FMO DATABASE

FMODB ID: QYZGY

Calculation Name: 6XKI-A-MD433-76ns

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	V6D=1
Software	ABINIT-MP - Open Ver. 1 Rev. 23Q2 / 20200603(SMP)

Total energy (hartree)

FMO2-HF: Electronic energy	-7630536.909003
FMO2-HF: Nuclear repulsion	7461332.958474
FMO2-HF: Total energy	-169203.950528
FMO2-MP2: Total energy	-169681.733507

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.
-320.948604	-264.902607	58.066917	-25.612243	-88.500671	0.117961

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.
-258.566	-241.359	21.876	-7.923	-31.155	-0.044

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 : 1 / q_Mulliken : 1.008 / q_NPA : 1.022

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].
82	82	ARG	1	0.865	0.891	2.460	46.003	46.385	1.229	-0.296	-1.315	-0.001
131	131	PRO	0	0.035	0.002	5.063	0.059	0.292	-0.001	-0.015	-0.217	0.000
132	132	GLY	0	0.034	0.026	2.477	0.657	0.158	0.413	0.207	-0.120	0.001
133	133	ARG	1	0.820	0.864	3.343	29.276	29.239	0.012	0.256	-0.230	0.000
135	135	PHE	0	0.041	0.012	5.367	2.210	2.284	-0.001	-0.001	-0.072	0.000
167	167	GLN	0	0.013	0.007	4.652	-1.157	-0.994	-0.001	-0.013	-0.149	0.000
254	254	ARG	1	0.941	0.949	3.300	48.556	49.010	0.008	-0.075	-0.387	0.000
276	276	GLY	0	0.008	-0.016	4.816	-0.664	-0.615	-0.001	-0.024	-0.025	0.000
277	277	ASP	-1	-1.012	-1.006	2.178	-75.471	-73.377	2.914	-2.105	-2.903	-0.023
278	278	MET	0	-0.038	0.015	3.253	2.765	2.561	-0.003	0.436	-0.229	-0.001
279	279	ASP	-1	-0.893	-0.943	4.363	-43.171	-42.991	-0.001	-0.014	-0.165	0.000
283	283	ARG	1	0.804	0.863	4.759	38.777	38.886	-0.001	-0.001	-0.107	0.000
390	384	A	-1	-0.443	-0.575	4.083	-37.810	-37.367	0.000	-0.063	-0.380	0.000
391	385	G	0	-0.306	-0.277	2.709	-16.638	-9.144	8.460	-2.494	-13.459	-0.020
392	385	G	-1	-0.475	-0.567	2.143	-40.351	-37.196	5.914	-3.418	-5.650	0.005
393	386	A	0	-0.345	-0.297	2.858	-2.142	-0.578	1.883	-0.890	-2.556	0.010
394	386	A	-1	-0.590	-0.686	3.140	-36.236	-36.737	0.152	1.466	-1.116	-0.002
395	387	G	0	-0.319	-0.288	2.554	-11.352	-9.298	0.900	-0.879	-2.075	-0.013
1	1	GLU	0	-0.081	-0.061	40.274	0.379	0.379	0.000	0.000	0.000	0.000
2	2	ILE	0	-0.024	-0.012	38.241	-0.177	-0.177	0.000	0.000	0.000	0.000
3	3	VAL	0	0.024	0.029	38.812	0.157	0.157	0.000	0.000	0.000	0.000
4	4	ASP	-1	-0.914	-0.963	39.418	-7.246	-7.246	0.000	0.000	0.000	0.000
5	5	SER	0	0.028	-0.004	39.973	0.004	0.004	0.000	0.000	0.000	0.000
6	6	PHE	0	-0.020	-0.027	32.502	-0.139	-0.139	0.000	0.000	0.000	0.000
7	7	ASP	-1	-0.886	-0.946	37.353	-7.146	-7.146	0.000	0.000	0.000	0.000
8	8	ASP	-1	-0.859	-0.918	40.157	-6.780	-6.780	0.000	0.000	0.000	0.000
9	9	MET	0	-0.169	-0.079	33.819	-0.104	-0.104	0.000	0.000	0.000	0.000
10	10	ASN	0	-0.069	-0.030	36.719	-0.053	-0.053	0.000	0.000	0.000	0.000
11	11	LEU	0	-0.007	0.000	32.569	-0.104	-0.104	0.000	0.000	0.000	0.000
12	12	SER	0	0.026	0.009	34.191	0.252	0.252	0.000	0.000	0.000	0.000
13	13	GLU	-1	-0.874	-0.937	36.171	-7.198	-7.198	0.000	0.000	0.000	0.000
14	14	SER	0	-0.031	-0.022	35.562	-0.107	-0.107	0.000	0.000	0.000	0.000
15	15	LEU	0	0.020	0.004	30.120	-0.173	-0.173	0.000	0.000	0.000	0.000
16	16	LEU	0	-0.001	-0.001	33.409	-0.217	-0.217	0.000	0.000	0.000	0.000
17	17	ARG	1	0.933	0.971	35.986	7.467	7.467	0.000	0.000	0.000	0.000
18	18	GLY	0	0.033	0.019	32.446	0.002	0.002	0.000	0.000	0.000	0.000
19	19	ILE	0	-0.024	-0.021	31.505	-0.211	-0.211	0.000	0.000	0.000	0.000
20	20	TYR	0	-0.002	-0.017	33.194	-0.013	-0.013	0.000	0.000	0.000	0.000
21	21	ALA	0	-0.028	-0.003	34.404	0.058	0.058	0.000	0.000	0.000	0.000
22	22	TYR	0	-0.048	-0.019	26.505	-0.322	-0.322	0.000	0.000	0.000	0.000
23	23	GLY	0	-0.004	0.015	32.167	-0.095	-0.095	0.000	0.000	0.000	0.000
