FMO DATABASE

FMODB ID: MV9GZ

Calculation Name: 4P6Z-G-Xray372

Preferred Name:

Target Type:

Ligand Name:

ligand 3-letter code:

PDB ID: 4P6Z

Chain ID: G

ChEMBL ID:

UniProt ID: Q10567

Base Structure: X-ray

Registration Date: 2023-06-22

Reference: C. Watanabe, N. Tani, K. Kamisaka, T. Honma et al., Interaction energy analysis of Apo structure dataset on FMODB, To be published.

DOI:

IFIE MAP

IFIE Diagram

Modeling method

Optimization	MOE:Amber10:EHT
Restraint	OptHSide
Protonation	MOE:Protonate 3D
Complement	MOE:Structure Preparation
Water	No
Procedure	Auto-FMO protocol ver. 2.20220422

FMO calculation

FMO method	FMO2-MP2/6-31G(d)
Fragmentation	Auto
Number of fragment	587
LigandResidueName
LigandFragmentNumber	0
LigandCharge
Software	ABINIT-MP - Open Ver. 1 Rev. 23Q2 / 20200603(SMP)

Total energy (hartree)

FMO2-HF: Electronic energy	-11324463.122566
FMO2-HF: Nuclear repulsion	11086057.326728
FMO2-HF: Total energy	-238405.795838
FMO2-MP2: Total energy	-239082.59861

3D Structure

Snapshot

Ligand structure

Ligand Interaction

Ligand binding energy

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.
N/A	N/A	N/A	N/A	N/A	N/A

Interactive mode: IFIE and PIEDA for fragment #1(G:2:PRO)

Summations of interaction energy for fragment #1(G:2:PRO)

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.
11.481	-2.503	0.096	14.749	-0.861	-0.003

Interaction energy analysis for fragmet #1(G:2:PRO)

