FMO DATABASE

FMODB ID: YZ442

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	-7626739.96848
FMO2-HF: Nuclear repulsion	7457685.20071
FMO2-HF: Total energy	-169054.767771
FMO2-MP2: Total energy	-169532.111861

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.
-309.641241	-261.491947	39.509449	-20.081605	-67.577138	0.073605

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.
-51.383	-18.252	24.172	-12.891	-44.411	-0.031

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 : -0.068 / q_NPA : -0.019

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	0.027	0.000	3.531	-0.573	0.074	0.037	-0.139	-0.545	0.000
132	132	GLY	0	0.028	0.019	2.645	-2.346	0.428	3.416	-2.845	-3.345	-0.001
133	133	ARG	1	0.815	0.862	2.622	-0.710	-0.594	0.846	1.227	-2.189	-0.017
134	134	VAL	0	0.023	0.007	5.106	-0.219	-0.088	-0.001	-0.010	-0.120	0.000
135	135	PHE	0	-0.009	-0.004	2.600	-11.022	-3.742	6.391	-3.182	-10.490	0.013
136	136	ASP	-1	-0.775	-0.836	2.687	-4.016	-2.345	0.265	-0.508	-1.428	0.000
137	137	MET	0	-0.034	-0.018	3.564	0.445	0.659	0.014	0.037	-0.264	0.000
139	139	ASN	0	-0.047	-0.019	2.485	0.057	0.728	1.307	-0.423	-1.555	-0.003
140	140	ARG	1	0.751	0.827	5.157	1.151	1.236	-0.001	-0.001	-0.082	0.000
166	166	ASP	-1	-0.845	-0.913	4.346	0.190	0.273	-0.001	-0.013	-0.068	0.000
167	167	GLN	0	0.003	0.011	2.690	-9.169	-4.073	5.476	-2.995	-7.577	0.012
168	168	ILE	0	0.033	0.003	3.546	-2.018	-2.035	0.027	0.965	-0.975	0.000
170	170	ASP	-1	-0.867	-0.936	2.763	-5.714	-2.013	0.746	-1.946	-2.502	-0.021
171	171	ILE	0	-0.072	-0.040	3.501	-0.313	0.498	0.044	-0.110	-0.745	0.000
391	385	A	0	-0.323	-0.290	3.031	-2.438	-1.094	0.199	-0.494	-1.049	-0.005
392	385	A	-1	-0.457	-0.581	2.723	-2.965	-1.296	0.199	-0.612	-1.255	-0.003
393	386	A	0	-0.345	-0.301	2.891	-7.050	-0.957	3.896	-1.152	-8.837	-0.009
394	386	A	-1	-0.498	-0.594	2.366	-1.375	-0.613	1.312	-0.690	-1.385	0.003
1	1	GLU	0	-0.115	-0.072	34.956	0.003	0.003	0.000	0.000	0.000	0.000
2	2	ILE	0	0.024	0.011	35.851	0.000	0.000	0.000	0.000	0.000	0.000
3	3	VAL	0	0.028	0.019	35.072	0.001	0.001	0.000	0.000	0.000	0.000
4	4	ASP	-1	-0.930	-0.967	36.449	-0.013	-0.013	0.000	0.000	0.000	0.000
5	5	SER	0	0.051	0.018	38.152	-0.003	-0.003	0.000	0.000	0.000	0.000
6	6	PHE	0	0.029	-0.005	32.313	0.002	0.002	0.000	0.000	0.000	0.000
7	7	ASP	-1	-0.933	-0.961	36.704	-0.014	-0.014	0.000	0.000	0.000	0.000
8	8	ASP	-1	-0.868	-0.931	39.450	-0.004	-0.004	0.000	0.000	0.000	0.000
9	9	MET	0	-0.147	-0.082	32.332	0.002	0.002	0.000	0.000	0.000	0.000
10	10	ASN	0	-0.063	-0.021	34.742	0.000	0.000	0.000	0.000	0.000	0.000
11	11	LEU	0	-0.011	0.000	31.285	0.001	0.001	0.000	0.000	0.000	0.000
12	12	SER	0	0.036	0.009	33.078	0.000	0.000	0.000	0.000	0.000	0.000
13	13	GLU	-1	-0.895	-0.948	34.860	-0.022	-0.022	0.000	0.000	0.000	0.000
14	14	SER	0	-0.035	-0.027	34.177	-0.003	-0.003	0.000	0.000	0.000	0.000
15	15	LEU	0	0.034	0.012	29.519	-0.005	-0.005	0.000	0.000	0.000	0.000
16	16	LEU	0	-0.019	-0.001	32.994	-0.004	-0.004	0.000	0.000	0.000	0.000
17	17	ARG	1	0.923	0.968	36.046	0.041	0.041	0.000	0.000	0.000	0.000
18	18	GLY	0	0.038	0.018	32.793	-0.003	-0.003	0.000	0.000	0.000	0.000
19	19	ILE	0	-0.027	-0.012	31.927	-0.005	-0.005	0.000	0.000	0.000	0.000
20	20	TYR	0	-0.011	-0.017	33.762	-0.002	-0.002	0.000	0.000	0.000	0.000
21	21	ALA	0	-0.049	-0.012	34.816	-0.001	-0.001	0.000	0.000	0.000	0.000
22	22	TYR	0	-0.045	-0.021	27.382	-0.008	-0.008	0.000	0.000	0.000	0.000
23	23	GLY	0	0.001	0.012	33.188	-0.003	-0.003	0.000	0.000	0.000	0.000
24	24	PHE	0	-0.083	-0.036	29.608	0.001	0.001	0.000	0.000	0.000	0.000
25	25	GLU	-1	-0.853	-0.935	35.722	-0.035	-0.035	0.000	0.000	0.000	0.000