24	24	PHE	0	-0.080	-0.040	29.089	-0.124	-0.124	0.000	0.000	0.000	0.000
25	25	GLU	-1	-0.890	-0.960	35.146	-7.269	-7.269	0.000	0.000	0.000	0.000
26	26	LYS	1	0.939	0.972	37.834	7.301	7.301	0.000	0.000	0.000	0.000
27	27	PRO	0	-0.028	0.016	34.712	-0.183	-0.183	0.000	0.000	0.000	0.000
28	28	SER	0	0.059	0.024	32.611	0.093	0.093	0.000	0.000	0.000	0.000
29	29	ALA	0	0.042	0.011	34.388	-0.062	-0.062	0.000	0.000	0.000	0.000
30	30	ILE	0	0.003	-0.008	29.359	0.038	0.038	0.000	0.000	0.000	0.000
31	31	GLN	0	0.034	0.026	29.132	0.142	0.142	0.000	0.000	0.000	0.000
32	32	GLN	0	0.063	0.016	30.924	0.012	0.012	0.000	0.000	0.000	0.000
33	33	ARG	1	0.899	0.954	33.241	8.311	8.311	0.000	0.000	0.000	0.000
34	34	ALA	0	-0.005	0.000	27.863	0.001	0.001	0.000	0.000	0.000	0.000
35	35	ILE	0	0.026	0.004	28.943	-0.090	-0.090	0.000	0.000	0.000	0.000
36	36	LEU	0	0.044	0.028	30.131	-0.016	-0.016	0.000	0.000	0.000	0.000
37	37	PRO	0	-0.042	-0.032	30.533	0.060	0.060	0.000	0.000	0.000	0.000
38	38	CYS	0	-0.014	0.008	25.669	-0.156	-0.156	0.000	0.000	0.000	0.000
39	39	ILE	0	0.055	0.030	27.783	-0.151	-0.151	0.000	0.000	0.000	0.000
40	40	LYS	1	0.862	0.935	29.984	7.855	7.855	0.000	0.000	0.000	0.000
41	41	GLY	0	0.066	0.052	27.519	0.141	0.141	0.000	0.000	0.000	0.000
42	42	TYR	0	-0.061	-0.029	27.443	-0.013	-0.013	0.000	0.000	0.000	0.000
43	43	ASP	-1	-0.725	-0.839	24.298	-10.808	-10.808	0.000	0.000	0.000	0.000
44	44	VAL	0	-0.021	-0.012	24.675	0.350	0.350	0.000	0.000	0.000	0.000
45	45	ILE	0	0.017	0.013	23.878	-0.448	-0.448	0.000	0.000	0.000	0.000
46	46	ALA	0	0.019	-0.005	24.893	0.456	0.456	0.000	0.000	0.000	0.000
47	47	GLN	0	-0.007	0.002	25.184	-0.197	-0.197	0.000	0.000	0.000	0.000
48	48	ALA	0	-0.013	-0.015	25.070	0.291	0.291	0.000	0.000	0.000	0.000
49	49	GLN	0	0.049	0.015	25.478	-0.419	-0.419	0.000	0.000	0.000	0.000
50	50	SER	0	0.029	0.016	25.903	-0.178	-0.178	0.000	0.000	0.000	0.000
51	51	GLY	0	0.027	0.019	26.975	0.267	0.267	0.000	0.000	0.000	0.000
52	52	THR	0	-0.082	-0.052	27.905	0.204	0.204	0.000	0.000	0.000	0.000
53	53	GLY	0	0.065	0.047	27.543	0.182	0.182	0.000	0.000	0.000	0.000
54	54	LYS	1	0.788	0.875	19.886	13.655	13.655	0.000	0.000	0.000	0.000
55	55	THR	0	0.033	0.005	21.110	-0.255	-0.255	0.000	0.000	0.000	0.000
56	56	ALA	0	0.048	0.017	23.096	-0.030	-0.030	0.000	0.000	0.000	0.000
57	57	THR	0	-0.042	-0.024	25.492	0.323	0.323	0.000	0.000	0.000	0.000
58	58	PHE	0	0.049	0.029	19.633	0.257	0.257	0.000	0.000	0.000	0.000
59	59	ALA	0	0.004	0.013	23.190	0.093	0.093	0.000	0.000	0.000	0.000
60	60	ILE	0	0.031	0.014	24.177	0.167	0.167	0.000	0.000	0.000	0.000
61	61	SER	0	-0.021	-0.027	26.233	0.136	0.136	0.000	0.000	0.000	0.000
62	62	ILE	0	0.006	0.004	20.758	0.090	0.090	0.000	0.000	0.000	0.000
63	63	LEU	0	-0.007	-0.013	25.023	0.201	0.201	0.000	0.000	0.000	0.000
64	64	GLN	0	0.047	0.033	27.290	0.183	0.183	0.000	0.000	0.000	0.000
65	65	GLN	0	-0.077	-0.041	26.491	0.298	0.298	0.000	0.000	0.000	0.000
66	66	ILE	0	-0.060	-0.024	23.746	-0.206	-0.206	0.000	0.000	0.000	0.000
67	67	GLU	-1	-0.911	-0.944	27.801	-8.137	-8.137	0.000	0.000	0.000	0.000
68	68	LEU	0	0.036	0.006	28.973	-0.245	-0.245	0.000	0.000	0.000	0.000
69	69	ASP	-1	-0.896	-0.942	29.985	-8.328	-8.328	0.000	0.000	0.000	0.000
70	70	LEU	0	-0.099	-0.040	26.393	-0.012	-0.012	0.000	0.000	0.000	0.000
71	71	LYS	1	0.954	0.973	26.496	8.773	8.773	0.000	0.000	0.000	0.000
72	72	ALA	0	0.015	-0.005	22.605	-0.152	-0.152	0.000	0.000	0.000	0.000
73	73	THR	0	0.001	0.007	17.148	-0.077	-0.077	0.000	0.000	0.000	0.000
74	74	GLN	0	-0.058	-0.030	20.307	-0.004	-0.004	0.000	0.000	0.000	0.000
75	75	ALA	0	0.004	-0.002	19.976	0.056	0.056	0.000	0.000	0.000	0.000