Snapshot

IFIE Diagram

Base fragment(s) of PIEDA/IFIE

Single fragment	Multi fragments
	Fragment list

Charge [e] FCHARGE : 0 / q_Mulliken : 0.016 / q_NPA : 0.008

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.	ChainChain species.	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].
3	G	4	PRO	0	0.004	0.013	2.565	11.688	-2.430	0.097	14.758	-0.737	-0.003
4	G	5	ILE	0	0.040	0.035	5.606	-0.291	-0.291	0.000	0.000	0.000	0.000
5	G	6	ARG	1	0.958	0.965	8.528	-0.021	-0.021	0.000	0.000	0.000	0.000
6	G	7	LEU	0	0.076	0.037	11.312	-0.038	-0.038	0.000	0.000	0.000	0.000
7	G	8	ARG	1	0.978	0.976	14.627	-0.142	-0.142	0.000	0.000	0.000	0.000
8	G	9	GLU	-1	-0.768	-0.848	12.414	-0.084	-0.084	0.000	0.000	0.000	0.000
9	G	10	LEU	0	0.034	0.030	13.523	-0.038	-0.038	0.000	0.000	0.000	0.000
10	G	11	ILE	0	-0.009	-0.007	14.945	-0.028	-0.028	0.000	0.000	0.000	0.000
11	G	12	ARG	1	0.813	0.871	16.564	0.030	0.030	0.000	0.000	0.000	0.000
12	G	13	THR	0	-0.007	-0.021	15.399	-0.028	-0.028	0.000	0.000	0.000	0.000
13	G	14	ILE	0	0.037	0.032	17.717	-0.011	-0.011	0.000	0.000	0.000	0.000
14	G	15	ARG	1	0.908	0.954	19.949	-0.059	-0.059	0.000	0.000	0.000	0.000
15	G	16	THR	0	-0.073	-0.042	20.178	-0.018	-0.018	0.000	0.000	0.000	0.000
16	G	17	ALA	0	-0.039	-0.008	22.384	-0.013	-0.013	0.000	0.000	0.000	0.000
17	G	18	ARG	1	0.858	0.912	23.191	0.022	0.022	0.000	0.000	0.000	0.000
18	G	19	THR	0	0.018	0.014	26.535	0.004	0.004	0.000	0.000	0.000	0.000
19	G	20	GLN	0	0.086	0.037	26.363	-0.002	-0.002	0.000	0.000	0.000	0.000
20	G	21	ALA	0	0.015	0.010	26.028	0.015	0.015	0.000	0.000	0.000	0.000
21	G	22	GLU	-1	-0.725	-0.852	22.279	0.004	0.004	0.000	0.000	0.000	0.000
22	G	23	GLU	-1	-0.864	-0.915	21.762	0.121	0.121	0.000	0.000	0.000	0.000
23	G	24	ARG	1	0.937	0.964	21.145	-0.121	-0.121	0.000	0.000	0.000	0.000
24	G	25	GLU	-1	-0.964	-0.985	20.249	0.095	0.095	0.000	0.000	0.000	0.000
25	G	26	MET	0	-0.043	-0.013	17.379	0.040	0.040	0.000	0.000	0.000	0.000
26	G	27	ILE	0	0.002	-0.002	16.383	0.062	0.062	0.000	0.000	0.000	0.000
27	G	28	GLN	0	0.021	0.011	16.989	0.059	0.059	0.000	0.000	0.000	0.000
28	G	29	LYS	1	0.976	1.000	11.494	-0.042	-0.042	0.000	0.000	0.000	0.000
29	G	30	GLU	-1	-0.829	-0.919	10.050	0.883	0.883	0.000	0.000	0.000	0.000
30	G	31	CYS	0	-0.002	-0.006	12.287	0.143	0.143	0.000	0.000	0.000	0.000
31	G	32	ALA	0	-0.038	-0.009	14.018	0.056	0.056	0.000	0.000	0.000	0.000
32	G	33	ALA	0	0.005	0.004	8.559	0.099	0.099	0.000	0.000	0.000	0.000
33	G	34	ILE	0	-0.041	-0.014	9.849	0.259	0.259	0.000	0.000	0.000	0.000
34	G	35	ARG	1	0.903	0.966	11.512	-0.423	-0.423	0.000	0.000	0.000	0.000
35	G	36	SER	0	-0.006	-0.011	10.827	-0.082	-0.082	0.000	0.000	0.000	0.000
36	G	37	SER	0	-0.018	0.008	8.131	0.023	0.023	0.000	0.000	0.000	0.000
37	G	38	PHE	0	-0.001	-0.036	9.770	-0.080	-0.080	0.000	0.000	0.000	0.000
38	G	39	ARG	1	0.930	0.984	13.183	-0.614	-0.614	0.000	0.000	0.000	0.000
39	G	40	GLU	-1	-0.938	-0.970	8.221	2.196	2.196	0.000	0.000	0.000	0.000
40	G	41	GLU	-1	-0.841	-0.899	12.222	0.546	0.546	0.000	0.000	0.000	0.000
41	G	42	ASP	-1	-0.744	-0.853	8.106	1.698	1.698	0.000	0.000	0.000	0.000
42	G	43	ASN	0	0.013	0.002	10.817	-0.077	-0.077	0.000	0.000	0.000	0.000
43	G	44	THR	0	-0.098	-0.048	7.839	-0.210	-0.210	0.000	0.000	0.000	0.000
44	G	45	TYR	0	-0.090	-0.073	4.504	-0.492	-0.358	-0.001	-0.009	-0.124	0.000
45	G	46	ARG	1	0.899	0.939	9.486	-0.704	-0.704	0.000	0.000	0.000	0.000
46	G	47	CYS	0	-0.007	0.007	12.657	-0.092	-0.092	0.000	0.000	0.000	0.000
47	G	48	ARG	1	0.902	0.930	7.399	-1.145	-1.145	0.000	0.000	0.000	0.000
48	G	49	ASN	0	0.054	0.021	8.521	-0.136	-0.136	0.000	0.000	0.000	0.000
49	G	50	VAL	0	0.071	0.039	12.392	-0.074	-0.074	0.000	0.000	0.000	0.000
50	G	51	ALA	0	-0.018	-0.007	15.709	-0.058	-0.058	0.000	0.000	0.000	0.000
51	G	52	LYS	1	0.750	0.869	9.532	-0.950	-0.950	0.000	0.000	0.000	0.000
52	G	53	LEU	0	0.007	0.016	15.771	-0.043	-0.043	0.000	0.000	0.000	0.000
53	G	54	LEU	0	0.011	0.027	17.551	-0.039	-0.039	0.000	0.000	0.000	0.000
54	G	55	TYR	0	-0.012	-0.013	18.446	-0.038	-0.038	0.000	0.000	0.000	0.000
55	G	56	MET	0	-0.010	-0.015	15.163	-0.032	-0.032	0.000	0.000	0.000	0.000
56	G	57	HIS	0	0.010	0.016	20.515	-0.010	-0.010	0.000	0.000	0.000	0.000
57	G	58	MET	0	-0.053	-0.024	23.118	-0.023	-0.023	0.000	0.000	0.000	0.000
58	G	59	LEU	0	-0.040	-0.019	21.766	-0.015	-0.015	0.000	0.000	0.000	0.000
59	G	60	GLY	0	0.020	0.028	25.322	-0.013	-0.013	0.000	0.000	0.000	0.000
60	G	61	TYR	0	-0.098	-0.071	22.149	0.005	0.005	0.000	0.000	0.000	0.000
61	G	62	PRO	0	-0.021	-0.016	22.393	0.009	0.009	0.000	0.000	0.000	0.000
62	G	63	ALA	0	0.061	0.010	20.849	0.025	0.025	0.000	0.000	0.000	0.000
63	G	64	HIS	0	0.049	0.032	21.845	0.020	0.020	0.000	0.000	0.000	0.000
64	G	65	PHE	0	0.019	-0.013	17.016	0.009	0.009	0.000	0.000	0.000	0.000
65	G	66	GLY	0	0.040	0.014	18.562	0.038	0.038	0.000	0.000	0.000	0.000
66	G	67	GLN	0	-0.001	-0.001	19.390	0.010	0.010	0.000	0.000	0.000	0.000
67	G	68	LEU	0	0.004	0.005	20.782	0.001	0.001	0.000	0.000	0.000	0.000
68	G	69	GLU	-1	-0.775	-0.879	15.813	0.637	0.637	0.000	0.000	0.000	0.000
69	G	70	CYS	0	-0.035	-0.014	19.278	0.012	0.012	0.000	0.000	0.000	0.000
70	G	71	LEU	0	0.053	0.020	21.138	-0.008	-0.008	0.000	0.000	0.000	0.000
71	G	72	LYS	1	0.770	0.875	17.263	-0.558	-0.558	0.000	0.000	0.000	0.000
72	G	73	LEU	0	-0.093	-0.037	15.849	0.011	0.011	0.000	0.000	0.000	0.000
73	G	74	ILE	0	-0.013	0.000	19.805	-0.018	-0.018	0.000	0.000	0.000	0.000
74	G	75	ALA	0	0.003	0.004	23.152	-0.021	-0.021	0.000	0.000	0.000	0.000
75	G	76	SER	0	-0.031	-0.023	18.521	-0.008	-0.008	0.000	0.000	0.000	0.000
76	G	77	GLN	0	0.030	-0.002	20.794	-0.027	-0.027	0.000	0.000	0.000	0.000
77	G	78	LYS	1	0.824	0.918	14.816	-0.510	-0.510	0.000	0.000	0.000	0.000
78	G	79	PHE	0	0.053	0.015	20.596	0.003	0.003	0.000	0.000	0.000	0.000
79	G	80	THR	0	-0.016	-0.031	17.318	-0.012	-0.012	0.000	0.000	0.000	0.000
80	G	81	ASP	-1	-0.773	-0.860	16.943	0.474	0.474	0.000	0.000	0.000	0.000
81	G	82	LYS	1	0.895	0.941	19.060	-0.233	-0.233	0.000	0.000	0.000	0.000
82	G	83	ARG	1	0.905	0.958	22.094	-0.192	-0.192	0.000	0.000	0.000	0.000
83	G	84	ILE	0	-0.025	-0.024	17.738	-0.014	-0.014	0.000	0.000	0.000	0.000
84	G	85	GLY	0	0.061	0.028	20.880	-0.001	-0.001	0.000	0.000	0.000	0.000
