A0A087Y8J2_POEFO Loading...

DNA repair protein RAD51 homolog

Plays an important role in homologous strand exchange, a key step in DNA repair through homologous recombination (HR). Binds to single-stranded DNA in an ATP-dependent manner to form nucleoprotein filaments which are essential for the homology search and strand exchange. Catalyzes the recognition of homology and strand exchange between homologous DNA partners to form a joint molecule between a processed DNA break and the repair template. Recruited to resolve stalled replication forks during replication stress. Also involved in interstrand cross-link repair.

AlphaFold DB , UniProt , Accession A0A087Y8J2, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 338 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	39.5	Very low	35.5	Very low	252 Å²	252	139.3 Å²	139.3	100%	1.241	72%	0.719	S	S	*	*				0	87.8	0	-106.9	-179.6	163.1	0	0	107.6
2	A	40.6	Very low	35	Very low	96 Å²	96	136.3 Å²	136.3	79%	0.793	70%	0.699	S	S	*	*			trans	176.5	85.8	167.3	0	0	0	0	0	107.1
3	M	35.8	Very low	34.6	Very low	172 Å²	172	129.8 Å²	129.8	85%	0.847	68%	0.678	S	S	*	*			trans	-169.6	50.5	164.9	-88.9	-144.1	174.9	0	0	109.3
4	R	40.4	Very low	34.4	Very low	240 Å²	240	130.9 Å²	130.9	91%	0.906	68%	0.678	S	S	*	*	S	Bend	trans	-136.5	11.7	174.2	-79.2	-167.1	178.4	-161.2	-1.3	113.3
5	G	34.4	Very low	34.4	Very low	52 Å²	52	130.9 Å²	130.9	54%	0.536	67%	0.674	S	S	.	*	S	Bend	trans	-100.4	-33.2	-177.4	0	0	0	0	0	114.3
6	E	35.6	Very low	34.4	Very low	145 Å²	145	132.8 Å²	132.8	68%	0.678	68%	0.679	S	S	*	*	H	α-helix	trans	-78.6	-39	-172.1	-71	166.5	166.4	0	0	112.4	R8 V9 E10	E6-R8 PolarHBondContact O-N 3.14Å; E6-R8 VanDerWaalsContact O-N 3.14Å; E6-V9 PolarHBondContact O-N 3.24Å; E6-E10 PolarHBondContact O-N 3.29Å
7	T	34.4	Very low	34.6	Very low	96 Å²	96	133.5 Å²	133.5	59%	0.589	68%	0.679	S	S	*	*	H	α-helix	trans	-67.6	-18.5	-176.9	-27.3	0	0	0	0	114.2	V11	T7-V11 WeakPolarHBondContact O-CG2 3.49Å
8	R	32.3	Very low	35.3	Very low	180 Å²	180	132.1 Å²	132.1	68%	0.679	67%	0.673	S	S	*	*	H	α-helix	trans	-89.2	-30.8	-179.2	-159.5	176.6	171.8	173.8	0.8	112	E6 E12	E6-R8 PolarHBondContact O-N 3.14Å; E6-R8 VanDerWaalsContact O-N 3.14Å; R8-E12 IonicContact NE-OE1 2.79Å; R8-E12 WeakPolarHBondContact O-CB 3.3Å; R8-E12 WeakPolarHBondContact O-CG 3.38Å; R8-E12 PolarHBondContact O-N 3.05Å
9	V	34.9	Very low	36.5	Very low	98 Å²	98	134.9 Å²	134.9	59%	0.594	68%	0.676	S	S	*	*	H	α-helix	trans	-76.2	-33.9	176.7	-178.4	0	0	0	0	110.8	E6 A13	E6-V9 PolarHBondContact O-N 3.24Å; V9-A13 VanDerWaalsContact O-CB 3.3Å; V9-A13 WeakPolarHBondContact O-CB 3.5Å; V9-A13 PolarHBondContact O-N 3.2Å
10	E	30.7	Very low	38.3	Very low	128 Å²	128	130.6 Å²	130.6	60%	0.598	67%	0.667	S	S	*	*	H	α-helix	trans	-69.9	-37.2	175	-71.1	177.9	163.7	0	0	112.7	E6 A13 E14	E6-E10 PolarHBondContact O-N 3.29Å; E10-A13 PolarHBondContact O-N 3.04Å; E10-E14 WeakPolarHBondContact O-CG 3.39Å; E10-E14 PolarHBondContact O-N 3.44Å
11	V	32.3	Very low	40.5	Very low	73 Å²	73	126.4 Å²	126.4	44%	0.442	65%	0.649	S	S	.	*	H	α-helix	trans	-72.9	-36.3	177.6	177.4	0	0	0	0	111.7	T7 E15	T7-V11 WeakPolarHBondContact O-CG2 3.49Å; V11-E15 WeakPolarHBondContact O-CG 3.2Å; V11-E15 PolarHBondContact O-N 3.44Å
12	E	28.9	Very low	42.9	Very low	103 Å²	103	115.5 Å²	115.5	48%	0.481	60%	0.595	S	S	.	*	H	α-helix	trans	-70	-31.8	174	-73.8	170.4	-173.6	0	0	111.7	R8 E16	R8-E12 IonicContact NE-OE1 2.79Å; R8-E12 WeakPolarHBondContact O-CB 3.3Å; R8-E12 WeakPolarHBondContact O-CG 3.38Å; R8-E12 PolarHBondContact O-N 3.05Å; E12-E16 PolarHBondContact O-N 3.25Å
13	A	29.9	Very low	45.4	Very low	52 Å²	52	114 Å²	114	43%	0.43	58%	0.577	S	S	.	*	H	α-helix	trans	-75.2	-33.2	175.6	0	0	0	0	0	113.9	V9 E10	V9-A13 VanDerWaalsContact O-CB 3.3Å; V9-A13 WeakPolarHBondContact O-CB 3.5Å; V9-A13 PolarHBondContact O-N 3.2Å; E10-A13 PolarHBondContact O-N 3.04Å
14	E	31.9	Very low	48	Very low	146 Å²	146	105.9 Å²	105.9	68%	0.682	54%	0.537	S	S	*	.	H	α-helix	trans	-72.9	-27.8	173.6	-75.2	-176.1	171.1	0	0	112.6	E10	E10-E14 WeakPolarHBondContact O-CG 3.39Å; E10-E14 PolarHBondContact O-N 3.44Å
15	E	33.7	Very low	50.4	Low	130 Å²	130	97.5 Å²	97.5	61%	0.607	52%	0.515	S	S	*	.	H	α-helix	trans	-77.2	-28.3	175.2	-74.9	-177.7	171.2	0	0	112.8	V11	V11-E15 WeakPolarHBondContact O-CG 3.2Å; V11-E15 PolarHBondContact O-N 3.44Å
16	E	34.7	Very low	53.2	Low	162 Å²	162	98.6 Å²	98.6	76%	0.757	50%	0.503	S	S	*	.	H	α-helix	trans	-72.6	-24.2	174.8	-78.2	-173.2	170.1	0	0	113.5	E12 N18	E12-E16 PolarHBondContact O-N 3.25Å; E16-N18 VanDerWaalsContact C-N 3.29Å; E16-N18 PolarHBondContact O-N 2.97Å
17	E	38.8	Very low	55.9	Low	145 Å²	145	91.7 Å²	91.7	68%	0.678	47%	0.47	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.5	1.3	-177	-83.7	-164.3	174	0	0	115.5
18	N	46.7	Very low	58.7	Low	108 Å²	108	91.7 Å²	91.7	58%	0.578	46%	0.464	S	S	*	.	T	Hydrogen-bonded Turn	trans	-111.8	7.7	-171.8	-117.4	2.5	0	0	0	115.1	E16	E16-N18 VanDerWaalsContact C-N 3.29Å; E16-N18 PolarHBondContact O-N 2.97Å
19	Y	57.4	Low	61.4	Low	186 Å²	186	91.2 Å²	91.2	73%	0.729	47%	0.469	S	S	*	.	S	Bend	trans	-97.9	101.8	178.1	-73.1	-86.2	0	0	0	111.1
20	G	72.3	Confident	63.9	Low	48 Å²	48	88.2 Å²	88.2	50%	0.495	45%	0.452	S	S	.	.	S	Bend	trans	127.7	176.2	176.9	0	0	0	0	0	113
21	P	85.2	Confident	66.7	Low	43 Å²	43	84.3 Å²	84.3	28%	0.279	45%	0.446	S	S	.	.	P	Polyproline II helix	trans	-63.4	136.7	-179.9	25.1	-33.8	0	0	0	111.4	T47 F258	P21-T47 HydrophobicContact CB-CG2 3.53Å; P21-T47 HydrophobicContact CG-CG2 4.39Å; P21-F258 HydrophobicContact CB-CD1 4.25Å; P21-F258 HydrophobicContact CB-CE1 4.28Å; P21-F258 HydrophobicContact CG-CD1 3.63Å; P21-F258 HydrophobicContact CG-CE1 3.92Å
22	Q	91	Very high	69.7	Low	23 Å²	23	81.4 Å²	81.4	11%	0.107	43%	0.428	C	S	.	.	P	Polyproline II helix	trans	-86.6	134	-179.2	-64.2	176.5	68.4	0	0	110.7	T47 I48 E49 L80	Q22-T47 CarbonylContact O-C 3.53Å; Q22-T47 WeakPolarHBondContact O-CA 3.45Å; Q22-T47 WeakPolarHBondContact O-CB 3.31Å; Q22-I48 HydrophobicContact CB-CB 4.16Å; Q22-I48 HydrophobicContact CB-CD1 3.52Å; Q22-I48 HydrophobicContact CB-CG1 3.95Å; Q22-I48 PolarHBondContact O-N 3.22Å; Q22-E49 PolarHBondContact N-OE1 3.47Å; Q22-E49 PolarHBondContact N-OE2 3.28Å; Q22-E49 PolarHBondContact NE2-OE1 3.2Å; Q22-L80 PolarHBondContact NE2-O 2.93Å; Q22-L80 VanDerWaalsContact NE2-O 3.07Å
23	P	91.4	Very high	72.9	Confident	64 Å²	64	78.8 Å²	78.8	42%	0.416	42%	0.421	S	S	.	.	B	Isolated β-bridge	trans	-69.5	145.8	-179.3	28.2	-34.3	0	0	0	111.7	S25 R26	P23-S25 PolarHBondContact O-N 3.29Å; P23-S25 VanDerWaalsContact O-N 3.15Å; P23-R26 HydrophobicContact CG-CG 4.39Å; P23-R26 PolarHBondContact O-N 3.1Å
24	L	91.9	Very high	76	Confident	2 Å²	2	79 Å²	79	1%	0.01	42%	0.423	C	S	.	.	G	3₁₀ helix	trans	-60.8	-24.5	-179.7	-78	-179.2	0	0	0	114.7	R26 L27 I37 L40 E41 F45 T47 V51	L24-R26 PolarHBondContact O-N 3.19Å; L24-R26 VanDerWaalsContact O-N 3.1Å; L24-L27 HydrophobicContact CD2-CD1 3.81Å; L24-L27 WeakPolarHBondContact O-CB 3.34Å; L24-L27 PolarHBondContact O-N 3.24Å; L24-I37 HydrophobicContact CB-CG2 4.02Å; L24-L40 HydrophobicContact CD1-CB 4.07Å; L24-E41 HydrophobicContact CD1-CG 3.91Å; L24-F45 HydrophobicContact CD1-CB 4.34Å; L24-F45 WeakPolarHBondContact CD1-O 3.44Å; L24-T47 VanDerWaalsContact CD2-O 3.27Å; L24-T47 WeakPolarHBondContact CD2-O 3.48Å; L24-V51 HydrophobicContact CD2-CG2 3.63Å
25	S	90.8	Very high	79.1	Confident	63 Å²	63	75.4 Å²	75.4	44%	0.441	41%	0.414	S	S	.	.	G	3₁₀ helix	trans	-55.8	-26.7	177.1	55.6	0	0	0	0	112.7	P23 L27 E28	P23-S25 PolarHBondContact O-N 3.29Å; P23-S25 VanDerWaalsContact O-N 3.15Å; S25-L27 PolarHBondContact O-N 3.03Å; S25-E28 VanDerWaalsContact O-CB 3.31Å; S25-E28 WeakPolarHBondContact O-CB 3.49Å; S25-E28 WeakPolarHBondContact O-CG 3.37Å; S25-E28 PolarHBondContact O-N 3.16Å
26	R	91.9	Very high	82.1	Confident	75 Å²	75	69.8 Å²	69.8	28%	0.283	39%	0.388	S	S	.	.	G	3₁₀ helix	trans	-60.6	-26.8	174.4	-70.2	-170.6	174.9	-175.9	-1.7	113	P23 L24 E28 H29 I48	P23-R26 HydrophobicContact CG-CG 4.39Å; P23-R26 PolarHBondContact O-N 3.1Å; L24-R26 PolarHBondContact O-N 3.19Å; L24-R26 VanDerWaalsContact O-N 3.1Å; R26-E28 PolarHBondContact O-N 3.09Å; R26-H29 PolarHBondContact O-N 2.75Å; R26-I48 HydrophobicContact CB-CD1 3.71Å; R26-I48 HydrophobicContact CG-CD1 4.43Å
27	L	93.1	Very high	85	Confident	0 Å²	0	62.3 Å²	62.3	0%	0	35%	0.353	C	S	.	.	G	3₁₀ helix	trans	-68.8	-16.8	176.3	-67	176.7	0	0	0	113.2	L24 S25 H29 C30 G31 I32 I37 I48 E76 A77 L80	L24-L27 HydrophobicContact CD2-CD1 3.81Å; L24-L27 WeakPolarHBondContact O-CB 3.34Å; L24-L27 PolarHBondContact O-N 3.24Å; S25-L27 PolarHBondContact O-N 3.03Å; L27-H29 VanDerWaalsContact C-N 3.26Å; L27-H29 PolarHBondContact O-N 2.93Å; L27-C30 WeakPolarHBondContact O-CB 3.36Å; L27-C30 PolarHBondContact O-N 3.43Å; L27-C30 VanDerWaalsContact O-N 3.09Å; L27-G31 PolarHBondContact O-N 3.46Å; L27-I32 HydrophobicContact CB-CB 4.13Å; L27-I32 HydrophobicContact CB-CG1 3.99Å; L27-I32 WeakPolarHBondContact O-CB 3.37Å; L27-I32 WeakPolarHBondContact O-CG1 3.49Å; L27-I32 PolarHBondContact O-N 3.25Å; L27-I32 VanDerWaalsContact O-N 3.16Å; L27-I37 HydrophobicContact CB-CD1 4.28Å; L27-I48 HydrophobicContact CG-CG1 4.4Å; L27-E76 HydrophobicContact CD2-CB 4.23Å; L27-A77 HydrophobicContact CD2-CB 4.35Å; L27-L80 HydrophobicContact CD2-CD1 4.1Å
28	E	92.1	Very high	87.7	Confident	96 Å²	96	61.5 Å²	61.5	45%	0.449	35%	0.347	S	S	.	.	G	3₁₀ helix	trans	-61.1	-39.6	172.6	-66.4	-168.3	170.9	0	0	111.1	S25 R26 C30 G31 A34 I37	S25-E28 VanDerWaalsContact O-CB 3.31Å; S25-E28 WeakPolarHBondContact O-CB 3.49Å; S25-E28 WeakPolarHBondContact O-CG 3.37Å; S25-E28 PolarHBondContact O-N 3.16Å; R26-E28 PolarHBondContact O-N 3.09Å; E28-C30 PolarHBondContact O-N 3.03Å; E28-G31 PolarHBondContact O-N 3.5Å; E28-A34 WeakPolarHBondContact OE1-CB 3.44Å; E28-I37 HydrophobicContact CB-CD1 4.31Å; E28-I37 HydrophobicContact CG-CD1 3.2Å
29	H	89.6	Confident	90.1	Very high	170 Å²	170	59 Å²	59	79%	0.787	33%	0.331	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.4	-20.8	176.6	-58.4	-61	0	0	0	112.8	R26 L27 G31	R26-H29 PolarHBondContact O-N 2.75Å; L27-H29 VanDerWaalsContact C-N 3.26Å; L27-H29 PolarHBondContact O-N 2.93Å; H29-G31 VanDerWaalsContact C-N 3.28Å
30	C	88.4	Confident	91.9	Very high	36 Å²	36	50.1 Å²	50.1	24%	0.243	30%	0.296	C	S	.	.	T	Hydrogen-bonded Turn	trans	-88.7	7.9	173.9	-53.4	0	0	0	0	112.8	L27 E28 E76	L27-C30 WeakPolarHBondContact O-CB 3.36Å; L27-C30 PolarHBondContact O-N 3.43Å; L27-C30 VanDerWaalsContact O-N 3.09Å; E28-C30 PolarHBondContact O-N 3.03Å; C30-E76 HydrophobicContact CB-CB 3.76Å; C30-E76 HydrophobicContact CB-CG 3.77Å
31	G	89.4	Confident	92.9	Very high	45 Å²	45	51.8 Å²	51.8	46%	0.464	29%	0.291	S	S	.	.	T	Hydrogen-bonded Turn	trans	76.3	25.5	178.1	0	0	0	0	0	113.8	L27 E28 H29 K72	L27-G31 PolarHBondContact O-N 3.46Å; E28-G31 PolarHBondContact O-N 3.5Å; H29-G31 VanDerWaalsContact C-N 3.28Å; G31-K72 PolarHBondContact O-NZ 3.47Å
