	67	GLU	-1	-0.906	-0.950	25.365	-0.069	-0.069	0.000	0.000	0.000	0.000
68	68	LEU	0	0.004	-0.013	25.844	-0.011	-0.011	0.000	0.000	0.000	0.000
69	69	ASP	-1	-0.865	-0.917	27.071	-0.097	-0.097	0.000	0.000	0.000	0.000
70	70	LEU	0	-0.115	-0.046	21.860	-0.007	-0.007	0.000	0.000	0.000	0.000
71	71	LYS	1	0.933	0.976	21.996	0.174	0.174	0.000	0.000	0.000	0.000
72	72	ALA	0	-0.024	-0.037	18.280	-0.019	-0.019	0.000	0.000	0.000	0.000
73	73	THR	0	-0.027	-0.018	14.974	0.000	0.000	0.000	0.000	0.000	0.000
74	74	GLN	0	-0.034	-0.026	17.189	0.016	0.016	0.000	0.000	0.000	0.000
75	75	ALA	0	-0.023	-0.008	17.398	0.024	0.024	0.000	0.000	0.000	0.000
76	76	LEU	0	-0.006	0.001	9.932	-0.033	-0.033	0.000	0.000	0.000	0.000
77	77	VAL	0	-0.014	-0.001	14.227	0.035	0.035	0.000	0.000	0.000	0.000
78	78	LEU	0	-0.005	-0.004	8.099	-0.030	-0.030	0.000	0.000	0.000	0.000
79	79	ALA	0	0.030	0.003	10.701	0.024	0.024	0.000	0.000	0.000	0.000
80	80	PRO	0	0.038	0.022	9.546	-0.038	-0.038	0.000	0.000	0.000	0.000
81	81	THR	0	0.025	0.027	9.603	-0.093	-0.093	0.000	0.000	0.000	0.000
82	82	ARG	1	0.854	0.902	8.392	0.818	0.818	0.000	0.000	0.000	0.000
83	83	GLU	-1	-0.762	-0.853	12.272	-0.290	-0.290	0.000	0.000	0.000	0.000
84	84	LEU	0	-0.022	-0.007	14.983	0.024	0.024	0.000	0.000	0.000	0.000
85	85	ALA	0	0.016	0.008	12.900	0.019	0.019	0.000	0.000	0.000	0.000
86	86	GLN	0	0.013	0.008	15.042	0.023	0.023	0.000	0.000	0.000	0.000
87	87	GLN	0	-0.005	0.013	17.766	0.014	0.014	0.000	0.000	0.000	0.000
88	88	ILE	0	-0.002	-0.011	16.446	0.012	0.012	0.000	0.000	0.000	0.000
89	89	GLN	0	0.050	0.022	18.329	0.006	0.006	0.000	0.000	0.000	0.000
90	90	LYS	1	0.938	0.970	20.040	0.127	0.127	0.000	0.000	0.000	0.000
91	91	VAL	0	-0.001	0.003	23.038	0.009	0.009	0.000	0.000	0.000	0.000
92	92	VAL	0	0.009	-0.005	20.200	0.009	0.009	0.000	0.000	0.000	0.000
93	93	MET	0	-0.008	0.000	22.585	0.004	0.004	0.000	0.000	0.000	0.000
94	94	ALA	0	-0.014	0.016	25.172	0.006	0.006	0.000	0.000	0.000	0.000
95	95	LEU	0	-0.046	-0.028	26.531	0.007	0.007	0.000	0.000	0.000	0.000
96	96	GLY	0	0.013	-0.005	26.715	0.006	0.006	0.000	0.000	0.000	0.000
97	97	ASP	-1	-0.955	-0.969	27.752	-0.102	-0.102	0.000	0.000	0.000	0.000
98	98	TYR	0	-0.011	-0.009	30.023	0.002	0.002	0.000	0.000	0.000	0.000
99	99	MET	0	-0.041	-0.022	28.894	0.002	0.002	0.000	0.000	0.000	0.000
100	100	GLY	0	0.037	0.032	28.917	-0.001	-0.001	0.000	0.000	0.000	0.000
101	101	ALA	0	-0.046	-0.014	24.844	-0.008	-0.008	0.000	0.000	0.000	0.000
102	102	SER	0	-0.018	-0.003	22.390	-0.009	-0.009	0.000	0.000	0.000	0.000
103	103	CYS	0	-0.032	-0.039	19.179	-0.004	-0.004	0.000	0.000	0.000	0.000
104	104	HIS	0	-0.028	-0.029	13.953	0.042	0.042	0.000	0.000	0.000	0.000
105	105	ALA	0	0.034	0.021	15.198	-0.002	-0.002	0.000	0.000	0.000	0.000
106	106	CYS	0	-0.022	-0.003	9.142	-0.056	-0.056	0.000	0.000	0.000	0.000