76	76	LEU	0	-0.013	-0.003	12.345	-0.286	-0.286	0.000	0.000	0.000	0.000
77	77	VAL	0	-0.014	-0.006	15.596	0.253	0.253	0.000	0.000	0.000	0.000
78	78	LEU	0	-0.010	-0.003	9.131	-0.879	-0.879	0.000	0.000	0.000	0.000
79	79	ALA	0	0.037	0.010	11.480	1.077	1.077	0.000	0.000	0.000	0.000
80	80	PRO	0	0.032	0.013	9.882	-1.298	-1.298	0.000	0.000	0.000	0.000
81	81	THR	0	0.005	0.013	7.711	-1.880	-1.880	0.000	0.000	0.000	0.000
83	83	GLU	-1	-0.772	-0.879	9.017	-24.347	-24.347	0.000	0.000	0.000	0.000
84	84	LEU	0	-0.022	0.002	11.837	1.554	1.554	0.000	0.000	0.000	0.000
85	85	ALA	0	0.014	0.001	11.624	1.268	1.268	0.000	0.000	0.000	0.000
86	86	GLN	0	0.004	-0.006	12.583	1.545	1.545	0.000	0.000	0.000	0.000
87	87	GLN	0	-0.023	0.004	14.977	0.710	0.710	0.000	0.000	0.000	0.000
88	88	ILE	0	0.009	-0.002	16.042	0.876	0.876	0.000	0.000	0.000	0.000
89	89	GLN	0	0.050	0.022	17.489	0.633	0.633	0.000	0.000	0.000	0.000
90	90	LYS	1	0.925	0.959	19.218	14.780	14.780	0.000	0.000	0.000	0.000
91	91	VAL	0	0.020	0.020	21.949	0.476	0.476	0.000	0.000	0.000	0.000
92	92	VAL	0	-0.013	-0.014	20.230	0.484	0.484	0.000	0.000	0.000	0.000
93	93	MET	0	0.005	0.003	22.474	0.382	0.382	0.000	0.000	0.000	0.000
94	94	ALA	0	-0.024	0.005	24.877	0.373	0.373	0.000	0.000	0.000	0.000
95	95	LEU	0	-0.045	-0.026	26.315	0.366	0.366	0.000	0.000	0.000	0.000
96	96	GLY	0	0.024	-0.002	27.407	0.324	0.324	0.000	0.000	0.000	0.000
97	97	ASP	-1	-0.951	-0.957	28.447	-9.265	-9.265	0.000	0.000	0.000	0.000
98	98	TYR	0	0.005	-0.018	30.613	0.280	0.280	0.000	0.000	0.000	0.000
99	99	MET	0	-0.064	-0.013	30.019	0.178	0.178	0.000	0.000	0.000	0.000
100	100	GLY	0	-0.002	0.015	30.805	0.066	0.066	0.000	0.000	0.000	0.000
101	101	ALA	0	-0.037	-0.008	26.644	-0.100	-0.100	0.000	0.000	0.000	0.000
102	102	SER	0	0.036	0.022	24.131	-0.282	-0.282	0.000	0.000	0.000	0.000
103	103	CYS	0	-0.065	-0.045	19.235	-0.231	-0.231	0.000	0.000	0.000	0.000
104	104	HIS	0	-0.010	-0.014	14.456	0.796	0.796	0.000	0.000	0.000	0.000
105	105	ALA	0	0.007	0.010	13.823	-0.098	-0.098	0.000	0.000	0.000	0.000
106	106	CYS	0	-0.039	-0.010	10.279	-0.159	-0.159	0.000	0.000	0.000	0.000
107	107	ILE	0	0.007	0.004	8.321	-0.866	-0.866	0.000	0.000	0.000	0.000
108	108	GLY	0	0.025	0.013	4.971	0.868	0.868	0.000	0.000	0.000	0.000
109	109	GLY	0	-0.002	0.001	5.483	-0.493	-0.493	0.000	0.000	0.000	0.000
110	110	THR	0	-0.010	-0.014	6.368	3.038	3.038	0.000	0.000	0.000	0.000
111	111	ASN	0	0.033	0.014	9.878	-0.417	-0.417	0.000	0.000	0.000	0.000
112	112	VAL	0	0.087	0.049	10.061	1.351	1.351	0.000	0.000	0.000	0.000
113	113	ARG	1	0.917	0.949	12.153	17.378	17.378	0.000	0.000	0.000	0.000
114	114	ALA	0	0.008	-0.001	15.622	0.916	0.916	0.000	0.000	0.000	0.000
115	115	GLU	-1	-0.828	-0.887	11.662	-19.558	-19.558	0.000	0.000	0.000	0.000
116	116	VAL	0	0.032	0.006	14.736	0.733	0.733	0.000	0.000	0.000	0.000
117	117	GLN	0	-0.030	-0.013	16.181	0.609	0.609	0.000	0.000	0.000	0.000
118	118	LYS	1	0.943	0.959	16.465	16.535	16.535	0.000	0.000	0.000	0.000
119	119	LEU	0	0.049	0.029	14.587	0.447	0.447	0.000	0.000	0.000	0.000
120	120	GLN	0	-0.023	-0.019	18.895	0.791	0.791	0.000	0.000	0.000	0.000
121	121	MET	0	-0.108	-0.043	21.148	0.597	0.597	0.000	0.000	0.000	0.000
122	122	GLU	-1	-0.967	-0.966	21.891	-11.379	-11.379	0.000	0.000	0.000	0.000
123	123	ALA	0	-0.055	-0.027	21.275	0.312	0.312	0.000	0.000	0.000	0.000
124	124	PRO	0	0.019	0.023	19.314	0.329	0.329	0.000	0.000	0.000	0.000
125	125	HIS	0	0.047	0.026	21.006	-0.467	-0.467	0.000	0.000	0.000	0.000
126	126	ILE	0	-0.023	-0.014	18.812	-0.054	-0.054	0.000	0.000	0.000	0.000
127	127	ILE	0	0.003	-0.006	13.511	-0.291	-0.291	0.000	0.000	0.000	0.000
128	128	VAL	0	0.031	0.021	14.032	0.057	0.057	0.000	0.000	0.000	0.000