32	I	95.5	Very high	93.2	Very high	12 Å²	12	55.8 Å²	55.8	6%	0.062	31%	0.31	C	S	.	.			trans	-83.6	135.6	164.3	-52.3	-51.8	0	0	0	108.2	L27 D36 I37 K72 V73 E76	L27-I32 HydrophobicContact CB-CB 4.13Å; L27-I32 HydrophobicContact CB-CG1 3.99Å; L27-I32 WeakPolarHBondContact O-CB 3.37Å; L27-I32 WeakPolarHBondContact O-CG1 3.49Å; L27-I32 PolarHBondContact O-N 3.25Å; L27-I32 VanDerWaalsContact O-N 3.16Å; I32-D36 HydrophobicContact CG2-CB 4.25Å; I32-I37 HydrophobicContact CG2-CD1 4.43Å; I32-I37 HydrophobicContact CG2-CG1 3.96Å; I32-K72 HydrophobicContact CD1-CD 3.91Å; I32-K72 HydrophobicContact CD1-CG 3.86Å; I32-V73 HydrophobicContact CD1-CG2 3.75Å; I32-V73 HydrophobicContact CG1-CG2 4.19Å; I32-V73 HydrophobicContact CG2-CG2 3.9Å; I32-E76 HydrophobicContact CD1-CG 4.34Å
33	S	95.7	Very high	93.3	Very high	48 Å²	48	56.4 Å²	56.4	34%	0.336	32%	0.319	S	S	.	.			trans	-74.9	143.9	-177.6	79.6	0	0	0	0	111.5	S35 D36 I37	S33-S35 PolarHBondContact O-N 3.1Å; S33-S35 VanDerWaalsContact O-N 3.1Å; S33-S35 PolarHBondContact OG-OG 2.88Å; S33-D36 PolarHBondContact O-N 2.95Å; S33-D36 VanDerWaalsContact OG-CG 3.31Å; S33-D36 PolarHBondContact OG-N 2.88Å; S33-D36 PolarHBondContact OG-OD2 2.75Å; S33-I37 PolarHBondContact O-N 3.07Å
34	A	95.4	Very high	93.2	Very high	58 Å²	58	53.7 Å²	53.7	48%	0.479	30%	0.303	S	S	.	.	H	α-helix	trans	-52.5	-33.9	173.9	0	0	0	0	0	112.7	E28 D36 I37 K38	E28-A34 WeakPolarHBondContact OE1-CB 3.44Å; A34-D36 VanDerWaalsContact C-N 3.33Å; A34-D36 PolarHBondContact O-N 2.87Å; A34-I37 PolarHBondContact O-N 3.46Å; A34-K38 WeakPolarHBondContact O-CB 3.46Å; A34-K38 PolarHBondContact O-N 3.15Å
35	S	96.1	Very high	93.3	Very high	70 Å²	70	53.8 Å²	53.8	49%	0.49	30%	0.303	S	S	.	.	H	α-helix	trans	-68.3	-28.8	176.3	72.7	0	0	0	0	114.3	S33 K39	S33-S35 PolarHBondContact O-N 3.1Å; S33-S35 VanDerWaalsContact O-N 3.1Å; S33-S35 PolarHBondContact OG-OG 2.88Å; S35-K39 WeakPolarHBondContact O-CG 3.37Å
36	D	96.1	Very high	93.4	Very high	12 Å²	12	52.7 Å²	52.7	6%	0.064	29%	0.291	C	S	.	.	H	α-helix	trans	-83.9	-35.6	175.9	-67.3	-39.2	0	0	0	110.4	I32 S33 A34 K39 L40 I65 K69	I32-D36 HydrophobicContact CG2-CB 4.25Å; S33-D36 PolarHBondContact O-N 2.95Å; S33-D36 VanDerWaalsContact OG-CG 3.31Å; S33-D36 PolarHBondContact OG-N 2.88Å; S33-D36 PolarHBondContact OG-OD2 2.75Å; A34-D36 VanDerWaalsContact C-N 3.33Å; A34-D36 PolarHBondContact O-N 2.87Å; D36-K39 WeakPolarHBondContact O-CB 3.49Å; D36-K39 PolarHBondContact O-N 2.88Å; D36-K39 IonicContact OD1-NZ 3.64Å; D36-K39 PolarHBondContact OD1-NZ 2.97Å; D36-L40 WeakPolarHBondContact O-CG 3.22Å; D36-L40 PolarHBondContact O-N 2.94Å; D36-L40 VanDerWaalsContact O-N 3.15Å; D36-I65 HydrophobicContact CB-CD1 4.12Å; D36-K69 IonicContact OD1-NZ 3.62Å; D36-K69 PolarHBondContact OD1-NZ 3.07Å; D36-K69 WeakPolarHBondContact OD2-CE 3.21Å; D36-K69 IonicContact OD2-NZ 3.78Å; D36-K69 PolarHBondContact OD2-NZ 3.3Å
37	I	96	Very high	93.6	Very high	5 Å²	5	49.2 Å²	49.2	3%	0.026	28%	0.278	C	S	.	.	H	α-helix	trans	-58	-48.6	170.7	-71.4	166.6	0	0	0	110.8	L24 L27 E28 I32 S33 A34 K39 L40 E41	L24-I37 HydrophobicContact CB-CG2 4.02Å; L27-I37 HydrophobicContact CB-CD1 4.28Å; E28-I37 HydrophobicContact CB-CD1 4.31Å; E28-I37 HydrophobicContact CG-CD1 3.2Å; I32-I37 HydrophobicContact CG2-CD1 4.43Å; I32-I37 HydrophobicContact CG2-CG1 3.96Å; S33-I37 PolarHBondContact O-N 3.07Å; A34-I37 PolarHBondContact O-N 3.46Å; I37-K39 PolarHBondContact O-N 3.03Å; I37-L40 WeakPolarHBondContact O-CA 2.98Å; I37-L40 VanDerWaalsContact O-CB 3.3Å; I37-L40 WeakPolarHBondContact O-CB 3.27Å; I37-L40 PolarHBondContact O-N 3.34Å; I37-E41 HydrophobicContact CG2-CG 4.45Å; I37-E41 PolarHBondContact O-N 2.98Å
38	K	95.4	Very high	93.6	Very high	127 Å²	127	49.2 Å²	49.2	55%	0.552	28%	0.278	S	S	*	.	H	α-helix	trans	-57.4	-35.7	177.2	-174.4	165	-174.6	163.5	0	113.4	A34 L40 E41 D42	A34-K38 WeakPolarHBondContact O-CB 3.46Å; A34-K38 PolarHBondContact O-N 3.15Å; K38-L40 VanDerWaalsContact C-N 3.33Å; K38-E41 PolarHBondContact O-N 3.46Å; K38-D42 WeakPolarHBondContact O-CB 3.43Å; K38-D42 PolarHBondContact O-N 3.44Å
39	K	96.5	Very high	93.8	Very high	55 Å²	55	45.5 Å²	45.5	24%	0.239	26%	0.261	C	S	.	.	H	α-helix	trans	-69.2	-32	175.3	-68.4	168.4	-166.2	156.7	0	112.7	S35 D36 I37 A43 I62 G64 I65	S35-K39 WeakPolarHBondContact O-CG 3.37Å; D36-K39 WeakPolarHBondContact O-CB 3.49Å; D36-K39 PolarHBondContact O-N 2.88Å; D36-K39 IonicContact OD1-NZ 3.64Å; D36-K39 PolarHBondContact OD1-NZ 2.97Å; I37-K39 PolarHBondContact O-N 3.03Å; K39-A43 VanDerWaalsContact O-CB 3.3Å; K39-A43 WeakPolarHBondContact O-CB 3.38Å; K39-A43 PolarHBondContact O-N 2.9Å; K39-A43 VanDerWaalsContact O-N 3.16Å; K39-I62 HydrophobicContact CB-CG2 4.03Å; K39-G64 PolarHBondContact NZ-O 3.48Å; K39-G64 VanDerWaalsContact NZ-O 3.07Å; K39-I65 HydrophobicContact CB-CD1 4.38Å; K39-I65 HydrophobicContact CD-CD1 3.98Å; K39-I65 HydrophobicContact CD-CG1 4.46Å
40	L	95.5	Very high	94	Very high	1 Å²	1	37.4 Å²	37.4	1%	0.005	22%	0.223	C	C	.	.	H	α-helix	trans	-67.8	-45.7	174	-63.8	169.4	0	0	0	109.5	L24 D36 I37 K38 A43 G44 F45 V51 L59 I62 V73	L24-L40 HydrophobicContact CD1-CB 4.07Å; D36-L40 WeakPolarHBondContact O-CG 3.22Å; D36-L40 PolarHBondContact O-N 2.94Å; D36-L40 VanDerWaalsContact O-N 3.15Å; I37-L40 WeakPolarHBondContact O-CA 2.98Å; I37-L40 VanDerWaalsContact O-CB 3.3Å; I37-L40 WeakPolarHBondContact O-CB 3.27Å; I37-L40 PolarHBondContact O-N 3.34Å; K38-L40 VanDerWaalsContact C-N 3.33Å; L40-A43 CarbonylContact O-C 3.45Å; L40-A43 WeakPolarHBondContact O-CA 3.43Å; L40-A43 WeakPolarHBondContact O-CB 3.43Å; L40-A43 PolarHBondContact O-N 2.73Å; L40-G44 PolarHBondContact O-N 2.72Å; L40-F45 CarbonylContact C-O 3.51Å; L40-F45 HydrophobicContact CB-CB 4.13Å; L40-F45 HydrophobicContact CD2-CD2 4.47Å; L40-F45 WeakPolarHBondContact O-CB 3.3Å; L40-F45 PolarHBondContact O-N 3.27Å; L40-V51 HydrophobicContact CD1-CG2 4.26Å; L40-L59 HydrophobicContact CD2-CD2 3.7Å; L40-I62 HydrophobicContact CD2-CD1 3.75Å; L40-V73 HydrophobicContact CD1-CG1 4Å
41	E	93.5	Very high	94.4	Very high	82 Å²	82	35.7 Å²	35.7	38%	0.383	21%	0.212	S	C	.	.	H	α-helix	trans	-59	-48.2	174.4	-67.7	174.5	167.1	0	0	112.1	L24 I37 K38 A43 G44 F45 H46	L24-E41 HydrophobicContact CD1-CG 3.91Å; I37-E41 HydrophobicContact CG2-CG 4.45Å; I37-E41 PolarHBondContact O-N 2.98Å; K38-E41 PolarHBondContact O-N 3.46Å; E41-A43 PolarHBondContact O-N 3.41Å; E41-A43 VanDerWaalsContact O-N 3.15Å; E41-G44 PolarHBondContact O-N 3.14Å; E41-F45 VanDerWaalsContact CA-O 3.22Å; E41-F45 WeakPolarHBondContact CA-O 3.43Å; E41-F45 PolarHBondContact N-O 3.26Å; E41-H46 PolarHBondContact O-CE1 3.45Å
42	D	92.1	Very high	94.6	Very high	128 Å²	128	34.1 Å²	34.1	68%	0.684	19%	0.194	S	C	*	.	H	α-helix	trans	-62.1	-22.5	176.5	-69.6	-23.1	0	0	0	112.3	K38	K38-D42 WeakPolarHBondContact O-CB 3.43Å; K38-D42 PolarHBondContact O-N 3.44Å
43	A	91.9	Very high	94.6	Very high	35 Å²	35	38.3 Å²	38.3	29%	0.289	21%	0.21	S	C	.	.	T	Hydrogen-bonded Turn	trans	-91.9	3	175.1	0	0	0	0	0	113.6	K39 L40 E41 F45 I62	K39-A43 VanDerWaalsContact O-CB 3.3Å; K39-A43 WeakPolarHBondContact O-CB 3.38Å; K39-A43 PolarHBondContact O-N 2.9Å; K39-A43 VanDerWaalsContact O-N 3.16Å; L40-A43 CarbonylContact O-C 3.45Å; L40-A43 WeakPolarHBondContact O-CA 3.43Å; L40-A43 WeakPolarHBondContact O-CB 3.43Å; L40-A43 PolarHBondContact O-N 2.73Å; E41-A43 PolarHBondContact O-N 3.41Å; E41-A43 VanDerWaalsContact O-N 3.15Å; A43-F45 HydrophobicContact CB-CD2 4.02Å; A43-F45 HydrophobicContact CB-CE2 4.17Å; A43-I62 HydrophobicContact CB-CD1 3.68Å; A43-I62 HydrophobicContact CB-CG1 3.79Å; A43-I62 HydrophobicContact CB-CG2 4.23Å
44	G	89.9	Confident	94.5	Very high	7 Å²	7	36.4 Å²	36.4	7%	0.072	20%	0.198	C	C	.	.	T	Hydrogen-bonded Turn	trans	87.1	17.3	176.3	0	0	0	0	0	115.1	L40 E41	L40-G44 PolarHBondContact O-N 2.72Å; E41-G44 PolarHBondContact O-N 3.14Å
45	F	93.6	Very high	94.5	Very high	4 Å²	4	37.2 Å²	37.2	2%	0.018	20%	0.198	C	C	.	.			trans	-94.1	116.8	167.6	-61	-85.7	0	0	0	108.1	L24 L40 E41 A43 A50 V51 A54 E58 L59 I62	L24-F45 HydrophobicContact CD1-CB 4.34Å; L24-F45 WeakPolarHBondContact CD1-O 3.44Å; L40-F45 CarbonylContact C-O 3.51Å; L40-F45 HydrophobicContact CB-CB 4.13Å; L40-F45 HydrophobicContact CD2-CD2 4.47Å; L40-F45 WeakPolarHBondContact O-CB 3.3Å; L40-F45 PolarHBondContact O-N 3.27Å; E41-F45 VanDerWaalsContact CA-O 3.22Å; E41-F45 WeakPolarHBondContact CA-O 3.43Å; E41-F45 PolarHBondContact N-O 3.26Å; A43-F45 HydrophobicContact CB-CD2 4.02Å; A43-F45 HydrophobicContact CB-CE2 4.17Å; F45-A50 HydrophobicContact CB-CB 4.44Å; F45-A50 HydrophobicContact CD1-CB 3.81Å; F45-A50 WeakPolarHBondContact CE1-O 3.42Å; F45-V51 HydrophobicContact CB-CG2 3.96Å; F45-V51 HydrophobicContact CD1-CG2 4.14Å; F45-V51 HydrophobicContact CG-CG2 4.21Å; F45-A54 HydrophobicContact CE1-CB 3.73Å; F45-A54 HydrophobicContact CZ-CB 4.21Å; F45-E58 HydrophobicContact CZ-CG 4.01Å; F45-E58 WeakPolarHBondContact CZ-OE1 3.34Å; F45-L59 HydrophobicContact CE1-CD2 4.49Å; F45-L59 HydrophobicContact CE2-CD2 4.16Å; F45-L59 HydrophobicContact CZ-CD2 4.11Å; F45-I62 HydrophobicContact CD2-CD1 4.13Å; F45-I62 HydrophobicContact CE2-CD1 3.82Å
46	H	93.6	Very high	94.5	Very high	40 Å²	40	36.7 Å²	36.7	19%	0.185	19%	0.187	C	C	.	.			trans	-115.7	-8.2	-178.9	-58.6	-70.5	0	0	0	113.2	E41 S207 A208 A211	E41-H46 PolarHBondContact O-CE1 3.45Å; H46-S207 PolarHBondContact CD2-OG 3.36Å; H46-A208 PolarHBondContact CD2-N 3.4Å; H46-A211 HydrophobicContact CB-CB 3.7Å
47	T	95.3	Very high	94.6	Very high	2 Å²	2	43.6 Å²	43.6	1%	0.012	22%	0.216	C	C	.	.	B	Isolated β-bridge	trans	-133.9	160.8	-175.6	70.4	0	0	0	0	111.2	P21 Q22 L24 E49 A50 V51 E257 F258	P21-T47 HydrophobicContact CB-CG2 3.53Å; P21-T47 HydrophobicContact CG-CG2 4.39Å; Q22-T47 CarbonylContact O-C 3.53Å; Q22-T47 WeakPolarHBondContact O-CA 3.45Å; Q22-T47 WeakPolarHBondContact O-CB 3.31Å; L24-T47 VanDerWaalsContact CD2-O 3.27Å; L24-T47 WeakPolarHBondContact CD2-O 3.48Å; T47-E49 VanDerWaalsContact C-N 3.32Å; T47-A50 PolarHBondContact O-N 3.41Å; T47-A50 WeakPolarHBondContact OG1-CB 3.28Å; T47-A50 PolarHBondContact OG1-N 3.4Å; T47-V51 PolarHBondContact O-N 3.43Å; T47-E257 WeakPolarHBondContact CB-OE1 3.49Å; T47-E257 HydrophobicContact CG2-CG 4.08Å; T47-E257 WeakPolarHBondContact CG2-OE1 3Å; T47-E257 VanDerWaalsContact OG1-CG 3.28Å; T47-E257 WeakPolarHBondContact OG1-CG 3.29Å; T47-E257 PolarHBondContact OG1-OE1 3.39Å; T47-F258 HydrophobicContact CG2-CE1 3.8Å; T47-F258 HydrophobicContact CG2-CZ 3.8Å