107	107	ILE	0	-0.025	-0.009	10.021	-0.014	-0.014	0.000	0.000	0.000	0.000
108	108	GLY	0	0.030	0.019	8.282	-0.015	-0.015	0.000	0.000	0.000	0.000
109	109	GLY	0	0.009	-0.006	8.838	0.078	0.078	0.000	0.000	0.000	0.000
110	110	THR	0	-0.012	0.003	11.411	0.054	0.054	0.000	0.000	0.000	0.000
111	111	ASN	0	0.014	-0.006	11.780	-0.070	-0.070	0.000	0.000	0.000	0.000
112	112	VAL	0	0.108	0.046	8.586	0.021	0.021	0.000	0.000	0.000	0.000
113	113	ARG	1	0.832	0.899	11.811	0.392	0.392	0.000	0.000	0.000	0.000
114	114	ALA	0	-0.043	-0.023	14.643	0.026	0.026	0.000	0.000	0.000	0.000
115	115	GLU	-1	-0.827	-0.882	11.568	-0.482	-0.482	0.000	0.000	0.000	0.000
116	116	VAL	0	-0.009	-0.017	9.945	0.024	0.024	0.000	0.000	0.000	0.000
117	117	GLN	0	-0.004	-0.003	13.108	0.043	0.043	0.000	0.000	0.000	0.000
118	118	LYS	1	0.955	0.987	16.568	0.279	0.279	0.000	0.000	0.000	0.000
119	119	LEU	0	0.030	0.013	11.626	0.022	0.022	0.000	0.000	0.000	0.000
120	120	GLN	0	-0.072	-0.024	14.994	-0.010	-0.010	0.000	0.000	0.000	0.000
121	121	MET	0	-0.062	-0.024	16.205	0.035	0.035	0.000	0.000	0.000	0.000
122	122	GLU	-1	-0.943	-0.988	19.459	-0.186	-0.186	0.000	0.000	0.000	0.000
123	123	ALA	0	-0.034	-0.010	17.676	0.020	0.020	0.000	0.000	0.000	0.000
124	124	PRO	0	0.024	0.014	16.785	0.021	0.021	0.000	0.000	0.000	0.000
125	125	HIS	0	0.070	0.057	18.304	-0.026	-0.026	0.000	0.000	0.000	0.000
126	126	ILE	0	-0.027	-0.010	18.098	0.009	0.009	0.000	0.000	0.000	0.000
127	127	ILE	0	0.009	-0.003	12.359	-0.026	-0.026	0.000	0.000	0.000	0.000
128	128	VAL	0	0.006	0.011	14.276	0.028	0.028	0.000	0.000	0.000	0.000
129	129	GLY	0	0.013	-0.001	10.840	-0.043	-0.043	0.000	0.000	0.000	0.000
130	130	THR	0	-0.004	-0.011	6.946	0.104	0.104	0.000	0.000	0.000	0.000
138	138	LEU	0	-0.008	0.001	6.101	0.191	0.191	0.000	0.000	0.000	0.000
141	141	ARG	1	0.881	0.944	6.894	0.650	0.650	0.000	0.000	0.000	0.000
142	142	TYR	0	0.019	-0.001	8.818	0.087	0.087	0.000	0.000	0.000	0.000
143	143	LEU	0	0.049	0.056	9.154	0.080	0.080	0.000	0.000	0.000	0.000
144	144	SER	0	-0.006	-0.024	10.650	-0.049	-0.049	0.000	0.000	0.000	0.000
145	145	PRO	0	0.046	0.011	10.969	0.028	0.028	0.000	0.000	0.000	0.000
146	146	LYS	1	0.878	0.946	13.728	0.147	0.147	0.000	0.000	0.000	0.000
147	147	TYR	0	0.017	0.004	16.751	0.014	0.014	0.000	0.000	0.000	0.000
148	148	ILE	0	-0.018	0.016	13.168	0.003	0.003	0.000	0.000	0.000	0.000
149	149	LYS	1	0.894	0.948	17.263	0.090	0.090	0.000	0.000	0.000	0.000
150	150	MET	0	-0.025	-0.007	17.948	0.014	0.014	0.000	0.000	0.000	0.000
151	151	PHE	0	0.006	-0.006	9.119	-0.030	-0.030	0.000	0.000	0.000	0.000
152	152	VAL	0	0.000	-0.002	14.728	0.026	0.026	0.000	0.000	0.000	0.000
153	153	LEU	0	0.012	0.004	11.649	-0.009	-0.009	0.000	0.000	0.000	0.000
154	154	ASP	-1	-0.805	-0.896	14.187	-0.047	-0.047	0.000	0.000	0.000	0.000
155	155	GLU	-1	-0.798	-0.892	15.005	-0.043	-0.043	0.000	0.000	0.000	0.000
