FMO DATABASE

FMODB ID: G6J21

Calculation Name: 6XKI-A-MD433-85ns

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	-7617513.516831
FMO2-HF: Nuclear repulsion	7448309.50535
FMO2-HF: Total energy	-169204.011481
FMO2-MP2: Total energy	-169681.717922

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.
-299.610838	-250.601287	38.930718	-21.012353	-66.927916	0.092915

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.
-45.834	-14.589	22.739	-11.887	-42.099	-0.03

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 : -0.060 / q_NPA : -0.022

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].
131	131	PRO	0	0.020	0.002	4.054	-0.254	0.030	0.000	-0.046	-0.238	0.000
132	132	GLY	0	0.046	0.031	2.479	-1.740	0.367	1.757	-1.780	-2.084	0.004
133	133	ARG	1	0.811	0.869	2.655	-2.031	-0.850	0.672	0.249	-2.102	-0.017
134	134	VAL	0	0.027	0.006	5.124	-0.427	-0.321	-0.001	-0.008	-0.097	0.000
135	135	PHE	0	0.028	0.007	2.530	-11.566	-5.072	5.735	-2.836	-9.393	0.008
136	136	ASP	-1	-0.747	-0.807	2.337	-5.411	-3.096	1.427	-1.279	-2.462	0.004
137	137	MET	0	-0.027	-0.007	3.114	0.494	0.255	0.046	0.541	-0.348	-0.001
139	139	ASN	0	-0.126	-0.069	3.392	-0.165	0.437	0.038	-0.124	-0.516	0.000
167	167	GLN	0	0.019	0.011	2.400	-6.429	-2.918	3.840	-1.895	-5.457	-0.004
168	168	ILE	0	-0.008	-0.011	4.399	-1.068	-1.065	-0.004	0.240	-0.239	0.000
170	170	ASP	-1	-0.859	-0.929	3.507	-3.222	-1.771	0.030	-0.591	-0.891	-0.004
171	171	ILE	0	-0.097	-0.042	5.324	-0.147	0.070	-0.001	-0.008	-0.208	0.000
391	385	A	-1	-0.472	-0.589	2.955	-1.839	-0.510	0.082	-0.430	-0.981	-0.001
392	385	A	0	-0.315	-0.275	2.515	-3.358	-1.654	0.976	-0.802	-1.878	-0.009
393	386	G	-1	-0.540	-0.654	2.498	-0.821	0.279	1.163	-0.636	-1.627	0.006
394	386	G	0	-0.385	-0.332	2.571	-7.472	0.246	6.815	-2.050	-12.484	-0.011
398	388	G	0	-0.285	-0.246	3.030	-3.476	-2.114	0.164	-0.432	-1.094	-0.005
1	1	GLU	0	-0.137	-0.078	34.420	0.014	0.014	0.000	0.000	0.000	0.000
2	2	ILE	0	0.048	0.011	36.300	0.002	0.002	0.000	0.000	0.000	0.000
3	3	VAL	0	0.026	0.024	34.253	-0.003	-0.003	0.000	0.000	0.000	0.000
4	4	ASP	-1	-0.930	-0.969	36.282	0.040	0.040	0.000	0.000	0.000	0.000
5	5	SER	0	0.041	0.012	38.291	-0.001	-0.001	0.000	0.000	0.000	0.000
6	6	PHE	0	0.030	-0.023	32.343	0.003	0.003	0.000	0.000	0.000	0.000
7	7	ASP	-1	-0.946	-0.958	36.360	0.025	0.025	0.000	0.000	0.000	0.000
8	8	ASP	-1	-0.828	-0.911	39.564	0.032	0.032	0.000	0.000	0.000	0.000
9	9	MET	0	-0.169	-0.084	32.846	0.004	0.004	0.000	0.000	0.000	0.000
10	10	ASN	0	-0.098	-0.042	35.648	-0.001	-0.001	0.000	0.000	0.000	0.000
11	11	LEU	0	-0.005	0.000	32.494	0.001	0.001	0.000	0.000	0.000	0.000
12	12	SER	0	0.030	0.011	34.158	-0.004	-0.004	0.000	0.000	0.000	0.000
13	13	GLU	-1	-0.875	-0.953	35.963	0.015	0.015	0.000	0.000	0.000	0.000
14	14	SER	0	-0.040	-0.017	34.665	0.000	0.000	0.000	0.000	0.000	0.000
15	15	LEU	0	0.018	0.015	30.079	-0.001	-0.001	0.000	0.000	0.000	0.000
16	16	LEU	0	0.019	0.012	33.389	0.001	0.001	0.000	0.000	0.000	0.000
17	17	ARG	1	0.911	0.958	36.201	-0.002	-0.002	0.000	0.000	0.000	0.000
18	18	GLY	0	0.032	0.021	32.777	-0.002	-0.002	0.000	0.000	0.000	0.000
19	19	ILE	0	-0.012	-0.010	32.215	0.000	0.000	0.000	0.000	0.000	0.000
20	20	TYR	0	0.000	-0.015	33.963	-0.001	-0.001	0.000	0.000	0.000	0.000
21	21	ALA	0	-0.021	-0.001	35.286	-0.001	-0.001	0.000	0.000	0.000	0.000
22	22	TYR	0	-0.036	-0.014	27.853	0.000	0.000	0.000	0.000	0.000	0.000
23	23	GLY	0	-0.031	-0.005	33.753	0.000	0.000	0.000	0.000	0.000	0.000
24	24	PHE	0	-0.069	-0.034	29.750	0.002	0.002	0.000	0.000	0.000	0.000
25	25	GLU	-1	-0.848	-0.918	34.378	0.026	0.026	0.000	0.000	0.000	0.000