26	26	LYS	1	0.917	0.947	37.919	0.023	0.023	0.000	0.000	0.000	0.000
27	27	PRO	0	-0.001	0.025	33.437	-0.003	-0.003	0.000	0.000	0.000	0.000
28	28	SER	0	0.055	0.032	32.089	0.003	0.003	0.000	0.000	0.000	0.000
29	29	ALA	0	0.011	-0.005	33.136	0.003	0.003	0.000	0.000	0.000	0.000
30	30	ILE	0	0.035	0.015	26.941	0.005	0.005	0.000	0.000	0.000	0.000
31	31	GLN	0	0.024	0.003	29.085	0.006	0.006	0.000	0.000	0.000	0.000
32	32	GLN	0	-0.056	-0.030	30.570	0.006	0.006	0.000	0.000	0.000	0.000
33	33	ARG	1	0.874	0.928	31.744	0.011	0.011	0.000	0.000	0.000	0.000
34	34	ALA	0	0.020	0.011	27.369	0.005	0.005	0.000	0.000	0.000	0.000
35	35	ILE	0	0.043	0.044	27.514	0.003	0.003	0.000	0.000	0.000	0.000
36	36	LEU	0	0.034	0.024	28.626	0.003	0.003	0.000	0.000	0.000	0.000
37	37	PRO	0	-0.016	-0.024	28.243	0.003	0.003	0.000	0.000	0.000	0.000
38	38	CYS	0	0.007	0.010	24.535	0.006	0.006	0.000	0.000	0.000	0.000
39	39	ILE	0	0.029	0.020	25.672	0.004	0.004	0.000	0.000	0.000	0.000
40	40	LYS	1	0.876	0.939	28.110	-0.018	-0.018	0.000	0.000	0.000	0.000
41	41	GLY	0	0.046	0.033	24.984	0.005	0.005	0.000	0.000	0.000	0.000
42	42	TYR	0	-0.056	-0.020	24.584	0.006	0.006	0.000	0.000	0.000	0.000
43	43	ASP	-1	-0.818	-0.899	20.486	0.080	0.080	0.000	0.000	0.000	0.000
44	44	VAL	0	-0.053	-0.035	21.828	-0.003	-0.003	0.000	0.000	0.000	0.000
45	45	ILE	0	-0.010	-0.005	20.493	0.000	0.000	0.000	0.000	0.000	0.000
46	46	ALA	0	0.020	-0.013	22.361	-0.002	-0.002	0.000	0.000	0.000	0.000
47	47	GLN	0	-0.014	-0.007	23.344	0.000	0.000	0.000	0.000	0.000	0.000
48	48	ALA	0	-0.020	-0.022	24.256	0.001	0.001	0.000	0.000	0.000	0.000
49	49	GLN	0	0.056	0.024	24.657	-0.010	-0.010	0.000	0.000	0.000	0.000
50	50	SER	0	0.006	-0.016	23.177	0.001	0.001	0.000	0.000	0.000	0.000
51	51	GLY	0	-0.007	0.012	25.837	0.000	0.000	0.000	0.000	0.000	0.000
52	52	THR	0	-0.008	-0.006	29.544	0.003	0.003	0.000	0.000	0.000	0.000
53	53	GLY	0	0.031	0.014	27.434	0.005	0.005	0.000	0.000	0.000	0.000
54	54	LYS	1	0.817	0.903	19.790	0.090	0.090	0.000	0.000	0.000	0.000
55	55	THR	0	0.022	0.007	21.359	0.005	0.005	0.000	0.000	0.000	0.000
56	56	ALA	0	0.024	0.007	23.161	0.003	0.003	0.000	0.000	0.000	0.000
57	57	THR	0	-0.003	-0.013	24.768	0.007	0.007	0.000	0.000	0.000	0.000
58	58	PHE	0	0.044	0.036	19.312	0.008	0.008	0.000	0.000	0.000	0.000
59	59	ALA	0	-0.001	-0.005	22.597	0.004	0.004	0.000	0.000	0.000	0.000
60	60	ILE	0	0.008	0.004	23.675	0.002	0.002	0.000	0.000	0.000	0.000
61	61	SER	0	0.005	-0.026	23.994	0.005	0.005	0.000	0.000	0.000	0.000
62	62	ILE	0	0.007	0.011	19.272	0.008	0.008	0.000	0.000	0.000	0.000
63	63	LEU	0	-0.008	-0.007	23.271	0.004	0.004	0.000	0.000	0.000	0.000
64	64	GLN	0	0.056	0.033	25.932	-0.002	-0.002	0.000	0.000	0.000	0.000
65	65	GLN	0	-0.064	-0.032	24.155	0.010	0.010	0.000	0.000	0.000	0.000
66	66	ILE	0	-0.065	-0.031	22.265	0.005	0.005	0.000	0.000	0.000	0.000
67	67	GLU	-1	-0.937	-0.963	26.037	0.016	0.016	0.000	0.000	0.000	0.000
68	68	LEU	0	0.004	-0.011	27.316	-0.001	-0.001	0.000	0.000	0.000	0.000
69	69	ASP	-1	-0.939	-0.956	28.385	-0.009	-0.009	0.000	0.000	0.000	0.000
70	70	LEU	0	-0.006	0.003	23.372	-0.001	-0.001	0.000	0.000	0.000	0.000
71	71	LYS	1	0.951	0.980	23.453	0.054	0.054	0.000	0.000	0.000	0.000
72	72	ALA	0	0.014	-0.003	19.309	0.001	0.001	0.000	0.000	0.000	0.000
73	73	THR	0	0.021	0.010	15.037	-0.011	-0.011	0.000	0.000	0.000	0.000
74	74	GLN	0	-0.021	0.000	18.028	0.028	0.028	0.000	0.000	0.000	0.000
75	75	ALA	0	0.002	0.001	17.784	0.014	0.014	0.000	0.000	0.000	0.000
76	76	LEU	0	-0.011	0.007	9.990	-0.018	-0.018	0.000	0.000	0.000	0.000
77	77	VAL	0	0.004	0.000	14.148	0.018	0.018	0.000	0.000	0.000	0.000