156	156	ALA	0	0.012	-0.003	14.067	0.014	0.014	0.000	0.000	0.000	0.000
157	157	ASP	-1	-0.770	-0.830	14.251	0.072	0.072	0.000	0.000	0.000	0.000
158	158	GLU	-1	-0.892	-0.928	12.623	0.035	0.035	0.000	0.000	0.000	0.000
159	159	MET	0	-0.058	-0.013	9.388	0.026	0.026	0.000	0.000	0.000	0.000
160	160	LEU	0	-0.040	-0.023	10.087	0.132	0.132	0.000	0.000	0.000	0.000
161	161	SER	0	0.019	0.004	11.715	0.002	0.002	0.000	0.000	0.000	0.000
162	162	ARG	1	0.782	0.857	11.466	-0.155	-0.155	0.000	0.000	0.000	0.000
163	163	GLY	0	0.101	0.050	9.352	0.021	0.021	0.000	0.000	0.000	0.000
164	164	PHE	0	-0.008	-0.001	5.293	0.223	0.223	0.000	0.000	0.000	0.000
165	165	LYS	1	0.906	0.960	7.022	0.038	0.038	0.000	0.000	0.000	0.000
166	166	ASP	-1	-0.864	-0.926	5.343	0.741	0.741	0.000	0.000	0.000	0.000
169	169	TYR	0	-0.011	-0.001	6.603	-0.320	-0.320	0.000	0.000	0.000	0.000
172	172	PHE	0	-0.047	-0.025	5.618	0.206	0.206	0.000	0.000	0.000	0.000
173	173	GLN	0	0.027	0.021	7.730	0.061	0.061	0.000	0.000	0.000	0.000
174	174	LYS	1	0.855	0.958	6.477	-0.063	-0.063	0.000	0.000	0.000	0.000
175	175	LEU	0	-0.038	-0.027	8.459	-0.028	-0.028	0.000	0.000	0.000	0.000
176	176	ASN	0	0.036	0.023	11.164	0.084	0.084	0.000	0.000	0.000	0.000
177	177	SER	0	0.050	0.029	14.583	-0.020	-0.020	0.000	0.000	0.000	0.000
178	178	ASN	0	-0.042	-0.034	16.078	0.001	0.001	0.000	0.000	0.000	0.000
179	179	THR	0	-0.029	-0.004	14.596	-0.019	-0.019	0.000	0.000	0.000	0.000
180	180	GLN	0	-0.014	-0.008	17.097	0.010	0.010	0.000	0.000	0.000	0.000
181	181	VAL	0	-0.021	-0.014	14.953	-0.013	-0.013	0.000	0.000	0.000	0.000
182	182	VAL	0	-0.006	-0.008	16.969	0.004	0.004	0.000	0.000	0.000	0.000
183	183	LEU	0	0.008	0.004	15.450	-0.003	-0.003	0.000	0.000	0.000	0.000
184	184	LEU	0	-0.001	-0.011	18.042	-0.003	-0.003	0.000	0.000	0.000	0.000
185	185	SER	0	-0.003	-0.022	18.463	-0.002	-0.002	0.000	0.000	0.000	0.000
186	186	ALA	0	0.045	0.044	20.620	-0.001	-0.001	0.000	0.000	0.000	0.000
187	187	THR	0	-0.028	-0.024	20.747	-0.001	-0.001	0.000	0.000	0.000	0.000
188	188	MET	0	-0.002	-0.010	19.441	0.009	0.009	0.000	0.000	0.000	0.000
189	189	PRO	0	0.056	0.039	19.772	-0.001	-0.001	0.000	0.000	0.000	0.000
190	190	SER	0	0.002	-0.016	21.900	0.004	0.004	0.000	0.000	0.000	0.000
191	191	ASP	-1	-0.868	-0.928	19.316	0.131	0.131	0.000	0.000	0.000	0.000
192	192	VAL	0	-0.042	-0.016	16.688	0.019	0.019	0.000	0.000	0.000	0.000
193	193	LEU	0	-0.041	-0.035	18.428	0.005	0.005	0.000	0.000	0.000	0.000
194	194	GLU	-1	-0.931	-0.939	20.108	0.122	0.122	0.000	0.000	0.000	0.000
195	195	VAL	0	-0.036	-0.020	13.722	0.011	0.011	0.000	0.000	0.000	0.000
196	196	THR	0	0.026	-0.003	16.144	0.003	0.003	0.000	0.000	0.000	0.000
197	197	LYS	1	0.903	0.960	17.709	-0.111	-0.111	0.000	0.000	0.000	0.000
198	198	LYS	1	0.944	0.970	14.085	-0.229	-0.229	0.000	0.000	0.000	0.000
199	199	PHE	0	-0.015	0.004	9.915	0.004	0.004	0.000	0.000	0.000	0.000
