FMO DATABASE

FMODB ID: MV4YZ

Calculation Name: 6XKI-A-MD433-94ns

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	-7630705.086185
FMO2-HF: Nuclear repulsion	7461351.217156
FMO2-HF: Total energy	-169353.869029
FMO2-MP2: Total energy	-169831.988004

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.
-334.613390	-278.596720	48.717995	-23.702419	-81.032245	0.099314

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.
-59.015	-23.832	36.39	-15.941	-55.635	-0.075

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 : -0.128 / q_NPA : -0.041

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	0.022	0.004	3.160	-1.045	-0.044	1.103	-0.458	-1.646	0.001
132	132	GLY	0	0.047	0.026	2.433	-2.166	-1.032	8.596	-4.481	-5.247	-0.006
133	133	ARG	1	0.818	0.867	2.485	0.987	-1.291	1.236	3.750	-2.708	-0.024
134	134	VAL	0	0.035	0.016	5.083	-0.156	0.025	-0.001	-0.011	-0.168	0.000
135	135	PHE	0	0.046	0.014	2.436	-11.588	-3.631	7.104	-3.581	-11.480	0.013
136	136	ASP	-1	-0.718	-0.820	2.560	-5.971	-2.207	1.254	-1.969	-3.050	-0.007
137	137	MET	0	-0.022	-0.015	3.116	1.164	0.849	0.062	0.620	-0.368	0.000
139	139	ASN	0	-0.099	-0.071	2.721	-0.555	0.641	0.526	-0.399	-1.324	-0.001
140	140	ARG	1	0.791	0.889	4.241	0.268	0.449	-0.001	-0.011	-0.169	0.000
166	166	ASP	-1	-0.937	-0.981	4.660	-0.693	-0.553	-0.001	-0.012	-0.127	0.000
167	167	GLN	0	0.103	0.050	2.685	-7.443	-3.405	6.317	-2.815	-7.541	-0.008
168	168	ILE	0	-0.027	-0.016	3.453	-1.552	-1.015	0.044	0.224	-0.805	-0.001
170	170	ASP	-1	-0.886	-0.931	2.494	-7.336	-4.194	2.311	-2.164	-3.290	-0.022
171	171	ILE	0	-0.059	-0.031	2.635	-0.573	0.749	0.244	-0.236	-1.330	-0.001
172	172	PHE	0	-0.034	-0.023	4.954	0.331	0.344	-0.001	-0.005	-0.007	0.000
391	385	G	0	-0.327	-0.280	2.373	-3.083	-1.433	0.673	-0.673	-1.650	-0.006
392	385	G	-1	-0.451	-0.596	2.526	-4.120	-1.954	0.591	-0.950	-1.809	-0.007
393	386	G	0	-0.387	-0.323	2.746	-7.472	0.801	5.808	-2.342	-11.738	-0.009
394	386	G	-1	-0.592	-0.642	2.685	-2.307	-1.226	0.525	-0.428	-1.178	0.003
1	1	GLU	0	-0.080	-0.055	40.852	0.001	0.001	0.000	0.000	0.000	0.000
2	2	ILE	0	-0.038	-0.020	33.833	0.001	0.001	0.000	0.000	0.000	0.000
3	3	VAL	0	0.071	0.048	34.750	-0.001	-0.001	0.000	0.000	0.000	0.000
4	4	ASP	-1	-0.920	-0.962	36.878	-0.041	-0.041	0.000	0.000	0.000	0.000
5	5	SER	0	0.071	-0.012	37.577	-0.005	-0.005	0.000	0.000	0.000	0.000
6	6	PHE	0	0.008	-0.017	31.237	0.002	0.002	0.000	0.000	0.000	0.000
7	7	ASP	-1	-0.836	-0.883	35.423	-0.030	-0.030	0.000	0.000	0.000	0.000
8	8	ASP	-1	-0.859	-0.920	38.169	-0.021	-0.021	0.000	0.000	0.000	0.000
9	9	MET	0	-0.180	-0.087	31.725	0.002	0.002	0.000	0.000	0.000	0.000
10	10	ASN	0	-0.069	-0.025	33.956	0.002	0.002	0.000	0.000	0.000	0.000
11	11	LEU	0	-0.020	-0.003	30.084	0.003	0.003	0.000	0.000	0.000	0.000
12	12	SER	0	0.022	-0.001	31.921	0.001	0.001	0.000	0.000	0.000	0.000
13	13	GLU	-1	-0.908	-0.952	33.729	-0.029	-0.029	0.000	0.000	0.000	0.000
14	14	SER	0	-0.007	-0.010	33.645	-0.004	-0.004	0.000	0.000	0.000	0.000
15	15	LEU	0	0.015	0.005	28.192	-0.006	-0.006	0.000	0.000	0.000	0.000
16	16	LEU	0	-0.006	0.003	31.883	-0.008	-0.008	0.000	0.000	0.000	0.000
17	17	ARG	1	0.930	0.977	34.649	0.041	0.041	0.000	0.000	0.000	0.000
18	18	GLY	0	0.020	0.012	31.707	-0.004	-0.004	0.000	0.000	0.000	0.000
19	19	ILE	0	-0.016	-0.011	30.413	-0.009	-0.009	0.000	0.000	0.000	0.000
20	20	TYR	0	-0.005	-0.010	32.518	-0.005	-0.005	0.000	0.000	0.000	0.000
21	21	ALA	0	-0.017	-0.004	34.507	-0.003	-0.003	0.000	0.000	0.000	0.000
22	22	TYR	0	-0.044	-0.018	27.145	-0.009	-0.009	0.000	0.000	0.000	0.000
23	23	GLY	0	-0.004	0.007	32.302	-0.007	-0.007	0.000	0.000	0.000	0.000