78	78	LEU	0	-0.012	-0.008	7.394	-0.021	-0.021	0.000	0.000	0.000	0.000
79	79	ALA	0	0.026	0.001	10.430	0.031	0.031	0.000	0.000	0.000	0.000
80	80	PRO	0	0.022	0.007	8.812	-0.061	-0.061	0.000	0.000	0.000	0.000
81	81	THR	0	0.000	-0.002	8.789	-0.171	-0.171	0.000	0.000	0.000	0.000
82	82	ARG	1	0.863	0.901	8.008	1.294	1.294	0.000	0.000	0.000	0.000
83	83	GLU	-1	-0.769	-0.865	12.053	-0.403	-0.403	0.000	0.000	0.000	0.000
84	84	LEU	0	-0.018	0.001	14.460	0.047	0.047	0.000	0.000	0.000	0.000
85	85	ALA	0	0.010	0.002	12.200	0.043	0.043	0.000	0.000	0.000	0.000
86	86	GLN	0	0.042	0.003	14.376	0.055	0.055	0.000	0.000	0.000	0.000
87	87	GLN	0	-0.011	0.015	17.169	0.023	0.023	0.000	0.000	0.000	0.000
88	88	ILE	0	-0.001	-0.007	15.669	0.024	0.024	0.000	0.000	0.000	0.000
89	89	GLN	0	0.029	0.013	17.852	0.013	0.013	0.000	0.000	0.000	0.000
90	90	LYS	1	0.936	0.981	19.675	0.173	0.173	0.000	0.000	0.000	0.000
91	91	VAL	0	-0.006	-0.004	22.614	0.012	0.012	0.000	0.000	0.000	0.000
92	92	VAL	0	0.006	-0.006	20.913	0.013	0.013	0.000	0.000	0.000	0.000
93	93	MET	0	-0.008	-0.002	23.000	0.010	0.010	0.000	0.000	0.000	0.000
94	94	ALA	0	-0.033	-0.005	25.467	0.007	0.007	0.000	0.000	0.000	0.000
95	95	LEU	0	-0.030	-0.014	26.157	0.008	0.008	0.000	0.000	0.000	0.000
96	96	GLY	0	0.035	0.006	27.679	0.008	0.008	0.000	0.000	0.000	0.000
97	97	ASP	-1	-0.944	-0.963	28.675	-0.077	-0.077	0.000	0.000	0.000	0.000
98	98	TYR	0	-0.036	-0.032	30.725	0.003	0.003	0.000	0.000	0.000	0.000
99	99	MET	0	-0.072	-0.023	28.672	0.002	0.002	0.000	0.000	0.000	0.000
100	100	GLY	0	0.026	0.026	29.632	0.004	0.004	0.000	0.000	0.000	0.000
101	101	ALA	0	-0.051	-0.025	25.483	0.001	0.001	0.000	0.000	0.000	0.000
102	102	SER	0	-0.041	-0.021	22.884	-0.013	-0.013	0.000	0.000	0.000	0.000
103	103	CYS	0	-0.064	-0.037	19.401	0.001	0.001	0.000	0.000	0.000	0.000
104	104	HIS	0	-0.043	-0.047	13.776	0.018	0.018	0.000	0.000	0.000	0.000
105	105	ALA	0	0.028	0.011	14.649	0.018	0.018	0.000	0.000	0.000	0.000
106	106	CYS	0	-0.069	-0.009	9.729	-0.009	-0.009	0.000	0.000	0.000	0.000
107	107	ILE	0	0.016	0.008	9.673	-0.024	-0.024	0.000	0.000	0.000	0.000
108	108	GLY	0	0.025	0.020	8.230	0.028	0.028	0.000	0.000	0.000	0.000
109	109	GLY	0	0.042	0.012	8.756	0.075	0.075	0.000	0.000	0.000	0.000
110	110	THR	0	-0.050	-0.026	11.554	0.097	0.097	0.000	0.000	0.000	0.000
111	111	ASN	0	0.030	0.000	12.079	-0.054	-0.054	0.000	0.000	0.000	0.000
112	112	VAL	0	0.101	0.048	8.755	0.029	0.029	0.000	0.000	0.000	0.000
113	113	ARG	1	0.960	0.986	12.057	0.252	0.252	0.000	0.000	0.000	0.000
114	114	ALA	0	-0.032	-0.030	15.200	0.030	0.030	0.000	0.000	0.000	0.000
115	115	GLU	-1	-0.739	-0.840	10.315	-0.437	-0.437	0.000	0.000	0.000	0.000
116	116	VAL	0	0.015	-0.006	11.266	0.040	0.040	0.000	0.000	0.000	0.000
117	117	GLN	0	-0.033	-0.018	13.725	0.037	0.037	0.000	0.000	0.000	0.000
118	118	LYS	1	0.934	0.973	17.021	0.251	0.251	0.000	0.000	0.000	0.000
119	119	LEU	0	0.029	0.003	11.753	0.023	0.023	0.000	0.000	0.000	0.000
120	120	GLN	0	-0.041	-0.011	15.901	0.009	0.009	0.000	0.000	0.000	0.000
121	121	MET	0	-0.091	-0.052	17.384	0.018	0.018	0.000	0.000	0.000	0.000
122	122	GLU	-1	-0.900	-0.926	20.704	-0.090	-0.090	0.000	0.000	0.000	0.000
123	123	ALA	0	-0.032	-0.009	18.833	0.013	0.013	0.000	0.000	0.000	0.000
124	124	PRO	0	0.001	-0.013	17.910	0.010	0.010	0.000	0.000	0.000	0.000
125	125	HIS	0	0.015	0.023	19.705	0.000	0.000	0.000	0.000	0.000	0.000
126	126	ILE	0	-0.029	-0.014	18.319	0.014	0.014	0.000	0.000	0.000	0.000
127	127	ILE	0	0.003	-0.002	12.820	-0.024	-0.024	0.000	0.000	0.000	0.000
128	128	VAL	0	0.013	0.012	13.743	0.024	0.024	0.000	0.000	0.000	0.000
129	129	GLY	0	0.032	-0.002	10.620	-0.023	-0.023	0.000	0.000	0.000	0.000