129	129	GLY	0	0.004	-0.010	10.671	-0.314	-0.314	0.000	0.000	0.000	0.000
130	130	THR	0	0.011	-0.008	6.049	0.965	0.965	0.000	0.000	0.000	0.000
134	134	VAL	0	0.033	0.018	6.539	2.216	2.216	0.000	0.000	0.000	0.000
136	136	ASP	-1	-0.810	-0.865	6.600	-22.219	-22.219	0.000	0.000	0.000	0.000
137	137	MET	0	-0.014	-0.008	8.135	2.187	2.187	0.000	0.000	0.000	0.000
138	138	LEU	0	-0.004	0.011	10.731	1.427	1.427	0.000	0.000	0.000	0.000
139	139	ASN	0	-0.112	-0.066	8.996	2.206	2.206	0.000	0.000	0.000	0.000
140	140	ARG	1	0.843	0.903	10.866	20.985	20.985	0.000	0.000	0.000	0.000
141	141	ARG	1	0.877	0.945	14.032	13.714	13.714	0.000	0.000	0.000	0.000
142	142	TYR	0	-0.010	0.006	15.210	0.627	0.627	0.000	0.000	0.000	0.000
143	143	LEU	0	0.021	0.020	12.345	0.641	0.641	0.000	0.000	0.000	0.000
144	144	SER	0	0.033	0.003	16.015	0.047	0.047	0.000	0.000	0.000	0.000
145	145	PRO	0	0.033	0.006	16.737	0.247	0.247	0.000	0.000	0.000	0.000
146	146	LYS	1	0.876	0.943	19.095	10.403	10.403	0.000	0.000	0.000	0.000
147	147	TYR	0	0.008	0.004	21.119	0.486	0.486	0.000	0.000	0.000	0.000
148	148	ILE	0	-0.013	0.000	16.538	0.147	0.147	0.000	0.000	0.000	0.000
149	149	LYS	1	0.902	0.961	19.918	10.205	10.205	0.000	0.000	0.000	0.000
150	150	MET	0	-0.012	0.012	21.072	0.207	0.207	0.000	0.000	0.000	0.000
151	151	PHE	0	-0.006	-0.009	12.228	-0.403	-0.403	0.000	0.000	0.000	0.000
152	152	VAL	0	0.009	-0.004	16.894	0.364	0.364	0.000	0.000	0.000	0.000
153	153	LEU	0	0.002	0.006	13.372	-0.740	-0.740	0.000	0.000	0.000	0.000
154	154	ASP	-1	-0.773	-0.880	15.868	-13.596	-13.596	0.000	0.000	0.000	0.000
155	155	GLU	-1	-0.854	-0.933	15.200	-15.767	-15.767	0.000	0.000	0.000	0.000
156	156	ALA	0	0.014	0.002	16.268	-0.590	-0.590	0.000	0.000	0.000	0.000
157	157	ASP	-1	-0.768	-0.833	17.071	-14.548	-14.548	0.000	0.000	0.000	0.000
158	158	GLU	-1	-0.821	-0.902	12.775	-18.249	-18.249	0.000	0.000	0.000	0.000
159	159	MET	0	-0.071	-0.012	9.134	-0.814	-0.814	0.000	0.000	0.000	0.000
160	160	LEU	0	-0.023	-0.022	12.804	-0.186	-0.186	0.000	0.000	0.000	0.000
161	161	SER	0	0.044	0.018	14.007	0.570	0.570	0.000	0.000	0.000	0.000
162	162	ARG	1	0.760	0.843	13.688	18.352	18.352	0.000	0.000	0.000	0.000
163	163	GLY	0	0.080	0.066	10.999	-0.466	-0.466	0.000	0.000	0.000	0.000
164	164	PHE	0	-0.019	-0.022	6.540	-1.926	-1.926	0.000	0.000	0.000	0.000
165	165	LYS	1	0.926	0.984	10.038	15.535	15.535	0.000	0.000	0.000	0.000
166	166	ASP	-1	-0.884	-0.960	10.961	-16.178	-16.178	0.000	0.000	0.000	0.000
168	168	ILE	0	-0.015	-0.014	7.734	0.403	0.403	0.000	0.000	0.000	0.000
169	169	TYR	0	0.024	-0.005	10.525	0.959	0.959	0.000	0.000	0.000	0.000
170	170	ASP	-1	-0.864	-0.916	8.415	-19.064	-19.064	0.000	0.000	0.000	0.000
171	171	ILE	0	-0.074	-0.040	7.305	0.636	0.636	0.000	0.000	0.000	0.000
172	172	PHE	0	-0.036	-0.031	10.511	0.949	0.949	0.000	0.000	0.000	0.000
173	173	GLN	0	-0.018	-0.006	13.335	1.329	1.329	0.000	0.000	0.000	0.000
174	174	LYS	1	0.862	0.955	11.815	15.826	15.826	0.000	0.000	0.000	0.000
175	175	LEU	0	-0.039	-0.026	13.930	0.691	0.691	0.000	0.000	0.000	0.000
176	176	ASN	0	-0.013	-0.007	16.203	0.477	0.477	0.000	0.000	0.000	0.000
177	177	SER	0	0.057	0.029	19.923	0.031	0.031	0.000	0.000	0.000	0.000
178	178	ASN	0	-0.050	-0.027	21.485	-0.058	-0.058	0.000	0.000	0.000	0.000
179	179	THR	0	-0.030	-0.008	18.202	0.162	0.162	0.000	0.000	0.000	0.000
180	180	GLN	0	0.001	-0.002	21.404	-0.112	-0.112	0.000	0.000	0.000	0.000
181	181	VAL	0	-0.005	-0.011	18.269	-0.500	-0.500	0.000	0.000	0.000	0.000
182	182	VAL	0	-0.033	-0.023	19.951	0.476	0.476	0.000	0.000	0.000	0.000
183	183	LEU	0	0.014	0.006	18.113	-0.637	-0.637	0.000	0.000	0.000	0.000
184	184	LEU	0	0.001	-0.005	20.084	0.615	0.615	0.000	0.000	0.000	0.000