24	24	PHE	0	-0.063	-0.037	29.631	-0.005	-0.005	0.000	0.000	0.000	0.000
25	25	GLU	-1	-0.921	-0.960	34.505	-0.058	-0.058	0.000	0.000	0.000	0.000
26	26	LYS	1	0.914	0.958	36.865	0.056	0.056	0.000	0.000	0.000	0.000
27	27	PRO	0	-0.036	0.005	32.954	-0.006	-0.006	0.000	0.000	0.000	0.000
28	28	SER	0	0.021	-0.012	30.080	0.004	0.004	0.000	0.000	0.000	0.000
29	29	ALA	0	0.033	0.007	32.590	0.004	0.004	0.000	0.000	0.000	0.000
30	30	ILE	0	-0.017	0.000	26.519	0.006	0.006	0.000	0.000	0.000	0.000
31	31	GLN	0	0.050	0.036	27.994	0.011	0.011	0.000	0.000	0.000	0.000
32	32	GLN	0	-0.016	-0.031	29.425	0.003	0.003	0.000	0.000	0.000	0.000
33	33	ARG	1	0.861	0.928	30.194	0.067	0.067	0.000	0.000	0.000	0.000
34	34	ALA	0	0.025	0.007	25.472	0.006	0.006	0.000	0.000	0.000	0.000
35	35	ILE	0	0.054	0.028	26.472	0.006	0.006	0.000	0.000	0.000	0.000
36	36	LEU	0	0.020	0.018	27.268	0.008	0.008	0.000	0.000	0.000	0.000
37	37	PRO	0	-0.039	-0.022	27.056	0.008	0.008	0.000	0.000	0.000	0.000
38	38	CYS	0	-0.008	-0.003	23.124	0.006	0.006	0.000	0.000	0.000	0.000
39	39	ILE	0	0.046	0.037	24.145	0.010	0.010	0.000	0.000	0.000	0.000
40	40	LYS	1	0.877	0.933	26.334	0.002	0.002	0.000	0.000	0.000	0.000
41	41	GLY	0	0.046	0.033	23.542	0.008	0.008	0.000	0.000	0.000	0.000
42	42	TYR	0	-0.036	-0.010	22.999	0.008	0.008	0.000	0.000	0.000	0.000
43	43	ASP	-1	-0.692	-0.807	19.510	0.048	0.048	0.000	0.000	0.000	0.000
44	44	VAL	0	-0.020	-0.020	20.698	-0.004	-0.004	0.000	0.000	0.000	0.000
45	45	ILE	0	0.003	0.004	20.327	-0.011	-0.011	0.000	0.000	0.000	0.000
46	46	ALA	0	0.008	-0.015	21.648	0.006	0.006	0.000	0.000	0.000	0.000
47	47	GLN	0	-0.020	-0.015	22.564	-0.004	-0.004	0.000	0.000	0.000	0.000
48	48	ALA	0	-0.016	-0.029	23.312	0.011	0.011	0.000	0.000	0.000	0.000
49	49	GLN	0	0.067	0.037	24.510	-0.026	-0.026	0.000	0.000	0.000	0.000
50	50	SER	0	0.028	0.019	25.845	-0.004	-0.004	0.000	0.000	0.000	0.000
51	51	GLY	0	0.009	0.002	26.769	0.010	0.010	0.000	0.000	0.000	0.000
52	52	THR	0	-0.033	-0.024	27.132	0.011	0.011	0.000	0.000	0.000	0.000
53	53	GLY	0	0.056	0.039	26.975	0.011	0.011	0.000	0.000	0.000	0.000
54	54	LYS	1	0.829	0.905	18.929	0.264	0.264	0.000	0.000	0.000	0.000
55	55	THR	0	0.030	0.013	20.145	0.005	0.005	0.000	0.000	0.000	0.000
56	56	ALA	0	0.067	0.028	22.153	0.008	0.008	0.000	0.000	0.000	0.000
57	57	THR	0	-0.038	-0.029	23.878	0.015	0.015	0.000	0.000	0.000	0.000
58	58	PHE	0	0.039	0.018	17.874	0.016	0.016	0.000	0.000	0.000	0.000
59	59	ALA	0	0.010	0.010	21.480	0.013	0.013	0.000	0.000	0.000	0.000
60	60	ILE	0	0.026	0.012	22.355	0.013	0.013	0.000	0.000	0.000	0.000
61	61	SER	0	-0.015	-0.030	22.887	0.014	0.014	0.000	0.000	0.000	0.000
62	62	ILE	0	-0.004	0.005	17.971	0.014	0.014	0.000	0.000	0.000	0.000
63	63	LEU	0	-0.006	0.001	21.940	0.014	0.014	0.000	0.000	0.000	0.000
64	64	GLN	0	0.063	0.031	24.730	0.004	0.004	0.000	0.000	0.000	0.000
65	65	GLN	0	-0.085	-0.046	22.245	0.021	0.021	0.000	0.000	0.000	0.000
66	66	ILE	0	-0.047	-0.007	21.202	0.014	0.014	0.000	0.000	0.000	0.000
67	67	GLU	-1	-0.946	-0.962	24.892	0.070	0.070	0.000	0.000	0.000	0.000
68	68	LEU	0	0.026	0.007	26.155	0.004	0.004	0.000	0.000	0.000	0.000
69	69	ASP	-1	-0.922	-0.941	26.969	0.018	0.018	0.000	0.000	0.000	0.000
70	70	LEU	0	-0.047	-0.033	22.700	0.016	0.016	0.000	0.000	0.000	0.000
71	71	LYS	1	0.934	0.968	20.889	-0.073	-0.073	0.000	0.000	0.000	0.000
72	72	ALA	0	-0.022	-0.009	17.534	-0.008	-0.008	0.000	0.000	0.000	0.000
73	73	THR	0	0.016	0.000	15.611	-0.007	-0.007	0.000	0.000	0.000	0.000
74	74	GLN	0	-0.019	-0.021	17.365	0.030	0.030	0.000	0.000	0.000	0.000
75	75	ALA	0	-0.027	-0.010	16.357	0.015	0.015	0.000	0.000	0.000	0.000
76	76	LEU	0	-0.006	-0.003	9.098	-0.010	-0.010	0.000	0.000	0.000	0.000