48	I	95.1	Very high	94.5	Very high	0 Å²	0	46.4 Å²	46.4	0%	0	23%	0.229	C	C	.	.	H	α-helix	trans	-66.9	-38.4	176.7	-59.1	175.7	0	0	0	110.4	Q22 R26 L27 A50 V51 A52 A77 L80 V81	Q22-I48 HydrophobicContact CB-CB 4.16Å; Q22-I48 HydrophobicContact CB-CD1 3.52Å; Q22-I48 HydrophobicContact CB-CG1 3.95Å; Q22-I48 PolarHBondContact O-N 3.22Å; R26-I48 HydrophobicContact CB-CD1 3.71Å; R26-I48 HydrophobicContact CG-CD1 4.43Å; L27-I48 HydrophobicContact CG-CG1 4.4Å; I48-A50 VanDerWaalsContact C-N 3.34Å; I48-A50 PolarHBondContact O-N 2.9Å; I48-V51 PolarHBondContact O-N 3.46Å; I48-A52 WeakPolarHBondContact O-CB 3.3Å; I48-A52 PolarHBondContact O-N 3.49Å; I48-A77 HydrophobicContact CG2-CB 3.86Å; I48-L80 HydrophobicContact CD1-CB 4.49Å; I48-L80 HydrophobicContact CD1-CD1 3.54Å; I48-L80 HydrophobicContact CG2-CB 4.07Å; I48-L80 HydrophobicContact CG2-CD1 4.21Å; I48-V81 HydrophobicContact CG2-CG2 3.89Å
49	E	94.4	Very high	94.5	Very high	19 Å²	19	40.4 Å²	40.4	9%	0.089	20%	0.203	C	C	.	.	H	α-helix	trans	-57.2	-45.8	175.4	-68.7	76.9	-169.6	0	0	111	Q22 T47 V51 A52 Y53 V81 E257	Q22-E49 PolarHBondContact N-OE1 3.47Å; Q22-E49 PolarHBondContact N-OE2 3.28Å; Q22-E49 PolarHBondContact NE2-OE1 3.2Å; T47-E49 VanDerWaalsContact C-N 3.32Å; E49-V51 PolarHBondContact O-N 3.29Å; E49-A52 PolarHBondContact O-N 3.13Å; E49-Y53 HydrophobicContact CB-CD2 4.23Å; E49-Y53 HydrophobicContact CB-CE2 3.76Å; E49-Y53 HydrophobicContact CG-CE2 4.32Å; E49-Y53 WeakPolarHBondContact O-CB 3.4Å; E49-Y53 VanDerWaalsContact O-CD2 3.24Å; E49-Y53 WeakPolarHBondContact O-CD2 3.36Å; E49-Y53 PolarHBondContact O-N 2.92Å; E49-V81 HydrophobicContact CG-CG2 4.26Å; E49-E257 HydrophobicContact CB-CG 4.24Å
50	A	94.6	Very high	94.5	Very high	0 Å²	0	41.2 Å²	41.2	0%	0	21%	0.21	C	C	.	.	H	α-helix	trans	-57.5	-39.7	177.6	0	0	0	0	0	112.2	F45 T47 I48 A54	F45-A50 HydrophobicContact CB-CB 4.44Å; F45-A50 HydrophobicContact CD1-CB 3.81Å; F45-A50 WeakPolarHBondContact CE1-O 3.42Å; T47-A50 PolarHBondContact O-N 3.41Å; T47-A50 WeakPolarHBondContact OG1-CB 3.28Å; T47-A50 PolarHBondContact OG1-N 3.4Å; I48-A50 VanDerWaalsContact C-N 3.34Å; I48-A50 PolarHBondContact O-N 2.9Å; A50-A54 WeakPolarHBondContact O-CB 3.39Å; A50-A54 PolarHBondContact O-N 3.19Å
51	V	95.9	Very high	94.6	Very high	0 Å²	0	47.2 Å²	47.2	0%	0	24%	0.242	C	C	.	.	H	α-helix	trans	-73.6	-45.6	178.1	172.9	0	0	0	0	111.2	L24 L40 F45 T47 I48 E49 Y53 A54 V73 L74 A77	L24-V51 HydrophobicContact CD2-CG2 3.63Å; L40-V51 HydrophobicContact CD1-CG2 4.26Å; F45-V51 HydrophobicContact CB-CG2 3.96Å; F45-V51 HydrophobicContact CD1-CG2 4.14Å; F45-V51 HydrophobicContact CG-CG2 4.21Å; T47-V51 PolarHBondContact O-N 3.43Å; I48-V51 PolarHBondContact O-N 3.46Å; E49-V51 PolarHBondContact O-N 3.29Å; V51-Y53 VanDerWaalsContact C-N 3.31Å; V51-Y53 PolarHBondContact O-N 3.15Å; V51-A54 WeakPolarHBondContact O-CB 3.46Å; V51-A54 PolarHBondContact O-N 2.95Å; V51-V73 HydrophobicContact CG1-CG1 3.4Å; V51-V73 VanDerWaalsContact CG1-CG1 3.4Å; V51-L74 VanDerWaalsContact O-CD2 3.3Å; V51-L74 WeakPolarHBondContact O-CD2 3.37Å; V51-A77 HydrophobicContact CB-CB 4.44Å; V51-A77 HydrophobicContact CG1-CB 3.98Å
52	A	95.3	Very high	94.7	Very high	12 Å²	12	44.2 Å²	44.2	10%	0.099	23%	0.228	C	C	.	.	H	α-helix	trans	-63.1	-37.6	-178.7	0	0	0	0	0	112.1	I48 E49 A54 A77 V81 M83	I48-A52 WeakPolarHBondContact O-CB 3.3Å; I48-A52 PolarHBondContact O-N 3.49Å; E49-A52 PolarHBondContact O-N 3.13Å; A52-A54 VanDerWaalsContact C-N 3.34Å; A52-A77 HydrophobicContact CB-CB 4.08Å; A52-V81 HydrophobicContact CB-CB 4.09Å; A52-V81 HydrophobicContact CB-CG1 4.46Å; A52-V81 HydrophobicContact CB-CG2 3.86Å; A52-M83 HydrophobicContact CB-CE 4.45Å; A52-M83 HydrophobicContact CB-SD 3.85Å
53	Y	93.9	Very high	94.9	Very high	99 Å²	99	47.5 Å²	47.5	39%	0.388	24%	0.236	S	C	.	.	T	Hydrogen-bonded Turn	trans	-81.6	-12.1	179.1	-57.7	-23	0	0	0	113.6	E49 V51 V81 M83	E49-Y53 HydrophobicContact CB-CD2 4.23Å; E49-Y53 HydrophobicContact CB-CE2 3.76Å; E49-Y53 HydrophobicContact CG-CE2 4.32Å; E49-Y53 WeakPolarHBondContact O-CB 3.4Å; E49-Y53 VanDerWaalsContact O-CD2 3.24Å; E49-Y53 WeakPolarHBondContact O-CD2 3.36Å; E49-Y53 PolarHBondContact O-N 2.92Å; V51-Y53 VanDerWaalsContact C-N 3.31Å; V51-Y53 PolarHBondContact O-N 3.15Å; Y53-V81 HydrophobicContact CE1-CG1 3.71Å; Y53-M83 HydrophobicContact CD1-SD 4.3Å; Y53-M83 HydrophobicContact CE1-CG 4.42Å; Y53-M83 HydrophobicContact CE1-SD 4.46Å
54	A	94.6	Very high	95	Very high	9 Å²	9	48.1 Å²	48.1	7%	0.074	25%	0.246	C	C	.	.	S	Bend	trans	-73.7	138.3	-178.6	0	0	0	0	0	111.8	F45 A50 V51 A52 L59	F45-A54 HydrophobicContact CE1-CB 3.73Å; F45-A54 HydrophobicContact CZ-CB 4.21Å; A50-A54 WeakPolarHBondContact O-CB 3.39Å; A50-A54 PolarHBondContact O-N 3.19Å; V51-A54 WeakPolarHBondContact O-CB 3.46Å; V51-A54 PolarHBondContact O-N 2.95Å; A52-A54 VanDerWaalsContact C-N 3.34Å; A54-L59 HydrophobicContact CB-CG 4.45Å
55	P	95.3	Very high	95.3	Very high	75 Å²	75	48.4 Å²	48.4	49%	0.487	25%	0.246	S	C	.	.			trans	-67.5	141.6	167.5	29	-31.9	0	0	0	109.7	K57 E58	P55-K57 PolarHBondContact O-N 3.47Å; P55-E58 WeakPolarHBondContact CD-OE2 3.3Å; P55-E58 HydrophobicContact CG-CB 4Å; P55-E58 WeakPolarHBondContact O-CB 3.33Å; P55-E58 PolarHBondContact O-N 3.28Å
56	K	96.8	Very high	95.5	Very high	58 Å²	58	51.1 Å²	51.1	25%	0.252	27%	0.265	S	S	.	.	H	α-helix	trans	-46.9	-37.4	175.3	-175.3	179.6	-179.2	179.4	0	113	E58 L59 L60 E67 A70 D71 L74	K56-E58 VanDerWaalsContact C-N 3.27Å; K56-E58 PolarHBondContact O-N 3.09Å; K56-L59 PolarHBondContact O-N 3.49Å; K56-L60 HydrophobicContact CG-CD1 4.12Å; K56-L60 HydrophobicContact CG-CG 4.27Å; K56-L60 VanDerWaalsContact O-CG 3.31Å; K56-L60 WeakPolarHBondContact O-CG 3.42Å; K56-L60 PolarHBondContact O-N 3.2Å; K56-E67 IonicContact NZ-OE1 3.33Å; K56-E67 PolarHBondContact NZ-OE1 3.49Å; K56-A70 HydrophobicContact CG-CB 4.28Å; K56-D71 WeakPolarHBondContact CD-OD1 3.35Å; K56-D71 WeakPolarHBondContact CE-OD1 3.23Å; K56-D71 IonicContact NZ-OD1 3.18Å; K56-D71 PolarHBondContact NZ-OD1 3.07Å; K56-D71 IonicContact NZ-OD2 2.9Å; K56-D71 PolarHBondContact NZ-OD2 3.16Å; K56-L74 HydrophobicContact CB-CD1 3.8Å; K56-L74 HydrophobicContact CG-CD1 4.13Å
57	K	96.7	Very high	95.7	Very high	158 Å²	158	54.9 Å²	54.9	69%	0.687	28%	0.283	S	S	*	.	H	α-helix	trans	-56.8	-37	177.4	-175	-178.4	177.4	-176.9	0	113.3	P55 N61	P55-K57 PolarHBondContact O-N 3.47Å; K57-N61 VanDerWaalsContact O-CG 3.32Å; K57-N61 PolarHBondContact O-N 3.15Å; K57-N61 PolarHBondContact O-ND2 3.1Å
58	E	94.4	Very high	95.7	Very high	63 Å²	63	58.4 Å²	58.4	29%	0.294	31%	0.313	S	S	.	.	H	α-helix	trans	-69.7	-44.2	179.3	-167.9	173.6	162	0	0	110.6	F45 P55 K56 L60 N61 R253	F45-E58 HydrophobicContact CZ-CG 4.01Å; F45-E58 WeakPolarHBondContact CZ-OE1 3.34Å; P55-E58 WeakPolarHBondContact CD-OE2 3.3Å; P55-E58 HydrophobicContact CG-CB 4Å; P55-E58 WeakPolarHBondContact O-CB 3.33Å; P55-E58 PolarHBondContact O-N 3.28Å; K56-E58 VanDerWaalsContact C-N 3.27Å; K56-E58 PolarHBondContact O-N 3.09Å; E58-L60 VanDerWaalsContact C-N 3.3Å; E58-L60 PolarHBondContact O-N 2.91Å; E58-N61 WeakPolarHBondContact O-CB 3.47Å; E58-N61 PolarHBondContact O-N 3.16Å; E58-N61 VanDerWaalsContact O-N 3.09Å; E58-R253 IonicContact OE1-NH1 2.75Å; E58-R253 PolarHBondContact OE1-NH1 2.81Å
59	L	96.3	Very high	95.8	Very high	1 Å²	1	61.8 Å²	61.8	1%	0.005	33%	0.327	C	S	.	.	H	α-helix	trans	-62.2	-36.4	175	-62.3	-179.5	0	0	0	112.7	L40 F45 A54 K56 N61 I62 A70 L74	L40-L59 HydrophobicContact CD2-CD2 3.7Å; F45-L59 HydrophobicContact CE1-CD2 4.49Å; F45-L59 HydrophobicContact CE2-CD2 4.16Å; F45-L59 HydrophobicContact CZ-CD2 4.11Å; A54-L59 HydrophobicContact CB-CG 4.45Å; K56-L59 PolarHBondContact O-N 3.49Å; L59-N61 PolarHBondContact O-N 2.86Å; L59-I62 HydrophobicContact CD2-CD1 3.99Å; L59-I62 VanDerWaalsContact O-CB 3.31Å; L59-I62 WeakPolarHBondContact O-CB 3.46Å; L59-I62 WeakPolarHBondContact O-CG1 3.35Å; L59-I62 PolarHBondContact O-N 3.06Å; L59-I62 VanDerWaalsContact O-N 3.11Å; L59-A70 HydrophobicContact CB-CB 4.21Å; L59-L74 HydrophobicContact CD1-CD1 3.97Å; L59-L74 HydrophobicContact CD1-CD2 3.7Å; L59-L74 HydrophobicContact CD1-CG 3.58Å
60	L	96.9	Very high	95.9	Very high	72 Å²	72	60.9 Å²	60.9	38%	0.377	32%	0.323	S	S	.	.	H	α-helix	trans	-67.5	-21.2	176.5	-70.4	174.7	0	0	0	113.6	K56 E58 I62 E67 A70	K56-L60 HydrophobicContact CG-CD1 4.12Å; K56-L60 HydrophobicContact CG-CG 4.27Å; K56-L60 VanDerWaalsContact O-CG 3.31Å; K56-L60 WeakPolarHBondContact O-CG 3.42Å; K56-L60 PolarHBondContact O-N 3.2Å; E58-L60 VanDerWaalsContact C-N 3.3Å; E58-L60 PolarHBondContact O-N 2.91Å; L60-I62 PolarHBondContact O-N 3.35Å; L60-E67 HydrophobicContact CD2-CB 4.26Å; L60-A70 HydrophobicContact CD2-CB 4.11Å
61	N	95.9	Very high	96.1	Very high	127 Å²	127	64.4 Å²	64.4	68%	0.679	34%	0.342	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.6	-12	174.6	-64.8	-29.8	0	0	0	112.1	K57 E58 L59 K63	K57-N61 VanDerWaalsContact O-CG 3.32Å; K57-N61 PolarHBondContact O-N 3.15Å; K57-N61 PolarHBondContact O-ND2 3.1Å; E58-N61 WeakPolarHBondContact O-CB 3.47Å; E58-N61 PolarHBondContact O-N 3.16Å; E58-N61 VanDerWaalsContact O-N 3.09Å; L59-N61 PolarHBondContact O-N 2.86Å; N61-K63 PolarHBondContact O-N 3.05Å
62	I	96.4	Very high	96.1	Very high	20 Å²	20	69 Å²	69	10%	0.103	36%	0.362	C	S	.	.	S	Bend	trans	-77.2	119.5	178.2	-54	173.1	0	0	0	109	K39 L40 A43 F45 L59 L60 G64 I65	K39-I62 HydrophobicContact CB-CG2 4.03Å; L40-I62 HydrophobicContact CD2-CD1 3.75Å; A43-I62 HydrophobicContact CB-CD1 3.68Å; A43-I62 HydrophobicContact CB-CG1 3.79Å; A43-I62 HydrophobicContact CB-CG2 4.23Å; F45-I62 HydrophobicContact CD2-CD1 4.13Å; F45-I62 HydrophobicContact CE2-CD1 3.82Å; L59-I62 HydrophobicContact CD2-CD1 3.99Å; L59-I62 VanDerWaalsContact O-CB 3.31Å; L59-I62 WeakPolarHBondContact O-CB 3.46Å; L59-I62 WeakPolarHBondContact O-CG1 3.35Å; L59-I62 PolarHBondContact O-N 3.06Å; L59-I62 VanDerWaalsContact O-N 3.11Å; L60-I62 PolarHBondContact O-N 3.35Å; I62-G64 PolarHBondContact O-N 3.28Å; I62-G64 VanDerWaalsContact O-N 3.14Å; I62-I65 HydrophobicContact CB-CB 4.3Å; I62-I65 HydrophobicContact CB-CG1 3.81Å; I62-I65 HydrophobicContact CG2-CG1 3.76Å; I62-I65 PolarHBondContact O-N 3.21Å; I62-I65 VanDerWaalsContact O-N 3.1Å
63	K	95.5	Very high	96.2	Very high	196 Å²	196	68.6 Å²	68.6	85%	0.852	36%	0.358	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.7	121.3	-178.6	-174.5	177.6	173.4	-179.6	0	110.8	N61	N61-K63 PolarHBondContact O-N 3.05Å
64	G	94.3	Very high	96.3	Very high	48 Å²	48	65.5 Å²	65.5	50%	0.495	35%	0.348	S	S	.	.	T	Hydrogen-bonded Turn	trans	89.2	8.8	177.6	0	0	0	0	0	115	K39 I62	K39-G64 PolarHBondContact NZ-O 3.48Å; K39-G64 VanDerWaalsContact NZ-O 3.07Å; I62-G64 PolarHBondContact O-N 3.28Å; I62-G64 VanDerWaalsContact O-N 3.14Å
65	I	97.2	Very high	96.4	Very high	13 Å²	13	67.5 Å²	67.5	7%	0.067	36%	0.364	C	S	.	.			trans	-98.2	114.5	163.6	-58.6	-58.6	0	0	0	108	D36 K39 I62 K69 A70	D36-I65 HydrophobicContact CB-CD1 4.12Å; K39-I65 HydrophobicContact CB-CD1 4.38Å; K39-I65 HydrophobicContact CD-CD1 3.98Å; K39-I65 HydrophobicContact CD-CG1 4.46Å; I62-I65 HydrophobicContact CB-CB 4.3Å; I62-I65 HydrophobicContact CB-CG1 3.81Å; I62-I65 HydrophobicContact CG2-CG1 3.76Å; I62-I65 PolarHBondContact O-N 3.21Å; I62-I65 VanDerWaalsContact O-N 3.1Å; I65-K69 HydrophobicContact CG2-CB 4.15Å; I65-A70 HydrophobicContact CG2-CB 4.06Å