85	G	86	TYR	0	-0.015	-0.055	21.760	-0.010	-0.010	0.000	0.000	0.000	0.000
86	G	87	LEU	0	-0.039	-0.008	22.650	-0.013	-0.013	0.000	0.000	0.000	0.000
87	G	88	GLY	0	0.040	-0.010	22.345	-0.011	-0.011	0.000	0.000	0.000	0.000
88	G	89	ALA	0	0.003	-0.001	23.362	-0.003	-0.003	0.000	0.000	0.000	0.000
89	G	90	MET	0	-0.073	-0.028	25.963	-0.017	-0.017	0.000	0.000	0.000	0.000
90	G	91	LEU	0	-0.053	-0.011	24.384	-0.009	-0.009	0.000	0.000	0.000	0.000
91	G	92	LEU	0	-0.016	-0.013	21.392	-0.002	-0.002	0.000	0.000	0.000	0.000
92	G	93	LEU	0	-0.033	-0.002	25.579	-0.003	-0.003	0.000	0.000	0.000	0.000
93	G	94	ASP	-1	-0.754	-0.883	28.254	0.166	0.166	0.000	0.000	0.000	0.000
94	G	95	GLU	-1	-0.829	-0.926	31.882	0.122	0.122	0.000	0.000	0.000	0.000
95	G	96	ARG	1	0.854	0.921	31.182	-0.163	-0.163	0.000	0.000	0.000	0.000
96	G	97	GLN	0	-0.053	-0.025	28.350	0.011	0.011	0.000	0.000	0.000	0.000
97	G	98	ASP	-1	-0.868	-0.915	31.768	0.145	0.145	0.000	0.000	0.000	0.000
98	G	99	VAL	0	-0.008	-0.004	28.007	0.004	0.004	0.000	0.000	0.000	0.000
99	G	100	HIS	0	0.053	0.025	30.985	0.015	0.015	0.000	0.000	0.000	0.000
100	G	101	LEU	0	0.061	0.025	33.001	0.001	0.001	0.000	0.000	0.000	0.000
101	G	102	LEU	0	0.010	0.005	26.405	0.000	0.000	0.000	0.000	0.000	0.000
102	G	103	MET	0	0.046	0.023	28.503	0.011	0.011	0.000	0.000	0.000	0.000
103	G	104	THR	0	-0.004	0.004	30.312	-0.004	-0.004	0.000	0.000	0.000	0.000
104	G	105	ASN	0	0.002	-0.001	30.536	-0.012	-0.012	0.000	0.000	0.000	0.000
105	G	106	CYS	0	-0.055	-0.030	27.493	0.003	0.003	0.000	0.000	0.000	0.000
106	G	107	ILE	0	0.039	0.016	29.642	-0.003	-0.003	0.000	0.000	0.000	0.000
107	G	108	LYS	1	0.914	0.966	31.980	-0.122	-0.122	0.000	0.000	0.000	0.000
108	G	109	ASN	0	-0.019	-0.013	30.122	-0.015	-0.015	0.000	0.000	0.000	0.000
109	G	110	ASP	-1	-0.808	-0.871	27.778	0.199	0.199	0.000	0.000	0.000	0.000
110	G	111	LEU	0	-0.009	-0.008	31.077	-0.005	-0.005	0.000	0.000	0.000	0.000
111	G	112	ASN	0	-0.092	-0.045	34.610	-0.015	-0.015	0.000	0.000	0.000	0.000
112	G	113	HIS	0	0.048	0.037	27.288	-0.010	-0.010	0.000	0.000	0.000	0.000
113	G	114	SER	0	0.035	0.020	31.548	-0.008	-0.008	0.000	0.000	0.000	0.000
114	G	115	THR	0	-0.055	-0.026	28.716	-0.007	-0.007	0.000	0.000	0.000	0.000
115	G	116	GLN	0	0.093	0.038	31.588	0.003	0.003	0.000	0.000	0.000	0.000
116	G	117	PHE	0	-0.013	-0.027	29.161	0.002	0.002	0.000	0.000	0.000	0.000
117	G	118	VAL	0	-0.016	0.008	26.900	0.007	0.007	0.000	0.000	0.000	0.000
118	G	119	GLN	0	0.068	0.034	29.446	0.002	0.002	0.000	0.000	0.000	0.000
119	G	120	GLY	0	-0.056	-0.041	32.495	-0.003	-0.003	0.000	0.000	0.000	0.000
120	G	121	LEU	0	-0.056	-0.012	25.838	-0.002	-0.002	0.000	0.000	0.000	0.000
121	G	122	ALA	0	0.072	0.053	29.917	0.002	0.002	0.000	0.000	0.000	0.000
122	G	123	LEU	0	0.015	0.001	31.591	-0.003	-0.003	0.000	0.000	0.000	0.000
123	G	124	CYS	0	-0.080	-0.039	31.680	-0.006	-0.006	0.000	0.000	0.000	0.000
124	G	125	THR	0	0.052	-0.003	29.596	0.002	0.002	0.000	0.000	0.000	0.000
125	G	126	LEU	0	-0.012	-0.003	31.786	-0.002	-0.002	0.000	0.000	0.000	0.000
126	G	127	GLY	0	0.006	-0.016	34.856	-0.004	-0.004	0.000	0.000	0.000	0.000
127	G	128	CYS	0	-0.110	-0.039	33.262	-0.006	-0.006	0.000	0.000	0.000	0.000
128	G	129	MET	0	-0.006	-0.003	30.495	-0.003	-0.003	0.000	0.000	0.000	0.000
129	G	130	GLY	0	0.022	0.017	34.464	0.004	0.004	0.000	0.000	0.000	0.000
130	G	131	SER	0	0.064	0.014	35.984	-0.009	-0.009	0.000	0.000	0.000	0.000
131	G	132	SER	0	0.080	0.035	37.755	0.000	0.000	0.000	0.000	0.000	0.000
132	G	133	GLU	-1	-0.888	-0.938	39.473	0.107	0.107	0.000	0.000	0.000	0.000
133	G	134	MET	0	-0.017	0.008	32.889	0.001	0.001	0.000	0.000	0.000	0.000
134	G	135	CYS	0	-0.080	-0.044	38.208	-0.002	-0.002	0.000	0.000	0.000	0.000
135	G	136	ARG	1	0.823	0.876	40.807	-0.085	-0.085	0.000	0.000	0.000	0.000
136	G	137	ASP	-1	-0.878	-0.933	39.269	0.108	0.108	0.000	0.000	0.000	0.000
137	G	138	LEU	0	-0.060	-0.052	36.129	0.000	0.000	0.000	0.000	0.000	0.000
138	G	139	ALA	0	0.021	0.028	40.043	-0.002	-0.002	0.000	0.000	0.000	0.000
139	G	140	GLY	0	0.045	0.016	43.321	-0.003	-0.003	0.000	0.000	0.000	0.000
140	G	141	GLU	-1	-0.811	-0.890	38.873	0.099	0.099	0.000	0.000	0.000	0.000
141	G	142	VAL	0	-0.012	-0.015	39.810	-0.001	-0.001	0.000	0.000	0.000	0.000
142	G	143	GLU	-1	-0.938	-0.964	41.874	0.066	0.066	0.000	0.000	0.000	0.000
143	G	144	LYS	1	0.855	0.914	40.131	-0.098	-0.098	0.000	0.000	0.000	0.000
144	G	145	LEU	0	-0.049	-0.033	38.488	-0.002	-0.002	0.000	0.000	0.000	0.000
145	G	146	LEU	0	-0.037	-0.003	42.267	-0.002	-0.002	0.000	0.000	0.000	0.000
146	G	147	LYS	1	0.913	0.959	44.964	-0.062	-0.062	0.000	0.000	0.000	0.000
147	G	148	THR	0	0.017	0.020	41.504	-0.003	-0.003	0.000	0.000	0.000	0.000
148	G	149	SER	0	0.038	0.014	44.257	-0.002	-0.002	0.000	0.000	0.000	0.000
149	G	150	ASN	0	0.001	-0.003	38.262	0.000	0.000	0.000	0.000	0.000	0.000
150	G	151	SER	0	0.107	0.030	42.118	0.002	0.002	0.000	0.000	0.000	0.000
151	G	152	TYR	0	-0.055	-0.026	32.578	0.005	0.005	0.000	0.000	0.000	0.000
152	G	153	LEU	0	0.015	0.002	35.561	0.004	0.004	0.000	0.000	0.000	0.000
153	G	154	ARG	1	0.933	0.979	38.993	-0.061	-0.061	0.000	0.000	0.000	0.000
154	G	155	LYS	1	0.937	0.976	38.314	-0.079	-0.079	0.000	0.000	0.000	0.000
155	G	156	LYS	1	0.874	0.948	33.245	-0.115	-0.115	0.000	0.000	0.000	0.000
156	G	157	ALA	0	0.039	0.036	39.357	0.002	0.002	0.000	0.000	0.000	0.000
157	G	158	ALA	0	0.029	0.013	41.422	0.000	0.000	0.000	0.000	0.000	0.000
158	G	159	LEU	0	0.002	-0.015	40.391	-0.001	-0.001	0.000	0.000	0.000	0.000
159	G	160	CYS	0	-0.014	0.007	38.917	0.003	0.003	0.000	0.000	0.000	0.000
160	G	161	ALA	0	0.034	0.022	40.634	0.001	0.001	0.000	0.000	0.000	0.000
161	G	162	VAL	0	-0.026	-0.002	44.042	-0.002	-0.002	0.000	0.000	0.000	0.000
162	G	163	HIS	0	-0.051	-0.018	38.475	-0.006	-0.006	0.000	0.000	0.000	0.000
163	G	164	VAL	0	0.024	0.004	42.168	0.000	0.000	0.000	0.000	0.000	0.000
164	G	165	ILE	0	-0.031	0.000	43.308	-0.002	-0.002	0.000	0.000	0.000	0.000
165	G	166	ARG	1	0.795	0.885	42.646	-0.080	-0.080	0.000	0.000	0.000	0.000
166	G	167	LYS	1	0.758	0.880	38.819	-0.112	-0.112	0.000	0.000	0.000	0.000
167	G	168	VAL	0	-0.034	-0.021	44.276	0.000	0.000	0.000	0.000	0.000	0.000
168	G	169	PRO	0	0.021	0.011	46.995	-0.001	-0.001	0.000	0.000	0.000	0.000