200	200	MET	0	-0.040	-0.013	15.124	-0.008	-0.008	0.000	0.000	0.000	0.000
201	201	ARG	1	0.750	0.832	17.652	-0.046	-0.046	0.000	0.000	0.000	0.000
202	202	ASP	-1	-0.987	-0.986	21.808	0.049	0.049	0.000	0.000	0.000	0.000
203	203	PRO	0	-0.008	0.012	21.585	-0.006	-0.006	0.000	0.000	0.000	0.000
204	204	ILE	0	0.016	0.000	23.934	0.000	0.000	0.000	0.000	0.000	0.000
205	205	ARG	1	0.935	0.955	24.348	-0.055	-0.055	0.000	0.000	0.000	0.000
206	206	ILE	0	-0.022	-0.009	26.808	-0.004	-0.004	0.000	0.000	0.000	0.000
207	207	LEU	0	-0.019	-0.012	24.422	-0.001	-0.001	0.000	0.000	0.000	0.000
208	208	VAL	0	0.001	0.009	28.450	-0.002	-0.002	0.000	0.000	0.000	0.000
209	209	LYS	1	0.950	0.986	29.615	-0.018	-0.018	0.000	0.000	0.000	0.000
210	210	LYS	1	0.911	0.963	29.059	-0.036	-0.036	0.000	0.000	0.000	0.000
211	211	GLU	-1	-0.896	-0.954	30.499	0.021	0.021	0.000	0.000	0.000	0.000
212	212	GLU	-1	-0.945	-0.986	32.230	0.008	0.008	0.000	0.000	0.000	0.000
213	213	LEU	0	-0.080	-0.034	26.700	-0.003	-0.003	0.000	0.000	0.000	0.000
214	214	THR	0	-0.005	-0.002	29.777	-0.004	-0.004	0.000	0.000	0.000	0.000
215	215	LEU	0	-0.008	0.001	28.015	-0.001	-0.001	0.000	0.000	0.000	0.000
216	216	GLU	-1	-0.804	-0.890	32.315	-0.013	-0.013	0.000	0.000	0.000	0.000
217	217	GLY	0	-0.048	-0.021	34.341	0.000	0.000	0.000	0.000	0.000	0.000
218	218	ILE	0	-0.024	-0.005	30.755	-0.003	-0.003	0.000	0.000	0.000	0.000
219	219	ARG	1	0.814	0.895	34.434	0.017	0.017	0.000	0.000	0.000	0.000
220	220	GLN	0	0.031	0.015	32.509	0.000	0.000	0.000	0.000	0.000	0.000
221	221	PHE	0	0.060	0.020	35.503	0.001	0.001	0.000	0.000	0.000	0.000
222	222	TYR	0	-0.030	-0.008	35.386	-0.001	-0.001	0.000	0.000	0.000	0.000
223	223	ILE	0	0.071	0.032	36.709	0.000	0.000	0.000	0.000	0.000	0.000
224	224	ASN	0	-0.045	-0.022	37.536	0.000	0.000	0.000	0.000	0.000	0.000
225	225	VAL	0	0.040	0.016	35.956	-0.001	-0.001	0.000	0.000	0.000	0.000
226	226	GLU	-1	-0.907	-0.937	39.223	0.006	0.006	0.000	0.000	0.000	0.000
227	227	ARG	1	0.920	0.949	37.075	0.001	0.001	0.000	0.000	0.000	0.000
228	228	GLU	-1	-0.724	-0.856	30.566	-0.013	-0.013	0.000	0.000	0.000	0.000
229	229	GLU	-1	-1.008	-1.006	34.680	-0.008	-0.008	0.000	0.000	0.000	0.000
230	230	TRP	0	0.024	-0.001	37.134	-0.001	-0.001	0.000	0.000	0.000	0.000
231	231	LYS	1	0.817	0.906	29.469	0.011	0.011	0.000	0.000	0.000	0.000
232	232	LEU	0	0.009	0.004	34.293	-0.003	-0.003	0.000	0.000	0.000	0.000
233	233	ASP	-1	-0.821	-0.919	35.780	-0.018	-0.018	0.000	0.000	0.000	0.000
234	234	THR	0	0.033	0.034	37.673	0.000	0.000	0.000	0.000	0.000	0.000
235	235	LEU	0	-0.046	-0.029	32.402	-0.001	-0.001	0.000	0.000	0.000	0.000
236	236	CYS	0	-0.100	-0.059	36.481	-0.003	-0.003	0.000	0.000	0.000	0.000
237	237	ASP	-1	-0.882	-0.920	39.133	-0.019	-0.019	0.000	0.000	0.000	0.000
238	238	LEU	0	-0.040	-0.034	35.949	-0.001	-0.001	0.000	0.000	0.000	0.000