66	S	96.9	Very high	96.4	Very high	61 Å²	61	65.6 Å²	65.6	43%	0.427	35%	0.349	S	S	.	.			trans	-85.2	169.1	175.1	64.6	0	0	0	0	111	A68 K69 A70	S66-A68 PolarHBondContact O-N 3.47Å; S66-K69 WeakPolarHBondContact O-CB 3.39Å; S66-K69 PolarHBondContact O-N 3.26Å; S66-K69 VanDerWaalsContact O-N 3.09Å; S66-K69 WeakPolarHBondContact OG-CG 3.19Å; S66-K69 PolarHBondContact OG-N 2.91Å; S66-A70 PolarHBondContact O-N 3.11Å
67	E	97.2	Very high	96.3	Very high	120 Å²	120	62.8 Å²	62.8	56%	0.561	34%	0.337	S	S	*	.	H	α-helix	trans	-56.4	-48.4	177.4	-173.1	165.4	-161.9	0	0	113.2	K56 L60 K69 A70 D71	K56-E67 IonicContact NZ-OE1 3.33Å; K56-E67 PolarHBondContact NZ-OE1 3.49Å; L60-E67 HydrophobicContact CD2-CB 4.26Å; E67-K69 PolarHBondContact O-N 3.18Å; E67-A70 PolarHBondContact O-N 3.26Å; E67-D71 PolarHBondContact O-N 3.12Å
68	A	96.9	Very high	96.1	Very high	76 Å²	76	57.2 Å²	57.2	63%	0.628	32%	0.32	S	S	*	.	H	α-helix	trans	-61.1	-33.1	176.9	0	0	0	0	0	113	S66 K72	S66-A68 PolarHBondContact O-N 3.47Å; A68-K72 WeakPolarHBondContact O-CB 3.36Å; A68-K72 PolarHBondContact O-N 3.35Å; A68-K72 VanDerWaalsContact O-N 3.13Å
69	K	96.5	Very high	96	Very high	71 Å²	71	61 Å²	61	31%	0.309	34%	0.335	S	S	.	.	H	α-helix	trans	-70.9	-45	175.4	-73.7	-177.6	173	-158.6	0	111.4	D36 I65 S66 E67 D71 K72 V73	D36-K69 IonicContact OD1-NZ 3.62Å; D36-K69 PolarHBondContact OD1-NZ 3.07Å; D36-K69 WeakPolarHBondContact OD2-CE 3.21Å; D36-K69 IonicContact OD2-NZ 3.78Å; D36-K69 PolarHBondContact OD2-NZ 3.3Å; I65-K69 HydrophobicContact CG2-CB 4.15Å; S66-K69 WeakPolarHBondContact O-CB 3.39Å; S66-K69 PolarHBondContact O-N 3.26Å; S66-K69 VanDerWaalsContact O-N 3.09Å; S66-K69 WeakPolarHBondContact OG-CG 3.19Å; S66-K69 PolarHBondContact OG-N 2.91Å; E67-K69 PolarHBondContact O-N 3.18Å; K69-D71 VanDerWaalsContact C-N 3.33Å; K69-D71 PolarHBondContact O-N 3.15Å; K69-K72 PolarHBondContact O-N 3.46Å; K69-V73 WeakPolarHBondContact O-CB 3.45Å; K69-V73 VanDerWaalsContact O-CG2 3.28Å; K69-V73 WeakPolarHBondContact O-CG2 3.24Å; K69-V73 PolarHBondContact O-N 3.28Å
70	A	97.5	Very high	95.8	Very high	0 Å²	0	63.7 Å²	63.7	0%	0	35%	0.35	C	S	.	.	H	α-helix	trans	-59.8	-44.4	177.3	0	0	0	0	0	111.3	K56 L59 L60 I65 S66 E67 K72 V73 L74	K56-A70 HydrophobicContact CG-CB 4.28Å; L59-A70 HydrophobicContact CB-CB 4.21Å; L60-A70 HydrophobicContact CD2-CB 4.11Å; I65-A70 HydrophobicContact CG2-CB 4.06Å; S66-A70 PolarHBondContact O-N 3.11Å; E67-A70 PolarHBondContact O-N 3.26Å; A70-K72 PolarHBondContact O-N 3.1Å; A70-V73 PolarHBondContact O-N 3.13Å; A70-L74 WeakPolarHBondContact O-CB 3.44Å; A70-L74 WeakPolarHBondContact O-CG 3.42Å; A70-L74 PolarHBondContact O-N 2.84Å
71	D	97.3	Very high	95.5	Very high	73 Å²	73	60.5 Å²	60.5	39%	0.39	33%	0.333	S	S	.	.	H	α-helix	trans	-62	-44.2	176.9	-72.8	-35.4	0	0	0	112.1	K56 E67 K69 A75	K56-D71 WeakPolarHBondContact CD-OD1 3.35Å; K56-D71 WeakPolarHBondContact CE-OD1 3.23Å; K56-D71 IonicContact NZ-OD1 3.18Å; K56-D71 PolarHBondContact NZ-OD1 3.07Å; K56-D71 IonicContact NZ-OD2 2.9Å; K56-D71 PolarHBondContact NZ-OD2 3.16Å; E67-D71 PolarHBondContact O-N 3.12Å; K69-D71 VanDerWaalsContact C-N 3.33Å; K69-D71 PolarHBondContact O-N 3.15Å; D71-A75 VanDerWaalsContact O-CB 3.23Å; D71-A75 WeakPolarHBondContact O-CB 3.05Å; D71-A75 PolarHBondContact O-N 3.17Å
72	K	96.6	Very high	95	Very high	97 Å²	97	59.2 Å²	59.2	42%	0.422	33%	0.332	S	S	.	.	H	α-helix	trans	-62.8	-49.8	177.4	-170	-176.1	-178.9	-174.4	0	111.5	G31 I32 A68 K69 A70 L74 A75 E76	G31-K72 PolarHBondContact O-NZ 3.47Å; I32-K72 HydrophobicContact CD1-CD 3.91Å; I32-K72 HydrophobicContact CD1-CG 3.86Å; A68-K72 WeakPolarHBondContact O-CB 3.36Å; A68-K72 PolarHBondContact O-N 3.35Å; A68-K72 VanDerWaalsContact O-N 3.13Å; K69-K72 PolarHBondContact O-N 3.46Å; A70-K72 PolarHBondContact O-N 3.1Å; K72-L74 PolarHBondContact O-N 3.42Å; K72-A75 PolarHBondContact O-N 3.46Å; K72-E76 HydrophobicContact CG-CG 4.47Å; K72-E76 WeakPolarHBondContact O-CG 3.37Å; K72-E76 PolarHBondContact O-N 2.92Å
73	V	96.8	Very high	94.5	Very high	4 Å²	4	62.8 Å²	62.8	2%	0.024	35%	0.349	C	S	.	.	H	α-helix	trans	-59.6	-46.6	-178.8	167.7	0	0	0	0	111	I32 L40 V51 K69 A70 E76 A77	I32-V73 HydrophobicContact CD1-CG2 3.75Å; I32-V73 HydrophobicContact CG1-CG2 4.19Å; I32-V73 HydrophobicContact CG2-CG2 3.9Å; L40-V73 HydrophobicContact CD1-CG1 4Å; V51-V73 HydrophobicContact CG1-CG1 3.4Å; V51-V73 VanDerWaalsContact CG1-CG1 3.4Å; K69-V73 WeakPolarHBondContact O-CB 3.45Å; K69-V73 VanDerWaalsContact O-CG2 3.28Å; K69-V73 WeakPolarHBondContact O-CG2 3.24Å; K69-V73 PolarHBondContact O-N 3.28Å; A70-V73 PolarHBondContact O-N 3.13Å; V73-E76 PolarHBondContact O-N 2.96Å; V73-A77 WeakPolarHBondContact O-CB 3.43Å; V73-A77 PolarHBondContact O-N 3.19Å
74	L	96.6	Very high	94.3	Very high	34 Å²	34	56.5 Å²	56.5	18%	0.178	34%	0.339	C	S	.	.	H	α-helix	trans	-62.8	-43.2	176.9	-74.8	168.8	0	0	0	112.1	V51 K56 L59 A70 K72 E76 A77 A78	V51-L74 VanDerWaalsContact O-CD2 3.3Å; V51-L74 WeakPolarHBondContact O-CD2 3.37Å; K56-L74 HydrophobicContact CB-CD1 3.8Å; K56-L74 HydrophobicContact CG-CD1 4.13Å; L59-L74 HydrophobicContact CD1-CD1 3.97Å; L59-L74 HydrophobicContact CD1-CD2 3.7Å; L59-L74 HydrophobicContact CD1-CG 3.58Å; A70-L74 WeakPolarHBondContact O-CB 3.44Å; A70-L74 WeakPolarHBondContact O-CG 3.42Å; A70-L74 PolarHBondContact O-N 2.84Å; K72-L74 PolarHBondContact O-N 3.42Å; L74-E76 VanDerWaalsContact C-N 3.34Å; L74-E76 PolarHBondContact O-N 3.26Å; L74-A77 PolarHBondContact O-N 3.27Å; L74-A78 WeakPolarHBondContact O-CB 3.3Å; L74-A78 PolarHBondContact O-N 3.1Å
75	A	95.6	Very high	94.3	Very high	50 Å²	50	64.9 Å²	64.9	41%	0.413	36%	0.363	S	S	.	.	H	α-helix	trans	-64.6	-37.2	179.9	0	0	0	0	0	112.6	D71 K72 K79	D71-A75 VanDerWaalsContact O-CB 3.23Å; D71-A75 WeakPolarHBondContact O-CB 3.05Å; D71-A75 PolarHBondContact O-N 3.17Å; K72-A75 PolarHBondContact O-N 3.46Å; A75-K79 WeakPolarHBondContact O-CG 3.41Å
76	E	95.5	Very high	94.2	Very high	35 Å²	35	67.2 Å²	67.2	16%	0.164	38%	0.378	C	S	.	.	H	α-helix	trans	-74.8	-43.5	176.5	-63.3	-49.8	135.5	0	0	111.9	L27 C30 I32 K72 V73 L74 A78 K79	L27-E76 HydrophobicContact CD2-CB 4.23Å; C30-E76 HydrophobicContact CB-CB 3.76Å; C30-E76 HydrophobicContact CB-CG 3.77Å; I32-E76 HydrophobicContact CD1-CG 4.34Å; K72-E76 HydrophobicContact CG-CG 4.47Å; K72-E76 WeakPolarHBondContact O-CG 3.37Å; K72-E76 PolarHBondContact O-N 2.92Å; V73-E76 PolarHBondContact O-N 2.96Å; L74-E76 VanDerWaalsContact C-N 3.34Å; L74-E76 PolarHBondContact O-N 3.26Å; E76-A78 VanDerWaalsContact C-N 3.27Å; E76-A78 PolarHBondContact O-N 2.94Å; E76-K79 WeakPolarHBondContact O-CB 3.35Å; E76-K79 PolarHBondContact O-N 3.47Å; E76-K79 VanDerWaalsContact O-N 3.15Å; E76-K79 IonicContact OE1-NZ 2.88Å; E76-K79 PolarHBondContact OE1-NZ 2.89Å; E76-K79 IonicContact OE2-NZ 2.88Å; E76-K79 PolarHBondContact OE2-NZ 3.47Å
77	A	95.1	Very high	94.1	Very high	0 Å²	0	67.8 Å²	67.8	0%	0	38%	0.379	C	S	.	.	H	α-helix	trans	-60	-38.7	175.5	0	0	0	0	0	111.9	L27 I48 V51 A52 V73 L74 K79 L80 V81	L27-A77 HydrophobicContact CD2-CB 4.35Å; I48-A77 HydrophobicContact CG2-CB 3.86Å; V51-A77 HydrophobicContact CB-CB 4.44Å; V51-A77 HydrophobicContact CG1-CB 3.98Å; A52-A77 HydrophobicContact CB-CB 4.08Å; V73-A77 WeakPolarHBondContact O-CB 3.43Å; V73-A77 PolarHBondContact O-N 3.19Å; L74-A77 PolarHBondContact O-N 3.27Å; A77-K79 PolarHBondContact O-N 3.1Å; A77-L80 PolarHBondContact O-N 3.23Å; A77-V81 PolarHBondContact O-N 3.37Å
78	A	93.2	Very high	94.1	Very high	40 Å²	40	66.1 Å²	66.1	33%	0.331	39%	0.385	S	S	.	.	H	α-helix	trans	-63.6	-20.2	178.6	0	0	0	0	0	114.7	L74 E76 L80 M83	L74-A78 WeakPolarHBondContact O-CB 3.3Å; L74-A78 PolarHBondContact O-N 3.1Å; E76-A78 VanDerWaalsContact C-N 3.27Å; E76-A78 PolarHBondContact O-N 2.94Å; A78-L80 VanDerWaalsContact C-N 3.34Å; A78-M83 HydrophobicContact CB-CE 3.27Å
79	K	92.3	Very high	94.1	Very high	142 Å²	142	67 Å²	67	62%	0.617	38%	0.383	S	S	*	.	H	α-helix	trans	-79	-22.5	175.2	-64.6	170.5	-165.7	168.9	0	112.4	A75 E76 A77	A75-K79 WeakPolarHBondContact O-CG 3.41Å; E76-K79 WeakPolarHBondContact O-CB 3.35Å; E76-K79 PolarHBondContact O-N 3.47Å; E76-K79 VanDerWaalsContact O-N 3.15Å; E76-K79 IonicContact OE1-NZ 2.88Å; E76-K79 PolarHBondContact OE1-NZ 2.89Å; E76-K79 IonicContact OE2-NZ 2.88Å; E76-K79 PolarHBondContact OE2-NZ 3.47Å; A77-K79 PolarHBondContact O-N 3.1Å
80	L	91.1	Very high	93.9	Very high	59 Å²	59	67.8 Å²	67.8	31%	0.309	39%	0.388	S	S	.	.	H	α-helix	trans	-97.8	-14.9	-174.9	-58	178.4	0	0	0	112.5	Q22 L27 I48 A77 A78	Q22-L80 PolarHBondContact NE2-O 2.93Å; Q22-L80 VanDerWaalsContact NE2-O 3.07Å; L27-L80 HydrophobicContact CD2-CD1 4.1Å; I48-L80 HydrophobicContact CD1-CB 4.49Å; I48-L80 HydrophobicContact CD1-CD1 3.54Å; I48-L80 HydrophobicContact CG2-CB 4.07Å; I48-L80 HydrophobicContact CG2-CD1 4.21Å; A77-L80 PolarHBondContact O-N 3.23Å; A78-L80 VanDerWaalsContact C-N 3.34Å
81	V	90.2	Very high	93.7	Very high	5 Å²	5	73 Å²	73	3%	0.03	41%	0.411	C	S	.	.	S	Bend	trans	-117.9	126.1	-179.1	-176.7	0	0	0	0	109.6	I48 E49 A52 Y53 A77 M83	I48-V81 HydrophobicContact CG2-CG2 3.89Å; E49-V81 HydrophobicContact CG-CG2 4.26Å; A52-V81 HydrophobicContact CB-CB 4.09Å; A52-V81 HydrophobicContact CB-CG1 4.46Å; A52-V81 HydrophobicContact CB-CG2 3.86Å; Y53-V81 HydrophobicContact CE1-CG1 3.71Å; A77-V81 PolarHBondContact O-N 3.37Å; V81-M83 HydrophobicContact CB-CG 4.21Å; V81-M83 HydrophobicContact CG1-CG 3.87Å; V81-M83 PolarHBondContact O-N 2.55Å
82	P	86.7	Confident	93.5	Very high	99 Å²	99	75.9 Å²	75.9	64%	0.643	42%	0.421	S	S	*	.			trans	-73.6	88.6	-179.9	30.1	-34.5	0	0	0	111.3
83	M	86.4	Confident	93.3	Very high	96 Å²	96	76.9 Å²	76.9	47%	0.473	43%	0.428	S	S	.	.			trans	-99.5	6.4	-178.3	-60.5	-168.4	-59.7	0	0	114.7	A52 Y53 A78 V81	A52-M83 HydrophobicContact CB-CE 4.45Å; A52-M83 HydrophobicContact CB-SD 3.85Å; Y53-M83 HydrophobicContact CD1-SD 4.3Å; Y53-M83 HydrophobicContact CE1-CG 4.42Å; Y53-M83 HydrophobicContact CE1-SD 4.46Å; A78-M83 HydrophobicContact CB-CE 3.27Å; V81-M83 HydrophobicContact CB-CG 4.21Å; V81-M83 HydrophobicContact CG1-CG 3.87Å; V81-M83 PolarHBondContact O-N 2.55Å
84	G	91.1	Very high	93	Very high	63 Å²	63	83 Å²	83	65%	0.649	45%	0.45	S	S	*	.	S	Bend	trans	-87.7	177.8	-177.1	0	0	0	0	0	114.2
85	F	94.3	Very high	92.7	Very high	225 Å²	225	85.8 Å²	85.8	99%	0.987	46%	0.459	S	S	*	.			trans	-66.2	138.3	168.7	-68.4	-81	0	0	0	110.7
86	T	93.6	Very high	92.5	Very high	62 Å²	62	87.1 Å²	87.1	38%	0.38	47%	0.47	S	S	.	.			trans	-130.4	163.1	174.2	173.1	0	0	0	0	108.9	E90	T86-E90 VanDerWaalsContact OG1-CB 3.31Å; T86-E90 WeakPolarHBondContact OG1-CB 3.01Å; T86-E90 PolarHBondContact OG1-OE2 2.72Å