130	130	THR	0	-0.008	-0.013	6.628	0.104	0.104	0.000	0.000	0.000	0.000
138	138	LEU	0	0.004	0.012	6.628	0.107	0.107	0.000	0.000	0.000	0.000
141	141	ARG	1	0.889	0.948	7.318	-0.504	-0.504	0.000	0.000	0.000	0.000
142	142	TYR	0	0.004	0.007	10.068	0.045	0.045	0.000	0.000	0.000	0.000
143	143	LEU	0	0.013	0.029	9.761	0.017	0.017	0.000	0.000	0.000	0.000
144	144	SER	0	0.004	-0.006	11.346	0.067	0.067	0.000	0.000	0.000	0.000
145	145	PRO	0	0.085	0.031	12.176	-0.027	-0.027	0.000	0.000	0.000	0.000
146	146	LYS	1	0.863	0.944	14.344	-0.105	-0.105	0.000	0.000	0.000	0.000
147	147	TYR	0	0.039	-0.005	17.780	0.007	0.007	0.000	0.000	0.000	0.000
148	148	ILE	0	-0.025	0.016	13.516	-0.013	-0.013	0.000	0.000	0.000	0.000
149	149	LYS	1	0.909	0.965	17.667	-0.005	-0.005	0.000	0.000	0.000	0.000
150	150	MET	0	0.002	0.018	18.308	0.004	0.004	0.000	0.000	0.000	0.000
151	151	PHE	0	0.006	-0.012	10.672	-0.011	-0.011	0.000	0.000	0.000	0.000
152	152	VAL	0	-0.011	-0.010	14.724	0.003	0.003	0.000	0.000	0.000	0.000
153	153	LEU	0	-0.013	0.004	10.591	-0.006	-0.006	0.000	0.000	0.000	0.000
154	154	ASP	-1	-0.771	-0.884	14.368	-0.093	-0.093	0.000	0.000	0.000	0.000
155	155	GLU	-1	-0.846	-0.923	14.314	-0.122	-0.122	0.000	0.000	0.000	0.000
156	156	ALA	0	0.020	-0.004	14.392	0.003	0.003	0.000	0.000	0.000	0.000
157	157	ASP	-1	-0.774	-0.841	14.468	-0.014	-0.014	0.000	0.000	0.000	0.000
158	158	GLU	-1	-0.891	-0.934	11.541	-0.192	-0.192	0.000	0.000	0.000	0.000
159	159	MET	0	-0.074	-0.001	7.871	0.021	0.021	0.000	0.000	0.000	0.000
160	160	LEU	0	-0.023	-0.018	10.142	0.128	0.128	0.000	0.000	0.000	0.000
161	161	SER	0	-0.017	-0.015	11.006	0.003	0.003	0.000	0.000	0.000	0.000
162	162	ARG	1	0.795	0.857	10.500	0.077	0.077	0.000	0.000	0.000	0.000
163	163	GLY	0	0.075	0.054	7.839	0.036	0.036	0.000	0.000	0.000	0.000
164	164	PHE	0	0.016	-0.003	5.250	0.417	0.417	0.000	0.000	0.000	0.000
165	165	LYS	1	0.824	0.915	6.855	0.063	0.063	0.000	0.000	0.000	0.000
169	169	TYR	0	-0.022	-0.007	6.323	-0.238	-0.238	0.000	0.000	0.000	0.000
172	172	PHE	0	-0.007	-0.015	5.469	0.228	0.228	0.000	0.000	0.000	0.000
173	173	GLN	0	-0.011	-0.004	7.639	0.076	0.076	0.000	0.000	0.000	0.000
174	174	LYS	1	0.849	0.940	5.393	-2.534	-2.534	0.000	0.000	0.000	0.000
175	175	LEU	0	-0.037	0.001	9.329	-0.023	-0.023	0.000	0.000	0.000	0.000
176	176	ASN	0	-0.062	-0.022	11.692	0.038	0.038	0.000	0.000	0.000	0.000
177	177	SER	0	-0.012	-0.022	15.383	-0.018	-0.018	0.000	0.000	0.000	0.000
178	178	ASN	0	-0.024	-0.019	17.990	-0.011	-0.011	0.000	0.000	0.000	0.000
179	179	THR	0	-0.062	-0.027	14.657	-0.017	-0.017	0.000	0.000	0.000	0.000
180	180	GLN	0	0.011	0.010	17.880	0.003	0.003	0.000	0.000	0.000	0.000
181	181	VAL	0	-0.029	-0.023	15.471	-0.003	-0.003	0.000	0.000	0.000	0.000
182	182	VAL	0	-0.008	-0.010	17.356	-0.007	-0.007	0.000	0.000	0.000	0.000
183	183	LEU	0	-0.009	0.000	15.040	0.000	0.000	0.000	0.000	0.000	0.000
184	184	LEU	0	0.007	-0.007	18.077	-0.003	-0.003	0.000	0.000	0.000	0.000
185	185	SER	0	-0.027	-0.033	18.306	-0.014	-0.014	0.000	0.000	0.000	0.000
186	186	ALA	0	0.065	0.044	20.257	0.009	0.009	0.000	0.000	0.000	0.000
187	187	THR	0	-0.017	-0.013	19.786	0.003	0.003	0.000	0.000	0.000	0.000
188	188	MET	0	-0.019	-0.019	20.168	0.006	0.006	0.000	0.000	0.000	0.000
189	189	PRO	0	0.040	0.039	19.412	0.004	0.004	0.000	0.000	0.000	0.000
190	190	SER	0	-0.008	-0.011	21.056	0.009	0.009	0.000	0.000	0.000	0.000
191	191	ASP	-1	-0.851	-0.918	18.224	0.080	0.080	0.000	0.000	0.000	0.000
192	192	VAL	0	-0.017	-0.004	15.925	0.015	0.015	0.000	0.000	0.000	0.000
193	193	LEU	0	0.001	-0.017	17.508	0.011	0.011	0.000	0.000	0.000	0.000