77	77	VAL	0	-0.020	-0.008	13.117	0.011	0.011	0.000	0.000	0.000	0.000
78	78	LEU	0	-0.007	-0.004	6.778	-0.029	-0.029	0.000	0.000	0.000	0.000
79	79	ALA	0	0.060	0.013	9.725	0.043	0.043	0.000	0.000	0.000	0.000
80	80	PRO	0	0.031	0.015	9.050	-0.097	-0.097	0.000	0.000	0.000	0.000
81	81	THR	0	0.006	0.001	8.630	-0.242	-0.242	0.000	0.000	0.000	0.000
82	82	ARG	1	0.880	0.910	7.838	1.709	1.709	0.000	0.000	0.000	0.000
83	83	GLU	-1	-0.796	-0.880	11.699	-0.562	-0.562	0.000	0.000	0.000	0.000
84	84	LEU	0	-0.026	-0.007	13.962	0.078	0.078	0.000	0.000	0.000	0.000
85	85	ALA	0	0.017	0.020	12.209	0.061	0.061	0.000	0.000	0.000	0.000
86	86	GLN	0	0.037	0.002	14.340	0.100	0.100	0.000	0.000	0.000	0.000
87	87	GLN	0	-0.108	-0.050	17.154	0.046	0.046	0.000	0.000	0.000	0.000
88	88	ILE	0	0.045	0.013	15.460	0.038	0.038	0.000	0.000	0.000	0.000
89	89	GLN	0	0.048	0.021	17.744	0.035	0.035	0.000	0.000	0.000	0.000
90	90	LYS	1	0.903	0.939	19.358	0.291	0.291	0.000	0.000	0.000	0.000
91	91	VAL	0	-0.019	0.018	22.013	0.016	0.016	0.000	0.000	0.000	0.000
92	92	VAL	0	0.000	-0.015	19.399	0.019	0.019	0.000	0.000	0.000	0.000
93	93	MET	0	-0.007	0.000	22.501	0.016	0.016	0.000	0.000	0.000	0.000
94	94	ALA	0	-0.034	0.001	24.826	0.010	0.010	0.000	0.000	0.000	0.000
95	95	LEU	0	-0.031	-0.011	25.265	0.009	0.009	0.000	0.000	0.000	0.000
96	96	GLY	0	-0.002	-0.020	26.491	0.011	0.011	0.000	0.000	0.000	0.000
97	97	ASP	-1	-0.925	-0.946	27.486	-0.070	-0.070	0.000	0.000	0.000	0.000
98	98	TYR	0	0.003	-0.021	30.088	0.007	0.007	0.000	0.000	0.000	0.000
99	99	MET	0	-0.081	-0.034	27.722	0.003	0.003	0.000	0.000	0.000	0.000
100	100	GLY	0	0.025	0.020	30.028	0.008	0.008	0.000	0.000	0.000	0.000
101	101	ALA	0	-0.045	-0.019	24.973	0.004	0.004	0.000	0.000	0.000	0.000
102	102	SER	0	-0.018	-0.039	22.519	-0.011	-0.011	0.000	0.000	0.000	0.000
103	103	CYS	0	-0.070	-0.040	18.362	0.008	0.008	0.000	0.000	0.000	0.000
104	104	HIS	0	-0.020	-0.029	13.514	0.027	0.027	0.000	0.000	0.000	0.000
105	105	ALA	0	0.006	0.005	14.860	0.004	0.004	0.000	0.000	0.000	0.000
106	106	CYS	0	-0.077	-0.030	9.633	0.015	0.015	0.000	0.000	0.000	0.000
107	107	ILE	0	0.001	0.003	9.568	-0.052	-0.052	0.000	0.000	0.000	0.000
108	108	GLY	0	0.005	0.011	7.828	0.067	0.067	0.000	0.000	0.000	0.000
109	109	GLY	0	0.015	0.005	8.476	0.084	0.084	0.000	0.000	0.000	0.000
110	110	THR	0	-0.007	-0.001	10.545	0.188	0.188	0.000	0.000	0.000	0.000
111	111	ASN	0	0.020	0.015	10.676	-0.013	-0.013	0.000	0.000	0.000	0.000
112	112	VAL	0	0.096	0.048	6.684	0.046	0.046	0.000	0.000	0.000	0.000
113	113	ARG	1	0.924	0.963	9.963	0.077	0.077	0.000	0.000	0.000	0.000
114	114	ALA	0	0.026	-0.004	11.812	0.032	0.032	0.000	0.000	0.000	0.000
115	115	GLU	-1	-0.755	-0.860	10.390	-0.439	-0.439	0.000	0.000	0.000	0.000
116	116	VAL	0	0.002	-0.003	10.647	0.029	0.029	0.000	0.000	0.000	0.000
117	117	GLN	0	-0.047	-0.036	12.744	0.018	0.018	0.000	0.000	0.000	0.000
118	118	LYS	1	0.956	0.996	16.005	0.240	0.240	0.000	0.000	0.000	0.000
119	119	LEU	0	0.036	0.017	12.514	0.015	0.015	0.000	0.000	0.000	0.000
120	120	GLN	0	-0.054	-0.036	14.904	0.023	0.023	0.000	0.000	0.000	0.000
121	121	MET	0	-0.100	-0.036	18.131	0.013	0.013	0.000	0.000	0.000	0.000
122	122	GLU	-1	-0.839	-0.907	19.953	-0.080	-0.080	0.000	0.000	0.000	0.000
123	123	ALA	0	-0.070	-0.019	20.020	0.008	0.008	0.000	0.000	0.000	0.000
124	124	PRO	0	0.036	0.043	17.529	0.004	0.004	0.000	0.000	0.000	0.000
125	125	HIS	0	0.071	0.032	19.147	0.005	0.005	0.000	0.000	0.000	0.000
126	126	ILE	0	-0.029	-0.012	17.493	0.017	0.017	0.000	0.000	0.000	0.000
127	127	ILE	0	0.018	-0.001	12.132	-0.014	-0.014	0.000	0.000	0.000	0.000