239	239	TYR	0	0.009	-0.024	35.162	-0.002	-0.002	0.000	0.000	0.000	0.000
240	240	GLU	-1	-0.906	-0.933	38.482	-0.031	-0.031	0.000	0.000	0.000	0.000
241	241	THR	0	0.004	-0.007	36.959	-0.001	-0.001	0.000	0.000	0.000	0.000
242	242	LEU	0	-0.059	-0.015	33.503	-0.003	-0.003	0.000	0.000	0.000	0.000
243	243	THR	0	-0.024	-0.007	36.694	-0.003	-0.003	0.000	0.000	0.000	0.000
244	244	ILE	0	-0.058	-0.027	39.256	-0.001	-0.001	0.000	0.000	0.000	0.000
245	245	THR	0	-0.076	-0.044	35.628	-0.003	-0.003	0.000	0.000	0.000	0.000
246	246	GLN	0	-0.017	-0.009	29.543	0.001	0.001	0.000	0.000	0.000	0.000
247	247	ALA	0	-0.024	-0.025	30.765	0.002	0.002	0.000	0.000	0.000	0.000
248	248	VAL	0	-0.023	-0.010	24.287	-0.007	-0.007	0.000	0.000	0.000	0.000
249	249	ILE	0	0.000	0.001	27.049	0.008	0.008	0.000	0.000	0.000	0.000
250	250	PHE	0	0.009	-0.001	21.391	-0.006	-0.006	0.000	0.000	0.000	0.000
251	251	ILE	0	-0.020	-0.017	22.601	0.010	0.010	0.000	0.000	0.000	0.000
252	252	ASN	0	0.017	-0.001	21.092	-0.013	-0.013	0.000	0.000	0.000	0.000
253	253	THR	0	-0.050	-0.014	19.455	0.003	0.003	0.000	0.000	0.000	0.000
254	254	ARG	1	0.946	0.952	12.209	0.266	0.266	0.000	0.000	0.000	0.000
255	255	ARG	1	0.955	0.981	19.762	0.001	0.001	0.000	0.000	0.000	0.000
256	256	LYS	1	0.783	0.863	22.707	0.016	0.016	0.000	0.000	0.000	0.000
257	257	VAL	0	0.050	0.036	21.972	0.003	0.003	0.000	0.000	0.000	0.000
258	258	ASP	-1	-0.836	-0.887	22.455	-0.100	-0.100	0.000	0.000	0.000	0.000
259	259	TRP	0	-0.015	-0.011	25.490	0.004	0.004	0.000	0.000	0.000	0.000
260	260	LEU	0	-0.001	-0.006	28.156	0.003	0.003	0.000	0.000	0.000	0.000
261	261	THR	0	-0.009	-0.026	26.965	0.000	0.000	0.000	0.000	0.000	0.000
262	262	GLU	-1	-0.878	-0.928	29.588	-0.038	-0.038	0.000	0.000	0.000	0.000
263	263	LYS	1	0.833	0.909	31.407	0.035	0.035	0.000	0.000	0.000	0.000
264	264	MET	0	-0.025	-0.005	32.719	0.003	0.003	0.000	0.000	0.000	0.000
265	265	HIS	0	-0.013	-0.008	31.339	0.003	0.003	0.000	0.000	0.000	0.000
266	266	ALA	0	-0.044	-0.004	35.303	0.001	0.001	0.000	0.000	0.000	0.000
267	267	ARG	1	0.776	0.878	37.686	0.025	0.025	0.000	0.000	0.000	0.000
268	268	ASP	-1	-0.897	-0.935	39.222	-0.035	-0.035	0.000	0.000	0.000	0.000
269	269	PHE	0	-0.026	-0.014	36.015	-0.001	-0.001	0.000	0.000	0.000	0.000
270	270	THR	0	-0.020	-0.005	34.300	-0.004	-0.004	0.000	0.000	0.000	0.000
271	271	VAL	0	-0.007	0.001	30.715	0.001	0.001	0.000	0.000	0.000	0.000
272	272	SER	0	-0.014	0.004	26.595	-0.004	-0.004	0.000	0.000	0.000	0.000
273	273	ALA	0	0.041	0.010	24.661	0.006	0.006	0.000	0.000	0.000	0.000
274	274	MET	0	-0.011	-0.008	17.670	-0.007	-0.007	0.000	0.000	0.000	0.000
275	275	HIS	0	0.015	-0.004	17.449	-0.010	-0.010	0.000	0.000	0.000	0.000
276	276	GLY	0	0.019	-0.017	13.545	-0.013	-0.013	0.000	0.000	0.000	0.000
277	277	ASP	-1	-1.007	-0.993	13.584	-0.250	-0.250	0.000	0.000	0.000	0.000