169	G	170	GLU	-1	-0.780	-0.859	50.076	0.070	0.070	0.000	0.000	0.000	0.000
170	G	171	LEU	0	0.046	0.017	46.244	-0.001	-0.001	0.000	0.000	0.000	0.000
171	G	172	MET	0	-0.028	-0.004	50.043	0.000	0.000	0.000	0.000	0.000	0.000
172	G	173	GLU	-1	-0.910	-0.950	50.982	0.055	0.055	0.000	0.000	0.000	0.000
173	G	174	MET	0	-0.007	0.007	47.168	-0.001	-0.001	0.000	0.000	0.000	0.000
174	G	175	PHE	0	0.008	-0.018	45.124	0.001	0.001	0.000	0.000	0.000	0.000
175	G	176	LEU	0	0.004	0.002	50.571	-0.001	-0.001	0.000	0.000	0.000	0.000
176	G	177	PRO	0	-0.019	-0.011	52.948	-0.002	-0.002	0.000	0.000	0.000	0.000
177	G	178	ALA	0	-0.023	-0.006	49.657	-0.002	-0.002	0.000	0.000	0.000	0.000
178	G	179	THR	0	-0.051	-0.039	51.030	0.000	0.000	0.000	0.000	0.000	0.000
179	G	180	LYS	1	0.921	0.977	52.899	-0.048	-0.048	0.000	0.000	0.000	0.000
180	G	181	ASN	0	-0.033	-0.026	54.954	0.000	0.000	0.000	0.000	0.000	0.000
181	G	182	LEU	0	0.055	0.033	49.998	0.000	0.000	0.000	0.000	0.000	0.000
182	G	183	LEU	0	0.017	0.006	52.700	0.000	0.000	0.000	0.000	0.000	0.000
183	G	184	ASN	0	-0.015	-0.012	55.108	0.000	0.000	0.000	0.000	0.000	0.000
184	G	185	GLU	-1	-0.858	-0.919	48.935	0.052	0.052	0.000	0.000	0.000	0.000
185	G	186	LYS	1	0.919	0.939	51.049	-0.042	-0.042	0.000	0.000	0.000	0.000
186	G	187	ASN	0	0.009	0.023	44.012	0.001	0.001	0.000	0.000	0.000	0.000
187	G	188	HIS	0	0.045	0.008	47.083	0.001	0.001	0.000	0.000	0.000	0.000
188	G	189	GLY	0	-0.001	0.014	43.845	0.001	0.001	0.000	0.000	0.000	0.000
189	G	190	VAL	0	-0.018	-0.014	44.403	0.002	0.002	0.000	0.000	0.000	0.000
190	G	191	LEU	0	0.014	0.025	46.155	0.001	0.001	0.000	0.000	0.000	0.000
191	G	192	HIS	0	0.040	0.031	45.588	0.002	0.002	0.000	0.000	0.000	0.000
192	G	193	THR	0	-0.012	-0.028	42.596	0.001	0.001	0.000	0.000	0.000	0.000
193	G	194	SER	0	-0.028	-0.015	45.944	0.000	0.000	0.000	0.000	0.000	0.000
194	G	195	VAL	0	0.041	0.015	48.892	-0.001	-0.001	0.000	0.000	0.000	0.000
195	G	196	VAL	0	-0.057	-0.009	45.738	-0.001	-0.001	0.000	0.000	0.000	0.000
196	G	197	LEU	0	0.007	-0.008	47.065	0.000	0.000	0.000	0.000	0.000	0.000
197	G	198	LEU	0	0.017	0.011	48.924	-0.001	-0.001	0.000	0.000	0.000	0.000
198	G	199	THR	0	-0.035	-0.042	51.310	-0.002	-0.002	0.000	0.000	0.000	0.000
199	G	200	GLU	-1	-0.766	-0.870	47.680	0.067	0.067	0.000	0.000	0.000	0.000
200	G	201	MET	0	-0.029	-0.012	50.675	-0.002	-0.002	0.000	0.000	0.000	0.000
201	G	202	CYS	0	-0.074	-0.033	53.206	-0.002	-0.002	0.000	0.000	0.000	0.000
202	G	203	GLU	-1	-0.856	-0.926	53.243	0.052	0.052	0.000	0.000	0.000	0.000
203	G	204	ARG	1	0.773	0.912	48.342	-0.065	-0.065	0.000	0.000	0.000	0.000
204	G	205	SER	0	0.083	0.032	54.916	-0.001	-0.001	0.000	0.000	0.000	0.000
205	G	206	PRO	0	0.066	0.023	58.115	0.000	0.000	0.000	0.000	0.000	0.000
206	G	207	ASP	-1	-0.864	-0.930	61.079	0.043	0.043	0.000	0.000	0.000	0.000
207	G	208	MET	0	0.014	-0.006	55.992	-0.001	-0.001	0.000	0.000	0.000	0.000
208	G	209	LEU	0	-0.004	0.013	59.249	-0.001	-0.001	0.000	0.000	0.000	0.000
209	G	210	ALA	0	-0.031	-0.017	60.871	-0.001	-0.001	0.000	0.000	0.000	0.000
210	G	211	HIS	0	-0.054	-0.037	60.274	-0.001	-0.001	0.000	0.000	0.000	0.000
211	G	212	PHE	0	0.027	-0.017	55.376	-0.001	-0.001	0.000	0.000	0.000	0.000
212	G	213	ARG	1	0.847	0.943	60.177	-0.037	-0.037	0.000	0.000	0.000	0.000
213	G	214	LYS	1	0.958	0.979	62.800	-0.039	-0.039	0.000	0.000	0.000	0.000
214	G	215	LEU	0	-0.057	-0.026	57.591	-0.001	-0.001	0.000	0.000	0.000	0.000
215	G	216	VAL	0	0.082	0.039	61.089	0.000	0.000	0.000	0.000	0.000	0.000
216	G	217	PRO	0	0.091	0.035	62.505	0.000	0.000	0.000	0.000	0.000	0.000
217	G	218	GLN	0	-0.057	-0.021	59.079	-0.001	-0.001	0.000	0.000	0.000	0.000
218	G	219	LEU	0	0.032	0.003	57.386	0.000	0.000	0.000	0.000	0.000	0.000
219	G	220	VAL	0	0.044	0.033	59.189	0.000	0.000	0.000	0.000	0.000	0.000
220	G	221	ARG	1	0.946	0.969	61.987	-0.030	-0.030	0.000	0.000	0.000	0.000
221	G	222	ILE	0	-0.037	-0.015	55.330	0.000	0.000	0.000	0.000	0.000	0.000
222	G	223	LEU	0	0.023	0.013	57.048	0.000	0.000	0.000	0.000	0.000	0.000
223	G	224	LYS	1	0.918	0.969	58.530	-0.027	-0.027	0.000	0.000	0.000	0.000
224	G	225	ASN	0	-0.063	-0.028	58.415	-0.001	-0.001	0.000	0.000	0.000	0.000
225	G	226	LEU	0	0.005	-0.009	53.338	0.000	0.000	0.000	0.000	0.000	0.000
226	G	227	ILE	0	-0.046	-0.020	57.000	-0.001	-0.001	0.000	0.000	0.000	0.000
227	G	228	MET	0	-0.042	-0.017	59.488	-0.001	-0.001	0.000	0.000	0.000	0.000
228	G	229	SER	0	-0.037	0.008	55.794	-0.001	-0.001	0.000	0.000	0.000	0.000
229	G	230	GLY	0	0.008	0.008	57.910	-0.001	-0.001	0.000	0.000	0.000	0.000
230	G	231	TYR	0	-0.016	-0.019	49.636	0.001	0.001	0.000	0.000	0.000	0.000
231	G	232	SER	0	0.020	0.010	50.070	-0.001	-0.001	0.000	0.000	0.000	0.000
232	G	233	PRO	0	0.004	0.014	47.823	0.001	0.001	0.000	0.000	0.000	0.000
233	G	234	GLU	-1	-0.884	-0.956	44.725	0.049	0.049	0.000	0.000	0.000	0.000
234	G	235	HIS	1	0.767	0.868	45.750	-0.048	-0.048	0.000	0.000	0.000	0.000
235	G	236	ASP	-1	-0.788	-0.890	47.905	0.031	0.031	0.000	0.000	0.000	0.000
236	G	237	VAL	0	-0.039	-0.028	46.647	0.001	0.001	0.000	0.000	0.000	0.000
237	G	238	SER	0	-0.101	-0.068	49.487	-0.001	-0.001	0.000	0.000	0.000	0.000
238	G	239	GLY	0	0.081	0.052	51.958	-0.001	-0.001	0.000	0.000	0.000	0.000
239	G	240	ILE	0	0.014	0.024	53.123	0.000	0.000	0.000	0.000	0.000	0.000
240	G	241	SER	0	0.045	0.022	51.737	0.002	0.002	0.000	0.000	0.000	0.000
241	G	242	ASP	-1	-0.851	-0.930	48.109	0.050	0.050	0.000	0.000	0.000	0.000
242	G	243	PRO	0	0.053	0.019	48.899	0.000	0.000	0.000	0.000	0.000	0.000
243	G	244	PHE	0	0.006	-0.002	44.946	0.001	0.001	0.000	0.000	0.000	0.000
244	G	245	LEU	0	-0.012	-0.002	48.845	0.001	0.001	0.000	0.000	0.000	0.000
245	G	246	GLN	0	-0.009	-0.006	50.661	-0.001	-0.001	0.000	0.000	0.000	0.000
246	G	247	VAL	0	0.044	0.026	51.370	0.000	0.000	0.000	0.000	0.000	0.000
247	G	248	ARG	1	0.909	0.951	47.608	-0.058	-0.058	0.000	0.000	0.000	0.000
248	G	249	ILE	0	-0.008	-0.006	52.064	0.000	0.000	0.000	0.000	0.000	0.000
249	G	250	LEU	0	0.008	0.002	55.202	-0.001	-0.001	0.000	0.000	0.000	0.000
250	G	251	ARG	1	0.894	0.949	50.321	-0.054	-0.054	0.000	0.000	0.000	0.000
251	G	252	LEU	0	-0.047	-0.033	54.496	0.000	0.000	0.000	0.000	0.000	0.000
252	G	253	LEU	0	0.009	-0.008	56.452	-0.001	-0.001	0.000	0.000	0.000	0.000