26	26	LYS	1	0.932	0.959	34.994	-0.031	-0.031	0.000	0.000	0.000	0.000
27	27	PRO	0	-0.022	0.010	33.500	0.002	0.002	0.000	0.000	0.000	0.000
28	28	SER	0	0.034	0.011	31.524	0.001	0.001	0.000	0.000	0.000	0.000
29	29	ALA	0	0.028	0.001	33.267	0.003	0.003	0.000	0.000	0.000	0.000
30	30	ILE	0	-0.005	-0.005	27.710	0.000	0.000	0.000	0.000	0.000	0.000
31	31	GLN	0	0.017	-0.008	27.471	0.003	0.003	0.000	0.000	0.000	0.000
32	32	GLN	0	-0.014	0.003	30.614	0.001	0.001	0.000	0.000	0.000	0.000
33	33	ARG	1	0.908	0.949	31.779	-0.072	-0.072	0.000	0.000	0.000	0.000
34	34	ALA	0	0.008	0.012	27.287	0.004	0.004	0.000	0.000	0.000	0.000
35	35	ILE	0	0.061	0.031	27.884	0.005	0.005	0.000	0.000	0.000	0.000
36	36	LEU	0	0.025	0.024	28.811	0.001	0.001	0.000	0.000	0.000	0.000
37	37	PRO	0	0.008	-0.002	28.404	-0.001	-0.001	0.000	0.000	0.000	0.000
38	38	CYS	0	-0.026	-0.014	24.792	0.008	0.008	0.000	0.000	0.000	0.000
39	39	ILE	0	0.047	0.027	26.161	0.001	0.001	0.000	0.000	0.000	0.000
40	40	LYS	1	0.872	0.940	28.633	-0.060	-0.060	0.000	0.000	0.000	0.000
41	41	GLY	0	0.065	0.053	25.362	-0.001	-0.001	0.000	0.000	0.000	0.000
42	42	TYR	0	-0.070	-0.047	24.994	0.006	0.006	0.000	0.000	0.000	0.000
43	43	ASP	-1	-0.709	-0.826	21.341	0.167	0.167	0.000	0.000	0.000	0.000
44	44	VAL	0	-0.029	-0.022	22.399	-0.008	-0.008	0.000	0.000	0.000	0.000
45	45	ILE	0	0.002	0.006	21.018	0.014	0.014	0.000	0.000	0.000	0.000
46	46	ALA	0	0.022	-0.002	22.949	-0.013	-0.013	0.000	0.000	0.000	0.000
47	47	GLN	0	0.033	0.013	23.342	0.006	0.006	0.000	0.000	0.000	0.000
48	48	ALA	0	-0.029	-0.022	24.294	-0.010	-0.010	0.000	0.000	0.000	0.000
49	49	GLN	0	0.037	0.007	24.577	0.001	0.001	0.000	0.000	0.000	0.000
50	50	SER	0	0.008	0.009	25.835	-0.004	-0.004	0.000	0.000	0.000	0.000
51	51	GLY	0	0.057	0.028	26.723	-0.003	-0.003	0.000	0.000	0.000	0.000
52	52	THR	0	-0.040	-0.025	27.557	-0.003	-0.003	0.000	0.000	0.000	0.000
53	53	GLY	0	0.051	0.034	27.125	-0.002	-0.002	0.000	0.000	0.000	0.000
54	54	LYS	1	0.804	0.892	19.743	-0.111	-0.111	0.000	0.000	0.000	0.000
55	55	THR	0	0.054	0.016	21.027	0.011	0.011	0.000	0.000	0.000	0.000
56	56	ALA	0	0.048	0.020	22.659	0.001	0.001	0.000	0.000	0.000	0.000
57	57	THR	0	-0.022	-0.016	24.805	-0.001	-0.001	0.000	0.000	0.000	0.000
58	58	PHE	0	0.051	0.023	18.761	0.001	0.001	0.000	0.000	0.000	0.000
59	59	ALA	0	0.002	0.009	23.232	-0.001	-0.001	0.000	0.000	0.000	0.000
60	60	ILE	0	0.031	0.014	24.374	-0.003	-0.003	0.000	0.000	0.000	0.000
61	61	SER	0	-0.032	-0.027	24.358	-0.002	-0.002	0.000	0.000	0.000	0.000
62	62	ILE	0	-0.017	-0.011	20.003	0.002	0.002	0.000	0.000	0.000	0.000
63	63	LEU	0	0.003	-0.003	24.031	-0.005	-0.005	0.000	0.000	0.000	0.000
64	64	GLN	0	0.042	0.029	26.911	-0.007	-0.007	0.000	0.000	0.000	0.000
65	65	GLN	0	-0.080	-0.045	24.617	-0.001	-0.001	0.000	0.000	0.000	0.000
66	66	ILE	0	-0.058	-0.016	23.104	0.001	0.001	0.000	0.000	0.000	0.000
67	67	GLU	-1	-0.877	-0.928	26.923	0.009	0.009	0.000	0.000	0.000	0.000
68	68	LEU	0	-0.009	-0.010	27.647	-0.003	-0.003	0.000	0.000	0.000	0.000
69	69	ASP	-1	-0.915	-0.951	28.695	-0.010	-0.010	0.000	0.000	0.000	0.000
70	70	LEU	0	-0.091	-0.036	24.568	-0.006	-0.006	0.000	0.000	0.000	0.000
71	71	LYS	1	0.959	0.975	23.377	0.071	0.071	0.000	0.000	0.000	0.000
72	72	ALA	0	-0.010	-0.024	20.563	-0.011	-0.011	0.000	0.000	0.000	0.000
73	73	THR	0	-0.015	-0.009	16.096	0.003	0.003	0.000	0.000	0.000	0.000
74	74	GLN	0	-0.048	-0.041	19.080	0.013	0.013	0.000	0.000	0.000	0.000
75	75	ALA	0	-0.016	-0.001	18.584	0.014	0.014	0.000	0.000	0.000	0.000
76	76	LEU	0	-0.006	0.006	10.746	-0.016	-0.016	0.000	0.000	0.000	0.000
77	77	VAL	0	0.002	-0.002	14.681	0.016	0.016	0.000	0.000	0.000	0.000
78	78	LEU	0	-0.020	-0.008	8.426	0.015	0.015	0.000	0.000	0.000	0.000