128	128	VAL	0	0.007	0.007	13.032	0.014	0.014	0.000	0.000	0.000	0.000
129	129	GLY	0	0.009	-0.008	10.139	-0.011	-0.011	0.000	0.000	0.000	0.000
130	130	THR	0	-0.019	-0.002	6.306	0.138	0.138	0.000	0.000	0.000	0.000
138	138	LEU	0	-0.026	0.002	5.861	0.141	0.141	0.000	0.000	0.000	0.000
141	141	ARG	1	0.840	0.930	6.015	-1.376	-1.376	0.000	0.000	0.000	0.000
142	142	TYR	0	0.030	0.026	9.914	-0.006	-0.006	0.000	0.000	0.000	0.000
143	143	LEU	0	0.029	0.022	9.554	0.004	0.004	0.000	0.000	0.000	0.000
144	144	SER	0	-0.002	-0.010	10.932	0.095	0.095	0.000	0.000	0.000	0.000
145	145	PRO	0	0.027	-0.007	11.917	-0.047	-0.047	0.000	0.000	0.000	0.000
146	146	LYS	1	0.859	0.951	14.648	-0.240	-0.240	0.000	0.000	0.000	0.000
147	147	TYR	0	0.026	-0.010	17.189	-0.021	-0.021	0.000	0.000	0.000	0.000
148	148	ILE	0	-0.015	0.015	12.898	-0.029	-0.029	0.000	0.000	0.000	0.000
149	149	LYS	1	0.935	0.966	16.162	-0.037	-0.037	0.000	0.000	0.000	0.000
150	150	MET	0	-0.031	0.006	17.031	-0.001	-0.001	0.000	0.000	0.000	0.000
151	151	PHE	0	-0.012	-0.008	8.476	-0.004	-0.004	0.000	0.000	0.000	0.000
152	152	VAL	0	0.009	0.001	13.373	0.001	0.001	0.000	0.000	0.000	0.000
153	153	LEU	0	0.007	0.006	10.177	-0.024	-0.024	0.000	0.000	0.000	0.000
154	154	ASP	-1	-0.781	-0.881	13.254	-0.246	-0.246	0.000	0.000	0.000	0.000
155	155	GLU	-1	-0.859	-0.934	13.641	-0.377	-0.377	0.000	0.000	0.000	0.000
156	156	ALA	0	0.007	-0.001	14.020	-0.026	-0.026	0.000	0.000	0.000	0.000
157	157	ASP	-1	-0.775	-0.839	14.426	-0.276	-0.276	0.000	0.000	0.000	0.000
158	158	GLU	-1	-0.905	-0.939	12.289	-0.631	-0.631	0.000	0.000	0.000	0.000
159	159	MET	0	-0.061	-0.006	8.195	-0.033	-0.033	0.000	0.000	0.000	0.000
160	160	LEU	0	-0.031	-0.031	10.236	0.035	0.035	0.000	0.000	0.000	0.000
161	161	SER	0	-0.005	-0.004	11.928	0.011	0.011	0.000	0.000	0.000	0.000
162	162	ARG	1	0.786	0.865	11.322	0.398	0.398	0.000	0.000	0.000	0.000
163	163	GLY	0	0.082	0.064	9.390	-0.014	-0.014	0.000	0.000	0.000	0.000
164	164	PHE	0	-0.022	-0.014	5.178	-0.334	-0.334	0.000	0.000	0.000	0.000
165	165	LYS	1	0.938	0.982	7.069	0.506	0.506	0.000	0.000	0.000	0.000
169	169	TYR	0	-0.018	-0.022	6.214	-0.044	-0.044	0.000	0.000	0.000	0.000
173	173	GLN	0	-0.017	-0.010	7.020	0.235	0.235	0.000	0.000	0.000	0.000
174	174	LYS	1	0.885	0.958	7.803	-1.369	-1.369	0.000	0.000	0.000	0.000
175	175	LEU	0	-0.006	-0.001	9.383	-0.020	-0.020	0.000	0.000	0.000	0.000
176	176	ASN	0	0.039	0.021	11.655	-0.006	-0.006	0.000	0.000	0.000	0.000
177	177	SER	0	0.028	0.010	15.325	-0.053	-0.053	0.000	0.000	0.000	0.000
178	178	ASN	0	-0.040	-0.036	17.205	-0.049	-0.049	0.000	0.000	0.000	0.000
179	179	THR	0	-0.040	-0.001	13.735	-0.020	-0.020	0.000	0.000	0.000	0.000
180	180	GLN	0	-0.003	-0.013	16.876	0.000	0.000	0.000	0.000	0.000	0.000
181	181	VAL	0	-0.022	-0.017	14.213	-0.008	-0.008	0.000	0.000	0.000	0.000
182	182	VAL	0	-0.025	-0.014	16.093	-0.004	-0.004	0.000	0.000	0.000	0.000
183	183	LEU	0	0.014	0.008	15.040	-0.018	-0.018	0.000	0.000	0.000	0.000
184	184	LEU	0	0.002	-0.005	17.325	0.012	0.012	0.000	0.000	0.000	0.000
185	185	SER	0	0.001	-0.028	17.889	-0.031	-0.031	0.000	0.000	0.000	0.000
186	186	ALA	0	0.028	0.032	20.209	0.023	0.023	0.000	0.000	0.000	0.000
187	187	THR	0	-0.032	-0.012	20.841	0.013	0.013	0.000	0.000	0.000	0.000
188	188	MET	0	-0.037	-0.017	20.017	-0.012	-0.012	0.000	0.000	0.000	0.000
189	189	PRO	0	0.054	0.032	20.842	0.019	0.019	0.000	0.000	0.000	0.000
190	190	SER	0	-0.013	-0.015	22.613	0.008	0.008	0.000	0.000	0.000	0.000
191	191	ASP	-1	-0.856	-0.929	20.456	-0.142	-0.142	0.000	0.000	0.000	0.000
192	192	VAL	0	-0.026	-0.014	17.746	0.004	0.004	0.000	0.000	0.000	0.000
193	193	LEU	0	-0.040	-0.030	19.109	0.020	0.020	0.000	0.000	0.000	0.000