194	194	GLU	-1	-0.851	-0.889	19.182	0.113	0.113	0.000	0.000	0.000	0.000
195	195	VAL	0	-0.004	0.001	12.979	0.013	0.013	0.000	0.000	0.000	0.000
196	196	THR	0	-0.039	-0.039	15.513	0.009	0.009	0.000	0.000	0.000	0.000
197	197	LYS	1	0.843	0.912	17.310	-0.095	-0.095	0.000	0.000	0.000	0.000
198	198	LYS	1	0.889	0.951	12.256	-0.197	-0.197	0.000	0.000	0.000	0.000
199	199	PHE	0	-0.019	-0.002	9.751	0.012	0.012	0.000	0.000	0.000	0.000
200	200	MET	0	-0.013	-0.001	14.854	-0.001	-0.001	0.000	0.000	0.000	0.000
201	201	ARG	1	0.932	0.948	18.553	-0.154	-0.154	0.000	0.000	0.000	0.000
202	202	ASP	-1	-0.947	-0.962	22.146	0.077	0.077	0.000	0.000	0.000	0.000
203	203	PRO	0	-0.005	0.016	21.991	-0.003	-0.003	0.000	0.000	0.000	0.000
204	204	ILE	0	-0.002	-0.004	24.346	-0.003	-0.003	0.000	0.000	0.000	0.000
205	205	ARG	1	0.927	0.959	23.687	-0.062	-0.062	0.000	0.000	0.000	0.000
206	206	ILE	0	-0.011	0.006	26.442	-0.003	-0.003	0.000	0.000	0.000	0.000
207	207	LEU	0	-0.007	-0.014	24.578	0.001	0.001	0.000	0.000	0.000	0.000
208	208	VAL	0	-0.017	-0.010	27.476	-0.001	-0.001	0.000	0.000	0.000	0.000
209	209	LYS	1	0.947	0.979	28.093	-0.003	-0.003	0.000	0.000	0.000	0.000
210	210	LYS	1	0.902	0.938	26.942	0.003	0.003	0.000	0.000	0.000	0.000
211	211	GLU	-1	-0.817	-0.912	28.522	-0.014	-0.014	0.000	0.000	0.000	0.000
212	212	GLU	-1	-0.959	-0.970	31.384	-0.019	-0.019	0.000	0.000	0.000	0.000
213	213	LEU	0	-0.081	-0.031	25.222	-0.003	-0.003	0.000	0.000	0.000	0.000
214	214	THR	0	0.015	0.016	28.582	-0.008	-0.008	0.000	0.000	0.000	0.000
215	215	LEU	0	-0.031	0.000	26.992	0.001	0.001	0.000	0.000	0.000	0.000
216	216	GLU	-1	-0.872	-0.934	31.135	-0.037	-0.037	0.000	0.000	0.000	0.000
217	217	GLY	0	-0.091	-0.057	34.011	-0.004	-0.004	0.000	0.000	0.000	0.000
218	218	ILE	0	-0.020	-0.016	29.927	-0.001	-0.001	0.000	0.000	0.000	0.000
219	219	ARG	1	0.762	0.872	34.376	0.063	0.063	0.000	0.000	0.000	0.000
220	220	GLN	0	0.045	0.018	31.844	-0.008	-0.008	0.000	0.000	0.000	0.000
221	221	PHE	0	0.060	0.025	34.766	0.004	0.004	0.000	0.000	0.000	0.000
222	222	TYR	0	-0.020	-0.013	34.201	-0.005	-0.005	0.000	0.000	0.000	0.000
223	223	ILE	0	0.053	0.016	35.298	0.003	0.003	0.000	0.000	0.000	0.000
224	224	ASN	0	-0.010	-0.005	36.381	-0.004	-0.004	0.000	0.000	0.000	0.000
225	225	VAL	0	0.028	0.014	35.032	-0.001	-0.001	0.000	0.000	0.000	0.000
226	226	GLU	-1	-0.931	-0.938	37.991	-0.042	-0.042	0.000	0.000	0.000	0.000
227	227	ARG	1	0.812	0.871	36.241	0.055	0.055	0.000	0.000	0.000	0.000
228	228	GLU	-1	-0.766	-0.882	29.505	-0.109	-0.109	0.000	0.000	0.000	0.000
229	229	GLU	-1	-0.900	-0.949	33.481	-0.066	-0.066	0.000	0.000	0.000	0.000
230	230	TRP	0	0.064	0.043	35.742	-0.001	-0.001	0.000	0.000	0.000	0.000
231	231	LYS	1	0.815	0.912	28.328	0.107	0.107	0.000	0.000	0.000	0.000
232	232	LEU	0	0.001	-0.001	33.182	-0.003	-0.003	0.000	0.000	0.000	0.000
233	233	ASP	-1	-0.798	-0.906	34.581	-0.080	-0.080	0.000	0.000	0.000	0.000
234	234	THR	0	0.020	0.015	36.225	0.003	0.003	0.000	0.000	0.000	0.000
235	235	LEU	0	-0.033	-0.029	31.264	0.000	0.000	0.000	0.000	0.000	0.000
236	236	CYS	0	-0.107	-0.060	35.288	-0.003	-0.003	0.000	0.000	0.000	0.000
237	237	ASP	-1	-0.849	-0.903	38.045	-0.067	-0.067	0.000	0.000	0.000	0.000
238	238	LEU	0	-0.028	-0.024	34.362	0.001	0.001	0.000	0.000	0.000	0.000
239	239	TYR	0	-0.027	-0.022	32.740	-0.004	-0.004	0.000	0.000	0.000	0.000
240	240	GLU	-1	-0.934	-0.950	37.244	-0.068	-0.068	0.000	0.000	0.000	0.000
241	241	THR	0	-0.060	-0.049	36.083	0.000	0.000	0.000	0.000	0.000	0.000
242	242	LEU	0	0.016	0.022	33.444	0.000	0.000	0.000	0.000	0.000	0.000
243	243	THR	0	0.009	0.002	36.952	-0.003	-0.003	0.000	0.000	0.000	0.000