87	T	95.9	Very high	92.2	Very high	73 Å²	73	91.9 Å²	91.9	45%	0.448	49%	0.492	S	S	.	.			trans	-74.4	152.1	177.2	70.5	0	0	0	0	111	T89 E90 F91	T87-T89 PolarHBondContact O-N 3.05Å; T87-E90 PolarHBondContact O-N 3.21Å; T87-E90 WeakPolarHBondContact OG1-CG 3.43Å; T87-E90 PolarHBondContact OG1-N 2.98Å; T87-F91 PolarHBondContact O-N 3.04Å; T87-F91 VanDerWaalsContact O-N 3.08Å
88	A	96.1	Very high	92.1	Very high	84 Å²	84	94.3 Å²	94.3	69%	0.694	50%	0.504	S	S	*	.	H	α-helix	trans	-60.7	-28.3	175.1	0	0	0	0	0	112.5	H92	A88-H92 WeakPolarHBondContact O-CB 3.46Å; A88-H92 PolarHBondContact O-N 3.47Å
89	T	96.8	Very high	92.3	Very high	94 Å²	94	94.2 Å²	94.2	58%	0.577	50%	0.498	S	S	*	.	H	α-helix	trans	-67.5	-47.5	176.3	-57.5	0	0	0	0	111.9	T87 F91 H92 Q93	T87-T89 PolarHBondContact O-N 3.05Å; T89-F91 VanDerWaalsContact C-N 3.33Å; T89-F91 PolarHBondContact O-N 3.42Å; T89-H92 PolarHBondContact O-N 3.45Å; T89-Q93 WeakPolarHBondContact O-CG 3.44Å; T89-Q93 PolarHBondContact O-N 3.36Å
90	E	92.9	Very high	92.5	Very high	88 Å²	88	90.7 Å²	90.7	41%	0.411	48%	0.484	S	S	.	.	H	α-helix	trans	-61.6	-42.9	175.5	-76.9	166.7	-162	0	0	111.1	T86 T87 H92 Q93 R94	T86-E90 VanDerWaalsContact OG1-CB 3.31Å; T86-E90 WeakPolarHBondContact OG1-CB 3.01Å; T86-E90 PolarHBondContact OG1-OE2 2.72Å; T87-E90 PolarHBondContact O-N 3.21Å; T87-E90 WeakPolarHBondContact OG1-CG 3.43Å; T87-E90 PolarHBondContact OG1-N 2.98Å; E90-H92 PolarHBondContact O-N 3.22Å; E90-Q93 PolarHBondContact O-N 3.5Å; E90-R94 WeakPolarHBondContact O-CG 3.48Å; E90-R94 PolarHBondContact O-N 2.76Å; E90-R94 VanDerWaalsContact O-N 3.11Å
91	F	93.1	Very high	92.9	Very high	110 Å²	110	87.9 Å²	87.9	48%	0.482	47%	0.469	S	S	.	.	H	α-helix	trans	-63.2	-40.3	176	-175.3	-110.2	0	0	0	112.5	T87 T89 R94 R95	T87-F91 PolarHBondContact O-N 3.04Å; T87-F91 VanDerWaalsContact O-N 3.08Å; T89-F91 VanDerWaalsContact C-N 3.33Å; T89-F91 PolarHBondContact O-N 3.42Å; F91-R94 PolarHBondContact O-N 3.47Å; F91-R95 HydrophobicContact CD1-CG 4.33Å; F91-R95 HydrophobicContact CE1-CG 3.95Å; F91-R95 HydrophobicContact CE2-CG 4.31Å; F91-R95 HydrophobicContact CZ-CG 3.94Å; F91-R95 WeakPolarHBondContact O-CG 3.4Å; F91-R95 PolarHBondContact O-N 3.49Å
92	H	93.3	Very high	93.3	Very high	133 Å²	133	88.5 Å²	88.5	62%	0.616	47%	0.473	S	S	*	.	H	α-helix	trans	-62.3	-41.9	176	176.7	58.5	0	0	0	112.3	A88 T89 E90 R95 A96	A88-H92 WeakPolarHBondContact O-CB 3.46Å; A88-H92 PolarHBondContact O-N 3.47Å; T89-H92 PolarHBondContact O-N 3.45Å; E90-H92 PolarHBondContact O-N 3.22Å; H92-R95 PolarHBondContact O-N 2.96Å; H92-A96 PolarHBondContact O-N 3.06Å
93	Q	93.4	Very high	93.8	Very high	119 Å²	119	83.9 Å²	83.9	56%	0.556	44%	0.443	S	S	*	.	H	α-helix	trans	-60.3	-47.6	175.9	-72.7	172.5	-13.1	0	0	111.3	T89 E90 R95 A96	T89-Q93 WeakPolarHBondContact O-CG 3.44Å; T89-Q93 PolarHBondContact O-N 3.36Å; E90-Q93 PolarHBondContact O-N 3.5Å; Q93-R95 VanDerWaalsContact C-N 3.3Å; Q93-R95 PolarHBondContact O-N 3.2Å; Q93-A96 WeakPolarHBondContact O-CB 3.31Å; Q93-A96 PolarHBondContact O-N 2.95Å; Q93-A96 VanDerWaalsContact O-N 3.11Å
94	R	89.7	Confident	94.4	Very high	131 Å²	131	79.5 Å²	79.5	49%	0.494	42%	0.423	S	S	.	.	H	α-helix	trans	-59.4	-40.6	175.3	-66.8	177.7	-172.3	-176.2	2.5	112.4	E90 F91 A96 E97	E90-R94 WeakPolarHBondContact O-CG 3.48Å; E90-R94 PolarHBondContact O-N 2.76Å; E90-R94 VanDerWaalsContact O-N 3.11Å; F91-R94 PolarHBondContact O-N 3.47Å; R94-A96 VanDerWaalsContact C-N 3.29Å; R94-A96 PolarHBondContact O-N 3.18Å; R94-E97 PolarHBondContact O-N 2.92Å
95	R	91.3	Very high	94.7	Very high	94 Å²	94	76.5 Å²	76.5	36%	0.355	39%	0.392	S	S	.	.	H	α-helix	trans	-68.9	-25.6	177.9	-75.1	-161.7	65.9	88.5	-0.9	113.6	F91 H92 Q93 E97 I98 E117	F91-R95 HydrophobicContact CD1-CG 4.33Å; F91-R95 HydrophobicContact CE1-CG 3.95Å; F91-R95 HydrophobicContact CE2-CG 4.31Å; F91-R95 HydrophobicContact CZ-CG 3.94Å; F91-R95 WeakPolarHBondContact O-CG 3.4Å; F91-R95 PolarHBondContact O-N 3.49Å; H92-R95 PolarHBondContact O-N 2.96Å; Q93-R95 VanDerWaalsContact C-N 3.3Å; Q93-R95 PolarHBondContact O-N 3.2Å; R95-E97 PolarHBondContact O-N 2.8Å; R95-I98 HydrophobicContact CB-CD1 4.07Å; R95-I98 HydrophobicContact CG-CD1 3.87Å; R95-I98 WeakPolarHBondContact O-CB 3.45Å; R95-I98 PolarHBondContact O-N 3.14Å; R95-E117 IonicContact CZ-OE1 2.74Å; R95-E117 IonicContact NH1-OE1 3.53Å; R95-E117 IonicContact NH2-OE1 3.99Å; R95-E117 PolarHBondContact NH2-OE1 2.96Å; R95-E117 IonicContact NH2-OE2 3.77Å; R95-E117 PolarHBondContact NH2-OE2 3.15Å
96	A	90.4	Very high	94.9	Very high	78 Å²	78	73.3 Å²	73.3	65%	0.645	38%	0.378	S	S	*	.	H	α-helix	trans	-68.3	-18.1	177.3	0	0	0	0	0	112.7	H92 Q93 R94	H92-A96 PolarHBondContact O-N 3.06Å; Q93-A96 WeakPolarHBondContact O-CB 3.31Å; Q93-A96 PolarHBondContact O-N 2.95Å; Q93-A96 VanDerWaalsContact O-N 3.11Å; R94-A96 VanDerWaalsContact C-N 3.29Å; R94-A96 PolarHBondContact O-N 3.18Å
97	E	89.4	Confident	95.1	Very high	134 Å²	134	74.6 Å²	74.6	63%	0.626	38%	0.379	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.7	1.1	178.4	-62.5	171.4	-176.3	0	0	112.6	R94 R95 I99	R94-E97 PolarHBondContact O-N 2.92Å; R95-E97 PolarHBondContact O-N 2.8Å; E97-I99 PolarHBondContact O-N 3.41Å
98	I	93.4	Very high	95.2	Very high	51 Å²	51	71.2 Å²	71.2	26%	0.262	36%	0.359	S	S	.	.			trans	-66.3	129.8	178	-70.2	173.3	0	0	0	110	R95 E117	R95-I98 HydrophobicContact CB-CD1 4.07Å; R95-I98 HydrophobicContact CG-CD1 3.87Å; R95-I98 WeakPolarHBondContact O-CB 3.45Å; R95-I98 PolarHBondContact O-N 3.14Å; I98-E117 HydrophobicContact CG2-CG 3.64Å
99	I	96.3	Very high	95.3	Very high	39 Å²	39	68.5 Å²	68.5	20%	0.2	33%	0.332	C	S	.	.			trans	-75.7	140.8	177.3	-60.4	173.6	0	0	0	109.3	E97 T118 I147	E97-I99 PolarHBondContact O-N 3.41Å; I99-T118 HydrophobicContact CB-CG2 4.07Å; I99-T118 HydrophobicContact CG2-CG2 4.33Å; I99-T118 WeakPolarHBondContact O-CG2 3.43Å; I99-T118 PolarHBondContact O-N 3.11Å; I99-T118 PolarHBondContact O-OG1 3.46Å; I99-T118 VanDerWaalsContact O-OG1 3.11Å; I99-I147 HydrophobicContact CD1-CD1 3.87Å; I99-I147 HydrophobicContact CD1-CG1 4.36Å
100	Q	97.5	Very high	95.4	Very high	68 Å²	68	71.1 Å²	71.1	32%	0.318	34%	0.336	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	123.8	173.9	-65.3	175.1	-28.7	0	0	108.9	Q113 G114 I116	Q100-Q113 PolarHBondContact OE1-O 3.17Å; Q100-G114 VanDerWaalsContact OE1-CA 3.31Å; Q100-I116 CarbonylContact C-O 3.58Å; Q100-I116 WeakPolarHBondContact CA-O 3.49Å
101	I	98.6	Very high	95.6	Very high	0 Å²	0	67.8 Å²	67.8	0%	0	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.5	122.7	-175.9	-58.4	169.4	0	0	0	109.2	G115 I116 T118 L139 C143 A216 L217 A261	I101-G115 CarbonylContact O-C 3.57Å; I101-G115 WeakPolarHBondContact O-CA 3.46Å; I101-I116 PolarHBondContact N-O 3.34Å; I101-I116 PolarHBondContact O-N 3.41Å; I101-T118 HydrophobicContact CD1-CG2 4.31Å; I101-T118 HydrophobicContact CG1-CG2 4.43Å; I101-L139 HydrophobicContact CG2-CD2 4.1Å; I101-C143 HydrophobicContact CD1-CB 3.84Å; I101-C143 HydrophobicContact CG1-CB 4.48Å; I101-C143 HydrophobicContact CG2-CB 3.97Å; I101-A216 HydrophobicContact CD1-CB 4.45Å; I101-L217 HydrophobicContact CD1-CB 4.25Å; I101-L217 HydrophobicContact CD1-CD1 4.36Å; I101-A261 HydrophobicContact CD1-CB 3.77Å
102	S	98.5	Very high	95.9	Very high	17 Å²	17	63 Å²	63	12%	0.119	30%	0.3	C	S	.	.			trans	-59.2	137.4	176.6	174.9	0	0	0	0	111.3	G104 D109 T142 G150	S102-G104 PolarHBondContact O-N 3.01Å; S102-G104 PolarHBondContact OG-N 3.18Å; S102-G104 VanDerWaalsContact OG-N 3.12Å; S102-D109 WeakPolarHBondContact CB-OD2 3Å; S102-D109 PolarHBondContact OG-OD2 3.42Å; S102-T142 WeakPolarHBondContact O-CB 3.41Å; S102-T142 PolarHBondContact O-OG1 3.37Å; S102-G150 WeakPolarHBondContact CB-O 3.43Å; S102-G150 PolarHBondContact N-O 3.44Å
103	T	98.6	Very high	96	Very high	2 Å²	2	62.7 Å²	62.7	1%	0.012	30%	0.299	C	S	.	.			trans	-78.4	-8.6	175.1	64.9	0	0	0	0	113.1	S105 L108 D109 L112 I116	T103-S105 VanDerWaalsContact C-N 3.29Å; T103-S105 PolarHBondContact OG1-N 3.35Å; T103-S105 PolarHBondContact OG1-O 3Å; T103-L108 HydrophobicContact CG2-CB 4.21Å; T103-L108 WeakPolarHBondContact OG1-CB 3.39Å; T103-D109 VanDerWaalsContact CB-OD1 3.3Å; T103-D109 WeakPolarHBondContact CB-OD1 3.41Å; T103-D109 WeakPolarHBondContact CG2-OD1 3.39Å; T103-D109 PolarHBondContact N-OD1 3.19Å; T103-D109 PolarHBondContact OG1-OD1 2.95Å; T103-L112 HydrophobicContact CG2-CD1 3.83Å; T103-I116 HydrophobicContact CG2-CD1 4.45Å; T103-I116 HydrophobicContact CG2-CG1 4.26Å
104	G	97.8	Very high	96.1	Very high	5 Å²	5	58.6 Å²	58.6	5%	0.052	29%	0.288	C	S	.	.	S	Bend	trans	81.9	-2.7	-171.9	0	0	0	0	0	114.8	S102 R176 Y177 V333	S102-G104 PolarHBondContact O-N 3.01Å; S102-G104 PolarHBondContact OG-N 3.18Å; S102-G104 VanDerWaalsContact OG-N 3.12Å; G104-R176 PolarHBondContact O-NH2 3.13Å; G104-Y177 VanDerWaalsContact CA-OH 3.31Å; G104-Y177 WeakPolarHBondContact CA-OH 3.49Å; G104-V333 CarbonylContact C-O 3.59Å
105	S	98.3	Very high	96.5	Very high	0 Å²	0	52.6 Å²	52.6	0%	0	27%	0.267	C	S	.	.			trans	-117.7	128	171.1	166.7	0	0	0	0	109.7	T103 E107 L108 D109 D335	T103-S105 VanDerWaalsContact C-N 3.29Å; T103-S105 PolarHBondContact OG1-N 3.35Å; T103-S105 PolarHBondContact OG1-O 3Å; S105-E107 VanDerWaalsContact C-N 3.28Å; S105-E107 PolarHBondContact O-N 2.93Å; S105-E107 PolarHBondContact OG-N 3Å; S105-L108 PolarHBondContact O-N 3.38Å; S105-L108 PolarHBondContact OG-N 3.37Å; S105-D109 WeakPolarHBondContact O-CB 3.38Å; S105-D109 PolarHBondContact O-N 2.58Å; S105-D335 WeakPolarHBondContact CA-OD1 3.48Å; S105-D335 WeakPolarHBondContact CB-OD1 3.18Å; S105-D335 PolarHBondContact OG-OD1 3.12Å
106	K	97.8	Very high	96.9	Very high	157 Å²	157	48.2 Å²	48.2	68%	0.683	25%	0.251	S	S	*	.	H	α-helix	trans	-64.2	-36.4	178	-65.9	177	179.5	176.7	0	111.7	D109 K110 D335	K106-D109 PolarHBondContact O-N 3.4Å; K106-K110 WeakPolarHBondContact O-CB 3.31Å; K106-K110 PolarHBondContact O-N 2.99Å; K106-D335 WeakPolarHBondContact CB-OD2 3.46Å; K106-D335 PolarHBondContact N-OD1 3.22Å; K106-D335 PolarHBondContact N-OD2 3.13Å
107	E	98	Very high	97.2	Very high	89 Å²	89	46.2 Å²	46.2	42%	0.416	23%	0.228	S	C	.	.	H	α-helix	trans	-69.6	-36.5	178.4	-69	-58.1	129.6	0	0	112.1	S105 L111 A324 D335	S105-E107 VanDerWaalsContact C-N 3.28Å; S105-E107 PolarHBondContact O-N 2.93Å; S105-E107 PolarHBondContact OG-N 3Å; E107-L111 WeakPolarHBondContact O-CB 3.15Å; E107-L111 PolarHBondContact O-N 3.32Å; E107-A324 HydrophobicContact CB-CB 4.3Å; E107-A324 WeakPolarHBondContact O-CB 3.34Å; E107-D335 PolarHBondContact N-OD1 2.99Å