79	79	ALA	0	0.037	0.017	11.084	-0.016	-0.016	0.000	0.000	0.000	0.000
80	80	PRO	0	0.035	0.006	9.531	0.001	0.001	0.000	0.000	0.000	0.000
81	81	THR	0	0.006	0.010	9.463	-0.087	-0.087	0.000	0.000	0.000	0.000
82	82	ARG	1	0.850	0.890	7.796	0.584	0.584	0.000	0.000	0.000	0.000
83	83	GLU	-1	-0.730	-0.858	11.956	-0.116	-0.116	0.000	0.000	0.000	0.000
84	84	LEU	0	0.002	0.012	14.682	0.011	0.011	0.000	0.000	0.000	0.000
85	85	ALA	0	0.010	0.003	12.366	0.013	0.013	0.000	0.000	0.000	0.000
86	86	GLN	0	0.010	-0.014	14.527	0.003	0.003	0.000	0.000	0.000	0.000
87	87	GLN	0	-0.038	-0.005	17.209	0.008	0.008	0.000	0.000	0.000	0.000
88	88	ILE	0	-0.002	0.001	16.038	0.002	0.002	0.000	0.000	0.000	0.000
89	89	GLN	0	-0.010	-0.012	18.346	-0.001	-0.001	0.000	0.000	0.000	0.000
90	90	LYS	1	0.958	0.979	20.130	0.032	0.032	0.000	0.000	0.000	0.000
91	91	VAL	0	-0.011	0.008	23.105	-0.001	-0.001	0.000	0.000	0.000	0.000
92	92	VAL	0	0.012	-0.005	21.055	0.001	0.001	0.000	0.000	0.000	0.000
93	93	MET	0	-0.020	0.013	23.233	-0.001	-0.001	0.000	0.000	0.000	0.000
94	94	ALA	0	0.007	0.011	25.737	-0.002	-0.002	0.000	0.000	0.000	0.000
95	95	LEU	0	-0.039	-0.023	26.837	0.001	0.001	0.000	0.000	0.000	0.000
96	96	GLY	0	0.027	0.006	27.903	0.002	0.002	0.000	0.000	0.000	0.000
97	97	ASP	-1	-0.935	-0.955	28.924	-0.016	-0.016	0.000	0.000	0.000	0.000
98	98	TYR	0	-0.027	-0.028	30.930	-0.003	-0.003	0.000	0.000	0.000	0.000
99	99	MET	0	-0.074	-0.034	30.017	0.000	0.000	0.000	0.000	0.000	0.000
100	100	GLY	0	0.023	0.023	30.778	-0.001	-0.001	0.000	0.000	0.000	0.000
101	101	ALA	0	-0.038	-0.010	25.936	-0.004	-0.004	0.000	0.000	0.000	0.000
102	102	SER	0	0.033	0.010	23.321	-0.003	-0.003	0.000	0.000	0.000	0.000
103	103	CYS	0	-0.049	-0.042	19.062	0.009	0.009	0.000	0.000	0.000	0.000
104	104	HIS	0	-0.019	-0.025	14.494	0.004	0.004	0.000	0.000	0.000	0.000
105	105	ALA	0	0.018	0.014	14.814	0.019	0.019	0.000	0.000	0.000	0.000
106	106	CYS	0	-0.061	-0.013	9.972	-0.026	-0.026	0.000	0.000	0.000	0.000
107	107	ILE	0	0.016	0.004	9.452	0.061	0.061	0.000	0.000	0.000	0.000
108	108	GLY	0	0.034	0.021	8.038	-0.010	-0.010	0.000	0.000	0.000	0.000
109	109	GLY	0	0.017	-0.008	8.606	0.002	0.002	0.000	0.000	0.000	0.000
110	110	THR	0	-0.038	-0.014	11.177	0.024	0.024	0.000	0.000	0.000	0.000
111	111	ASN	0	0.030	0.012	11.933	-0.058	-0.058	0.000	0.000	0.000	0.000
112	112	VAL	0	0.108	0.042	9.634	0.030	0.030	0.000	0.000	0.000	0.000
113	113	ARG	1	0.847	0.912	12.394	0.409	0.409	0.000	0.000	0.000	0.000
114	114	ALA	0	-0.020	-0.005	15.765	0.023	0.023	0.000	0.000	0.000	0.000
115	115	GLU	-1	-0.775	-0.871	10.989	-0.158	-0.158	0.000	0.000	0.000	0.000
116	116	VAL	0	-0.008	-0.007	12.452	0.024	0.024	0.000	0.000	0.000	0.000
117	117	GLN	0	-0.003	-0.005	14.799	0.037	0.037	0.000	0.000	0.000	0.000
118	118	LYS	1	0.957	0.981	16.900	0.142	0.142	0.000	0.000	0.000	0.000
119	119	LEU	0	0.003	0.007	10.840	0.015	0.015	0.000	0.000	0.000	0.000
120	120	GLN	0	-0.019	-0.008	13.394	-0.009	-0.009	0.000	0.000	0.000	0.000
121	121	MET	0	-0.108	-0.064	15.887	0.022	0.022	0.000	0.000	0.000	0.000
122	122	GLU	-1	-0.932	-0.961	19.279	-0.065	-0.065	0.000	0.000	0.000	0.000
123	123	ALA	0	-0.077	-0.018	18.601	0.014	0.014	0.000	0.000	0.000	0.000
124	124	PRO	0	0.022	0.020	18.026	0.013	0.013	0.000	0.000	0.000	0.000
125	125	HIS	0	0.076	0.054	19.532	0.008	0.008	0.000	0.000	0.000	0.000
126	126	ILE	0	-0.017	-0.007	18.589	0.016	0.016	0.000	0.000	0.000	0.000
127	127	ILE	0	0.004	0.003	12.902	-0.020	-0.020	0.000	0.000	0.000	0.000
128	128	VAL	0	0.012	0.006	13.943	0.034	0.034	0.000	0.000	0.000	0.000
129	129	GLY	0	0.031	0.002	10.641	-0.041	-0.041	0.000	0.000	0.000	0.000