244	244	ILE	0	-0.035	-0.009	39.197	0.003	0.003	0.000	0.000	0.000	0.000
245	245	THR	0	-0.085	-0.058	34.088	-0.001	-0.001	0.000	0.000	0.000	0.000
246	246	GLN	0	-0.005	0.016	28.593	0.006	0.006	0.000	0.000	0.000	0.000
247	247	ALA	0	0.021	0.000	30.406	0.003	0.003	0.000	0.000	0.000	0.000
248	248	VAL	0	-0.019	-0.006	23.726	-0.009	-0.009	0.000	0.000	0.000	0.000
249	249	ILE	0	0.005	0.005	26.041	0.011	0.011	0.000	0.000	0.000	0.000
250	250	PHE	0	0.019	0.007	19.941	-0.015	-0.015	0.000	0.000	0.000	0.000
251	251	ILE	0	-0.019	-0.016	22.159	0.019	0.019	0.000	0.000	0.000	0.000
252	252	ASN	0	0.039	0.010	19.967	-0.030	-0.030	0.000	0.000	0.000	0.000
253	253	THR	0	-0.040	-0.001	18.772	-0.010	-0.010	0.000	0.000	0.000	0.000
254	254	ARG	1	0.973	0.979	13.582	0.506	0.506	0.000	0.000	0.000	0.000
255	255	ARG	1	0.972	0.989	19.298	0.174	0.174	0.000	0.000	0.000	0.000
256	256	LYS	1	0.785	0.874	22.417	0.147	0.147	0.000	0.000	0.000	0.000
257	257	VAL	0	0.043	0.029	20.911	0.014	0.014	0.000	0.000	0.000	0.000
258	258	ASP	-1	-0.830	-0.892	21.795	-0.270	-0.270	0.000	0.000	0.000	0.000
259	259	TRP	0	-0.018	-0.010	24.741	0.017	0.017	0.000	0.000	0.000	0.000
260	260	LEU	0	-0.011	-0.011	27.226	0.011	0.011	0.000	0.000	0.000	0.000
261	261	THR	0	-0.011	-0.024	26.110	0.006	0.006	0.000	0.000	0.000	0.000
262	262	GLU	-1	-0.941	-0.967	28.475	-0.154	-0.154	0.000	0.000	0.000	0.000
263	263	LYS	1	0.902	0.945	30.812	0.120	0.120	0.000	0.000	0.000	0.000
264	264	MET	0	0.001	0.004	32.120	0.009	0.009	0.000	0.000	0.000	0.000
265	265	HIS	0	0.015	0.009	32.779	0.004	0.004	0.000	0.000	0.000	0.000
266	266	ALA	0	-0.069	-0.037	34.539	0.006	0.006	0.000	0.000	0.000	0.000
267	267	ARG	1	0.775	0.879	36.832	0.093	0.093	0.000	0.000	0.000	0.000
268	268	ASP	-1	-0.918	-0.942	38.532	-0.085	-0.085	0.000	0.000	0.000	0.000
269	269	PHE	0	-0.030	-0.005	35.503	0.002	0.002	0.000	0.000	0.000	0.000
270	270	THR	0	-0.037	-0.013	34.230	-0.005	-0.005	0.000	0.000	0.000	0.000
271	271	VAL	0	0.024	-0.004	29.011	0.001	0.001	0.000	0.000	0.000	0.000
272	272	SER	0	0.009	0.004	26.445	-0.008	-0.008	0.000	0.000	0.000	0.000
273	273	ALA	0	0.041	0.020	23.836	0.006	0.006	0.000	0.000	0.000	0.000
274	274	MET	0	-0.026	0.001	17.713	0.001	0.001	0.000	0.000	0.000	0.000
275	275	HIS	0	-0.005	-0.026	16.650	-0.039	-0.039	0.000	0.000	0.000	0.000
276	276	GLY	0	0.018	-0.010	12.665	-0.004	-0.004	0.000	0.000	0.000	0.000
277	277	ASP	-1	-1.018	-1.015	12.498	-0.642	-0.642	0.000	0.000	0.000	0.000
278	278	MET	0	-0.014	0.030	14.513	0.029	0.029	0.000	0.000	0.000	0.000
279	279	ASP	-1	-0.855	-0.925	15.403	-0.540	-0.540	0.000	0.000	0.000	0.000
280	280	GLN	0	-0.049	-0.048	13.597	-0.043	-0.043	0.000	0.000	0.000	0.000
281	281	LYS	1	0.798	0.872	16.095	0.341	0.341	0.000	0.000	0.000	0.000
282	282	GLU	-1	-0.780	-0.868	19.337	-0.277	-0.277	0.000	0.000	0.000	0.000
283	283	ARG	1	0.788	0.860	11.521	0.724	0.724	0.000	0.000	0.000	0.000
284	284	ASP	-1	-0.913	-0.949	18.773	-0.266	-0.266	0.000	0.000	0.000	0.000
285	285	VAL	0	-0.019	-0.012	20.085	0.031	0.031	0.000	0.000	0.000	0.000
286	286	ILE	0	0.002	0.003	21.817	0.023	0.023	0.000	0.000	0.000	0.000
287	287	MET	0	0.008	0.005	20.065	0.029	0.029	0.000	0.000	0.000	0.000
288	288	ARG	1	0.939	0.969	22.539	0.192	0.192	0.000	0.000	0.000	0.000
289	289	GLU	-1	-0.882	-0.935	25.206	-0.136	-0.136	0.000	0.000	0.000	0.000
290	290	PHE	0	-0.009	0.009	25.141	0.012	0.012	0.000	0.000	0.000	0.000
291	291	ARG	1	0.831	0.893	20.750	0.209	0.209	0.000	0.000	0.000	0.000
292	292	SER	0	-0.075	-0.057	27.127	0.013	0.013	0.000	0.000	0.000	0.000
293	293	GLY	0	0.015	0.013	29.977	0.009	0.009	0.000	0.000	0.000	0.000
294	294	SER	0	-0.013	0.007	31.641	0.009	0.009	0.000	0.000	0.000	0.000