278	278	MET	0	-0.057	0.006	15.738	0.006	0.006	0.000	0.000	0.000	0.000
279	279	ASP	-1	-0.809	-0.923	15.263	-0.370	-0.370	0.000	0.000	0.000	0.000
280	280	GLN	0	-0.017	-0.019	13.696	-0.016	-0.016	0.000	0.000	0.000	0.000
281	281	LYS	1	0.771	0.873	16.045	0.227	0.227	0.000	0.000	0.000	0.000
282	282	GLU	-1	-0.815	-0.891	19.261	-0.157	-0.157	0.000	0.000	0.000	0.000
283	283	ARG	1	0.767	0.840	11.886	0.435	0.435	0.000	0.000	0.000	0.000
284	284	ASP	-1	-0.844	-0.912	18.790	-0.201	-0.201	0.000	0.000	0.000	0.000
285	285	VAL	0	-0.020	-0.022	20.058	0.019	0.019	0.000	0.000	0.000	0.000
286	286	ILE	0	0.040	0.026	21.234	0.015	0.015	0.000	0.000	0.000	0.000
287	287	MET	0	0.015	0.011	19.955	0.020	0.020	0.000	0.000	0.000	0.000
288	288	ARG	1	0.836	0.905	22.959	0.186	0.186	0.000	0.000	0.000	0.000
289	289	GLU	-1	-0.808	-0.855	25.391	-0.092	-0.092	0.000	0.000	0.000	0.000
290	290	PHE	0	-0.025	-0.009	25.260	0.008	0.008	0.000	0.000	0.000	0.000
291	291	ARG	1	0.864	0.908	21.335	0.141	0.141	0.000	0.000	0.000	0.000
292	292	SER	0	-0.049	-0.033	27.798	0.006	0.006	0.000	0.000	0.000	0.000
293	293	GLY	0	-0.037	-0.005	30.633	0.006	0.006	0.000	0.000	0.000	0.000
294	294	SER	0	-0.062	-0.041	32.115	0.006	0.006	0.000	0.000	0.000	0.000
295	295	SER	0	0.007	0.012	28.008	0.006	0.006	0.000	0.000	0.000	0.000
296	296	ARG	1	0.914	0.929	30.866	0.059	0.059	0.000	0.000	0.000	0.000
297	297	VAL	0	0.066	0.032	30.833	0.003	0.003	0.000	0.000	0.000	0.000
298	298	LEU	0	-0.035	0.001	23.114	-0.003	-0.003	0.000	0.000	0.000	0.000
299	299	ILE	0	0.035	0.017	25.597	0.004	0.004	0.000	0.000	0.000	0.000
300	300	THR	0	-0.055	-0.049	20.479	-0.014	-0.014	0.000	0.000	0.000	0.000
301	301	THR	0	0.044	0.002	16.905	0.016	0.016	0.000	0.000	0.000	0.000
302	302	ASP	-1	-0.776	-0.890	16.902	-0.042	-0.042	0.000	0.000	0.000	0.000
303	303	LEU	0	-0.032	0.003	13.218	-0.002	-0.002	0.000	0.000	0.000	0.000
304	304	LEU	0	-0.008	-0.023	15.880	-0.006	-0.006	0.000	0.000	0.000	0.000
305	305	ALA	0	0.005	0.014	18.453	0.014	0.014	0.000	0.000	0.000	0.000
306	306	ARG	1	0.834	0.881	16.071	0.009	0.009	0.000	0.000	0.000	0.000
307	307	GLY	0	0.007	0.000	18.543	-0.017	-0.017	0.000	0.000	0.000	0.000
308	308	ILE	0	-0.032	-0.015	18.335	-0.001	-0.001	0.000	0.000	0.000	0.000
309	309	ASP	-1	-0.851	-0.905	21.611	-0.063	-0.063	0.000	0.000	0.000	0.000
310	310	VAL	0	-0.007	-0.007	24.693	-0.008	-0.008	0.000	0.000	0.000	0.000
311	311	GLN	0	0.059	0.018	27.224	0.008	0.008	0.000	0.000	0.000	0.000
312	312	GLN	0	-0.023	-0.021	30.811	0.004	0.004	0.000	0.000	0.000	0.000
313	313	VAL	0	-0.007	0.020	27.746	0.003	0.003	0.000	0.000	0.000	0.000
314	314	SER	0	0.025	0.024	31.033	0.002	0.002	0.000	0.000	0.000	0.000
315	315	LEU	0	0.031	0.017	32.968	0.003	0.003	0.000	0.000	0.000	0.000
316	316	VAL	0	-0.026	-0.012	27.502	-0.006	-0.006	0.000	0.000	0.000	0.000
317	317	ILE	0	0.023	0.010	29.339	0.005	0.005	0.000	0.000	0.000	0.000