253	G	254	ARG	1	0.835	0.925	56.388	-0.043	-0.043	0.000	0.000	0.000	0.000
254	G	255	ILE	0	-0.053	-0.028	55.527	0.000	0.000	0.000	0.000	0.000	0.000
255	G	256	LEU	0	-0.095	-0.044	58.634	0.000	0.000	0.000	0.000	0.000	0.000
256	G	257	GLY	0	0.048	0.008	61.569	-0.001	-0.001	0.000	0.000	0.000	0.000
257	G	258	ARG	1	0.849	0.923	61.927	-0.038	-0.038	0.000	0.000	0.000	0.000
258	G	259	ASN	0	-0.017	-0.027	64.643	0.000	0.000	0.000	0.000	0.000	0.000
259	G	260	ASP	-1	-0.788	-0.871	67.495	0.033	0.033	0.000	0.000	0.000	0.000
260	G	261	ASP	-1	-0.794	-0.893	69.285	0.028	0.028	0.000	0.000	0.000	0.000
261	G	262	ASP	-1	-0.899	-0.920	70.575	0.028	0.028	0.000	0.000	0.000	0.000
262	G	263	SER	0	-0.004	-0.034	65.538	0.000	0.000	0.000	0.000	0.000	0.000
263	G	264	SER	0	-0.014	-0.032	67.256	0.000	0.000	0.000	0.000	0.000	0.000
264	G	265	GLU	-1	-0.882	-0.926	68.457	0.025	0.025	0.000	0.000	0.000	0.000
265	G	266	ALA	0	-0.033	-0.017	67.522	0.000	0.000	0.000	0.000	0.000	0.000
266	G	267	MET	0	-0.085	-0.037	63.308	0.000	0.000	0.000	0.000	0.000	0.000
267	G	268	ASN	0	0.075	0.023	65.995	-0.001	-0.001	0.000	0.000	0.000	0.000
268	G	269	ASP	-1	-0.868	-0.923	68.744	0.025	0.025	0.000	0.000	0.000	0.000
269	G	270	ILE	0	-0.077	-0.047	62.680	0.000	0.000	0.000	0.000	0.000	0.000
270	G	271	LEU	0	-0.015	-0.009	62.027	0.000	0.000	0.000	0.000	0.000	0.000
271	G	272	ALA	0	0.043	0.026	64.986	0.000	0.000	0.000	0.000	0.000	0.000
272	G	273	GLN	0	-0.006	0.005	65.444	0.000	0.000	0.000	0.000	0.000	0.000
273	G	274	VAL	0	-0.008	-0.014	60.008	0.000	0.000	0.000	0.000	0.000	0.000
274	G	275	ALA	0	-0.026	-0.017	63.208	0.000	0.000	0.000	0.000	0.000	0.000
275	G	276	THR	0	-0.101	-0.058	64.682	-0.001	-0.001	0.000	0.000	0.000	0.000
276	G	277	ASN	0	-0.037	-0.012	63.205	-0.001	-0.001	0.000	0.000	0.000	0.000
277	G	278	THR	0	-0.054	-0.012	58.689	0.000	0.000	0.000	0.000	0.000	0.000
278	G	279	GLU	-1	-0.802	-0.864	58.902	0.022	0.022	0.000	0.000	0.000	0.000
279	G	280	THR	0	-0.049	-0.038	58.511	0.001	0.001	0.000	0.000	0.000	0.000
280	G	281	SER	0	-0.035	-0.040	58.131	0.000	0.000	0.000	0.000	0.000	0.000
281	G	282	LYS	1	0.943	0.972	51.533	-0.026	-0.026	0.000	0.000	0.000	0.000
282	G	283	ASN	0	0.049	0.011	49.229	0.000	0.000	0.000	0.000	0.000	0.000
283	G	284	VAL	0	0.008	0.001	50.160	0.001	0.001	0.000	0.000	0.000	0.000
284	G	285	GLY	0	0.077	0.050	52.634	0.001	0.001	0.000	0.000	0.000	0.000
285	G	286	ASN	0	-0.004	-0.030	55.789	0.000	0.000	0.000	0.000	0.000	0.000
286	G	287	ALA	0	-0.013	0.011	52.312	0.000	0.000	0.000	0.000	0.000	0.000
287	G	288	ILE	0	-0.020	-0.005	53.548	0.001	0.001	0.000	0.000	0.000	0.000
288	G	289	LEU	0	0.025	0.027	56.076	0.000	0.000	0.000	0.000	0.000	0.000
289	G	290	TYR	0	0.043	0.028	53.458	0.000	0.000	0.000	0.000	0.000	0.000
290	G	291	GLU	-1	-0.898	-0.964	54.744	0.044	0.044	0.000	0.000	0.000	0.000
291	G	292	THR	0	-0.031	-0.015	57.078	0.000	0.000	0.000	0.000	0.000	0.000
292	G	293	VAL	0	0.013	0.002	60.301	0.000	0.000	0.000	0.000	0.000	0.000
293	G	294	LEU	0	-0.039	-0.014	56.560	0.000	0.000	0.000	0.000	0.000	0.000
294	G	295	THR	0	-0.033	-0.040	59.472	0.000	0.000	0.000	0.000	0.000	0.000
295	G	296	ILE	0	-0.008	-0.005	61.603	0.000	0.000	0.000	0.000	0.000	0.000
296	G	297	MET	0	-0.035	-0.014	64.378	-0.001	-0.001	0.000	0.000	0.000	0.000
297	G	298	ASP	-1	-0.804	-0.863	61.329	0.038	0.038	0.000	0.000	0.000	0.000
298	G	299	ILE	0	-0.010	0.017	63.585	0.000	0.000	0.000	0.000	0.000	0.000
299	G	300	LYS	1	0.792	0.906	66.075	-0.029	-0.029	0.000	0.000	0.000	0.000
300	G	301	SER	0	0.015	0.002	68.574	0.000	0.000	0.000	0.000	0.000	0.000
301	G	302	GLU	-1	-0.825	-0.906	71.253	0.022	0.022	0.000	0.000	0.000	0.000
302	G	303	SER	0	0.025	-0.019	72.752	0.001	0.001	0.000	0.000	0.000	0.000
303	G	304	GLY	0	-0.012	0.009	74.247	0.000	0.000	0.000	0.000	0.000	0.000
304	G	305	LEU	0	0.015	0.023	67.765	0.000	0.000	0.000	0.000	0.000	0.000
305	G	306	ARG	1	0.796	0.858	68.510	-0.028	-0.028	0.000	0.000	0.000	0.000
306	G	307	VAL	0	-0.033	-0.016	70.211	0.000	0.000	0.000	0.000	0.000	0.000
307	G	308	LEU	0	0.023	0.017	68.743	0.000	0.000	0.000	0.000	0.000	0.000
308	G	309	ALA	0	0.031	0.015	66.056	0.000	0.000	0.000	0.000	0.000	0.000
309	G	310	ILE	0	0.003	-0.008	66.613	0.000	0.000	0.000	0.000	0.000	0.000
310	G	311	ASN	0	-0.014	-0.014	68.491	0.000	0.000	0.000	0.000	0.000	0.000
311	G	312	ILE	0	-0.043	-0.009	63.445	-0.001	-0.001	0.000	0.000	0.000	0.000
312	G	313	LEU	0	0.013	0.002	62.173	0.000	0.000	0.000	0.000	0.000	0.000
313	G	314	GLY	0	0.030	0.021	65.016	0.000	0.000	0.000	0.000	0.000	0.000
314	G	315	ARG	1	0.917	0.944	66.179	-0.023	-0.023	0.000	0.000	0.000	0.000
315	G	316	PHE	0	-0.034	-0.019	59.591	0.000	0.000	0.000	0.000	0.000	0.000
316	G	317	LEU	0	0.004	0.001	62.346	0.000	0.000	0.000	0.000	0.000	0.000
317	G	318	LEU	0	-0.003	-0.005	64.094	0.000	0.000	0.000	0.000	0.000	0.000
318	G	319	ASN	0	0.002	0.023	60.341	-0.001	-0.001	0.000	0.000	0.000	0.000
319	G	320	ASN	0	0.032	0.006	60.737	0.000	0.000	0.000	0.000	0.000	0.000
320	G	321	ASP	-1	-0.818	-0.906	54.852	0.030	0.030	0.000	0.000	0.000	0.000
321	G	322	LYS	1	0.900	0.930	54.595	-0.027	-0.027	0.000	0.000	0.000	0.000
322	G	323	ASN	0	-0.045	-0.033	51.363	0.003	0.003	0.000	0.000	0.000	0.000
323	G	324	ILE	0	-0.010	0.007	54.449	0.001	0.001	0.000	0.000	0.000	0.000
324	G	325	ARG	1	0.819	0.906	57.482	-0.024	-0.024	0.000	0.000	0.000	0.000
325	G	326	TYR	0	0.020	0.010	52.682	0.001	0.001	0.000	0.000	0.000	0.000
326	G	327	VAL	0	-0.015	-0.007	54.758	0.001	0.001	0.000	0.000	0.000	0.000
327	G	328	ALA	0	0.007	0.018	57.109	0.001	0.001	0.000	0.000	0.000	0.000
328	G	329	LEU	0	0.035	0.009	59.903	0.000	0.000	0.000	0.000	0.000	0.000
329	G	330	THR	0	-0.023	-0.016	55.282	0.001	0.001	0.000	0.000	0.000	0.000
330	G	331	SER	0	-0.051	-0.048	58.542	0.001	0.001	0.000	0.000	0.000	0.000
331	G	332	LEU	0	-0.013	-0.015	60.403	0.000	0.000	0.000	0.000	0.000	0.000
332	G	333	LEU	0	-0.018	-0.006	59.007	0.000	0.000	0.000	0.000	0.000	0.000
333	G	334	LYS	1	0.866	0.938	54.691	-0.042	-0.042	0.000	0.000	0.000	0.000
334	G	335	THR	0	-0.042	-0.008	61.221	0.000	0.000	0.000	0.000	0.000	0.000
335	G	336	VAL	0	0.043	0.032	64.701	-0.001	-0.001	0.000	0.000	0.000	0.000
336	G	337	GLN	0	-0.052	-0.034	63.163	-0.001	-0.001	0.000	0.000	0.000	0.000