130	130	THR	0	-0.014	-0.015	6.802	0.032	0.032	0.000	0.000	0.000	0.000
138	138	LEU	0	0.019	0.018	6.704	0.004	0.004	0.000	0.000	0.000	0.000
140	140	ARG	1	0.739	0.853	5.152	1.338	1.338	0.000	0.000	0.000	0.000
141	141	ARG	1	0.891	0.946	6.897	0.275	0.275	0.000	0.000	0.000	0.000
142	142	TYR	0	-0.001	-0.006	9.259	0.037	0.037	0.000	0.000	0.000	0.000
143	143	LEU	0	0.067	0.049	10.119	0.048	0.048	0.000	0.000	0.000	0.000
144	144	SER	0	0.004	-0.013	11.120	0.014	0.014	0.000	0.000	0.000	0.000
145	145	PRO	0	0.037	0.008	11.885	0.013	0.013	0.000	0.000	0.000	0.000
146	146	LYS	1	0.857	0.943	14.398	0.014	0.014	0.000	0.000	0.000	0.000
147	147	TYR	0	0.035	-0.005	17.779	0.004	0.004	0.000	0.000	0.000	0.000
148	148	ILE	0	-0.025	0.012	14.753	0.001	0.001	0.000	0.000	0.000	0.000
149	149	LYS	1	0.884	0.939	18.844	-0.045	-0.045	0.000	0.000	0.000	0.000
150	150	MET	0	-0.027	0.007	19.067	0.003	0.003	0.000	0.000	0.000	0.000
151	151	PHE	0	-0.007	-0.010	9.924	-0.006	-0.006	0.000	0.000	0.000	0.000
152	152	VAL	0	0.015	0.006	15.662	0.001	0.001	0.000	0.000	0.000	0.000
153	153	LEU	0	0.010	0.003	11.787	0.027	0.027	0.000	0.000	0.000	0.000
154	154	ASP	-1	-0.785	-0.888	14.591	0.104	0.104	0.000	0.000	0.000	0.000
155	155	GLU	-1	-0.854	-0.930	14.436	0.144	0.144	0.000	0.000	0.000	0.000
156	156	ALA	0	0.002	-0.010	14.466	0.028	0.028	0.000	0.000	0.000	0.000
157	157	ASP	-1	-0.769	-0.832	14.784	0.248	0.248	0.000	0.000	0.000	0.000
158	158	GLU	-1	-0.863	-0.922	11.963	0.302	0.302	0.000	0.000	0.000	0.000
159	159	MET	0	-0.081	-0.006	8.204	0.072	0.072	0.000	0.000	0.000	0.000
160	160	LEU	0	-0.025	-0.027	10.626	0.145	0.145	0.000	0.000	0.000	0.000
161	161	SER	0	0.011	0.006	11.281	-0.001	-0.001	0.000	0.000	0.000	0.000
162	162	ARG	1	0.778	0.848	10.709	-0.289	-0.289	0.000	0.000	0.000	0.000
163	163	GLY	0	0.032	0.033	7.824	0.146	0.146	0.000	0.000	0.000	0.000
164	164	PHE	0	0.000	0.008	5.668	0.459	0.459	0.000	0.000	0.000	0.000
165	165	LYS	1	0.880	0.943	7.255	-0.316	-0.316	0.000	0.000	0.000	0.000
166	166	ASP	-1	-0.837	-0.919	5.479	0.737	0.737	0.000	0.000	0.000	0.000
169	169	TYR	0	-0.014	-0.019	7.582	-0.248	-0.248	0.000	0.000	0.000	0.000
172	172	PHE	0	-0.019	-0.014	7.340	-0.055	-0.055	0.000	0.000	0.000	0.000
173	173	GLN	0	-0.046	-0.017	7.487	0.008	0.008	0.000	0.000	0.000	0.000
174	174	LYS	1	0.887	0.964	8.363	-0.215	-0.215	0.000	0.000	0.000	0.000
175	175	LEU	0	-0.009	-0.001	10.963	-0.064	-0.064	0.000	0.000	0.000	0.000
176	176	ASN	0	0.004	0.005	13.898	0.004	0.004	0.000	0.000	0.000	0.000
177	177	SER	0	0.050	0.033	16.982	0.007	0.007	0.000	0.000	0.000	0.000
178	178	ASN	0	-0.044	-0.031	17.910	0.006	0.006	0.000	0.000	0.000	0.000
179	179	THR	0	-0.082	-0.047	15.957	-0.012	-0.012	0.000	0.000	0.000	0.000
180	180	GLN	0	-0.036	-0.011	18.821	0.006	0.006	0.000	0.000	0.000	0.000
181	181	VAL	0	-0.009	-0.009	15.794	0.011	0.011	0.000	0.000	0.000	0.000
182	182	VAL	0	-0.021	-0.013	17.937	-0.016	-0.016	0.000	0.000	0.000	0.000
183	183	LEU	0	0.013	0.006	16.260	0.018	0.018	0.000	0.000	0.000	0.000
184	184	LEU	0	-0.004	-0.010	18.453	-0.023	-0.023	0.000	0.000	0.000	0.000
185	185	SER	0	-0.036	-0.052	18.568	0.005	0.005	0.000	0.000	0.000	0.000
186	186	ALA	0	0.033	0.035	20.571	-0.003	-0.003	0.000	0.000	0.000	0.000
187	187	THR	0	-0.009	-0.015	20.526	-0.013	-0.013	0.000	0.000	0.000	0.000
188	188	MET	0	-0.028	-0.023	19.815	0.012	0.012	0.000	0.000	0.000	0.000
189	189	PRO	0	0.033	0.032	20.636	-0.012	-0.012	0.000	0.000	0.000	0.000
190	190	SER	0	-0.027	-0.028	22.557	0.014	0.014	0.000	0.000	0.000	0.000
191	191	ASP	-1	-0.842	-0.916	20.843	0.203	0.203	0.000	0.000	0.000	0.000
192	192	VAL	0	0.011	0.008	17.336	0.021	0.021	0.000	0.000	0.000	0.000