194	194	GLU	-1	-0.848	-0.890	20.356	0.001	0.001	0.000	0.000	0.000	0.000
195	195	VAL	0	0.006	-0.004	14.688	0.019	0.019	0.000	0.000	0.000	0.000
196	196	THR	0	-0.025	-0.025	16.507	0.024	0.024	0.000	0.000	0.000	0.000
197	197	LYS	1	0.865	0.929	17.624	0.018	0.018	0.000	0.000	0.000	0.000
198	198	LYS	1	0.885	0.963	11.650	-0.032	-0.032	0.000	0.000	0.000	0.000
199	199	PHE	0	-0.037	-0.023	9.610	0.027	0.027	0.000	0.000	0.000	0.000
200	200	MET	0	-0.049	-0.018	14.841	0.013	0.013	0.000	0.000	0.000	0.000
201	201	ARG	1	0.750	0.839	17.332	-0.100	-0.100	0.000	0.000	0.000	0.000
202	202	ASP	-1	-0.924	-0.954	21.468	0.043	0.043	0.000	0.000	0.000	0.000
203	203	PRO	0	-0.045	-0.009	21.162	-0.004	-0.004	0.000	0.000	0.000	0.000
204	204	ILE	0	0.020	0.000	23.276	-0.006	-0.006	0.000	0.000	0.000	0.000
205	205	ARG	1	0.927	0.962	24.691	0.033	0.033	0.000	0.000	0.000	0.000
206	206	ILE	0	-0.023	0.002	25.874	0.003	0.003	0.000	0.000	0.000	0.000
207	207	LEU	0	0.004	-0.007	25.002	-0.009	-0.009	0.000	0.000	0.000	0.000
208	208	VAL	0	-0.013	-0.013	27.913	0.008	0.008	0.000	0.000	0.000	0.000
209	209	LYS	1	0.933	0.974	29.068	0.079	0.079	0.000	0.000	0.000	0.000
210	210	LYS	1	0.957	0.988	28.046	0.137	0.137	0.000	0.000	0.000	0.000
211	211	GLU	-1	-0.878	-0.954	30.049	-0.113	-0.113	0.000	0.000	0.000	0.000
212	212	GLU	-1	-1.032	-1.007	32.863	-0.098	-0.098	0.000	0.000	0.000	0.000
213	213	LEU	0	-0.020	-0.011	26.667	-0.002	-0.002	0.000	0.000	0.000	0.000
214	214	THR	0	-0.004	0.006	30.112	-0.011	-0.011	0.000	0.000	0.000	0.000
215	215	LEU	0	0.017	0.008	28.719	0.002	0.002	0.000	0.000	0.000	0.000
216	216	GLU	-1	-0.887	-0.937	33.219	-0.116	-0.116	0.000	0.000	0.000	0.000
217	217	GLY	0	-0.058	-0.024	35.760	0.004	0.004	0.000	0.000	0.000	0.000
218	218	ILE	0	-0.033	-0.016	31.040	-0.001	-0.001	0.000	0.000	0.000	0.000
219	219	ARG	1	0.834	0.905	34.335	0.129	0.129	0.000	0.000	0.000	0.000
220	220	GLN	0	0.048	0.027	33.050	-0.013	-0.013	0.000	0.000	0.000	0.000
221	221	PHE	0	0.045	0.012	35.174	0.009	0.009	0.000	0.000	0.000	0.000
222	222	TYR	0	-0.050	-0.030	34.826	-0.013	-0.013	0.000	0.000	0.000	0.000
223	223	ILE	0	0.054	0.026	35.920	0.008	0.008	0.000	0.000	0.000	0.000
224	224	ASN	0	-0.037	-0.038	36.605	-0.012	-0.012	0.000	0.000	0.000	0.000
225	225	VAL	0	0.029	0.018	35.455	0.006	0.006	0.000	0.000	0.000	0.000
226	226	GLU	-1	-0.821	-0.870	37.345	-0.110	-0.110	0.000	0.000	0.000	0.000
227	227	ARG	1	0.912	0.942	37.118	0.124	0.124	0.000	0.000	0.000	0.000
228	228	GLU	-1	-0.737	-0.863	29.527	-0.232	-0.232	0.000	0.000	0.000	0.000
229	229	GLU	-1	-0.914	-0.970	33.046	-0.163	-0.163	0.000	0.000	0.000	0.000
230	230	TRP	0	0.000	-0.004	34.556	-0.001	-0.001	0.000	0.000	0.000	0.000
231	231	LYS	1	0.826	0.913	28.526	0.233	0.233	0.000	0.000	0.000	0.000
232	232	LEU	0	0.011	0.010	32.857	-0.004	-0.004	0.000	0.000	0.000	0.000
233	233	ASP	-1	-0.810	-0.909	34.386	-0.148	-0.148	0.000	0.000	0.000	0.000
234	234	THR	0	-0.007	0.003	36.295	0.007	0.007	0.000	0.000	0.000	0.000
235	235	LEU	0	-0.023	-0.020	31.259	0.001	0.001	0.000	0.000	0.000	0.000
236	236	CYS	0	-0.084	-0.039	35.449	0.000	0.000	0.000	0.000	0.000	0.000
237	237	ASP	-1	-0.896	-0.933	38.066	-0.124	-0.124	0.000	0.000	0.000	0.000
238	238	LEU	0	-0.026	-0.012	34.812	0.003	0.003	0.000	0.000	0.000	0.000
239	239	TYR	0	0.013	-0.003	34.041	-0.001	-0.001	0.000	0.000	0.000	0.000
240	240	GLU	-1	-0.901	-0.935	37.592	-0.124	-0.124	0.000	0.000	0.000	0.000
241	241	THR	0	-0.083	-0.058	37.091	0.000	0.000	0.000	0.000	0.000	0.000
242	242	LEU	0	-0.019	-0.011	32.517	-0.004	-0.004	0.000	0.000	0.000	0.000
243	243	THR	0	-0.022	-0.026	35.767	-0.003	-0.003	0.000	0.000	0.000	0.000