337	G	338	THR	0	0.036	0.010	66.540	0.000	0.000	0.000	0.000	0.000	0.000
338	G	339	ASP	-1	-0.808	-0.881	68.641	0.027	0.027	0.000	0.000	0.000	0.000
339	G	340	HIS	0	0.044	0.057	70.166	-0.001	-0.001	0.000	0.000	0.000	0.000
340	G	341	ASN	0	-0.017	-0.031	71.586	-0.001	-0.001	0.000	0.000	0.000	0.000
341	G	342	ALA	0	0.007	0.009	70.662	-0.001	-0.001	0.000	0.000	0.000	0.000
342	G	343	VAL	0	0.056	0.033	67.082	0.000	0.000	0.000	0.000	0.000	0.000
343	G	344	GLN	0	-0.051	-0.034	69.910	-0.001	-0.001	0.000	0.000	0.000	0.000
344	G	345	ARG	1	0.916	0.970	72.479	-0.023	-0.023	0.000	0.000	0.000	0.000
345	G	346	HIS	0	0.009	0.007	69.090	-0.001	-0.001	0.000	0.000	0.000	0.000
346	G	347	ARG	1	0.910	0.953	70.319	-0.022	-0.022	0.000	0.000	0.000	0.000
347	G	348	SER	0	0.015	0.019	70.839	0.000	0.000	0.000	0.000	0.000	0.000
348	G	349	THR	0	0.058	0.013	68.469	0.000	0.000	0.000	0.000	0.000	0.000
349	G	350	ILE	0	0.004	-0.005	65.536	0.000	0.000	0.000	0.000	0.000	0.000
350	G	351	VAL	0	0.036	0.019	66.182	0.001	0.001	0.000	0.000	0.000	0.000
351	G	352	ASP	-1	-0.901	-0.953	67.771	0.020	0.020	0.000	0.000	0.000	0.000
352	G	353	CYS	0	-0.103	-0.050	62.898	0.000	0.000	0.000	0.000	0.000	0.000
353	G	354	LEU	0	-0.065	-0.025	62.986	0.001	0.001	0.000	0.000	0.000	0.000
354	G	355	LYS	1	0.890	0.941	63.928	-0.020	-0.020	0.000	0.000	0.000	0.000
355	G	356	ASP	-1	-0.810	-0.878	59.918	0.025	0.025	0.000	0.000	0.000	0.000
356	G	357	LEU	0	0.010	-0.010	58.711	0.001	0.001	0.000	0.000	0.000	0.000
357	G	358	ASP	-1	-0.859	-0.906	54.206	0.033	0.033	0.000	0.000	0.000	0.000
358	G	359	VAL	0	0.096	0.046	53.336	0.000	0.000	0.000	0.000	0.000	0.000
359	G	360	SER	0	-0.005	-0.019	52.800	0.001	0.001	0.000	0.000	0.000	0.000
360	G	361	ILE	0	-0.081	-0.036	54.660	0.000	0.000	0.000	0.000	0.000	0.000
361	G	362	LYS	1	0.858	0.949	58.025	-0.026	-0.026	0.000	0.000	0.000	0.000
362	G	363	ARG	1	0.758	0.874	54.832	-0.039	-0.039	0.000	0.000	0.000	0.000
363	G	364	ARG	1	0.850	0.882	55.257	-0.040	-0.040	0.000	0.000	0.000	0.000
364	G	365	ALA	0	0.019	0.014	59.065	0.000	0.000	0.000	0.000	0.000	0.000
365	G	366	MET	0	0.003	0.033	59.452	-0.001	-0.001	0.000	0.000	0.000	0.000
366	G	367	GLU	-1	-0.828	-0.894	57.425	0.039	0.039	0.000	0.000	0.000	0.000
367	G	368	LEU	0	0.007	-0.002	62.002	0.000	0.000	0.000	0.000	0.000	0.000
368	G	369	SER	0	-0.010	-0.027	64.275	-0.001	-0.001	0.000	0.000	0.000	0.000
369	G	370	PHE	0	-0.002	-0.011	63.846	-0.001	-0.001	0.000	0.000	0.000	0.000
370	G	371	ALA	0	-0.062	-0.011	64.768	0.000	0.000	0.000	0.000	0.000	0.000
371	G	372	LEU	0	-0.001	-0.008	66.906	0.000	0.000	0.000	0.000	0.000	0.000
372	G	373	VAL	0	-0.032	0.010	70.067	-0.001	-0.001	0.000	0.000	0.000	0.000
373	G	374	ASN	0	-0.045	-0.042	72.356	0.000	0.000	0.000	0.000	0.000	0.000
374	G	375	GLY	0	0.077	0.029	75.445	0.000	0.000	0.000	0.000	0.000	0.000
375	G	376	ASN	0	-0.023	-0.007	78.608	0.000	0.000	0.000	0.000	0.000	0.000
376	G	377	ASN	0	-0.008	-0.032	74.000	-0.001	-0.001	0.000	0.000	0.000	0.000
377	G	378	ILE	0	0.034	0.048	74.358	0.000	0.000	0.000	0.000	0.000	0.000
378	G	379	ARG	1	0.967	0.981	76.631	-0.019	-0.019	0.000	0.000	0.000	0.000
379	G	380	GLY	0	-0.026	-0.013	77.956	0.000	0.000	0.000	0.000	0.000	0.000
380	G	381	MET	0	0.024	0.000	70.172	0.000	0.000	0.000	0.000	0.000	0.000
381	G	382	MET	0	0.013	0.046	71.818	0.000	0.000	0.000	0.000	0.000	0.000
382	G	383	LYS	1	0.946	0.979	73.041	-0.018	-0.018	0.000	0.000	0.000	0.000
383	G	384	GLU	-1	-0.871	-0.925	70.639	0.020	0.020	0.000	0.000	0.000	0.000
384	G	385	LEU	0	-0.011	-0.009	67.438	0.000	0.000	0.000	0.000	0.000	0.000
385	G	386	LEU	0	0.023	-0.008	68.711	0.000	0.000	0.000	0.000	0.000	0.000
386	G	387	TYR	0	0.001	0.008	70.063	0.000	0.000	0.000	0.000	0.000	0.000
387	G	388	PHE	0	0.016	-0.017	61.837	0.000	0.000	0.000	0.000	0.000	0.000
388	G	389	LEU	0	0.011	-0.004	64.902	0.001	0.001	0.000	0.000	0.000	0.000
389	G	390	ASP	-1	-0.816	-0.885	65.957	0.021	0.021	0.000	0.000	0.000	0.000
390	G	391	SER	0	-0.084	-0.034	66.683	0.000	0.000	0.000	0.000	0.000	0.000
391	G	392	CYS	0	-0.041	-0.019	62.345	0.001	0.001	0.000	0.000	0.000	0.000
392	G	393	GLU	-1	-0.835	-0.900	57.725	0.027	0.027	0.000	0.000	0.000	0.000
393	G	394	PRO	0	0.035	-0.019	56.494	0.001	0.001	0.000	0.000	0.000	0.000
394	G	395	GLU	-1	-0.886	-0.930	53.866	0.038	0.038	0.000	0.000	0.000	0.000
395	G	396	PHE	0	0.033	0.013	56.068	0.001	0.001	0.000	0.000	0.000	0.000
396	G	397	LYS	1	0.838	0.927	59.117	-0.025	-0.025	0.000	0.000	0.000	0.000
397	G	398	ALA	0	0.048	0.033	58.276	0.000	0.000	0.000	0.000	0.000	0.000
398	G	399	ASP	-1	-0.829	-0.898	57.325	0.039	0.039	0.000	0.000	0.000	0.000
399	G	400	CYS	0	-0.036	-0.008	60.450	-0.001	-0.001	0.000	0.000	0.000	0.000
400	G	401	ALA	0	0.042	0.019	63.706	-0.001	-0.001	0.000	0.000	0.000	0.000
401	G	402	SER	0	-0.041	-0.025	61.907	0.000	0.000	0.000	0.000	0.000	0.000
402	G	403	GLY	0	0.006	0.003	64.078	0.000	0.000	0.000	0.000	0.000	0.000
403	G	404	ILE	0	-0.025	-0.025	65.565	-0.001	-0.001	0.000	0.000	0.000	0.000
404	G	405	PHE	0	0.019	-0.003	66.811	-0.001	-0.001	0.000	0.000	0.000	0.000
405	G	406	LEU	0	0.038	0.038	65.050	0.000	0.000	0.000	0.000	0.000	0.000
406	G	407	ALA	0	-0.006	-0.017	68.723	-0.001	-0.001	0.000	0.000	0.000	0.000
407	G	408	ALA	0	-0.018	-0.011	71.058	-0.001	-0.001	0.000	0.000	0.000	0.000
408	G	409	GLU	-1	-0.851	-0.925	70.086	0.029	0.029	0.000	0.000	0.000	0.000
409	G	410	LYS	1	0.882	0.963	68.592	-0.031	-0.031	0.000	0.000	0.000	0.000
410	G	411	TYR	0	-0.066	-0.051	72.145	0.000	0.000	0.000	0.000	0.000	0.000
411	G	412	ALA	0	0.067	0.032	76.511	-0.001	-0.001	0.000	0.000	0.000	0.000
412	G	413	PRO	0	-0.092	-0.037	78.581	0.000	0.000	0.000	0.000	0.000	0.000
413	G	414	SER	0	0.019	0.002	82.076	0.000	0.000	0.000	0.000	0.000	0.000
414	G	415	LYS	1	0.942	0.958	81.402	-0.021	-0.021	0.000	0.000	0.000	0.000
415	G	416	ARG	1	0.829	0.891	81.524	-0.017	-0.017	0.000	0.000	0.000	0.000
416	G	417	TRP	0	-0.022	-0.015	75.508	0.000	0.000	0.000	0.000	0.000	0.000
417	G	418	HIS	0	-0.018	-0.014	74.645	0.000	0.000	0.000	0.000	0.000	0.000
418	G	419	ILE	0	0.049	0.026	76.848	0.001	0.001	0.000	0.000	0.000	0.000
419	G	420	ASP	-1	-0.773	-0.847	77.650	0.019	0.019	0.000	0.000	0.000	0.000
420	G	421	THR	0	-0.046	-0.030	74.368	0.000	0.000	0.000	0.000	0.000	0.000