193	193	LEU	0	-0.063	-0.047	18.754	0.017	0.017	0.000	0.000	0.000	0.000
194	194	GLU	-1	-0.811	-0.883	20.676	0.178	0.178	0.000	0.000	0.000	0.000
195	195	VAL	0	-0.030	-0.018	14.005	0.005	0.005	0.000	0.000	0.000	0.000
196	196	THR	0	0.044	0.007	15.999	0.014	0.014	0.000	0.000	0.000	0.000
197	197	LYS	1	0.810	0.897	17.921	-0.190	-0.190	0.000	0.000	0.000	0.000
198	198	LYS	1	0.872	0.950	11.686	-0.385	-0.385	0.000	0.000	0.000	0.000
199	199	PHE	0	-0.018	-0.008	10.592	0.003	0.003	0.000	0.000	0.000	0.000
200	200	MET	0	-0.066	-0.014	15.756	-0.014	-0.014	0.000	0.000	0.000	0.000
201	201	ARG	1	0.819	0.884	19.551	-0.136	-0.136	0.000	0.000	0.000	0.000
202	202	ASP	-1	-0.919	-0.963	22.726	0.127	0.127	0.000	0.000	0.000	0.000
203	203	PRO	0	-0.046	-0.004	22.089	-0.007	-0.007	0.000	0.000	0.000	0.000
204	204	ILE	0	0.036	0.021	24.665	-0.006	-0.006	0.000	0.000	0.000	0.000
205	205	ARG	1	0.946	0.971	24.145	-0.152	-0.152	0.000	0.000	0.000	0.000
206	206	ILE	0	-0.039	-0.017	26.913	-0.011	-0.011	0.000	0.000	0.000	0.000
207	207	LEU	0	-0.007	-0.005	26.379	0.006	0.006	0.000	0.000	0.000	0.000
208	208	VAL	0	0.023	0.011	28.689	-0.008	-0.008	0.000	0.000	0.000	0.000
209	209	LYS	1	0.926	0.961	29.656	-0.070	-0.070	0.000	0.000	0.000	0.000
210	210	LYS	1	0.950	0.954	28.979	-0.108	-0.108	0.000	0.000	0.000	0.000
211	211	GLU	-1	-0.921	-0.940	31.365	0.060	0.060	0.000	0.000	0.000	0.000
212	212	GLU	-1	-0.970	-0.983	32.952	0.059	0.059	0.000	0.000	0.000	0.000
213	213	LEU	0	-0.074	-0.030	26.931	0.001	0.001	0.000	0.000	0.000	0.000
214	214	THR	0	-0.013	-0.006	29.227	-0.001	-0.001	0.000	0.000	0.000	0.000
215	215	LEU	0	0.046	0.031	28.373	-0.001	-0.001	0.000	0.000	0.000	0.000
216	216	GLU	-1	-0.898	-0.949	31.749	0.045	0.045	0.000	0.000	0.000	0.000
217	217	GLY	0	-0.054	-0.021	34.070	-0.003	-0.003	0.000	0.000	0.000	0.000
218	218	ILE	0	-0.032	-0.011	30.605	-0.004	-0.004	0.000	0.000	0.000	0.000
219	219	ARG	1	0.935	0.975	34.121	-0.022	-0.022	0.000	0.000	0.000	0.000
220	220	GLN	0	0.058	0.034	32.458	0.001	0.001	0.000	0.000	0.000	0.000
221	221	PHE	0	0.037	0.007	34.925	-0.001	-0.001	0.000	0.000	0.000	0.000
222	222	TYR	0	-0.009	0.001	34.650	0.003	0.003	0.000	0.000	0.000	0.000
223	223	ILE	0	0.067	0.030	35.658	-0.003	-0.003	0.000	0.000	0.000	0.000
224	224	ASN	0	0.022	0.008	36.773	0.004	0.004	0.000	0.000	0.000	0.000
225	225	VAL	0	0.028	0.016	34.102	-0.003	-0.003	0.000	0.000	0.000	0.000
226	226	GLU	-1	-0.863	-0.904	37.584	0.029	0.029	0.000	0.000	0.000	0.000
227	227	ARG	1	0.839	0.884	35.895	-0.028	-0.028	0.000	0.000	0.000	0.000
228	228	GLU	-1	-0.752	-0.875	29.490	0.042	0.042	0.000	0.000	0.000	0.000
229	229	GLU	-1	-0.948	-0.980	33.130	0.021	0.021	0.000	0.000	0.000	0.000
230	230	TRP	0	0.006	0.010	35.113	-0.003	-0.003	0.000	0.000	0.000	0.000
231	231	LYS	1	0.824	0.931	29.079	-0.048	-0.048	0.000	0.000	0.000	0.000
232	232	LEU	0	0.009	0.010	32.721	-0.002	-0.002	0.000	0.000	0.000	0.000
233	233	ASP	-1	-0.821	-0.912	34.362	0.011	0.011	0.000	0.000	0.000	0.000
234	234	THR	0	-0.017	-0.006	35.915	0.000	0.000	0.000	0.000	0.000	0.000
235	235	LEU	0	-0.029	-0.025	31.115	-0.001	-0.001	0.000	0.000	0.000	0.000
236	236	CYS	0	-0.099	-0.057	35.274	-0.003	-0.003	0.000	0.000	0.000	0.000
237	237	ASP	-1	-0.933	-0.949	38.117	0.012	0.012	0.000	0.000	0.000	0.000
238	238	LEU	0	-0.001	-0.001	35.381	0.000	0.000	0.000	0.000	0.000	0.000
239	239	TYR	0	0.017	0.020	34.620	-0.001	-0.001	0.000	0.000	0.000	0.000
240	240	GLU	-1	-0.891	-0.935	38.153	0.004	0.004	0.000	0.000	0.000	0.000
241	241	THR	0	-0.007	-0.029	37.318	-0.001	-0.001	0.000	0.000	0.000	0.000
242	242	LEU	0	-0.041	-0.027	32.326	0.000	0.000	0.000	0.000	0.000	0.000