108	L	98.1	Very high	97.6	Very high	3 Å²	3	40.7 Å²	40.7	2%	0.016	20%	0.203	C	C	.	.	H	α-helix	trans	-69.6	-43.7	172	-72.4	-177.5	0	0	0	112	T103 S105 K110 L111 L112 L135 C311 A324 F326 V333	T103-L108 HydrophobicContact CG2-CB 4.21Å; T103-L108 WeakPolarHBondContact OG1-CB 3.39Å; S105-L108 PolarHBondContact O-N 3.38Å; S105-L108 PolarHBondContact OG-N 3.37Å; L108-K110 VanDerWaalsContact C-N 3.26Å; L108-K110 PolarHBondContact O-N 3.01Å; L108-L111 WeakPolarHBondContact O-CB 3.27Å; L108-L111 PolarHBondContact O-N 3.27Å; L108-L111 VanDerWaalsContact O-N 3.14Å; L108-L112 WeakPolarHBondContact O-CG 3.19Å; L108-L112 PolarHBondContact O-N 3.06Å; L108-L135 HydrophobicContact CD1-CD2 4.49Å; L108-C311 HydrophobicContact CD2-CB 3.43Å; L108-C311 VanDerWaalsContact CD2-CB 3.43Å; L108-A324 HydrophobicContact CD2-CB 4.39Å; L108-F326 HydrophobicContact CD1-CB 3.88Å; L108-F326 HydrophobicContact CD1-CD1 3.96Å; L108-F326 HydrophobicContact CD1-CD2 4.33Å; L108-F326 HydrophobicContact CD1-CG 3.82Å; L108-F326 HydrophobicContact CD2-CB 4.43Å; L108-F326 HydrophobicContact CD2-CD1 3.87Å; L108-F326 HydrophobicContact CD2-CG 4.42Å; L108-F326 HydrophobicContact CG-CB 3.95Å; L108-F326 HydrophobicContact CG-CD1 4.19Å; L108-F326 HydrophobicContact CG-CG 4.24Å; L108-V333 HydrophobicContact CD1-CG1 4.09Å
109	D	98.4	Very high	97.7	Very high	26 Å²	26	39.6 Å²	39.6	14%	0.139	21%	0.205	C	C	.	.	H	α-helix	trans	-63.8	-37.2	178.4	-65.8	-11.7	0	0	0	110.6	S102 T103 S105 K106 L112 Q113 G114	S102-D109 WeakPolarHBondContact CB-OD2 3Å; S102-D109 PolarHBondContact OG-OD2 3.42Å; T103-D109 VanDerWaalsContact CB-OD1 3.3Å; T103-D109 WeakPolarHBondContact CB-OD1 3.41Å; T103-D109 WeakPolarHBondContact CG2-OD1 3.39Å; T103-D109 PolarHBondContact N-OD1 3.19Å; T103-D109 PolarHBondContact OG1-OD1 2.95Å; S105-D109 WeakPolarHBondContact O-CB 3.38Å; S105-D109 PolarHBondContact O-N 2.58Å; K106-D109 PolarHBondContact O-N 3.4Å; D109-L112 CarbonylContact O-C 3.48Å; D109-L112 PolarHBondContact O-N 3.35Å; D109-Q113 CarbonylContact O-C 3.48Å; D109-Q113 WeakPolarHBondContact O-CA 3.43Å; D109-Q113 PolarHBondContact O-N 3.04Å; D109-G114 PolarHBondContact O-N 3.21Å
110	K	98.3	Very high	97.7	Very high	149 Å²	149	37.9 Å²	37.9	65%	0.648	20%	0.197	S	C	*	.	H	α-helix	trans	-64.3	-42.3	172.2	-177.5	-177.2	178.2	-174.1	0	112.4	K106 L108 L112 Q113	K106-K110 WeakPolarHBondContact O-CB 3.31Å; K106-K110 PolarHBondContact O-N 2.99Å; L108-K110 VanDerWaalsContact C-N 3.26Å; L108-K110 PolarHBondContact O-N 3.01Å; K110-L112 VanDerWaalsContact C-N 3.26Å; K110-L112 PolarHBondContact O-N 3.08Å; K110-Q113 PolarHBondContact O-N 3.15Å
111	L	98.3	Very high	97.8	Very high	18 Å²	18	34.7 Å²	34.7	9%	0.094	18%	0.181	C	C	.	.	H	α-helix	trans	-58.3	-42.1	174.7	178.4	66.2	0	0	0	110.9	E107 L108 Q113 C311 I313 A322 A324	E107-L111 WeakPolarHBondContact O-CB 3.15Å; E107-L111 PolarHBondContact O-N 3.32Å; L108-L111 WeakPolarHBondContact O-CB 3.27Å; L108-L111 PolarHBondContact O-N 3.27Å; L108-L111 VanDerWaalsContact O-N 3.14Å; L111-Q113 VanDerWaalsContact C-N 3.35Å; L111-C311 HydrophobicContact CD2-CB 4.22Å; L111-I313 HydrophobicContact CD1-CD1 3.62Å; L111-I313 HydrophobicContact CD1-CG1 3.99Å; L111-I313 HydrophobicContact CD2-CG1 4.14Å; L111-I313 HydrophobicContact CG-CD1 3.73Å; L111-I313 HydrophobicContact CG-CG1 3.92Å; L111-I313 WeakPolarHBondContact O-CD1 3.45Å; L111-A322 HydrophobicContact CD1-CB 3.45Å; L111-A322 VanDerWaalsContact CD1-CB 3.45Å; L111-A324 HydrophobicContact CB-CB 3.84Å; L111-A324 HydrophobicContact CD2-CB 3.83Å; L111-A324 HydrophobicContact CG-CB 4.27Å
112	L	98	Very high	97.8	Very high	10 Å²	10	34.9 Å²	34.9	5%	0.052	18%	0.183	C	C	.	.	T	Hydrogen-bonded Turn	trans	-87.4	-0.6	-178.6	-59.3	176	0	0	0	114.2	T103 L108 D109 K110 G114 G115 I116 L299 L319	T103-L112 HydrophobicContact CG2-CD1 3.83Å; L108-L112 WeakPolarHBondContact O-CG 3.19Å; L108-L112 PolarHBondContact O-N 3.06Å; D109-L112 CarbonylContact O-C 3.48Å; D109-L112 PolarHBondContact O-N 3.35Å; K110-L112 VanDerWaalsContact C-N 3.26Å; K110-L112 PolarHBondContact O-N 3.08Å; L112-G114 PolarHBondContact O-N 3.33Å; L112-G115 WeakPolarHBondContact CB-O 3.45Å; L112-I116 HydrophobicContact CD1-CD1 3.86Å; L112-L299 HydrophobicContact CD1-CD1 4.44Å; L112-L299 HydrophobicContact CD2-CD1 4.19Å; L112-L299 HydrophobicContact CD2-CD2 3.77Å; L112-L319 HydrophobicContact CD2-CD1 4.13Å
113	Q	96.6	Very high	97.8	Very high	127 Å²	127	34 Å²	34	59%	0.593	18%	0.177	S	C	*	.	T	Hydrogen-bonded Turn	trans	55.9	34.9	-174.9	-57.5	178.1	9.5	0	0	114.3	Q100 D109 K110 L111 L319	Q100-Q113 PolarHBondContact OE1-O 3.17Å; D109-Q113 CarbonylContact O-C 3.48Å; D109-Q113 WeakPolarHBondContact O-CA 3.43Å; D109-Q113 PolarHBondContact O-N 3.04Å; K110-Q113 PolarHBondContact O-N 3.15Å; L111-Q113 VanDerWaalsContact C-N 3.35Å; Q113-L319 HydrophobicContact CB-CD2 4.1Å; Q113-L319 VanDerWaalsContact CD-CD2 3.43Å; Q113-L319 HydrophobicContact CG-CD2 3.7Å
114	G	95.6	Very high	97.8	Very high	32 Å²	32	34 Å²	34	33%	0.33	18%	0.176	S	C	.	.	S	Bend	trans	143.1	-25.1	169.8	0	0	0	0	0	114.3	Q100 D109 L112	Q100-G114 VanDerWaalsContact OE1-CA 3.31Å; D109-G114 PolarHBondContact O-N 3.21Å; L112-G114 PolarHBondContact O-N 3.33Å
115	G	97.8	Very high	97.8	Very high	5 Å²	5	34 Å²	34	5%	0.052	18%	0.175	C	C	.	.	S	Bend	trans	140.3	-152.8	175.5	0	0	0	0	0	113.1	I101 L112	I101-G115 CarbonylContact O-C 3.57Å; I101-G115 WeakPolarHBondContact O-CA 3.46Å; L112-G115 WeakPolarHBondContact CB-O 3.45Å
116	I	98.5	Very high	97.7	Very high	2 Å²	2	34 Å²	34	1%	0.01	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81	116.8	176.8	-56.2	-63.5	0	0	0	109.4	Q100 I101 T103 L112 T122 L139 A261 V263 L299	Q100-I116 CarbonylContact C-O 3.58Å; Q100-I116 WeakPolarHBondContact CA-O 3.49Å; I101-I116 PolarHBondContact N-O 3.34Å; I101-I116 PolarHBondContact O-N 3.41Å; T103-I116 HydrophobicContact CG2-CD1 4.45Å; T103-I116 HydrophobicContact CG2-CG1 4.26Å; L112-I116 HydrophobicContact CD1-CD1 3.86Å; I116-T122 HydrophobicContact CD1-CG2 3.87Å; I116-L139 HydrophobicContact CG1-CD1 4.15Å; I116-L139 HydrophobicContact CG1-CD2 3.92Å; I116-A261 HydrophobicContact CG2-CB 4.1Å; I116-V263 HydrophobicContact CG2-CG2 3.72Å; I116-L299 HydrophobicContact CD1-CD1 4.45Å
117	E	97.4	Very high	97.5	Very high	36 Å²	36	29.8 Å²	29.8	17%	0.168	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.5	133.1	179.6	-176	173.7	105.9	0	0	112.2	R95 I98	R95-E117 IonicContact CZ-OE1 2.74Å; R95-E117 IonicContact NH1-OE1 3.53Å; R95-E117 IonicContact NH2-OE1 3.99Å; R95-E117 PolarHBondContact NH2-OE1 2.96Å; R95-E117 IonicContact NH2-OE2 3.77Å; R95-E117 PolarHBondContact NH2-OE2 3.15Å; I98-E117 HydrophobicContact CG2-CG 3.64Å
118	T	97.3	Very high	97.2	Very high	18 Å²	18	33.8 Å²	33.8	11%	0.11	17%	0.174	C	C	.	.	S	Bend	trans	-77.2	156.6	170.2	62.7	0	0	0	0	112.3	I99 I101 S120 G259 A261	I99-T118 HydrophobicContact CB-CG2 4.07Å; I99-T118 HydrophobicContact CG2-CG2 4.33Å; I99-T118 WeakPolarHBondContact O-CG2 3.43Å; I99-T118 PolarHBondContact O-N 3.11Å; I99-T118 PolarHBondContact O-OG1 3.46Å; I99-T118 VanDerWaalsContact O-OG1 3.11Å; I101-T118 HydrophobicContact CD1-CG2 4.31Å; I101-T118 HydrophobicContact CG1-CG2 4.43Å; T118-S120 VanDerWaalsContact C-N 3.26Å; T118-S120 PolarHBondContact O-N 3.31Å; T118-G259 VanDerWaalsContact CB-O 3.31Å; T118-G259 WeakPolarHBondContact CB-O 3.14Å; T118-A261 HydrophobicContact CG2-CB 3.98Å
119	G	95.8	Very high	97	Very high	28 Å²	28	41.9 Å²	41.9	29%	0.289	21%	0.205	S	C	.	.	S	Bend	trans	71.6	22.8	-177	0	0	0	0	0	113.1	V260	G119-V260 PolarHBondContact N-O 3.07Å
120	S	96.6	Very high	96.9	Very high	4 Å²	4	40.7 Å²	40.7	3%	0.028	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.5	161.4	-177.4	-169.3	0	0	0	0	111.9	T118 V262 T296	T118-S120 VanDerWaalsContact C-N 3.26Å; T118-S120 PolarHBondContact O-N 3.31Å; S120-V262 PolarHBondContact O-N 3.34Å; S120-T296 WeakPolarHBondContact OG-CB 3.46Å; S120-T296 WeakPolarHBondContact OG-CG2 3.47Å; S120-T296 PolarHBondContact OG-OG1 3.42Å
121	I	98.6	Very high	96.8	Very high	0 Å²	0	34 Å²	34	0%	0	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.7	119	173.3	-59.9	177.4	0	0	0	109.4	L251 L252 V262 I264 T296 T297	I121-L251 HydrophobicContact CD1-CB 4Å; I121-L252 HydrophobicContact CD1-CB 4.01Å; I121-V262 WeakPolarHBondContact CA-O 3.32Å; I121-V262 HydrophobicContact CG1-CB 4.1Å; I121-V262 HydrophobicContact CG1-CG1 4.18Å; I121-I264 HydrophobicContact CG2-CD1 3.81Å; I121-I264 HydrophobicContact CG2-CG1 4.09Å; I121-I264 HydrophobicContact CG2-CG2 4.48Å; I121-T296 PolarHBondContact O-N 2.98Å; I121-T297 PolarHBondContact O-N 3.05Å
122	T	98.8	Very high	96.8	Very high	4 Å²	4	34.4 Å²	34.4	3%	0.025	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	117.8	170.6	-60.1	0	0	0	0	110.7	I116 V262 V263 I264 T297 L299	I116-T122 HydrophobicContact CD1-CG2 3.87Å; T122-V262 PolarHBondContact N-O 2.88Å; T122-V263 WeakPolarHBondContact O-CA 3.3Å; T122-I264 PolarHBondContact O-N 2.96Å; T122-T297 CarbonylContact C-O 3.58Å; T122-T297 WeakPolarHBondContact CA-O 3.41Å; T122-L299 HydrophobicContact CG2-CD1 3.99Å; T122-L299 HydrophobicContact CG2-CG 4.23Å
123	E	98.8	Very high	96.8	Very high	0 Å²	0	35.3 Å²	35.3	0%	0	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95	127.7	176.7	-177.5	-167.9	168.7	0	0	110.9	I264 N266 S295 T297 R298 L299	E123-I264 CarbonylContact C-O 3.57Å; E123-I264 WeakPolarHBondContact CA-O 3.38Å; E123-I264 HydrophobicContact CB-CD1 4.19Å; E123-I264 HydrophobicContact CB-CG1 3.89Å; E123-I264 HydrophobicContact CG-CD1 4.31Å; E123-I264 HydrophobicContact CG-CG1 4.09Å; E123-N266 HydrophobicContact CG-CB 4.15Å; E123-N266 WeakPolarHBondContact OE1-CB 3.36Å; E123-N266 PolarHBondContact OE1-ND2 3.11Å; E123-S295 PolarHBondContact OE2-OG 3.09Å; E123-T297 PolarHBondContact N-O 2.82Å; E123-R298 HydrophobicContact CB-CG 4.35Å; E123-R298 CarbonylContact O-C 3.57Å; E123-R298 WeakPolarHBondContact O-CA 3.28Å; E123-R298 IonicContact OE1-NH2 2.8Å; E123-R298 PolarHBondContact OE1-NH2 2.93Å; E123-R298 IonicContact OE2-CZ 3.93Å; E123-R298 IonicContact OE2-NE 2.72Å; E123-R298 PolarHBondContact OE2-NE 3.33Å; E123-R298 IonicContact OE2-NH2 2.72Å; E123-R298 PolarHBondContact OE2-NH2 3.47Å; E123-L299 PolarHBondContact O-N 2.86Å
124	M	98.6	Very high	96.9	Very high	0 Å²	0	31.5 Å²	31.5	0%	0	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	120.1	169.6	-60.2	-177.6	-62	0	0	110.5	K132 L135 C136 V263 I264 T265 N266 L299	M124-K132 WeakPolarHBondContact O-CD 3.48Å; M124-L135 HydrophobicContact CE-CG 4.45Å; M124-L135 HydrophobicContact SD-CB 4.31Å; M124-L135 HydrophobicContact SD-CD2 3.37Å; M124-L135 WeakPolarHBondContact SD-CD2 3.41Å; M124-L135 HydrophobicContact SD-CG 3.85Å; M124-C136 WeakPolarHBondContact CE-SG 3.24Å; M124-V263 HydrophobicContact CE-CG1 3.34Å; M124-V263 HydrophobicContact SD-CG1 4.37Å; M124-I264 PolarHBondContact N-O 2.94Å; M124-T265 HydrophobicContact CE-CG2 4.01Å; M124-T265 CarbonylContact O-C 3.53Å; M124-T265 WeakPolarHBondContact O-CA 3.38Å; M124-N266 PolarHBondContact O-N 3.15Å; M124-L299 WeakPolarHBondContact CA-O 3.1Å; M124-L299 HydrophobicContact CG-CB 4.31Å; M124-L299 HydrophobicContact CG-CD1 4.29Å