421	G	422	ILE	0	0.015	0.016	73.062	0.000	0.000	0.000	0.000	0.000	0.000
422	G	423	MET	0	-0.005	0.011	73.021	0.001	0.001	0.000	0.000	0.000	0.000
423	G	424	ARG	1	0.824	0.920	72.500	-0.020	-0.020	0.000	0.000	0.000	0.000
424	G	425	VAL	0	0.006	0.002	68.223	0.000	0.000	0.000	0.000	0.000	0.000
425	G	426	LEU	0	-0.017	-0.027	69.188	0.001	0.001	0.000	0.000	0.000	0.000
426	G	427	THR	0	-0.015	-0.019	70.433	0.000	0.000	0.000	0.000	0.000	0.000
427	G	428	THR	0	-0.068	-0.015	69.110	0.000	0.000	0.000	0.000	0.000	0.000
428	G	429	ALA	0	-0.035	-0.017	65.366	0.000	0.000	0.000	0.000	0.000	0.000
429	G	430	GLY	0	0.082	0.030	65.563	0.000	0.000	0.000	0.000	0.000	0.000
430	G	431	SER	0	-0.024	-0.022	62.014	0.001	0.001	0.000	0.000	0.000	0.000
431	G	432	TYR	0	-0.068	-0.037	58.607	0.002	0.002	0.000	0.000	0.000	0.000
432	G	433	VAL	0	-0.041	-0.005	61.618	0.001	0.001	0.000	0.000	0.000	0.000
433	G	434	ARG	1	0.869	0.906	57.166	-0.041	-0.041	0.000	0.000	0.000	0.000
434	G	435	ASP	-1	-0.773	-0.895	61.701	0.033	0.033	0.000	0.000	0.000	0.000
435	G	436	ASP	-1	-0.883	-0.922	60.592	0.038	0.038	0.000	0.000	0.000	0.000
436	G	437	ALA	0	0.015	0.001	63.612	0.000	0.000	0.000	0.000	0.000	0.000
437	G	438	VAL	0	-0.007	-0.003	66.049	-0.001	-0.001	0.000	0.000	0.000	0.000
438	G	439	PRO	0	-0.026	-0.015	66.914	-0.001	-0.001	0.000	0.000	0.000	0.000
439	G	440	ASN	0	-0.016	-0.023	68.618	-0.001	-0.001	0.000	0.000	0.000	0.000
440	G	441	LEU	0	0.008	0.011	69.762	-0.001	-0.001	0.000	0.000	0.000	0.000
441	G	442	ILE	0	0.014	0.001	72.591	-0.001	-0.001	0.000	0.000	0.000	0.000
442	G	443	GLN	0	0.021	0.001	72.205	-0.001	-0.001	0.000	0.000	0.000	0.000
443	G	444	LEU	0	0.034	0.030	73.015	-0.001	-0.001	0.000	0.000	0.000	0.000
444	G	445	ILE	0	-0.078	-0.033	76.645	-0.001	-0.001	0.000	0.000	0.000	0.000
445	G	446	THR	0	-0.044	-0.017	78.296	-0.001	-0.001	0.000	0.000	0.000	0.000
446	G	447	ASN	0	-0.001	0.006	79.338	0.000	0.000	0.000	0.000	0.000	0.000
447	G	448	SER	0	-0.094	-0.060	80.748	0.000	0.000	0.000	0.000	0.000	0.000
448	G	449	VAL	0	0.054	0.024	83.444	0.000	0.000	0.000	0.000	0.000	0.000
449	G	450	GLU	-1	-0.862	-0.953	85.629	0.020	0.020	0.000	0.000	0.000	0.000
450	G	451	MET	0	-0.056	0.018	84.108	0.000	0.000	0.000	0.000	0.000	0.000
451	G	452	HIS	0	0.061	0.040	83.024	0.000	0.000	0.000	0.000	0.000	0.000
452	G	453	ALA	0	0.096	0.063	84.180	0.000	0.000	0.000	0.000	0.000	0.000
453	G	454	TYR	0	-0.010	-0.030	83.090	0.000	0.000	0.000	0.000	0.000	0.000
454	G	455	THR	0	-0.006	-0.020	79.782	0.000	0.000	0.000	0.000	0.000	0.000
455	G	456	VAL	0	0.001	-0.004	81.086	0.000	0.000	0.000	0.000	0.000	0.000
456	G	457	GLN	0	0.038	0.031	82.161	0.000	0.000	0.000	0.000	0.000	0.000
457	G	458	ARG	1	0.798	0.865	80.065	-0.019	-0.019	0.000	0.000	0.000	0.000
458	G	459	LEU	0	0.023	0.008	75.642	0.000	0.000	0.000	0.000	0.000	0.000
459	G	460	TYR	0	0.020	0.007	78.213	0.000	0.000	0.000	0.000	0.000	0.000
460	G	461	LYS	1	0.933	0.962	79.807	-0.016	-0.016	0.000	0.000	0.000	0.000
461	G	462	ALA	0	-0.025	-0.004	75.911	0.000	0.000	0.000	0.000	0.000	0.000
462	G	463	ILE	0	-0.009	-0.011	74.213	0.000	0.000	0.000	0.000	0.000	0.000
463	G	464	LEU	0	-0.051	-0.020	75.856	0.000	0.000	0.000	0.000	0.000	0.000
464	G	465	GLY	0	-0.040	0.001	76.616	0.000	0.000	0.000	0.000	0.000	0.000
465	G	466	ASP	-1	-0.783	-0.877	70.274	0.022	0.022	0.000	0.000	0.000	0.000
466	G	467	TYR	0	0.001	0.002	71.074	0.000	0.000	0.000	0.000	0.000	0.000
467	G	468	SER	0	-0.086	-0.065	66.687	0.001	0.001	0.000	0.000	0.000	0.000
468	G	469	GLN	0	-0.044	-0.038	66.369	0.002	0.002	0.000	0.000	0.000	0.000
469	G	470	GLN	0	0.081	0.038	64.506	0.000	0.000	0.000	0.000	0.000	0.000
470	G	471	PRO	0	0.024	0.005	65.085	-0.001	-0.001	0.000	0.000	0.000	0.000
471	G	472	LEU	0	-0.002	0.015	67.814	0.000	0.000	0.000	0.000	0.000	0.000
472	G	473	VAL	0	0.060	0.028	69.469	-0.001	-0.001	0.000	0.000	0.000	0.000
473	G	474	GLN	0	-0.076	-0.028	65.615	0.000	0.000	0.000	0.000	0.000	0.000
474	G	475	VAL	0	0.032	0.008	71.083	0.000	0.000	0.000	0.000	0.000	0.000
475	G	476	ALA	0	0.017	0.016	73.351	-0.001	-0.001	0.000	0.000	0.000	0.000
476	G	477	ALA	0	0.044	0.023	74.221	-0.001	-0.001	0.000	0.000	0.000	0.000
477	G	478	TRP	0	0.006	-0.008	74.351	0.000	0.000	0.000	0.000	0.000	0.000
478	G	479	CYS	0	-0.063	-0.031	76.338	0.000	0.000	0.000	0.000	0.000	0.000
479	G	480	ILE	0	-0.028	-0.009	78.981	-0.001	-0.001	0.000	0.000	0.000	0.000
480	G	481	GLY	0	0.021	0.002	79.382	0.000	0.000	0.000	0.000	0.000	0.000
481	G	482	GLU	-1	-0.780	-0.882	79.879	0.022	0.022	0.000	0.000	0.000	0.000
482	G	483	TYR	0	-0.064	-0.052	81.013	0.000	0.000	0.000	0.000	0.000	0.000
483	G	484	GLY	0	0.081	0.040	84.685	0.000	0.000	0.000	0.000	0.000	0.000
484	G	485	ASP	-1	-0.788	-0.898	85.635	0.018	0.018	0.000	0.000	0.000	0.000
485	G	486	LEU	0	-0.040	-0.019	87.010	0.000	0.000	0.000	0.000	0.000	0.000
486	G	487	LEU	0	-0.057	-0.011	83.588	0.000	0.000	0.000	0.000	0.000	0.000
487	G	488	VAL	0	-0.006	-0.015	87.388	0.000	0.000	0.000	0.000	0.000	0.000
488	G	489	SER	0	-0.029	-0.019	89.980	0.000	0.000	0.000	0.000	0.000	0.000
489	G	490	GLY	0	0.030	0.034	92.279	0.000	0.000	0.000	0.000	0.000	0.000
490	G	491	GLN	0	-0.071	-0.062	92.710	0.000	0.000	0.000	0.000	0.000	0.000
491	G	492	CYS	0	-0.050	-0.026	89.603	0.001	0.001	0.000	0.000	0.000	0.000
492	G	493	GLU	-1	-0.916	-0.943	91.906	0.014	0.014	0.000	0.000	0.000	0.000
493	G	494	GLU	-1	-0.853	-0.950	88.329	0.018	0.018	0.000	0.000	0.000	0.000
494	G	495	GLU	-1	-0.947	-0.960	86.782	0.016	0.016	0.000	0.000	0.000	0.000
495	G	496	GLU	-1	-0.871	-0.933	90.656	0.013	0.013	0.000	0.000	0.000	0.000
496	G	497	PRO	0	-0.041	0.001	90.450	0.000	0.000	0.000	0.000	0.000	0.000
497	G	498	ILE	0	-0.038	-0.029	86.536	0.000	0.000	0.000	0.000	0.000	0.000
498	G	499	GLN	0	-0.015	-0.013	90.157	0.000	0.000	0.000	0.000	0.000	0.000
499	G	500	VAL	0	-0.014	0.011	86.959	0.000	0.000	0.000	0.000	0.000	0.000
500	G	501	THR	0	-0.029	-0.052	88.428	0.000	0.000	0.000	0.000	0.000	0.000
501	G	502	GLU	-1	-0.851	-0.937	87.640	0.015	0.015	0.000	0.000	0.000	0.000
502	G	503	ASP	-1	-0.803	-0.911	86.268	0.015	0.015	0.000	0.000	0.000	0.000
503	G	504	GLU	-1	-0.819	-0.872	84.860	0.015	0.015	0.000	0.000	0.000	0.000
504	G	505	VAL	0	-0.006	0.000	82.563	0.001	0.001	0.000	0.000	0.000	0.000
505	G	506	LEU	0	-0.036	-0.034	81.414	0.001	0.001	0.000	0.000	0.000	0.000