295	295	SER	0	-0.033	-0.008	27.606	0.006	0.006	0.000	0.000	0.000	0.000
296	296	ARG	1	0.908	0.950	30.191	0.095	0.095	0.000	0.000	0.000	0.000
297	297	VAL	0	0.017	-0.003	29.967	0.004	0.004	0.000	0.000	0.000	0.000
298	298	LEU	0	-0.029	0.004	22.410	-0.007	-0.007	0.000	0.000	0.000	0.000
299	299	ILE	0	0.004	-0.002	24.376	0.005	0.005	0.000	0.000	0.000	0.000
300	300	THR	0	-0.019	-0.033	19.293	-0.029	-0.029	0.000	0.000	0.000	0.000
301	301	THR	0	0.036	0.009	15.905	0.028	0.028	0.000	0.000	0.000	0.000
302	302	ASP	-1	-0.802	-0.888	15.846	-0.208	-0.208	0.000	0.000	0.000	0.000
303	303	LEU	0	-0.003	0.013	12.970	-0.008	-0.008	0.000	0.000	0.000	0.000
304	304	LEU	0	-0.034	-0.022	14.985	0.005	0.005	0.000	0.000	0.000	0.000
305	305	ALA	0	0.027	0.019	17.312	0.034	0.034	0.000	0.000	0.000	0.000
306	306	ARG	1	0.821	0.885	14.820	0.144	0.144	0.000	0.000	0.000	0.000
307	307	GLY	0	0.045	0.014	17.438	-0.021	-0.021	0.000	0.000	0.000	0.000
308	308	ILE	0	-0.057	-0.018	17.455	0.012	0.012	0.000	0.000	0.000	0.000
309	309	ASP	-1	-0.909	-0.956	20.810	-0.104	-0.104	0.000	0.000	0.000	0.000
310	310	VAL	0	-0.011	-0.006	24.311	-0.005	-0.005	0.000	0.000	0.000	0.000
311	311	GLN	0	0.045	0.018	26.812	0.003	0.003	0.000	0.000	0.000	0.000
312	312	GLN	0	-0.062	-0.042	30.236	0.009	0.009	0.000	0.000	0.000	0.000
313	313	VAL	0	-0.033	-0.001	27.565	0.004	0.004	0.000	0.000	0.000	0.000
314	314	SER	0	-0.009	-0.014	30.575	0.003	0.003	0.000	0.000	0.000	0.000
315	315	LEU	0	0.025	0.017	31.768	0.005	0.005	0.000	0.000	0.000	0.000
316	316	VAL	0	-0.019	-0.003	26.245	-0.009	-0.009	0.000	0.000	0.000	0.000
317	317	ILE	0	0.019	0.008	28.527	0.009	0.009	0.000	0.000	0.000	0.000
318	318	ASN	0	0.000	-0.004	25.383	-0.024	-0.024	0.000	0.000	0.000	0.000
319	319	TYR	0	0.052	0.011	26.811	0.010	0.010	0.000	0.000	0.000	0.000
320	320	ASP	-1	-0.784	-0.878	24.153	-0.135	-0.135	0.000	0.000	0.000	0.000
321	321	LEU	0	0.048	0.022	25.103	-0.008	-0.008	0.000	0.000	0.000	0.000
322	322	PRO	0	-0.043	0.008	21.604	-0.005	-0.005	0.000	0.000	0.000	0.000
323	323	THR	0	0.009	-0.032	19.199	0.009	0.009	0.000	0.000	0.000	0.000
324	324	ASN	0	-0.010	-0.004	17.804	0.010	0.010	0.000	0.000	0.000	0.000
325	325	ARG	1	1.037	1.011	20.219	0.013	0.013	0.000	0.000	0.000	0.000
326	326	GLU	-1	-0.827	-0.911	20.193	-0.023	-0.023	0.000	0.000	0.000	0.000
327	327	ASN	0	-0.059	-0.041	18.658	-0.011	-0.011	0.000	0.000	0.000	0.000
328	328	TYR	0	-0.008	-0.005	20.432	-0.014	-0.014	0.000	0.000	0.000	0.000
329	329	ILE	0	0.023	0.010	23.562	-0.006	-0.006	0.000	0.000	0.000	0.000
330	330	HIS	0	-0.069	-0.042	19.946	-0.013	-0.013	0.000	0.000	0.000	0.000
331	331	ARG	1	0.822	0.873	19.996	0.160	0.160	0.000	0.000	0.000	0.000
332	332	ILE	0	0.017	0.009	22.999	-0.002	-0.002	0.000	0.000	0.000	0.000
333	333	GLY	0	0.000	0.000	25.439	0.004	0.004	0.000	0.000	0.000	0.000
334	334	ARG	1	0.794	0.893	20.797	0.146	0.146	0.000	0.000	0.000	0.000
335	335	GLY	0	0.016	0.029	24.918	-0.002	-0.002	0.000	0.000	0.000	0.000
336	336	GLY	0	-0.011	-0.023	28.646	0.003	0.003	0.000	0.000	0.000	0.000
337	337	ARG	1	0.805	0.931	26.100	0.106	0.106	0.000	0.000	0.000	0.000
338	338	PHE	0	0.020	-0.001	30.260	0.004	0.004	0.000	0.000	0.000	0.000
339	339	GLY	0	0.010	0.013	32.620	0.004	0.004	0.000	0.000	0.000	0.000
340	340	ARG	1	0.921	0.974	35.044	0.075	0.075	0.000	0.000	0.000	0.000
341	341	LYS	1	0.964	0.976	34.804	0.043	0.043	0.000	0.000	0.000	0.000
342	342	GLY	0	0.061	0.039	32.965	-0.001	-0.001	0.000	0.000	0.000	0.000
343	343	VAL	0	-0.013	0.006	33.287	0.006	0.006	0.000	0.000	0.000	0.000
344	344	ALA	0	-0.001	0.001	30.446	-0.008	-0.008	0.000	0.000	0.000	0.000
345	345	ILE	0	0.035	0.018	31.531	0.006	0.006	0.000	0.000	0.000	0.000