244	244	ILE	0	-0.009	-0.006	38.358	0.001	0.001	0.000	0.000	0.000	0.000
245	245	THR	0	-0.013	0.004	34.408	0.000	0.000	0.000	0.000	0.000	0.000
246	246	GLN	0	-0.050	-0.020	27.784	0.007	0.007	0.000	0.000	0.000	0.000
247	247	ALA	0	-0.008	-0.014	30.526	0.004	0.004	0.000	0.000	0.000	0.000
248	248	VAL	0	-0.035	-0.015	24.009	-0.011	-0.011	0.000	0.000	0.000	0.000
249	249	ILE	0	0.010	0.001	25.934	0.010	0.010	0.000	0.000	0.000	0.000
250	250	PHE	0	0.027	0.015	20.832	-0.019	-0.019	0.000	0.000	0.000	0.000
251	251	ILE	0	-0.022	-0.013	22.159	0.026	0.026	0.000	0.000	0.000	0.000
252	252	ASN	0	0.028	0.002	20.335	-0.045	-0.045	0.000	0.000	0.000	0.000
253	253	THR	0	-0.042	-0.013	18.615	-0.026	-0.026	0.000	0.000	0.000	0.000
254	254	ARG	1	0.889	0.931	10.631	1.173	1.173	0.000	0.000	0.000	0.000
255	255	ARG	1	0.981	0.988	18.685	0.470	0.470	0.000	0.000	0.000	0.000
256	256	LYS	1	0.813	0.887	21.518	0.309	0.309	0.000	0.000	0.000	0.000
257	257	VAL	0	0.028	0.014	20.780	0.027	0.027	0.000	0.000	0.000	0.000
258	258	ASP	-1	-0.938	-0.951	21.968	-0.340	-0.340	0.000	0.000	0.000	0.000
259	259	TRP	0	-0.010	-0.006	23.816	0.031	0.031	0.000	0.000	0.000	0.000
260	260	LEU	0	-0.015	-0.019	26.674	0.020	0.020	0.000	0.000	0.000	0.000
261	261	THR	0	-0.027	-0.029	25.322	0.014	0.014	0.000	0.000	0.000	0.000
262	262	GLU	-1	-0.890	-0.929	27.947	-0.205	-0.205	0.000	0.000	0.000	0.000
263	263	LYS	1	0.860	0.927	30.201	0.225	0.225	0.000	0.000	0.000	0.000
264	264	MET	0	-0.015	-0.007	31.408	0.016	0.016	0.000	0.000	0.000	0.000
265	265	HIS	0	-0.018	-0.018	28.636	0.011	0.011	0.000	0.000	0.000	0.000
266	266	ALA	0	-0.008	0.003	33.679	0.011	0.011	0.000	0.000	0.000	0.000
267	267	ARG	1	0.737	0.848	36.057	0.166	0.166	0.000	0.000	0.000	0.000
268	268	ASP	-1	-0.922	-0.947	37.374	-0.137	-0.137	0.000	0.000	0.000	0.000
269	269	PHE	0	-0.031	-0.012	34.886	0.003	0.003	0.000	0.000	0.000	0.000
270	270	THR	0	-0.016	-0.005	33.022	-0.006	-0.006	0.000	0.000	0.000	0.000
271	271	VAL	0	0.006	-0.002	29.470	0.002	0.002	0.000	0.000	0.000	0.000
272	272	SER	0	0.018	0.035	25.796	-0.001	-0.001	0.000	0.000	0.000	0.000
273	273	ALA	0	0.037	0.016	23.355	0.003	0.003	0.000	0.000	0.000	0.000
274	274	MET	0	-0.008	-0.015	17.702	-0.033	-0.033	0.000	0.000	0.000	0.000
275	275	HIS	0	0.058	0.004	16.815	-0.035	-0.035	0.000	0.000	0.000	0.000
276	276	GLY	0	0.030	-0.005	12.950	-0.008	-0.008	0.000	0.000	0.000	0.000
277	277	ASP	-1	-0.931	-0.950	13.251	-0.917	-0.917	0.000	0.000	0.000	0.000
278	278	MET	0	-0.098	-0.008	15.635	0.079	0.079	0.000	0.000	0.000	0.000
279	279	ASP	-1	-0.795	-0.885	14.876	-0.651	-0.651	0.000	0.000	0.000	0.000
280	280	GLN	0	-0.049	-0.055	13.047	-0.116	-0.116	0.000	0.000	0.000	0.000
281	281	LYS	1	0.771	0.859	15.154	0.459	0.459	0.000	0.000	0.000	0.000
282	282	GLU	-1	-0.824	-0.888	18.544	-0.324	-0.324	0.000	0.000	0.000	0.000
283	283	ARG	1	0.809	0.870	11.261	1.030	1.030	0.000	0.000	0.000	0.000
284	284	ASP	-1	-0.864	-0.932	17.218	-0.472	-0.472	0.000	0.000	0.000	0.000
285	285	VAL	0	-0.067	-0.019	19.556	0.043	0.043	0.000	0.000	0.000	0.000
286	286	ILE	0	0.017	0.007	21.338	0.025	0.025	0.000	0.000	0.000	0.000
287	287	MET	0	0.035	0.027	19.169	0.039	0.039	0.000	0.000	0.000	0.000
288	288	ARG	1	0.932	0.968	21.844	0.250	0.250	0.000	0.000	0.000	0.000
289	289	GLU	-1	-0.854	-0.898	24.354	-0.196	-0.196	0.000	0.000	0.000	0.000
290	290	PHE	0	0.054	0.040	24.101	0.016	0.016	0.000	0.000	0.000	0.000
291	291	ARG	1	0.937	0.965	24.661	0.239	0.239	0.000	0.000	0.000	0.000
292	292	SER	0	-0.117	-0.078	26.614	0.020	0.020	0.000	0.000	0.000	0.000
293	293	GLY	0	0.009	0.023	29.402	0.014	0.014	0.000	0.000	0.000	0.000
294	294	SER	0	-0.105	-0.078	30.369	0.008	0.008	0.000	0.000	0.000	0.000