185	185	SER	0	-0.050	-0.052	20.155	-0.623	-0.623	0.000	0.000	0.000	0.000
186	186	ALA	0	0.059	0.043	21.929	0.479	0.479	0.000	0.000	0.000	0.000
187	187	THR	0	0.005	-0.012	21.514	0.516	0.516	0.000	0.000	0.000	0.000
188	188	MET	0	-0.020	-0.023	22.019	-0.474	-0.474	0.000	0.000	0.000	0.000
189	189	PRO	0	0.051	0.035	21.600	0.473	0.473	0.000	0.000	0.000	0.000
190	190	SER	0	0.005	-0.012	24.456	-0.042	-0.042	0.000	0.000	0.000	0.000
191	191	ASP	-1	-0.859	-0.922	21.873	-11.824	-11.824	0.000	0.000	0.000	0.000
192	192	VAL	0	-0.009	0.001	19.174	-0.129	-0.129	0.000	0.000	0.000	0.000
193	193	LEU	0	-0.036	-0.026	21.332	0.112	0.112	0.000	0.000	0.000	0.000
194	194	GLU	-1	-0.859	-0.898	23.466	-9.716	-9.716	0.000	0.000	0.000	0.000
195	195	VAL	0	-0.040	-0.016	16.951	0.038	0.038	0.000	0.000	0.000	0.000
196	196	THR	0	0.023	-0.007	20.134	-0.013	-0.013	0.000	0.000	0.000	0.000
197	197	LYS	1	0.795	0.880	21.639	10.227	10.227	0.000	0.000	0.000	0.000
198	198	LYS	1	0.896	0.973	16.876	13.468	13.468	0.000	0.000	0.000	0.000
199	199	PHE	0	-0.033	-0.013	14.191	-0.061	-0.061	0.000	0.000	0.000	0.000
200	200	MET	0	-0.062	-0.014	20.152	0.218	0.218	0.000	0.000	0.000	0.000
201	201	ARG	1	0.775	0.863	22.565	10.743	10.743	0.000	0.000	0.000	0.000
202	202	ASP	-1	-0.920	-0.971	26.997	-8.347	-8.347	0.000	0.000	0.000	0.000
203	203	PRO	0	-0.054	-0.013	26.030	0.060	0.060	0.000	0.000	0.000	0.000
204	204	ILE	0	0.032	0.019	28.130	0.297	0.297	0.000	0.000	0.000	0.000
205	205	ARG	1	0.942	0.960	27.899	9.206	9.206	0.000	0.000	0.000	0.000
206	206	ILE	0	-0.067	-0.031	29.377	0.371	0.371	0.000	0.000	0.000	0.000
207	207	LEU	0	0.001	0.000	27.789	-0.314	-0.314	0.000	0.000	0.000	0.000
208	208	VAL	0	-0.001	-0.004	29.771	0.284	0.284	0.000	0.000	0.000	0.000
209	209	LYS	1	0.956	0.980	30.762	8.073	8.073	0.000	0.000	0.000	0.000
210	210	LYS	1	0.952	0.970	29.721	9.641	9.641	0.000	0.000	0.000	0.000
211	211	GLU	-1	-0.947	-0.971	31.495	-8.278	-8.278	0.000	0.000	0.000	0.000
212	212	GLU	-1	-0.930	-0.965	32.784	-8.155	-8.155	0.000	0.000	0.000	0.000
213	213	LEU	0	-0.106	-0.044	27.019	-0.110	-0.110	0.000	0.000	0.000	0.000
214	214	THR	0	-0.027	-0.011	28.687	-0.412	-0.412	0.000	0.000	0.000	0.000
215	215	LEU	0	0.005	0.014	26.488	0.063	0.063	0.000	0.000	0.000	0.000
216	216	GLU	-1	-0.912	-0.958	30.833	-8.795	-8.795	0.000	0.000	0.000	0.000
217	217	GLY	0	-0.031	-0.016	32.616	0.158	0.158	0.000	0.000	0.000	0.000
218	218	ILE	0	-0.033	-0.004	28.184	-0.065	-0.065	0.000	0.000	0.000	0.000
219	219	ARG	1	0.969	0.993	31.504	8.246	8.246	0.000	0.000	0.000	0.000
220	220	GLN	0	0.054	0.030	30.425	-0.448	-0.448	0.000	0.000	0.000	0.000
221	221	PHE	0	0.021	0.005	31.556	0.343	0.343	0.000	0.000	0.000	0.000
222	222	TYR	0	-0.038	-0.016	30.966	-0.442	-0.442	0.000	0.000	0.000	0.000
223	223	ILE	0	0.060	0.030	29.751	0.269	0.269	0.000	0.000	0.000	0.000
224	224	ASN	0	-0.046	-0.021	30.967	-0.310	-0.310	0.000	0.000	0.000	0.000
225	225	VAL	0	0.050	0.017	28.239	0.042	0.042	0.000	0.000	0.000	0.000
226	226	GLU	-1	-0.858	-0.904	31.681	-8.409	-8.409	0.000	0.000	0.000	0.000
227	227	ARG	1	0.831	0.901	30.471	8.886	8.886	0.000	0.000	0.000	0.000
228	228	GLU	-1	-0.700	-0.834	22.789	-13.040	-13.040	0.000	0.000	0.000	0.000
229	229	GLU	-1	-0.971	-1.000	26.161	-11.050	-11.050	0.000	0.000	0.000	0.000
230	230	TRP	0	-0.019	-0.015	28.060	0.204	0.204	0.000	0.000	0.000	0.000
231	231	LYS	1	0.816	0.907	22.124	13.080	13.080	0.000	0.000	0.000	0.000
232	232	LEU	0	0.019	0.000	23.794	-0.046	-0.046	0.000	0.000	0.000	0.000
233	233	ASP	-1	-0.818	-0.915	25.801	-10.150	-10.150	0.000	0.000	0.000	0.000
234	234	THR	0	0.044	0.037	29.097	0.331	0.331	0.000	0.000	0.000	0.000