125	F	98.1	Very high	97.1	Very high	5 Å²	5	30.1 Å²	30.1	2%	0.022	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.2	156.3	179.5	73.1	-88.9	0	0	0	112.5	N266 V268 P285 R298 L299 Y300 L301 Y314	F125-N266 WeakPolarHBondContact CA-O 3.42Å; F125-N266 HydrophobicContact CB-CB 3.93Å; F125-V268 HydrophobicContact CD2-CG1 3.74Å; F125-V268 HydrophobicContact CE2-CG1 4.5Å; F125-P285 HydrophobicContact CB-CB 4.25Å; F125-P285 HydrophobicContact CD1-CB 4.37Å; F125-P285 HydrophobicContact CD2-CB 3.81Å; F125-P285 HydrophobicContact CD2-CG 4.22Å; F125-P285 HydrophobicContact CE2-CB 4.18Å; F125-P285 HydrophobicContact CE2-CG 4.08Å; F125-P285 HydrophobicContact CG-CB 3.9Å; F125-P285 HydrophobicContact CZ-CG 4.23Å; F125-R298 HydrophobicContact CE1-CB 4.33Å; F125-L299 WeakPolarHBondContact CD1-O 3.48Å; F125-L299 PolarHBondContact N-O 3.48Å; F125-Y300 AromaticContact CD2-CD2 3.75Å; F125-Y300 HydrophobicContact CD2-CD2 3.75Å; F125-Y300 HydrophobicContact CD2-CE2 4.44Å; F125-Y300 AromaticContact CE2-CD2 3.4Å; F125-Y300 HydrophobicContact CE2-CD2 3.4Å; F125-Y300 VanDerWaalsContact CE2-CD2 3.4Å; F125-Y300 HydrophobicContact CE2-CE2 4.17Å; F125-Y300 AromaticContact CE2-CG 3.9Å; F125-Y300 HydrophobicContact CE2-CG 3.9Å; F125-Y300 HydrophobicContact CZ-CD2 4.06Å; F125-Y300 HydrophobicContact CZ-CG 4.11Å; F125-L301 PolarHBondContact O-N 2.91Å; F125-Y314 HydrophobicContact CE1-CD1 4.18Å; F125-Y314 HydrophobicContact CE1-CD2 4.36Å; F125-Y314 AromaticContact CE1-CG 3.9Å; F125-Y314 HydrophobicContact CE1-CG 3.9Å; F125-Y314 HydrophobicContact CZ-CD1 4.01Å; F125-Y314 AromaticContact CZ-CD2 3.6Å; F125-Y314 HydrophobicContact CZ-CD2 3.6Å; F125-Y314 HydrophobicContact CZ-CE1 4.4Å; F125-Y314 AromaticContact CZ-CE2 4Å; F125-Y314 HydrophobicContact CZ-CE2 4Å; F125-Y314 AromaticContact CZ-CG 3.59Å; F125-Y314 HydrophobicContact CZ-CG 3.59Å
126	G	96.6	Very high	97.1	Very high	1 Å²	1	29.9 Å²	29.9	1%	0.01	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	160.9	176.9	179.1	0	0	0	0	0	112	K132 L301	G126-K132 PolarHBondContact O-NZ 2.89Å; G126-L301 WeakPolarHBondContact CA-O 3.44Å
127	E	94.1	Very high	97.1	Very high	69 Å²	69	29.9 Å²	29.9	32%	0.322	14%	0.144	S	C	.	.	S	Bend	trans	-62.7	170.7	179.8	-65.7	-174.6	90.2	0	0	112.9	T130 K132 V268 K283	E127-T130 HydrophobicContact CB-CG2 4.01Å; E127-T130 WeakPolarHBondContact O-CG2 3.35Å; E127-T130 PolarHBondContact O-OG1 3.01Å; E127-K132 PolarHBondContact O-NZ 3.42Å; E127-V268 HydrophobicContact CB-CG2 4.42Å; E127-V268 HydrophobicContact CG-CG2 3.73Å; E127-K283 HydrophobicContact CG-CD 3.72Å; E127-K283 VanDerWaalsContact OE1-CE 3.24Å; E127-K283 WeakPolarHBondContact OE1-CE 3.35Å; E127-K283 IonicContact OE1-NZ 2.84Å; E127-K283 WeakPolarHBondContact OE2-CE 3.36Å; E127-K283 IonicContact OE2-NZ 2.87Å; E127-K283 PolarHBondContact OE2-NZ 3.18Å
128	F	91.6	Very high	97.2	Very high	172 Å²	172	28.2 Å²	28.2	75%	0.754	14%	0.136	S	C	*	.	T	Hydrogen-bonded Turn	trans	-57.7	151.3	168.8	67.3	-84.8	0	0	0	109.8	T130	F128-T130 PolarHBondContact O-N 2.87Å
129	R	93.1	Very high	97.3	Very high	173 Å²	173	27.3 Å²	27.3	65%	0.653	13%	0.131	S	C	*	.	T	Hydrogen-bonded Turn	trans	66.7	9.4	177.9	-159.5	-179.8	176.8	-176.8	2.3	115.7	G131 R309	R129-G131 VanDerWaalsContact C-N 3.32Å; R129-G131 PolarHBondContact O-N 2.86Å; R129-R309 PolarHBondContact O-NE 2.98Å; R129-R309 PolarHBondContact O-NH2 3.1Å
130	T	96.8	Very high	97.4	Very high	2 Å²	2	26 Å²	26	1%	0.012	12%	0.117	C	C	.	.	S	Bend	trans	-79.6	-10.1	177.1	60.1	0	0	0	0	114.5	E127 F128 L301 R309	E127-T130 HydrophobicContact CB-CG2 4.01Å; E127-T130 WeakPolarHBondContact O-CG2 3.35Å; E127-T130 PolarHBondContact O-OG1 3.01Å; F128-T130 PolarHBondContact O-N 2.87Å; T130-L301 VanDerWaalsContact CG2-O 3.31Å; T130-L301 WeakPolarHBondContact CG2-O 3.5Å; T130-R309 WeakPolarHBondContact O-CD 3.44Å; T130-R309 WeakPolarHBondContact O-CG 3.33Å
131	G	96.3	Very high	97.5	Very high	9 Å²	9	25.8 Å²	25.8	9%	0.093	12%	0.116	C	C	.	.	S	Bend	trans	105	6.6	172.2	0	0	0	0	0	116.3	R129 T133 Q134 L135	R129-G131 VanDerWaalsContact C-N 3.32Å; R129-G131 PolarHBondContact O-N 2.86Å; G131-T133 PolarHBondContact O-N 3.31Å; G131-Q134 WeakPolarHBondContact O-CA 3.41Å; G131-Q134 WeakPolarHBondContact O-CB 3.39Å; G131-Q134 PolarHBondContact O-N 3.43Å; G131-L135 PolarHBondContact O-N 3.26Å
132	K	98.3	Very high	97.5	Very high	25 Å²	25	25.8 Å²	25.8	11%	0.109	12%	0.116	C	C	.	.	H	α-helix	trans	-46	-61.6	179.9	-63.1	-177.2	-63	-74.6	0	113.2	M124 G126 E127 Q134 L135 C136 T265 N266 L301	M124-K132 WeakPolarHBondContact O-CD 3.48Å; G126-K132 PolarHBondContact O-NZ 2.89Å; E127-K132 PolarHBondContact O-NZ 3.42Å; K132-Q134 VanDerWaalsContact C-N 3.27Å; K132-Q134 PolarHBondContact O-N 3.23Å; K132-L135 PolarHBondContact O-N 2.89Å; K132-L135 VanDerWaalsContact O-N 3.15Å; K132-C136 PolarHBondContact O-N 2.96Å; K132-C136 PolarHBondContact O-SG 2.85Å; K132-C136 VanDerWaalsContact O-SG 3.39Å; K132-T265 HydrophobicContact CB-CG2 4.11Å; K132-N266 VanDerWaalsContact CD-O 3.31Å; K132-N266 WeakPolarHBondContact CD-O 3.45Å; K132-N266 VanDerWaalsContact CE-O 3.32Å; K132-N266 WeakPolarHBondContact CE-O 3.42Å; K132-L301 HydrophobicContact CG-CD1 3.88Å
133	T	98.4	Very high	97.5	Very high	30 Å²	30	25.6 Å²	25.6	18%	0.184	11%	0.114	C	C	.	.	H	α-helix	trans	-61.8	-30.6	177.5	-52.1	0	0	0	0	113.5	G131 C136 H137 T164 D221	G131-T133 PolarHBondContact O-N 3.31Å; T133-C136 PolarHBondContact O-N 3.04Å; T133-H137 VanDerWaalsContact O-CG 3.28Å; T133-H137 PolarHBondContact O-N 3.42Å; T133-H137 PolarHBondContact O-ND1 3.33Å; T133-T164 WeakPolarHBondContact CG2-OG1 3.49Å; T133-D221 WeakPolarHBondContact CB-OD2 3.49Å; T133-D221 VanDerWaalsContact CG2-OD2 3.31Å; T133-D221 WeakPolarHBondContact CG2-OD2 3.27Å; T133-D221 PolarHBondContact OG1-OD2 2.8Å
134	Q	98.4	Very high	97.5	Very high	46 Å²	46	27 Å²	27	22%	0.215	12%	0.121	C	C	.	.	H	α-helix	trans	-69.7	-37.1	177	-66.7	-66	-52.6	0	0	111.7	G131 K132 T138 I328 V333	G131-Q134 WeakPolarHBondContact O-CA 3.41Å; G131-Q134 WeakPolarHBondContact O-CB 3.39Å; G131-Q134 PolarHBondContact O-N 3.43Å; K132-Q134 VanDerWaalsContact C-N 3.27Å; K132-Q134 PolarHBondContact O-N 3.23Å; Q134-T138 PolarHBondContact O-N 3.24Å; Q134-T138 VanDerWaalsContact O-N 3.1Å; Q134-T138 PolarHBondContact O-OG1 3.23Å; Q134-I328 HydrophobicContact CB-CD1 4.43Å; Q134-I328 HydrophobicContact CB-CG2 4.2Å; Q134-I328 HydrophobicContact CG-CD1 4.31Å; Q134-I328 HydrophobicContact CG-CG2 3.9Å; Q134-V333 HydrophobicContact CB-CG2 4.37Å
135	L	98.6	Very high	97.5	Very high	3 Å²	3	27.1 Å²	27.1	2%	0.016	12%	0.121	C	C	.	.	H	α-helix	trans	-68.2	-42.2	172.9	-174.1	50.1	0	0	0	110.7	L108 M124 G131 K132 H137 T138 L139 V333	L108-L135 HydrophobicContact CD1-CD2 4.49Å; M124-L135 HydrophobicContact CE-CG 4.45Å; M124-L135 HydrophobicContact SD-CB 4.31Å; M124-L135 HydrophobicContact SD-CD2 3.37Å; M124-L135 WeakPolarHBondContact SD-CD2 3.41Å; M124-L135 HydrophobicContact SD-CG 3.85Å; G131-L135 PolarHBondContact O-N 3.26Å; K132-L135 PolarHBondContact O-N 2.89Å; K132-L135 VanDerWaalsContact O-N 3.15Å; L135-H137 PolarHBondContact O-N 3.35Å; L135-T138 PolarHBondContact O-N 3.09Å; L135-T138 VanDerWaalsContact O-N 3.14Å; L135-L139 HydrophobicContact CD1-CD1 4.36Å; L135-L139 HydrophobicContact CD1-CG 4.3Å; L135-L139 HydrophobicContact CG-CD1 4.14Å; L135-L139 WeakPolarHBondContact O-CG 3.31Å; L135-L139 PolarHBondContact O-N 3.3Å; L135-V333 HydrophobicContact CB-CG2 4.19Å; L135-V333 HydrophobicContact CD1-CB 4.25Å; L135-V333 HydrophobicContact CD1-CG1 4.11Å; L135-V333 HydrophobicContact CD1-CG2 4.2Å
136	C	98.8	Very high	97.5	Very high	0 Å²	0	29 Å²	29	0%	0	13%	0.134	C	C	.	.	H	α-helix	trans	-56.7	-45.8	172.1	-65.6	0	0	0	0	113.1	M124 K132 T133 T138 L139 A140 Y158 I219 T265	M124-C136 WeakPolarHBondContact CE-SG 3.24Å; K132-C136 PolarHBondContact O-N 2.96Å; K132-C136 PolarHBondContact O-SG 2.85Å; K132-C136 VanDerWaalsContact O-SG 3.39Å; T133-C136 PolarHBondContact O-N 3.04Å; C136-T138 VanDerWaalsContact C-N 3.3Å; C136-T138 PolarHBondContact O-N 3.11Å; C136-L139 PolarHBondContact O-N 2.84Å; C136-A140 PolarHBondContact O-N 2.97Å; C136-Y158 HydrophobicContact CB-CE2 3.84Å; C136-Y158 WeakPolarHBondContact CB-OH 3.37Å; C136-I219 HydrophobicContact CB-CD1 4.12Å; C136-I219 HydrophobicContact CB-CG2 3.96Å; C136-I219 VanDerWaalsContact O-CD1 3.27Å; C136-I219 WeakPolarHBondContact O-CD1 3.45Å; C136-T265 WeakPolarHBondContact SG-CG2 3.41Å
137	H	98.9	Very high	97.4	Very high	3 Å²	3	32.7 Å²	32.7	1%	0.014	15%	0.153	C	C	.	.	H	α-helix	trans	-61.9	-37.5	175.8	-70.7	158.4	0	0	0	112.8	T133 L135 F165 R166 R169 L170	T133-H137 VanDerWaalsContact O-CG 3.28Å; T133-H137 PolarHBondContact O-N 3.42Å; T133-H137 PolarHBondContact O-ND1 3.33Å; L135-H137 PolarHBondContact O-N 3.35Å; H137-F165 AromaticContact CD2-CD2 3.91Å; H137-F165 AromaticContact NE2-CD2 3.75Å; H137-R166 PolarHBondContact NE2-N 3.42Å; H137-R169 HydrophobicContact CB-CB 4.34Å; H137-L170 HydrophobicContact CB-CD1 3.92Å
138	T	98.8	Very high	97.4	Very high	0 Å²	0	36 Å²	36	0%	0	17%	0.173	C	C	.	.	H	α-helix	trans	-67.7	-46.2	177.6	-53	0	0	0	0	110.2	Q134 L135 C136 A140 V141 T142 V173 V333	Q134-T138 PolarHBondContact O-N 3.24Å; Q134-T138 VanDerWaalsContact O-N 3.1Å; Q134-T138 PolarHBondContact O-OG1 3.23Å; L135-T138 PolarHBondContact O-N 3.09Å; L135-T138 VanDerWaalsContact O-N 3.14Å; C136-T138 VanDerWaalsContact C-N 3.3Å; C136-T138 PolarHBondContact O-N 3.11Å; T138-A140 VanDerWaalsContact C-N 3.33Å; T138-A140 PolarHBondContact O-N 3.26Å; T138-V141 PolarHBondContact O-N 2.99Å; T138-V141 VanDerWaalsContact O-N 3.08Å; T138-T142 HydrophobicContact CG2-CG2 4.14Å; T138-T142 PolarHBondContact O-N 3.29Å; T138-T142 PolarHBondContact O-OG1 3.37Å; T138-V173 HydrophobicContact CG2-CG1 4.2Å; T138-V333 HydrophobicContact CG2-CB 4.26Å; T138-V333 PolarHBondContact OG1-N 2.73Å
139	L	98.9	Very high	97.6	Very high	0 Å²	0	33.2 Å²	33.2	0%	0	16%	0.162	C	C	.	.	H	α-helix	trans	-61.8	-36.4	178.6	-71.7	168.2	0	0	0	113.2	I101 I116 L135 C136 V141 T142 C143 L217 V263	I101-L139 HydrophobicContact CG2-CD2 4.1Å; I116-L139 HydrophobicContact CG1-CD1 4.15Å; I116-L139 HydrophobicContact CG1-CD2 3.92Å; L135-L139 HydrophobicContact CD1-CD1 4.36Å; L135-L139 HydrophobicContact CD1-CG 4.3Å; L135-L139 HydrophobicContact CG-CD1 4.14Å; L135-L139 WeakPolarHBondContact O-CG 3.31Å; L135-L139 PolarHBondContact O-N 3.3Å; C136-L139 PolarHBondContact O-N 2.84Å; L139-V141 PolarHBondContact O-N 2.87Å; L139-V141 VanDerWaalsContact O-N 3.14Å; L139-T142 WeakPolarHBondContact CA-OG1 3.38Å; L139-T142 PolarHBondContact O-N 3.09Å; L139-C143 WeakPolarHBondContact O-CB 3.45Å; L139-C143 PolarHBondContact O-N 3.03Å; L139-L217 HydrophobicContact CB-CD2 3.72Å; L139-L217 WeakPolarHBondContact O-CD2 3.29Å; L139-V263 HydrophobicContact CD1-CG1 4.42Å; L139-V263 HydrophobicContact CD1-CG2 4.28Å