243	243	THR	0	-0.072	-0.047	35.504	-0.004	-0.004	0.000	0.000	0.000	0.000
244	244	ILE	0	-0.033	-0.001	38.253	-0.001	-0.001	0.000	0.000	0.000	0.000
245	245	THR	0	-0.060	-0.024	34.632	0.001	0.001	0.000	0.000	0.000	0.000
246	246	GLN	0	-0.058	-0.030	29.868	0.001	0.001	0.000	0.000	0.000	0.000
247	247	ALA	0	0.000	-0.010	30.637	0.004	0.004	0.000	0.000	0.000	0.000
248	248	VAL	0	-0.008	0.001	23.976	-0.005	-0.005	0.000	0.000	0.000	0.000
249	249	ILE	0	-0.013	0.000	26.467	0.006	0.006	0.000	0.000	0.000	0.000
250	250	PHE	0	0.026	0.004	20.926	-0.004	-0.004	0.000	0.000	0.000	0.000
251	251	ILE	0	-0.025	-0.020	21.867	0.003	0.003	0.000	0.000	0.000	0.000
252	252	ASN	0	0.010	-0.009	20.489	-0.004	-0.004	0.000	0.000	0.000	0.000
253	253	THR	0	-0.049	-0.019	18.486	0.009	0.009	0.000	0.000	0.000	0.000
254	254	ARG	1	0.938	0.951	10.580	0.124	0.124	0.000	0.000	0.000	0.000
255	255	ARG	1	0.965	0.976	18.450	-0.087	-0.087	0.000	0.000	0.000	0.000
256	256	LYS	1	0.806	0.875	21.468	-0.054	-0.054	0.000	0.000	0.000	0.000
257	257	VAL	0	0.058	0.038	20.775	-0.002	-0.002	0.000	0.000	0.000	0.000
258	258	ASP	-1	-0.826	-0.889	21.251	-0.040	-0.040	0.000	0.000	0.000	0.000
259	259	TRP	0	-0.017	-0.007	24.292	-0.001	-0.001	0.000	0.000	0.000	0.000
260	260	LEU	0	-0.017	-0.010	26.798	-0.001	-0.001	0.000	0.000	0.000	0.000
261	261	THR	0	-0.002	-0.029	25.785	-0.002	-0.002	0.000	0.000	0.000	0.000
262	262	GLU	-1	-0.884	-0.941	28.345	-0.024	-0.024	0.000	0.000	0.000	0.000
263	263	LYS	1	0.850	0.934	30.192	-0.011	-0.011	0.000	0.000	0.000	0.000
264	264	MET	0	-0.034	-0.019	30.782	0.001	0.001	0.000	0.000	0.000	0.000
265	265	HIS	0	0.011	0.017	32.092	0.000	0.000	0.000	0.000	0.000	0.000
266	266	ALA	0	-0.041	-0.018	33.845	0.000	0.000	0.000	0.000	0.000	0.000
267	267	ARG	1	0.781	0.880	36.154	-0.005	-0.005	0.000	0.000	0.000	0.000
268	268	ASP	-1	-0.905	-0.945	37.292	-0.011	-0.011	0.000	0.000	0.000	0.000
269	269	PHE	0	-0.046	-0.018	35.029	-0.001	-0.001	0.000	0.000	0.000	0.000
270	270	THR	0	-0.042	-0.020	33.919	-0.002	-0.002	0.000	0.000	0.000	0.000
271	271	VAL	0	0.000	-0.005	29.385	0.003	0.003	0.000	0.000	0.000	0.000
272	272	SER	0	-0.022	0.000	26.043	-0.006	-0.006	0.000	0.000	0.000	0.000
273	273	ALA	0	0.043	0.012	23.532	0.007	0.007	0.000	0.000	0.000	0.000
274	274	MET	0	-0.021	-0.002	17.116	-0.011	-0.011	0.000	0.000	0.000	0.000
275	275	HIS	0	-0.005	-0.008	16.538	-0.003	-0.003	0.000	0.000	0.000	0.000
276	276	GLY	0	0.027	-0.014	12.478	-0.018	-0.018	0.000	0.000	0.000	0.000
277	277	ASP	-1	-0.994	-1.002	12.068	-0.240	-0.240	0.000	0.000	0.000	0.000
278	278	MET	0	-0.044	0.011	13.968	0.004	0.004	0.000	0.000	0.000	0.000
279	279	ASP	-1	-0.926	-0.966	14.422	-0.247	-0.247	0.000	0.000	0.000	0.000
280	280	GLN	0	-0.001	-0.010	13.345	-0.021	-0.021	0.000	0.000	0.000	0.000
281	281	LYS	1	0.916	0.937	15.377	0.206	0.206	0.000	0.000	0.000	0.000
282	282	GLU	-1	-0.892	-0.938	18.822	-0.099	-0.099	0.000	0.000	0.000	0.000
283	283	ARG	1	0.816	0.857	11.757	0.253	0.253	0.000	0.000	0.000	0.000
284	284	ASP	-1	-0.938	-0.959	18.421	-0.078	-0.078	0.000	0.000	0.000	0.000
285	285	VAL	0	-0.054	-0.022	19.910	0.014	0.014	0.000	0.000	0.000	0.000
286	286	ILE	0	0.039	0.026	21.819	0.011	0.011	0.000	0.000	0.000	0.000
287	287	MET	0	0.045	0.027	19.335	0.014	0.014	0.000	0.000	0.000	0.000
288	288	ARG	1	0.921	0.964	22.724	0.077	0.077	0.000	0.000	0.000	0.000
289	289	GLU	-1	-0.871	-0.923	25.311	-0.038	-0.038	0.000	0.000	0.000	0.000
290	290	PHE	0	0.015	0.017	25.248	0.006	0.006	0.000	0.000	0.000	0.000
291	291	ARG	1	0.854	0.918	23.574	0.019	0.019	0.000	0.000	0.000	0.000
292	292	SER	0	-0.074	-0.060	27.493	0.004	0.004	0.000	0.000	0.000	0.000
293	293	GLY	0	0.021	0.015	30.263	0.001	0.001	0.000	0.000	0.000	0.000