235	235	LEU	0	-0.039	-0.025	22.738	0.050	0.050	0.000	0.000	0.000	0.000
236	236	CYS	0	-0.094	-0.054	27.253	-0.092	-0.092	0.000	0.000	0.000	0.000
237	237	ASP	-1	-0.883	-0.927	29.030	-8.888	-8.888	0.000	0.000	0.000	0.000
238	238	LEU	0	-0.058	-0.030	27.898	0.161	0.161	0.000	0.000	0.000	0.000
239	239	TYR	0	-0.010	-0.025	25.322	0.023	0.023	0.000	0.000	0.000	0.000
240	240	GLU	-1	-0.886	-0.928	29.284	-8.822	-8.822	0.000	0.000	0.000	0.000
241	241	THR	0	0.007	-0.009	30.316	0.093	0.093	0.000	0.000	0.000	0.000
242	242	LEU	0	-0.038	-0.029	24.809	-0.126	-0.126	0.000	0.000	0.000	0.000
243	243	THR	0	-0.011	0.001	27.707	-0.270	-0.270	0.000	0.000	0.000	0.000
244	244	ILE	0	-0.009	0.008	30.175	0.055	0.055	0.000	0.000	0.000	0.000
245	245	THR	0	-0.072	-0.040	29.220	-0.014	-0.014	0.000	0.000	0.000	0.000
246	246	GLN	0	-0.022	0.002	22.678	0.217	0.217	0.000	0.000	0.000	0.000
247	247	ALA	0	0.006	-0.006	24.250	0.129	0.129	0.000	0.000	0.000	0.000
248	248	VAL	0	-0.024	-0.009	18.199	-0.454	-0.454	0.000	0.000	0.000	0.000
249	249	ILE	0	-0.003	0.000	19.463	0.465	0.465	0.000	0.000	0.000	0.000
250	250	PHE	0	0.023	0.008	16.081	-0.843	-0.843	0.000	0.000	0.000	0.000
251	251	ILE	0	-0.032	-0.023	14.633	0.872	0.872	0.000	0.000	0.000	0.000
252	252	ASN	0	0.003	-0.018	15.369	-0.958	-0.958	0.000	0.000	0.000	0.000
253	253	THR	0	-0.033	-0.017	12.567	-0.722	-0.722	0.000	0.000	0.000	0.000
255	255	ARG	1	1.001	0.999	10.175	24.320	24.320	0.000	0.000	0.000	0.000
256	256	LYS	1	0.797	0.876	12.506	15.827	15.827	0.000	0.000	0.000	0.000
257	257	VAL	0	0.037	0.021	11.877	1.035	1.035	0.000	0.000	0.000	0.000
258	258	ASP	-1	-0.886	-0.928	10.406	-24.620	-24.620	0.000	0.000	0.000	0.000
259	259	TRP	0	-0.021	-0.011	13.531	1.255	1.255	0.000	0.000	0.000	0.000
260	260	LEU	0	-0.005	-0.012	17.039	0.843	0.843	0.000	0.000	0.000	0.000
261	261	THR	0	-0.010	-0.023	15.431	0.752	0.752	0.000	0.000	0.000	0.000
262	262	GLU	-1	-0.941	-0.953	17.436	-14.887	-14.887	0.000	0.000	0.000	0.000
263	263	LYS	1	0.894	0.950	18.970	13.264	13.264	0.000	0.000	0.000	0.000
264	264	MET	0	-0.023	-0.018	21.324	0.469	0.469	0.000	0.000	0.000	0.000
265	265	HIS	0	-0.029	-0.016	18.422	0.279	0.279	0.000	0.000	0.000	0.000
266	266	ALA	0	-0.023	0.003	22.423	0.367	0.367	0.000	0.000	0.000	0.000
267	267	ARG	1	0.753	0.864	24.731	11.039	11.039	0.000	0.000	0.000	0.000
268	268	ASP	-1	-0.914	-0.941	26.096	-10.253	-10.253	0.000	0.000	0.000	0.000
269	269	PHE	0	-0.036	-0.013	25.081	0.248	0.248	0.000	0.000	0.000	0.000
270	270	THR	0	-0.010	-0.003	23.758	-0.526	-0.526	0.000	0.000	0.000	0.000
271	271	VAL	0	0.019	-0.004	19.359	0.226	0.226	0.000	0.000	0.000	0.000
272	272	SER	0	-0.004	0.024	16.827	-0.483	-0.483	0.000	0.000	0.000	0.000
273	273	ALA	0	0.031	0.014	13.682	0.233	0.233	0.000	0.000	0.000	0.000
274	274	MET	0	-0.018	-0.013	10.566	-0.251	-0.251	0.000	0.000	0.000	0.000
275	275	HIS	0	0.033	0.009	6.953	-1.707	-1.707	0.000	0.000	0.000	0.000
280	280	GLN	0	0.002	-0.019	6.204	-0.483	-0.483	0.000	0.000	0.000	0.000
281	281	LYS	1	0.896	0.938	7.675	25.654	25.654	0.000	0.000	0.000	0.000
282	282	GLU	-1	-0.880	-0.924	9.695	-19.337	-19.337	0.000	0.000	0.000	0.000
284	284	ASP	-1	-0.838	-0.907	10.354	-17.029	-17.029	0.000	0.000	0.000	0.000
285	285	VAL	0	-0.011	-0.004	13.080	1.472	1.472	0.000	0.000	0.000	0.000
286	286	ILE	0	0.040	0.016	11.926	1.178	1.178	0.000	0.000	0.000	0.000
287	287	MET	0	0.026	0.013	14.109	1.515	1.515	0.000	0.000	0.000	0.000
288	288	ARG	1	0.798	0.888	15.851	17.368	17.368	0.000	0.000	0.000	0.000
289	289	GLU	-1	-0.864	-0.932	18.317	-12.780	-12.780	0.000	0.000	0.000	0.000
290	290	PHE	0	-0.021	-0.004	18.396	0.643	0.643	0.000	0.000	0.000	0.000
291	291	ARG	1	0.824	0.885	17.131	15.990	15.990	0.000	0.000	0.000	0.000