295	295	SER	0	-0.027	-0.020	27.784	0.001	0.001	0.000	0.000	0.000	0.000
296	296	ARG	1	0.855	0.919	29.533	0.163	0.163	0.000	0.000	0.000	0.000
297	297	VAL	0	0.072	0.046	30.263	0.002	0.002	0.000	0.000	0.000	0.000
298	298	LEU	0	-0.041	-0.011	22.560	-0.006	-0.006	0.000	0.000	0.000	0.000
299	299	ILE	0	0.049	0.025	24.036	0.001	0.001	0.000	0.000	0.000	0.000
300	300	THR	0	-0.048	-0.054	19.725	-0.030	-0.030	0.000	0.000	0.000	0.000
301	301	THR	0	0.041	0.009	16.115	0.037	0.037	0.000	0.000	0.000	0.000
302	302	ASP	-1	-0.787	-0.885	16.386	-0.425	-0.425	0.000	0.000	0.000	0.000
303	303	LEU	0	-0.021	0.012	13.476	0.002	0.002	0.000	0.000	0.000	0.000
304	304	LEU	0	-0.006	-0.017	15.431	0.019	0.019	0.000	0.000	0.000	0.000
305	305	ALA	0	0.007	0.012	18.123	0.050	0.050	0.000	0.000	0.000	0.000
306	306	ARG	1	0.826	0.878	15.904	0.400	0.400	0.000	0.000	0.000	0.000
307	307	GLY	0	0.047	0.023	18.237	-0.023	-0.023	0.000	0.000	0.000	0.000
308	308	ILE	0	-0.015	-0.001	17.941	0.029	0.029	0.000	0.000	0.000	0.000
309	309	ASP	-1	-0.841	-0.916	21.191	-0.191	-0.191	0.000	0.000	0.000	0.000
310	310	VAL	0	-0.049	-0.010	24.104	0.016	0.016	0.000	0.000	0.000	0.000
311	311	GLN	0	0.050	0.018	26.594	0.007	0.007	0.000	0.000	0.000	0.000
312	312	GLN	0	-0.043	-0.032	29.474	0.010	0.010	0.000	0.000	0.000	0.000
313	313	VAL	0	-0.020	0.009	26.814	0.003	0.003	0.000	0.000	0.000	0.000
314	314	SER	0	0.014	0.021	30.304	0.004	0.004	0.000	0.000	0.000	0.000
315	315	LEU	0	-0.002	-0.005	32.189	0.002	0.002	0.000	0.000	0.000	0.000
316	316	VAL	0	0.004	-0.003	27.218	-0.014	-0.014	0.000	0.000	0.000	0.000
317	317	ILE	0	0.008	0.001	28.582	0.013	0.013	0.000	0.000	0.000	0.000
318	318	ASN	0	-0.004	-0.009	25.957	-0.041	-0.041	0.000	0.000	0.000	0.000
319	319	TYR	0	0.063	0.017	27.074	0.018	0.018	0.000	0.000	0.000	0.000
320	320	ASP	-1	-0.755	-0.856	24.583	-0.288	-0.288	0.000	0.000	0.000	0.000
321	321	LEU	0	0.020	0.011	25.711	-0.011	-0.011	0.000	0.000	0.000	0.000
322	322	PRO	0	-0.025	0.013	22.736	-0.009	-0.009	0.000	0.000	0.000	0.000
323	323	THR	0	0.018	0.003	21.040	0.015	0.015	0.000	0.000	0.000	0.000
324	324	ASN	0	-0.023	-0.026	17.865	0.048	0.048	0.000	0.000	0.000	0.000
325	325	ARG	1	0.982	0.987	21.760	0.182	0.182	0.000	0.000	0.000	0.000
326	326	GLU	-1	-0.844	-0.919	21.291	-0.212	-0.212	0.000	0.000	0.000	0.000
327	327	ASN	0	-0.069	-0.048	18.564	0.019	0.019	0.000	0.000	0.000	0.000
328	328	TYR	0	0.006	-0.007	21.481	-0.010	-0.010	0.000	0.000	0.000	0.000
329	329	ILE	0	0.013	0.008	24.971	0.001	0.001	0.000	0.000	0.000	0.000
330	330	HIS	0	-0.078	-0.041	20.904	-0.001	-0.001	0.000	0.000	0.000	0.000
331	331	ARG	1	0.850	0.895	20.450	0.360	0.360	0.000	0.000	0.000	0.000
332	332	ILE	0	0.011	0.001	23.823	0.005	0.005	0.000	0.000	0.000	0.000
333	333	GLY	0	0.012	0.015	26.284	0.011	0.011	0.000	0.000	0.000	0.000
334	334	ARG	1	0.753	0.878	21.516	0.292	0.292	0.000	0.000	0.000	0.000
335	335	GLY	0	0.022	0.018	25.643	0.002	0.002	0.000	0.000	0.000	0.000
336	336	GLY	0	0.012	0.006	29.382	0.003	0.003	0.000	0.000	0.000	0.000
337	337	ARG	1	0.800	0.898	25.746	0.215	0.215	0.000	0.000	0.000	0.000
338	338	PHE	0	-0.022	-0.029	30.435	0.009	0.009	0.000	0.000	0.000	0.000
339	339	GLY	0	0.023	0.013	32.570	0.008	0.008	0.000	0.000	0.000	0.000
340	340	ARG	1	0.817	0.911	32.504	0.151	0.151	0.000	0.000	0.000	0.000
341	341	LYS	1	0.949	0.975	34.918	0.105	0.105	0.000	0.000	0.000	0.000
342	342	GLY	0	0.104	0.048	33.455	-0.004	-0.004	0.000	0.000	0.000	0.000
343	343	VAL	0	-0.059	-0.004	33.761	0.009	0.009	0.000	0.000	0.000	0.000
344	344	ALA	0	0.032	0.014	31.070	-0.012	-0.012	0.000	0.000	0.000	0.000