318	318	ASN	0	-0.025	-0.009	26.450	-0.008	-0.008	0.000	0.000	0.000	0.000
319	319	TYR	0	0.064	0.020	28.003	0.004	0.004	0.000	0.000	0.000	0.000
320	320	ASP	-1	-0.770	-0.863	25.408	-0.015	-0.015	0.000	0.000	0.000	0.000
321	321	LEU	0	0.047	0.018	26.460	-0.003	-0.003	0.000	0.000	0.000	0.000
322	322	PRO	0	-0.021	0.023	22.702	0.003	0.003	0.000	0.000	0.000	0.000
323	323	THR	0	0.024	-0.006	22.223	0.007	0.007	0.000	0.000	0.000	0.000
324	324	ASN	0	-0.014	-0.008	20.232	-0.003	-0.003	0.000	0.000	0.000	0.000
325	325	ARG	1	0.964	0.984	22.366	-0.046	-0.046	0.000	0.000	0.000	0.000
326	326	GLU	-1	-0.811	-0.909	21.481	0.050	0.050	0.000	0.000	0.000	0.000
327	327	ASN	0	-0.052	-0.044	19.492	-0.008	-0.008	0.000	0.000	0.000	0.000
328	328	TYR	0	0.004	-0.006	21.950	-0.011	-0.011	0.000	0.000	0.000	0.000
329	329	ILE	0	0.010	0.004	24.540	-0.007	-0.007	0.000	0.000	0.000	0.000
330	330	HIS	0	-0.078	-0.041	21.030	-0.016	-0.016	0.000	0.000	0.000	0.000
331	331	ARG	1	0.827	0.893	20.978	0.021	0.021	0.000	0.000	0.000	0.000
332	332	ILE	0	0.012	0.006	24.169	-0.006	-0.006	0.000	0.000	0.000	0.000
333	333	GLY	0	-0.007	0.002	26.074	-0.001	-0.001	0.000	0.000	0.000	0.000
334	334	ARG	1	0.771	0.879	22.166	0.060	0.060	0.000	0.000	0.000	0.000
335	335	GLY	0	0.016	0.013	26.173	-0.004	-0.004	0.000	0.000	0.000	0.000
336	336	GLY	0	0.000	-0.003	30.032	0.001	0.001	0.000	0.000	0.000	0.000
337	337	ARG	1	0.798	0.913	27.792	0.059	0.059	0.000	0.000	0.000	0.000
338	338	PHE	0	-0.031	-0.035	31.518	0.003	0.003	0.000	0.000	0.000	0.000
339	339	GLY	0	-0.011	-0.002	33.661	0.002	0.002	0.000	0.000	0.000	0.000
340	340	ARG	1	0.871	0.944	34.383	0.056	0.056	0.000	0.000	0.000	0.000
341	341	LYS	1	0.889	0.939	36.161	0.026	0.026	0.000	0.000	0.000	0.000
342	342	GLY	0	0.065	0.010	34.413	-0.004	-0.004	0.000	0.000	0.000	0.000
343	343	VAL	0	-0.040	-0.003	34.382	0.004	0.004	0.000	0.000	0.000	0.000
344	344	ALA	0	-0.001	-0.003	31.157	-0.004	-0.004	0.000	0.000	0.000	0.000
345	345	ILE	0	0.013	0.014	32.598	0.004	0.004	0.000	0.000	0.000	0.000
346	346	ASN	0	-0.020	-0.019	30.862	-0.003	-0.003	0.000	0.000	0.000	0.000
347	347	MET	0	-0.011	0.001	32.223	0.001	0.001	0.000	0.000	0.000	0.000
348	348	VAL	0	-0.027	-0.006	32.992	0.002	0.002	0.000	0.000	0.000	0.000
349	349	THR	0	-0.050	-0.044	33.486	-0.001	-0.001	0.000	0.000	0.000	0.000
350	350	GLU	-1	-0.842	-0.931	35.670	0.013	0.013	0.000	0.000	0.000	0.000
351	351	GLU	-1	-0.965	-0.983	32.338	0.029	0.029	0.000	0.000	0.000	0.000
352	352	ASP	-1	-0.823	-0.883	31.312	0.008	0.008	0.000	0.000	0.000	0.000
353	353	LYS	1	0.851	0.919	33.052	-0.009	-0.009	0.000	0.000	0.000	0.000
354	354	ARG	1	0.857	0.924	32.874	-0.029	-0.029	0.000	0.000	0.000	0.000
355	355	THR	0	0.038	0.016	28.098	0.002	0.002	0.000	0.000	0.000	0.000
356	356	LEU	0	0.030	0.022	31.024	0.000	0.000	0.000	0.000	0.000	0.000