292	292	SER	0	-0.018	0.001	21.778	0.705	0.705	0.000	0.000	0.000	0.000
293	293	GLY	0	-0.049	-0.009	23.462	0.537	0.537	0.000	0.000	0.000	0.000
294	294	SER	0	-0.034	-0.013	23.254	0.270	0.270	0.000	0.000	0.000	0.000
295	295	SER	0	-0.032	-0.003	19.352	0.179	0.179	0.000	0.000	0.000	0.000
296	296	ARG	1	0.889	0.926	22.279	10.310	10.310	0.000	0.000	0.000	0.000
297	297	VAL	0	0.039	0.008	21.400	0.163	0.163	0.000	0.000	0.000	0.000
298	298	LEU	0	-0.018	-0.002	14.516	-0.288	-0.288	0.000	0.000	0.000	0.000
299	299	ILE	0	0.014	0.007	15.659	0.256	0.256	0.000	0.000	0.000	0.000
300	300	THR	0	-0.022	-0.037	13.375	-1.532	-1.532	0.000	0.000	0.000	0.000
301	301	THR	0	0.033	0.005	9.556	1.455	1.455	0.000	0.000	0.000	0.000
302	302	ASP	-1	-0.802	-0.888	12.738	-17.559	-17.559	0.000	0.000	0.000	0.000
303	303	LEU	0	-0.015	0.015	7.804	0.083	0.083	0.000	0.000	0.000	0.000
304	304	LEU	0	-0.012	-0.018	10.908	0.420	0.420	0.000	0.000	0.000	0.000
305	305	ALA	0	0.026	0.013	14.105	1.309	1.309	0.000	0.000	0.000	0.000
306	306	ARG	1	0.783	0.857	13.853	16.977	16.977	0.000	0.000	0.000	0.000
307	307	GLY	0	0.053	0.022	15.476	-0.516	-0.516	0.000	0.000	0.000	0.000
308	308	ILE	0	-0.051	-0.021	14.102	0.583	0.583	0.000	0.000	0.000	0.000
309	309	ASP	-1	-0.857	-0.916	18.034	-11.596	-11.596	0.000	0.000	0.000	0.000
310	310	VAL	0	0.005	-0.002	19.881	-0.089	-0.089	0.000	0.000	0.000	0.000
311	311	GLN	0	0.036	0.008	22.965	0.435	0.435	0.000	0.000	0.000	0.000
312	312	GLN	0	0.014	-0.009	25.507	0.183	0.183	0.000	0.000	0.000	0.000
313	313	VAL	0	-0.039	-0.002	22.465	0.251	0.251	0.000	0.000	0.000	0.000
314	314	SER	0	0.003	0.008	25.876	0.297	0.297	0.000	0.000	0.000	0.000
315	315	LEU	0	-0.010	-0.003	26.330	0.058	0.058	0.000	0.000	0.000	0.000
316	316	VAL	0	-0.006	0.001	22.273	-0.515	-0.515	0.000	0.000	0.000	0.000
317	317	ILE	0	0.016	0.008	23.195	0.446	0.446	0.000	0.000	0.000	0.000
318	318	ASN	0	-0.001	-0.003	21.961	-1.318	-1.318	0.000	0.000	0.000	0.000
319	319	TYR	0	0.056	0.020	20.329	0.621	0.621	0.000	0.000	0.000	0.000
320	320	ASP	-1	-0.752	-0.851	18.368	-15.037	-15.037	0.000	0.000	0.000	0.000
321	321	LEU	0	0.041	0.021	21.301	-0.207	-0.207	0.000	0.000	0.000	0.000
322	322	PRO	0	-0.006	0.025	19.926	-0.442	-0.442	0.000	0.000	0.000	0.000
323	323	THR	0	0.035	0.005	19.421	0.797	0.797	0.000	0.000	0.000	0.000
324	324	ASN	0	-0.010	-0.011	19.565	0.522	0.522	0.000	0.000	0.000	0.000
325	325	ARG	1	0.967	0.991	21.512	11.783	11.783	0.000	0.000	0.000	0.000
326	326	GLU	-1	-0.827	-0.909	21.494	-12.217	-12.217	0.000	0.000	0.000	0.000
327	327	ASN	0	-0.038	-0.041	17.239	0.004	0.004	0.000	0.000	0.000	0.000
328	328	TYR	0	-0.014	-0.013	20.154	-0.329	-0.329	0.000	0.000	0.000	0.000
329	329	ILE	0	0.008	0.000	23.169	0.061	0.061	0.000	0.000	0.000	0.000
330	330	HIS	0	-0.044	-0.008	18.675	-0.038	-0.038	0.000	0.000	0.000	0.000
331	331	ARG	1	0.818	0.879	17.169	15.872	15.872	0.000	0.000	0.000	0.000
332	332	ILE	0	0.003	0.004	20.717	0.077	0.077	0.000	0.000	0.000	0.000
333	333	GLY	0	0.014	0.016	23.278	0.359	0.359	0.000	0.000	0.000	0.000
334	334	ARG	1	0.746	0.874	18.059	14.523	14.523	0.000	0.000	0.000	0.000
335	335	GLY	0	0.017	0.014	22.154	-0.018	-0.018	0.000	0.000	0.000	0.000
336	336	GLY	0	0.028	0.002	25.712	0.082	0.082	0.000	0.000	0.000	0.000
337	337	ARG	1	0.757	0.903	23.993	12.253	12.253	0.000	0.000	0.000	0.000
338	338	PHE	0	-0.014	-0.026	27.686	0.282	0.282	0.000	0.000	0.000	0.000
339	339	GLY	0	0.006	0.009	30.147	0.259	0.259	0.000	0.000	0.000	0.000
340	340	ARG	1	0.861	0.953	29.238	10.088	10.088	0.000	0.000	0.000	0.000
341	341	LYS	1	0.874	0.946	32.154	7.991	7.991	0.000	0.000	0.000	0.000
342	342	GLY	0	0.051	0.010	30.110	-0.183	-0.183	0.000	0.000	0.000	0.000