294	294	SER	0	-0.084	-0.022	30.985	0.003	0.003	0.000	0.000	0.000	0.000
295	295	SER	0	0.000	0.001	28.427	0.002	0.002	0.000	0.000	0.000	0.000
296	296	ARG	1	0.970	0.982	30.842	0.013	0.013	0.000	0.000	0.000	0.000
297	297	VAL	0	0.055	0.012	29.638	0.004	0.004	0.000	0.000	0.000	0.000
298	298	LEU	0	-0.031	-0.005	22.349	-0.005	-0.005	0.000	0.000	0.000	0.000
299	299	ILE	0	0.014	0.012	24.273	0.008	0.008	0.000	0.000	0.000	0.000
300	300	THR	0	-0.047	-0.040	19.598	-0.010	-0.010	0.000	0.000	0.000	0.000
301	301	THR	0	0.036	-0.012	15.857	0.009	0.009	0.000	0.000	0.000	0.000
302	302	ASP	-1	-0.813	-0.915	16.248	0.081	0.081	0.000	0.000	0.000	0.000
303	303	LEU	0	-0.044	-0.003	13.436	0.008	0.008	0.000	0.000	0.000	0.000
304	304	LEU	0	0.017	-0.009	15.468	0.006	0.006	0.000	0.000	0.000	0.000
305	305	ALA	0	-0.014	0.004	18.331	0.006	0.006	0.000	0.000	0.000	0.000
306	306	ARG	1	0.831	0.881	15.409	-0.164	-0.164	0.000	0.000	0.000	0.000
307	307	GLY	0	0.020	0.015	17.729	-0.014	-0.014	0.000	0.000	0.000	0.000
308	308	ILE	0	-0.039	-0.022	16.821	-0.005	-0.005	0.000	0.000	0.000	0.000
309	309	ASP	-1	-0.893	-0.940	20.413	0.030	0.030	0.000	0.000	0.000	0.000
310	310	VAL	0	-0.044	-0.030	23.910	-0.010	-0.010	0.000	0.000	0.000	0.000
311	311	GLN	0	-0.008	-0.006	26.422	0.006	0.006	0.000	0.000	0.000	0.000
312	312	GLN	0	-0.028	-0.032	30.143	0.002	0.002	0.000	0.000	0.000	0.000
313	313	VAL	0	-0.020	0.012	27.735	0.001	0.001	0.000	0.000	0.000	0.000
314	314	SER	0	-0.027	-0.023	31.211	0.004	0.004	0.000	0.000	0.000	0.000
315	315	LEU	0	0.023	0.009	32.724	0.004	0.004	0.000	0.000	0.000	0.000
316	316	VAL	0	0.014	0.003	27.086	-0.003	-0.003	0.000	0.000	0.000	0.000
317	317	ILE	0	-0.006	-0.002	28.757	0.003	0.003	0.000	0.000	0.000	0.000
318	318	ASN	0	-0.007	-0.002	26.090	0.000	0.000	0.000	0.000	0.000	0.000
319	319	TYR	0	0.090	0.022	27.132	-0.001	-0.001	0.000	0.000	0.000	0.000
320	320	ASP	-1	-0.800	-0.876	24.575	0.053	0.053	0.000	0.000	0.000	0.000
321	321	LEU	0	0.030	0.018	25.866	-0.001	-0.001	0.000	0.000	0.000	0.000
322	322	PRO	0	-0.004	0.035	22.605	0.004	0.004	0.000	0.000	0.000	0.000
323	323	THR	0	0.034	-0.009	21.848	-0.003	-0.003	0.000	0.000	0.000	0.000
324	324	ASN	0	0.005	0.008	18.075	-0.012	-0.012	0.000	0.000	0.000	0.000
325	325	ARG	1	1.013	1.001	21.753	-0.120	-0.120	0.000	0.000	0.000	0.000
326	326	GLU	-1	-0.875	-0.922	20.476	0.165	0.165	0.000	0.000	0.000	0.000
327	327	ASN	0	-0.051	-0.036	18.386	-0.016	-0.016	0.000	0.000	0.000	0.000
328	328	TYR	0	-0.003	-0.014	20.990	-0.013	-0.013	0.000	0.000	0.000	0.000
329	329	ILE	0	0.009	0.005	24.430	-0.009	-0.009	0.000	0.000	0.000	0.000
330	330	HIS	0	-0.044	-0.025	20.433	-0.017	-0.017	0.000	0.000	0.000	0.000
331	331	ARG	1	0.800	0.868	20.793	-0.077	-0.077	0.000	0.000	0.000	0.000
332	332	ILE	0	0.004	0.003	23.503	-0.009	-0.009	0.000	0.000	0.000	0.000
333	333	GLY	0	0.020	0.027	25.445	-0.004	-0.004	0.000	0.000	0.000	0.000
334	334	ARG	1	0.785	0.897	22.078	-0.049	-0.049	0.000	0.000	0.000	0.000
335	335	GLY	0	0.037	0.021	26.046	-0.006	-0.006	0.000	0.000	0.000	0.000
336	336	GLY	0	0.010	-0.004	29.847	0.003	0.003	0.000	0.000	0.000	0.000
337	337	ARG	1	0.807	0.930	25.584	-0.025	-0.025	0.000	0.000	0.000	0.000
338	338	PHE	0	-0.023	-0.026	31.867	-0.002	-0.002	0.000	0.000	0.000	0.000
339	339	GLY	0	0.010	0.007	34.237	-0.001	-0.001	0.000	0.000	0.000	0.000
340	340	ARG	1	0.778	0.882	35.531	-0.009	-0.009	0.000	0.000	0.000	0.000
341	341	LYS	1	0.937	0.961	35.695	-0.022	-0.022	0.000	0.000	0.000	0.000
342	342	GLY	0	0.085	0.040	33.656	-0.002	-0.002	0.000	0.000	0.000	0.000
343	343	VAL	0	-0.059	-0.020	33.691	0.001	0.001	0.000	0.000	0.000	0.000