345	345	ILE	0	0.028	0.023	31.976	0.010	0.010	0.000	0.000	0.000	0.000
346	346	ASN	0	0.003	-0.006	30.257	-0.028	-0.028	0.000	0.000	0.000	0.000
347	347	MET	0	-0.030	-0.008	31.234	0.009	0.009	0.000	0.000	0.000	0.000
348	348	VAL	0	-0.023	0.002	31.991	-0.008	-0.008	0.000	0.000	0.000	0.000
349	349	THR	0	-0.006	-0.018	32.124	0.011	0.011	0.000	0.000	0.000	0.000
350	350	GLU	-1	-0.871	-0.954	34.628	-0.115	-0.115	0.000	0.000	0.000	0.000
351	351	GLU	-1	-0.999	-0.981	29.356	-0.190	-0.190	0.000	0.000	0.000	0.000
352	352	ASP	-1	-0.813	-0.881	29.993	-0.206	-0.206	0.000	0.000	0.000	0.000
353	353	LYS	1	0.767	0.864	32.266	0.122	0.122	0.000	0.000	0.000	0.000
354	354	ARG	1	0.867	0.915	33.988	0.126	0.126	0.000	0.000	0.000	0.000
355	355	THR	0	0.043	0.019	28.164	-0.002	-0.002	0.000	0.000	0.000	0.000
356	356	LEU	0	0.046	0.031	30.984	-0.004	-0.004	0.000	0.000	0.000	0.000
357	357	ARG	1	0.868	0.941	32.841	0.112	0.112	0.000	0.000	0.000	0.000
358	358	ASP	-1	-0.857	-0.916	30.589	-0.137	-0.137	0.000	0.000	0.000	0.000
359	359	ILE	0	-0.029	-0.014	27.294	0.001	0.001	0.000	0.000	0.000	0.000
360	360	GLU	-1	-0.804	-0.897	30.423	-0.120	-0.120	0.000	0.000	0.000	0.000
361	361	THR	0	-0.073	-0.070	33.825	0.006	0.006	0.000	0.000	0.000	0.000
362	362	PHE	0	-0.045	-0.015	25.835	0.007	0.007	0.000	0.000	0.000	0.000
363	363	TYR	0	-0.025	-0.053	25.800	0.004	0.004	0.000	0.000	0.000	0.000
364	364	ASN	0	-0.043	-0.012	32.211	0.006	0.006	0.000	0.000	0.000	0.000
365	365	THR	0	-0.027	0.010	33.167	0.004	0.004	0.000	0.000	0.000	0.000
366	366	SER	0	-0.056	-0.040	36.195	0.003	0.003	0.000	0.000	0.000	0.000
367	367	ILE	0	-0.048	-0.007	33.369	-0.004	-0.004	0.000	0.000	0.000	0.000
368	368	GLU	-1	-0.893	-0.933	37.779	-0.099	-0.099	0.000	0.000	0.000	0.000
369	369	GLU	-1	-0.939	-0.971	39.196	-0.114	-0.114	0.000	0.000	0.000	0.000
370	370	MET	0	-0.038	-0.014	38.648	-0.001	-0.001	0.000	0.000	0.000	0.000
371	371	PRO	0	-0.009	-0.003	40.766	0.003	0.003	0.000	0.000	0.000	0.000
372	372	LEU	0	0.032	0.014	43.535	-0.003	-0.003	0.000	0.000	0.000	0.000
373	373	ASN	0	-0.024	-0.019	46.034	-0.003	-0.003	0.000	0.000	0.000	0.000
374	374	VAL	0	0.020	0.001	39.684	0.001	0.001	0.000	0.000	0.000	0.000
375	375	ALA	0	0.000	-0.012	41.641	-0.003	-0.003	0.000	0.000	0.000	0.000
376	376	ASP	-1	-0.910	-0.941	42.703	-0.097	-0.097	0.000	0.000	0.000	0.000
377	377	LEU	0	-0.129	-0.052	39.877	0.002	0.002	0.000	0.000	0.000	0.000
378	378	ILE	-1	-0.925	-0.956	37.150	-0.132	-0.132	0.000	0.000	0.000	0.000
379	379	A	0	-0.365	-0.305	22.087	-0.011	-0.011	0.000	0.000	0.000	0.000
380	379	A	-1	-0.556	-0.649	16.907	-0.245	-0.245	0.000	0.000	0.000	0.000
381	380	G	0	-0.352	-0.297	18.651	-0.021	-0.021	0.000	0.000	0.000	0.000
382	380	G	-1	-0.527	-0.625	15.859	-0.395	-0.395	0.000	0.000	0.000	0.000
383	381	A	0	-0.322	-0.278	14.942	-0.013	-0.013	0.000	0.000	0.000	0.000
384	381	A	-1	-0.620	-0.681	15.509	-0.488	-0.488	0.000	0.000	0.000	0.000
385	382	G	0	-0.354	-0.304	12.331	-0.070	-0.070	0.000	0.000	0.000	0.000
386	382	G	-1	-0.539	-0.666	14.895	-0.640	-0.640	0.000	0.000	0.000	0.000
387	383	A	0	-0.322	-0.285	8.531	-0.090	-0.090	0.000	0.000	0.000	0.000
388	383	A	-1	-0.466	-0.586	11.262	-0.817	-0.817	0.000	0.000	0.000	0.000
389	384	G	0	-0.354	-0.303	5.139	-0.219	-0.219	0.000	0.000	0.000	0.000
390	384	G	-1	-0.455	-0.595	7.000	-1.118	-1.118	0.000	0.000	0.000	0.000
395	387	G	0	-0.315	-0.294	6.322	-1.235	-1.235	0.000	0.000	0.000	0.000
396	387	G	-1	-0.599	-0.667	6.613	-0.073	-0.073	0.000	0.000	0.000	0.000
397	388	G	0	-0.368	-0.321	7.149	0.366	0.366	0.000	0.000	0.000	0.000
398	388	G	0	0.230	0.202	10.640	0.045	0.045	0.000	0.000	0.000	0.000

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