346	346	ASN	0	-0.023	-0.009	29.644	-0.014	-0.014	0.000	0.000	0.000	0.000
347	347	MET	0	-0.009	-0.004	31.029	0.003	0.003	0.000	0.000	0.000	0.000
348	348	VAL	0	-0.036	-0.009	31.514	-0.003	-0.003	0.000	0.000	0.000	0.000
349	349	THR	0	-0.039	-0.048	32.034	0.004	0.004	0.000	0.000	0.000	0.000
350	350	GLU	-1	-0.816	-0.907	34.568	-0.038	-0.038	0.000	0.000	0.000	0.000
351	351	GLU	-1	-0.830	-0.896	31.529	-0.037	-0.037	0.000	0.000	0.000	0.000
352	352	ASP	-1	-0.845	-0.884	29.506	-0.077	-0.077	0.000	0.000	0.000	0.000
353	353	LYS	1	0.866	0.908	31.609	0.041	0.041	0.000	0.000	0.000	0.000
354	354	ARG	1	0.800	0.881	32.986	0.038	0.038	0.000	0.000	0.000	0.000
355	355	THR	0	0.035	0.018	27.283	0.005	0.005	0.000	0.000	0.000	0.000
356	356	LEU	0	-0.001	0.001	30.232	0.001	0.001	0.000	0.000	0.000	0.000
357	357	ARG	1	0.883	0.941	31.970	0.028	0.028	0.000	0.000	0.000	0.000
358	358	ASP	-1	-0.896	-0.941	29.884	-0.021	-0.021	0.000	0.000	0.000	0.000
359	359	ILE	0	-0.057	-0.034	25.883	0.003	0.003	0.000	0.000	0.000	0.000
360	360	GLU	-1	-0.811	-0.899	29.715	-0.033	-0.033	0.000	0.000	0.000	0.000
361	361	THR	0	-0.054	-0.036	33.187	0.003	0.003	0.000	0.000	0.000	0.000
362	362	PHE	0	-0.070	-0.025	24.718	0.005	0.005	0.000	0.000	0.000	0.000
363	363	TYR	0	-0.039	-0.066	24.723	0.002	0.002	0.000	0.000	0.000	0.000
364	364	ASN	0	-0.053	-0.019	31.113	0.001	0.001	0.000	0.000	0.000	0.000
365	365	THR	0	-0.029	-0.007	32.768	-0.001	-0.001	0.000	0.000	0.000	0.000
366	366	SER	0	-0.050	-0.055	35.638	0.003	0.003	0.000	0.000	0.000	0.000
367	367	ILE	0	-0.087	-0.029	32.602	-0.003	-0.003	0.000	0.000	0.000	0.000
368	368	GLU	-1	-0.833	-0.888	36.575	-0.035	-0.035	0.000	0.000	0.000	0.000
369	369	GLU	-1	-0.977	-0.990	38.657	-0.048	-0.048	0.000	0.000	0.000	0.000
370	370	MET	0	-0.042	-0.019	38.395	-0.001	-0.001	0.000	0.000	0.000	0.000
371	371	PRO	0	-0.001	0.016	40.358	0.002	0.002	0.000	0.000	0.000	0.000
372	372	LEU	0	0.015	-0.010	42.621	-0.003	-0.003	0.000	0.000	0.000	0.000
373	373	ASN	0	0.000	0.004	44.884	-0.001	-0.001	0.000	0.000	0.000	0.000
374	374	VAL	0	0.057	0.010	41.026	-0.001	-0.001	0.000	0.000	0.000	0.000
375	375	ALA	0	-0.061	-0.035	42.853	-0.001	-0.001	0.000	0.000	0.000	0.000
376	376	ASP	-1	-0.923	-0.957	45.136	-0.042	-0.042	0.000	0.000	0.000	0.000
377	377	LEU	0	-0.087	-0.021	37.937	0.000	0.000	0.000	0.000	0.000	0.000
378	378	ILE	-1	-0.875	-0.922	37.480	-0.059	-0.059	0.000	0.000	0.000	0.000
379	379	A	0	-0.351	-0.263	16.768	-0.013	-0.013	0.000	0.000	0.000	0.000
380	379	A	-1	-0.527	-0.663	13.007	0.193	0.193	0.000	0.000	0.000	0.000
381	380	G	0	-0.386	-0.310	17.589	-0.003	-0.003	0.000	0.000	0.000	0.000
382	380	G	-1	-0.534	-0.632	13.666	0.038	0.038	0.000	0.000	0.000	0.000
383	381	A	0	-0.357	-0.271	16.492	-0.018	-0.018	0.000	0.000	0.000	0.000
384	381	A	-1	-0.595	-0.674	14.518	-0.161	-0.161	0.000	0.000	0.000	0.000
385	382	G	0	-0.335	-0.293	13.318	0.036	0.036	0.000	0.000	0.000	0.000
386	382	G	-1	-0.551	-0.694	15.335	-0.314	-0.314	0.000	0.000	0.000	0.000
387	383	A	0	-0.350	-0.298	10.011	-0.027	-0.027	0.000	0.000	0.000	0.000
388	383	A	-1	-0.494	-0.598	11.907	-0.557	-0.557	0.000	0.000	0.000	0.000
389	384	A	0	-0.361	-0.289	6.936	-0.153	-0.153	0.000	0.000	0.000	0.000
390	384	A	-1	-0.407	-0.581	7.266	-0.656	-0.656	0.000	0.000	0.000	0.000
395	387	A	0	-0.351	-0.291	6.312	0.006	0.006	0.000	0.000	0.000	0.000
396	387	A	-1	-0.623	-0.672	6.200	-0.739	-0.739	0.000	0.000	0.000	0.000
397	388	G	0	-0.387	-0.310	9.891	0.071	0.071	0.000	0.000	0.000	0.000
398	388	G	0	0.285	0.202	8.276	0.030	0.030	0.000	0.000	0.000	0.000

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