344	344	ALA	0	0.024	0.014	30.713	-0.001	-0.001	0.000	0.000	0.000	0.000
345	345	ILE	0	0.017	0.014	32.096	0.001	0.001	0.000	0.000	0.000	0.000
346	346	ASN	0	-0.005	-0.011	30.124	0.004	0.004	0.000	0.000	0.000	0.000
347	347	MET	0	-0.004	-0.002	31.375	-0.002	-0.002	0.000	0.000	0.000	0.000
348	348	VAL	0	-0.013	0.007	32.296	0.003	0.003	0.000	0.000	0.000	0.000
349	349	THR	0	-0.061	-0.050	32.376	-0.003	-0.003	0.000	0.000	0.000	0.000
350	350	GLU	-1	-0.842	-0.940	34.872	0.045	0.045	0.000	0.000	0.000	0.000
351	351	GLU	-1	-0.920	-0.954	31.835	0.064	0.064	0.000	0.000	0.000	0.000
352	352	ASP	-1	-0.877	-0.905	29.989	0.066	0.066	0.000	0.000	0.000	0.000
353	353	LYS	1	0.835	0.904	32.212	-0.040	-0.040	0.000	0.000	0.000	0.000
354	354	ARG	1	0.814	0.890	32.745	-0.076	-0.076	0.000	0.000	0.000	0.000
355	355	THR	0	0.034	0.003	27.892	0.004	0.004	0.000	0.000	0.000	0.000
356	356	LEU	0	0.018	0.018	30.806	0.002	0.002	0.000	0.000	0.000	0.000
357	357	ARG	1	0.871	0.914	33.134	-0.051	-0.051	0.000	0.000	0.000	0.000
358	358	ASP	-1	-0.820	-0.868	30.921	0.084	0.084	0.000	0.000	0.000	0.000
359	359	ILE	0	-0.033	-0.019	28.021	0.005	0.005	0.000	0.000	0.000	0.000
360	360	GLU	-1	-0.774	-0.864	30.846	0.053	0.053	0.000	0.000	0.000	0.000
361	361	THR	0	-0.067	-0.048	33.982	-0.001	-0.001	0.000	0.000	0.000	0.000
362	362	PHE	0	-0.090	-0.048	26.394	0.004	0.004	0.000	0.000	0.000	0.000
363	363	TYR	0	-0.030	-0.055	25.885	0.003	0.003	0.000	0.000	0.000	0.000
364	364	ASN	0	-0.037	0.002	32.450	-0.001	-0.001	0.000	0.000	0.000	0.000
365	365	THR	0	-0.014	-0.010	34.791	-0.004	-0.004	0.000	0.000	0.000	0.000
366	366	SER	0	-0.072	-0.049	35.992	0.003	0.003	0.000	0.000	0.000	0.000
367	367	ILE	0	-0.040	-0.015	32.524	0.000	0.000	0.000	0.000	0.000	0.000
368	368	GLU	-1	-0.861	-0.904	37.185	0.037	0.037	0.000	0.000	0.000	0.000
369	369	GLU	-1	-0.965	-0.997	39.049	0.029	0.029	0.000	0.000	0.000	0.000
370	370	MET	0	-0.046	-0.018	38.472	-0.001	-0.001	0.000	0.000	0.000	0.000
371	371	PRO	0	-0.003	0.017	40.399	-0.001	-0.001	0.000	0.000	0.000	0.000
372	372	LEU	0	0.042	0.001	43.505	-0.001	-0.001	0.000	0.000	0.000	0.000
373	373	ASN	0	-0.003	-0.010	45.992	0.000	0.000	0.000	0.000	0.000	0.000
374	374	VAL	0	0.012	0.003	39.339	-0.001	-0.001	0.000	0.000	0.000	0.000
375	375	ALA	0	0.039	0.014	41.704	0.000	0.000	0.000	0.000	0.000	0.000
376	376	ASP	-1	-0.929	-0.952	43.294	0.010	0.010	0.000	0.000	0.000	0.000
377	377	LEU	0	-0.186	-0.101	41.597	0.001	0.001	0.000	0.000	0.000	0.000
378	378	ILE	-1	-0.763	-0.828	37.425	0.014	0.014	0.000	0.000	0.000	0.000
379	379	A	-1	-0.534	-0.628	15.463	0.372	0.372	0.000	0.000	0.000	0.000
380	379	A	0	-0.368	-0.303	21.285	-0.013	-0.013	0.000	0.000	0.000	0.000
381	380	G	-1	-0.516	-0.621	16.158	0.316	0.316	0.000	0.000	0.000	0.000
382	380	G	0	-0.368	-0.311	19.592	0.006	0.006	0.000	0.000	0.000	0.000
383	381	A	-1	-0.622	-0.683	16.523	0.191	0.191	0.000	0.000	0.000	0.000
384	381	A	0	-0.374	-0.315	16.471	-0.004	-0.004	0.000	0.000	0.000	0.000
385	382	G	-1	-0.522	-0.656	15.034	0.080	0.080	0.000	0.000	0.000	0.000
386	382	G	0	-0.338	-0.290	12.742	0.105	0.105	0.000	0.000	0.000	0.000
387	383	A	-1	-0.442	-0.571	10.995	-0.067	-0.067	0.000	0.000	0.000	0.000
388	383	A	0	-0.346	-0.300	8.936	0.022	0.022	0.000	0.000	0.000	0.000
389	384	G	-1	-0.460	-0.587	7.607	-0.275	-0.275	0.000	0.000	0.000	0.000
390	384	G	0	-0.380	-0.323	5.231	-0.331	-0.331	0.000	0.000	0.000	0.000
395	387	A	-1	-0.577	-0.669	5.828	-0.691	-0.691	0.000	0.000	0.000	0.000
396	387	A	0	-0.318	-0.279	6.006	-0.158	-0.158	0.000	0.000	0.000	0.000
397	388	G	0	0.261	0.237	8.595	0.048	0.048	0.000	0.000	0.000	0.000

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