357	357	ARG	1	0.888	0.941	33.224	-0.014	-0.014	0.000	0.000	0.000	0.000
358	358	ASP	-1	-0.857	-0.920	30.483	0.035	0.035	0.000	0.000	0.000	0.000
359	359	ILE	0	-0.033	-0.012	28.092	0.003	0.003	0.000	0.000	0.000	0.000
360	360	GLU	-1	-0.763	-0.873	31.127	0.008	0.008	0.000	0.000	0.000	0.000
361	361	THR	0	-0.099	-0.063	33.632	0.001	0.001	0.000	0.000	0.000	0.000
362	362	PHE	0	-0.096	-0.051	26.066	0.002	0.002	0.000	0.000	0.000	0.000
363	363	TYR	0	0.034	-0.012	26.359	0.001	0.001	0.000	0.000	0.000	0.000
364	364	ASN	0	-0.046	-0.019	32.775	-0.002	-0.002	0.000	0.000	0.000	0.000
365	365	THR	0	-0.005	0.004	35.005	-0.001	-0.001	0.000	0.000	0.000	0.000
366	366	SER	0	-0.023	-0.011	36.938	0.001	0.001	0.000	0.000	0.000	0.000
367	367	ILE	0	-0.044	-0.024	33.498	-0.002	-0.002	0.000	0.000	0.000	0.000
368	368	GLU	-1	-0.915	-0.951	37.971	-0.003	-0.003	0.000	0.000	0.000	0.000
369	369	GLU	-1	-0.959	-0.980	39.624	-0.006	-0.006	0.000	0.000	0.000	0.000
370	370	MET	0	-0.051	-0.023	39.303	-0.002	-0.002	0.000	0.000	0.000	0.000
371	371	PRO	0	-0.007	0.005	41.292	0.001	0.001	0.000	0.000	0.000	0.000
372	372	LEU	0	0.007	-0.014	44.073	-0.001	-0.001	0.000	0.000	0.000	0.000
373	373	ASN	0	0.003	0.004	44.868	-0.001	-0.001	0.000	0.000	0.000	0.000
374	374	VAL	0	0.012	0.008	38.514	0.001	0.001	0.000	0.000	0.000	0.000
375	375	ALA	0	0.016	-0.007	40.972	-0.001	-0.001	0.000	0.000	0.000	0.000
376	376	ASP	-1	-0.878	-0.922	41.928	-0.023	-0.023	0.000	0.000	0.000	0.000
377	377	LEU	0	-0.091	-0.044	40.521	0.001	0.001	0.000	0.000	0.000	0.000
378	378	ILE	-1	-0.954	-0.960	37.235	-0.031	-0.031	0.000	0.000	0.000	0.000
379	379	A	0	-0.368	-0.301	20.558	-0.011	-0.011	0.000	0.000	0.000	0.000
380	379	A	-1	-0.527	-0.626	15.581	0.311	0.311	0.000	0.000	0.000	0.000
381	380	G	0	-0.367	-0.319	18.530	0.007	0.007	0.000	0.000	0.000	0.000
382	380	G	-1	-0.510	-0.622	15.461	0.237	0.237	0.000	0.000	0.000	0.000
383	381	A	0	-0.358	-0.305	16.882	-0.008	-0.008	0.000	0.000	0.000	0.000
384	381	A	-1	-0.621	-0.673	15.455	0.091	0.091	0.000	0.000	0.000	0.000
385	382	G	0	-0.374	-0.302	13.225	0.056	0.056	0.000	0.000	0.000	0.000
386	382	G	-1	-0.550	-0.690	15.852	-0.053	-0.053	0.000	0.000	0.000	0.000
387	383	A	0	-0.352	-0.293	9.141	-0.004	-0.004	0.000	0.000	0.000	0.000
388	383	A	-1	-0.471	-0.593	11.730	-0.203	-0.203	0.000	0.000	0.000	0.000
389	384	A	0	-0.361	-0.309	6.273	-0.063	-0.063	0.000	0.000	0.000	0.000
390	384	A	-1	-0.442	-0.581	7.854	-0.448	-0.448	0.000	0.000	0.000	0.000
395	387	G	0	-0.349	-0.299	5.952	0.262	0.262	0.000	0.000	0.000	0.000
396	387	G	-1	-0.550	-0.638	6.655	-0.609	-0.609	0.000	0.000	0.000	0.000
397	388	G	0	-0.305	-0.275	8.758	0.085	0.085	0.000	0.000	0.000	0.000
398	388	G	0	0.258	0.243	10.756	-0.019	-0.019	0.000	0.000	0.000	0.000

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Interactive mode: IFIE and PIEDA for fragment #399(:389:V6D)