506	G	507	ASP	-1	-0.875	-0.927	80.728	0.016	0.016	0.000	0.000	0.000	0.000
507	G	508	ILE	0	-0.023	-0.005	77.299	0.001	0.001	0.000	0.000	0.000	0.000
508	G	509	LEU	0	-0.019	-0.005	76.858	0.001	0.001	0.000	0.000	0.000	0.000
509	G	510	GLU	-1	-0.859	-0.946	75.994	0.019	0.019	0.000	0.000	0.000	0.000
510	G	511	SER	0	-0.077	-0.036	75.319	0.001	0.001	0.000	0.000	0.000	0.000
511	G	512	VAL	0	0.004	-0.004	71.661	0.001	0.001	0.000	0.000	0.000	0.000
512	G	513	LEU	0	-0.034	0.006	71.318	0.001	0.001	0.000	0.000	0.000	0.000
513	G	514	ILE	0	-0.005	-0.006	70.939	0.001	0.001	0.000	0.000	0.000	0.000
514	G	515	SER	0	0.002	0.014	69.495	0.000	0.000	0.000	0.000	0.000	0.000
515	G	516	ASN	0	0.007	-0.018	64.635	0.001	0.001	0.000	0.000	0.000	0.000
516	G	517	MET	0	-0.039	-0.011	64.638	0.001	0.001	0.000	0.000	0.000	0.000
517	G	518	SER	0	-0.038	-0.022	65.249	0.001	0.001	0.000	0.000	0.000	0.000
518	G	519	THR	0	-0.007	-0.013	62.307	0.001	0.001	0.000	0.000	0.000	0.000
519	G	520	SER	0	-0.028	-0.038	63.341	-0.001	-0.001	0.000	0.000	0.000	0.000
520	G	521	VAL	0	0.081	0.018	63.570	-0.001	-0.001	0.000	0.000	0.000	0.000
521	G	522	THR	0	-0.046	-0.013	66.320	-0.001	-0.001	0.000	0.000	0.000	0.000
522	G	523	ARG	1	0.885	0.957	66.072	-0.027	-0.027	0.000	0.000	0.000	0.000
523	G	524	GLY	0	0.018	0.003	69.101	-0.001	-0.001	0.000	0.000	0.000	0.000
524	G	525	TYR	0	-0.053	-0.037	68.421	-0.001	-0.001	0.000	0.000	0.000	0.000
525	G	526	ALA	0	0.039	0.015	72.518	-0.001	-0.001	0.000	0.000	0.000	0.000
526	G	527	LEU	0	0.004	0.018	73.395	-0.001	-0.001	0.000	0.000	0.000	0.000
527	G	528	THR	0	0.018	-0.009	74.840	-0.001	-0.001	0.000	0.000	0.000	0.000
528	G	529	ALA	0	-0.009	0.020	76.500	-0.001	-0.001	0.000	0.000	0.000	0.000
529	G	530	ILE	0	0.055	0.018	78.126	-0.001	-0.001	0.000	0.000	0.000	0.000
530	G	531	MET	0	-0.039	-0.004	79.512	-0.001	-0.001	0.000	0.000	0.000	0.000
531	G	532	LYS	1	0.838	0.925	78.281	-0.024	-0.024	0.000	0.000	0.000	0.000
532	G	533	LEU	0	0.005	0.012	82.384	-0.001	-0.001	0.000	0.000	0.000	0.000
533	G	534	SER	0	-0.069	-0.060	84.345	-0.001	-0.001	0.000	0.000	0.000	0.000
534	G	535	THR	0	-0.054	-0.025	86.170	-0.001	-0.001	0.000	0.000	0.000	0.000
535	G	536	ARG	1	0.743	0.858	83.764	-0.021	-0.021	0.000	0.000	0.000	0.000
536	G	537	PHE	0	0.002	0.004	88.178	0.000	0.000	0.000	0.000	0.000	0.000
537	G	538	THR	0	0.001	-0.003	89.979	0.000	0.000	0.000	0.000	0.000	0.000
538	G	539	CYS	0	-0.033	0.005	92.886	0.000	0.000	0.000	0.000	0.000	0.000
539	G	540	THR	0	-0.011	-0.009	89.456	0.000	0.000	0.000	0.000	0.000	0.000
540	G	541	VAL	0	0.092	0.050	88.063	0.000	0.000	0.000	0.000	0.000	0.000
541	G	542	ASN	0	0.020	-0.012	87.486	0.001	0.001	0.000	0.000	0.000	0.000
542	G	543	ARG	1	0.854	0.926	86.234	-0.014	-0.014	0.000	0.000	0.000	0.000
543	G	544	ILE	0	0.087	0.054	83.134	0.000	0.000	0.000	0.000	0.000	0.000
544	G	545	LYS	1	0.908	0.970	82.745	-0.016	-0.016	0.000	0.000	0.000	0.000
545	G	546	LYS	1	0.906	0.963	81.713	-0.017	-0.017	0.000	0.000	0.000	0.000
546	G	547	VAL	0	-0.016	0.013	78.659	0.000	0.000	0.000	0.000	0.000	0.000
547	G	548	VAL	0	0.014	0.004	78.321	0.001	0.001	0.000	0.000	0.000	0.000
548	G	549	SER	0	-0.085	-0.047	78.355	0.000	0.000	0.000	0.000	0.000	0.000
549	G	550	ILE	0	-0.024	-0.022	77.635	0.000	0.000	0.000	0.000	0.000	0.000
550	G	551	TYR	0	0.004	0.001	72.052	0.001	0.001	0.000	0.000	0.000	0.000
551	G	552	GLY	0	-0.007	0.007	73.971	0.001	0.001	0.000	0.000	0.000	0.000
552	G	553	SER	0	-0.089	-0.053	72.807	0.000	0.000	0.000	0.000	0.000	0.000
553	G	554	SER	0	-0.005	0.012	69.326	0.000	0.000	0.000	0.000	0.000	0.000
554	G	555	ILE	0	0.044	0.002	62.846	0.000	0.000	0.000	0.000	0.000	0.000
555	G	556	ASP	-1	-0.847	-0.897	65.169	0.033	0.033	0.000	0.000	0.000	0.000
556	G	557	VAL	0	0.056	0.019	63.518	-0.001	-0.001	0.000	0.000	0.000	0.000
557	G	558	GLU	-1	-0.812	-0.887	66.439	0.031	0.031	0.000	0.000	0.000	0.000
558	G	559	LEU	0	-0.026	-0.015	68.358	-0.001	-0.001	0.000	0.000	0.000	0.000
559	G	560	GLN	0	-0.020	0.005	69.802	0.000	0.000	0.000	0.000	0.000	0.000
560	G	561	GLN	0	0.025	0.000	69.511	-0.002	-0.002	0.000	0.000	0.000	0.000
561	G	562	ARG	1	0.847	0.918	69.576	-0.030	-0.030	0.000	0.000	0.000	0.000
562	G	563	ALA	0	0.024	0.013	74.290	-0.001	-0.001	0.000	0.000	0.000	0.000
563	G	564	VAL	0	-0.001	-0.001	74.755	-0.001	-0.001	0.000	0.000	0.000	0.000
564	G	565	GLU	-1	-0.944	-0.966	75.388	0.026	0.026	0.000	0.000	0.000	0.000
565	G	566	TYR	0	-0.022	-0.041	75.936	-0.001	-0.001	0.000	0.000	0.000	0.000
566	G	567	ASN	0	0.001	-0.001	79.890	-0.001	-0.001	0.000	0.000	0.000	0.000
567	G	568	ALA	0	-0.060	-0.026	81.038	-0.001	-0.001	0.000	0.000	0.000	0.000
568	G	569	LEU	0	-0.008	-0.012	82.165	-0.001	-0.001	0.000	0.000	0.000	0.000
569	G	570	PHE	0	0.010	-0.001	83.182	-0.001	-0.001	0.000	0.000	0.000	0.000
570	G	571	LYS	1	0.895	0.964	85.057	-0.019	-0.019	0.000	0.000	0.000	0.000
571	G	572	LYS	1	0.902	0.948	85.126	-0.020	-0.020	0.000	0.000	0.000	0.000
572	G	573	TYR	0	-0.031	-0.022	84.976	-0.001	-0.001	0.000	0.000	0.000	0.000
573	G	574	ASP	-1	-0.744	-0.860	88.896	0.018	0.018	0.000	0.000	0.000	0.000
574	G	575	HIS	0	0.017	0.015	90.232	0.000	0.000	0.000	0.000	0.000	0.000
575	G	576	MET	0	-0.033	-0.028	86.126	0.000	0.000	0.000	0.000	0.000	0.000
576	G	577	ARG	1	0.869	0.934	86.142	-0.018	-0.018	0.000	0.000	0.000	0.000
577	G	578	SER	0	0.053	0.026	87.069	0.000	0.000	0.000	0.000	0.000	0.000
578	G	579	ALA	0	-0.049	-0.011	88.692	0.000	0.000	0.000	0.000	0.000	0.000
579	G	580	LEU	0	-0.008	-0.014	82.639	0.000	0.000	0.000	0.000	0.000	0.000
580	G	581	LEU	0	-0.083	-0.037	81.048	0.001	0.001	0.000	0.000	0.000	0.000
581	G	582	GLU	-1	-0.850	-0.908	84.485	0.019	0.019	0.000	0.000	0.000	0.000
582	G	583	ARG	1	0.796	0.879	83.476	-0.018	-0.018	0.000	0.000	0.000	0.000
583	G	584	MET	0	-0.037	0.000	78.723	0.000	0.000	0.000	0.000	0.000	0.000
584	G	585	PRO	0	-0.016	-0.020	80.271	0.000	0.000	0.000	0.000	0.000	0.000
585	G	586	VAL	0	-0.003	0.016	79.915	0.000	0.000	0.000	0.000	0.000	0.000
586	G	587	MET	0	-0.060	-0.015	72.338	0.000	0.000	0.000	0.000	0.000	0.000
587	G	588	GLU	-1	-0.924	-0.965	75.118	0.027	0.027	0.000	0.000	0.000	0.000

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Interactive mode: IFIE and PIEDA for fragment #1(G:2:PRO)