343	343	VAL	0	-0.054	-0.023	29.416	0.289	0.289	0.000	0.000	0.000	0.000
344	344	ALA	0	0.017	0.010	27.654	-0.438	-0.438	0.000	0.000	0.000	0.000
345	345	ILE	0	0.028	0.008	27.375	0.384	0.384	0.000	0.000	0.000	0.000
346	346	ASN	0	-0.023	-0.011	26.569	-0.937	-0.937	0.000	0.000	0.000	0.000
347	347	MET	0	-0.014	0.000	25.460	0.235	0.235	0.000	0.000	0.000	0.000
348	348	VAL	0	-0.030	-0.010	26.713	-0.296	-0.296	0.000	0.000	0.000	0.000
349	349	THR	0	-0.011	-0.019	27.622	0.413	0.413	0.000	0.000	0.000	0.000
350	350	GLU	-1	-0.815	-0.929	30.295	-8.563	-8.563	0.000	0.000	0.000	0.000
351	351	GLU	-1	-0.975	-0.971	27.901	-10.333	-10.333	0.000	0.000	0.000	0.000
352	352	ASP	-1	-0.814	-0.888	26.196	-11.642	-11.642	0.000	0.000	0.000	0.000
353	353	LYS	1	0.818	0.890	28.914	8.514	8.514	0.000	0.000	0.000	0.000
354	354	ARG	1	0.846	0.921	30.385	9.517	9.517	0.000	0.000	0.000	0.000
355	355	THR	0	0.058	0.019	25.048	0.166	0.166	0.000	0.000	0.000	0.000
356	356	LEU	0	0.044	0.025	28.489	-0.136	-0.136	0.000	0.000	0.000	0.000
357	357	ARG	1	0.985	1.005	30.231	8.435	8.435	0.000	0.000	0.000	0.000
358	358	ASP	-1	-0.884	-0.928	29.341	-9.737	-9.737	0.000	0.000	0.000	0.000
359	359	ILE	0	-0.048	-0.023	25.673	-0.075	-0.075	0.000	0.000	0.000	0.000
360	360	GLU	-1	-0.855	-0.941	29.645	-8.701	-8.701	0.000	0.000	0.000	0.000
361	361	THR	0	-0.062	-0.038	33.230	0.302	0.302	0.000	0.000	0.000	0.000
362	362	PHE	0	-0.089	-0.042	26.528	0.160	0.160	0.000	0.000	0.000	0.000
363	363	TYR	0	-0.037	-0.060	25.200	0.003	0.003	0.000	0.000	0.000	0.000
364	364	ASN	0	-0.081	-0.031	31.895	0.041	0.041	0.000	0.000	0.000	0.000
365	365	THR	0	0.002	0.004	32.735	0.178	0.178	0.000	0.000	0.000	0.000
366	366	SER	0	-0.001	-0.001	36.060	0.072	0.072	0.000	0.000	0.000	0.000
367	367	ILE	0	-0.058	-0.016	31.211	-0.117	-0.117	0.000	0.000	0.000	0.000
368	368	GLU	-1	-0.911	-0.950	35.493	-7.664	-7.664	0.000	0.000	0.000	0.000
369	369	GLU	-1	-0.980	-0.991	35.437	-8.451	-8.451	0.000	0.000	0.000	0.000
370	370	MET	0	-0.030	-0.020	33.022	0.041	0.041	0.000	0.000	0.000	0.000
371	371	PRO	0	0.004	0.008	35.604	0.164	0.164	0.000	0.000	0.000	0.000
372	372	LEU	0	0.007	-0.002	37.144	-0.138	-0.138	0.000	0.000	0.000	0.000
373	373	ASN	0	-0.027	-0.017	38.656	-0.139	-0.139	0.000	0.000	0.000	0.000
374	374	VAL	0	0.069	0.030	33.232	0.012	0.012	0.000	0.000	0.000	0.000
375	375	ALA	0	-0.003	-0.005	36.534	-0.038	-0.038	0.000	0.000	0.000	0.000
376	376	ASP	-1	-0.902	-0.942	38.939	-7.255	-7.255	0.000	0.000	0.000	0.000
377	377	LEU	0	-0.104	-0.066	34.965	0.037	0.037	0.000	0.000	0.000	0.000
378	378	ILE	-1	-0.923	-0.945	33.055	-8.682	-8.682	0.000	0.000	0.000	0.000
379	379	A	0	-0.365	-0.305	21.080	0.060	0.060	0.000	0.000	0.000	0.000
380	379	A	-1	-0.516	-0.616	15.635	-16.265	-16.265	0.000	0.000	0.000	0.000
381	380	G	0	-0.374	-0.321	18.031	-0.186	-0.186	0.000	0.000	0.000	0.000
382	380	G	-1	-0.527	-0.627	13.985	-19.177	-19.177	0.000	0.000	0.000	0.000
383	381	A	0	-0.383	-0.324	16.460	0.152	0.152	0.000	0.000	0.000	0.000
384	381	A	-1	-0.608	-0.673	12.141	-22.255	-22.255	0.000	0.000	0.000	0.000
385	382	G	0	-0.361	-0.301	13.149	-0.425	-0.425	0.000	0.000	0.000	0.000
386	382	G	-1	-0.515	-0.649	9.211	-26.766	-26.766	0.000	0.000	0.000	0.000
387	383	A	0	-0.351	-0.293	9.364	0.023	0.023	0.000	0.000	0.000	0.000
388	383	A	-1	-0.481	-0.599	6.052	-34.191	-34.191	0.000	0.000	0.000	0.000
389	384	A	0	-0.362	-0.299	5.825	-1.598	-1.598	0.000	0.000	0.000	0.000
396	387	G	-1	-0.644	-0.696	7.323	-24.634	-24.634	0.000	0.000	0.000	0.000
397	388	G	0	-0.318	-0.277	6.537	-5.583	-5.583	0.000	0.000	0.000	0.000
398	388	G	0	0.272	0.247	11.855	1.308	1.308	0.000	0.000	0.000	0.000

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