140	A	98.8	Very high	97.7	Very high	0 Å²	0	26.1 Å²	26.1	0%	0	14%	0.143	C	C	.	.	H	α-helix	trans	-62.3	-18	176.1	0	0	0	0	0	113.7	C136 T138 Q144 A156 V188 I219	C136-A140 PolarHBondContact O-N 2.97Å; T138-A140 VanDerWaalsContact C-N 3.33Å; T138-A140 PolarHBondContact O-N 3.26Å; A140-Q144 PolarHBondContact O-NE2 3.49Å; A140-A156 HydrophobicContact CB-CB 4.24Å; A140-V188 HydrophobicContact CB-CG2 4.46Å; A140-I219 HydrophobicContact CB-CD1 4.08Å
141	V	98.8	Very high	97.7	Very high	0 Å²	0	26 Å²	26	0%	0	14%	0.142	C	C	.	.	H	α-helix	trans	-100.1	-46.6	173.7	-177.1	0	0	0	0	111	T138 L139 C143 Q144 L170 V173 A174 L179 V184	T138-V141 PolarHBondContact O-N 2.99Å; T138-V141 VanDerWaalsContact O-N 3.08Å; L139-V141 PolarHBondContact O-N 2.87Å; L139-V141 VanDerWaalsContact O-N 3.14Å; V141-C143 VanDerWaalsContact C-N 3.26Å; V141-C143 PolarHBondContact O-N 2.97Å; V141-Q144 WeakPolarHBondContact O-CB 3.41Å; V141-Q144 PolarHBondContact O-N 3.36Å; V141-L170 HydrophobicContact CG2-CB 3.94Å; V141-L170 HydrophobicContact CG2-CG 3.87Å; V141-V173 HydrophobicContact CB-CB 4.21Å; V141-V173 HydrophobicContact CB-CG1 3.7Å; V141-V173 HydrophobicContact CG1-CB 4.37Å; V141-V173 HydrophobicContact CG1-CG1 3.85Å; V141-V173 HydrophobicContact CG2-CB 4Å; V141-V173 HydrophobicContact CG2-CG1 4.05Å; V141-A174 HydrophobicContact CG1-CB 4.47Å; V141-L179 HydrophobicContact CG1-CD1 3.81Å; V141-V184 HydrophobicContact CB-CG1 4.42Å; V141-V184 HydrophobicContact CG1-CG1 4.09Å; V141-V184 HydrophobicContact CG2-CG1 3.82Å
142	T	98.7	Very high	97.7	Very high	0 Å²	0	25.7 Å²	25.7	0%	0	14%	0.139	C	C	.	.	H	α-helix	trans	-64.8	-28.6	-176.9	58.8	0	0	0	0	112.9	S102 T138 L139 Q144 L145 G151 Y177	S102-T142 WeakPolarHBondContact O-CB 3.41Å; S102-T142 PolarHBondContact O-OG1 3.37Å; T138-T142 HydrophobicContact CG2-CG2 4.14Å; T138-T142 PolarHBondContact O-N 3.29Å; T138-T142 PolarHBondContact O-OG1 3.37Å; L139-T142 WeakPolarHBondContact CA-OG1 3.38Å; L139-T142 PolarHBondContact O-N 3.09Å; T142-Q144 PolarHBondContact O-N 3.27Å; T142-L145 HydrophobicContact CG2-CD1 4.37Å; T142-L145 WeakPolarHBondContact O-CB 3.47Å; T142-L145 PolarHBondContact O-N 3.23Å; T142-L145 VanDerWaalsContact O-N 3.15Å; T142-G151 WeakPolarHBondContact O-CA 3.4Å; T142-Y177 HydrophobicContact CG2-CE2 3.76Å
143	C	98.6	Very high	97.5	Very high	0 Å²	0	29 Å²	29	0%	0	16%	0.155	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.3	-20.6	174.7	77.1	0	0	0	0	113.7	I101 L139 V141 G152 E153 G154 A216 L217	I101-C143 HydrophobicContact CD1-CB 3.84Å; I101-C143 HydrophobicContact CG1-CB 4.48Å; I101-C143 HydrophobicContact CG2-CB 3.97Å; L139-C143 WeakPolarHBondContact O-CB 3.45Å; L139-C143 PolarHBondContact O-N 3.03Å; V141-C143 VanDerWaalsContact C-N 3.26Å; V141-C143 PolarHBondContact O-N 2.97Å; C143-G152 CarbonylContact O-C 3.5Å; C143-G152 WeakPolarHBondContact O-CA 3.45Å; C143-G152 PolarHBondContact O-N 3Å; C143-E153 PolarHBondContact O-N 3.33Å; C143-G154 PolarHBondContact O-N 2.98Å; C143-A216 HydrophobicContact CB-CB 4.13Å; C143-L217 HydrophobicContact CB-CB 3.87Å; C143-L217 HydrophobicContact CB-CD2 4.16Å
144	Q	98.4	Very high	97.4	Very high	29 Å²	29	28 Å²	28	14%	0.136	15%	0.151	C	C	.	.	T	Hydrogen-bonded Turn	trans	-85.2	-12.3	-179.9	-50.1	-172.5	31	0	0	112.6	A140 V141 T142 V184 N187	A140-Q144 PolarHBondContact O-NE2 3.49Å; V141-Q144 WeakPolarHBondContact O-CB 3.41Å; V141-Q144 PolarHBondContact O-N 3.36Å; T142-Q144 PolarHBondContact O-N 3.27Å; Q144-V184 PolarHBondContact NE2-O 2.98Å; Q144-N187 PolarHBondContact OE1-ND2 3.38Å
145	L	98.3	Very high	97.4	Very high	2 Å²	2	29 Å²	29	1%	0.01	15%	0.154	C	C	.	.	S	Bend	trans	-65.9	157.1	178.7	-63.6	171.5	0	0	0	111.1	T142 Q149 G151 G152 E153 Y177 L179	T142-L145 HydrophobicContact CG2-CD1 4.37Å; T142-L145 WeakPolarHBondContact O-CB 3.47Å; T142-L145 PolarHBondContact O-N 3.23Å; T142-L145 VanDerWaalsContact O-N 3.15Å; L145-Q149 HydrophobicContact CB-CB 4.36Å; L145-G151 CarbonylContact O-C 3.58Å; L145-G151 VanDerWaalsContact O-CA 3.27Å; L145-G151 WeakPolarHBondContact O-CA 3.39Å; L145-G152 PolarHBondContact O-N 3.35Å; L145-E153 PolarHBondContact O-N 3.26Å; L145-Y177 HydrophobicContact CD1-CD1 3.71Å; L145-Y177 HydrophobicContact CD1-CE1 3.84Å; L145-Y177 HydrophobicContact CD1-CG 4.13Å; L145-Y177 HydrophobicContact CD2-CD1 4.31Å; L145-Y177 HydrophobicContact CD2-CG 4.25Å; L145-L179 HydrophobicContact CD2-CD1 3.82Å; L145-L179 HydrophobicContact CD2-CD2 3.99Å; L145-L179 HydrophobicContact CD2-CG 4.18Å
146	P	97.5	Very high	97.4	Very high	45 Å²	45	28.9 Å²	28.9	29%	0.292	15%	0.153	S	C	.	.			trans	-51	149.3	165.5	-30.9	39.8	0	0	0	113.3	D148 Q149 G150 G151 E153	P146-D148 VanDerWaalsContact C-N 3.27Å; P146-D148 WeakPolarHBondContact CB-OD1 3.31Å; P146-D148 PolarHBondContact O-N 3.43Å; P146-Q149 HydrophobicContact CB-CB 4.45Å; P146-Q149 HydrophobicContact CB-CG 4.34Å; P146-Q149 CarbonylContact O-C 3.6Å; P146-Q149 WeakPolarHBondContact O-CA 3.31Å; P146-Q149 PolarHBondContact O-N 3.25Å; P146-G150 PolarHBondContact O-N 3.32Å; P146-G151 PolarHBondContact O-N 3.11Å; P146-E153 WeakPolarHBondContact CA-OE1 3.45Å
147	I	95	Very high	97.4	Very high	79 Å²	79	29.4 Å²	29.4	41%	0.405	16%	0.156	S	C	.	.	G	3₁₀ helix	trans	-61.9	-37.6	-179.1	-66.6	170.5	0	0	0	110.9	I99 Q149 G150 E153	I99-I147 HydrophobicContact CD1-CD1 3.87Å; I99-I147 HydrophobicContact CD1-CG1 4.36Å; I147-Q149 PolarHBondContact O-N 3.32Å; I147-G150 PolarHBondContact O-N 3.22Å; I147-E153 HydrophobicContact CG1-CB 4.48Å; I147-E153 HydrophobicContact CG1-CG 4.03Å; I147-E153 PolarHBondContact N-OE1 3.25Å
148	D	94.6	Very high	97.4	Very high	138 Å²	138	29.3 Å²	29.3	74%	0.738	16%	0.155	S	C	*	.	G	3₁₀ helix	trans	-67.3	-12.7	176.9	70.1	-26.6	0	0	0	113.7	P146	P146-D148 VanDerWaalsContact C-N 3.27Å; P146-D148 WeakPolarHBondContact CB-OD1 3.31Å; P146-D148 PolarHBondContact O-N 3.43Å
149	Q	95.4	Very high	97.4	Very high	113 Å²	113	29.4 Å²	29.4	53%	0.528	16%	0.156	S	C	.	.	G	3₁₀ helix	trans	-104.7	12.4	173	-61.9	-177.6	29.2	0	0	112.9	L145 P146 I147	L145-Q149 HydrophobicContact CB-CB 4.36Å; P146-Q149 HydrophobicContact CB-CB 4.45Å; P146-Q149 HydrophobicContact CB-CG 4.34Å; P146-Q149 CarbonylContact O-C 3.6Å; P146-Q149 WeakPolarHBondContact O-CA 3.31Å; P146-Q149 PolarHBondContact O-N 3.25Å; I147-Q149 PolarHBondContact O-N 3.32Å
150	G	95.1	Very high	97.4	Very high	24 Å²	24	29.4 Å²	29.4	25%	0.247	16%	0.156	C	C	.	.	T	Hydrogen-bonded Turn	trans	77.8	20.6	179.3	0	0	0	0	0	114	S102 P146 I147	S102-G150 WeakPolarHBondContact CB-O 3.43Å; S102-G150 PolarHBondContact N-O 3.44Å; P146-G150 PolarHBondContact O-N 3.32Å; I147-G150 PolarHBondContact O-N 3.22Å
151	G	97.3	Very high	97.3	Very high	0 Å²	0	29.9 Å²	29.9	0%	0	16%	0.159	C	C	.	.			trans	-95.4	-172.8	169.4	0	0	0	0	0	113.3	T142 L145 P146	T142-G151 WeakPolarHBondContact O-CA 3.4Å; L145-G151 CarbonylContact O-C 3.58Å; L145-G151 VanDerWaalsContact O-CA 3.27Å; L145-G151 WeakPolarHBondContact O-CA 3.39Å; P146-G151 PolarHBondContact O-N 3.11Å
152	G	95.6	Very high	97.1	Very high	2 Å²	2	33.6 Å²	33.6	2%	0.021	18%	0.176	C	C	.	.			trans	-117.9	4	178.4	0	0	0	0	0	114.3	C143 L145 G154 R214	C143-G152 CarbonylContact O-C 3.5Å; C143-G152 WeakPolarHBondContact O-CA 3.45Å; C143-G152 PolarHBondContact O-N 3Å; L145-G152 PolarHBondContact O-N 3.35Å; G152-G154 PolarHBondContact O-N 3.38Å; G152-R214 PolarHBondContact O-NH2 2.78Å
153	E	95.2	Very high	97	Very high	96 Å²	96	34.2 Å²	34.2	45%	0.449	18%	0.183	S	C	.	.	S	Bend	trans	48.4	43.4	-178	-70.5	175.8	-172	0	0	113.4	C143 L145 P146 I147 R214	C143-E153 PolarHBondContact O-N 3.33Å; L145-E153 PolarHBondContact O-N 3.26Å; P146-E153 WeakPolarHBondContact CA-OE1 3.45Å; I147-E153 HydrophobicContact CG1-CB 4.48Å; I147-E153 HydrophobicContact CG1-CG 4.03Å; I147-E153 PolarHBondContact N-OE1 3.25Å; E153-R214 VanDerWaalsContact CB-NH1 3.35Å; E153-R214 PolarHBondContact O-NH1 3.18Å; E153-R214 IonicContact OE2-NH1 2.69Å
154	G	95.3	Very high	96.9	Very high	9 Å²	9	36.3 Å²	36.3	9%	0.093	20%	0.195	C	C	.	.	S	Bend	trans	-148	161.9	-177.4	0	0	0	0	0	113.2	C143 G152	C143-G154 PolarHBondContact O-N 2.98Å; G152-G154 PolarHBondContact O-N 3.38Å
155	K	98.5	Very high	96.8	Very high	66 Å²	66	36 Å²	36	29%	0.287	19%	0.194	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-66.5	161.1	175.8	-64.3	-178.7	-177.8	175.4	0	111.3	N187 R214 Y215 A216	K155-N187 WeakPolarHBondContact CA-O 3.27Å; K155-N187 WeakPolarHBondContact CB-O 3.31Å; K155-N187 HydrophobicContact CG-CB 4.2Å; K155-R214 PolarHBondContact N-O 3.42Å; K155-R214 VanDerWaalsContact N-O 3.13Å; K155-Y215 HydrophobicContact CB-CD1 3.58Å; K155-Y215 HydrophobicContact CB-CE1 3.55Å; K155-Y215 HydrophobicContact CB-CG 4.09Å; K155-Y215 HydrophobicContact CD-CE1 4.48Å; K155-Y215 CarbonylContact O-C 3.57Å; K155-Y215 WeakPolarHBondContact O-CA 3.36Å; K155-Y215 WeakPolarHBondContact O-CD1 3.37Å; K155-A216 PolarHBondContact O-N 3.37Å
156	A	98.8	Very high	96.8	Very high	0 Å²	0	42 Å²	42	0%	0	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	147.4	171.6	0	0	0	0	0	111.3	A140 N187 V188 A189 Y215 L217	A140-A156 HydrophobicContact CB-CB 4.24Å; A156-N187 PolarHBondContact N-O 3.11Å; A156-V188 HydrophobicContact CB-CG1 4.35Å; A156-V188 HydrophobicContact CB-CG2 4.13Å; A156-V188 WeakPolarHBondContact O-CA 3.23Å; A156-A189 PolarHBondContact O-N 3.18Å; A156-Y215 WeakPolarHBondContact O-CE1 3.37Å; A156-L217 WeakPolarHBondContact CA-O 3.41Å
157	M	98.8	Very high	96.9	Very high	11 Å²	11	42.1 Å²	42.1	5%	0.054	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	132.7	168.5	-171.4	171.6	-62	0	0	109.9	A189 A206 M209 M210 Y215 L217 L218 I219	M157-A189 CarbonylContact C-O 3.57Å; M157-A189 WeakPolarHBondContact CA-O 3.45Å; M157-A189 HydrophobicContact CG-CB 4.45Å; M157-A206 HydrophobicContact CE-CB 3.95Å; M157-A206 HydrophobicContact SD-CB 3.27Å; M157-A206 WeakPolarHBondContact SD-CB 3.32Å; M157-M209 HydrophobicContact CE-CB 3.98Å; M157-M209 HydrophobicContact CE-CE 4.37Å; M157-M209 HydrophobicContact CE-SD 3.83Å; M157-M210 HydrophobicContact CE-CE 4.37Å; M157-M210 HydrophobicContact SD-CE 4.4Å; M157-Y215 HydrophobicContact CB-CD1 4.06Å; M157-Y215 HydrophobicContact CB-CE1 4.14Å; M157-Y215 HydrophobicContact CE-CD1 4.41Å; M157-Y215 HydrophobicContact CE-CE1 4.03Å; M157-Y215 HydrophobicContact CE-CE2 4.46Å; M157-L217 PolarHBondContact N-O 3.48Å; M157-L218 HydrophobicContact CB-CD1 3.82Å; M157-L218 HydrophobicContact CG-CD1 3.81Å; M157-L218 HydrophobicContact SD-CD1 3.98Å; M157-I219 PolarHBondContact O-N 3.49Å
158	Y	98.9	Very high	97	Very high	1 Å²	1	44.2 Å²	44.2	0%	0.004	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	109.4	-176.1	-154.7	-66.9	0	0	0	110.6	C136 D160 F165 A189 Y190 A191 I219 D221	C136-Y158 HydrophobicContact CB-CE2 3.84Å; C136-Y158 WeakPolarHBondContact CB-OH 3.37Å; Y158-D160 HydrophobicContact CD1-CB 4.08Å; Y158-D160 HydrophobicContact CE1-CB 4.07Å; Y158-F165 HydrophobicContact CD1-CD2 4.01Å; Y158-F165 AromaticContact CD2-CD2 3.91Å; Y158-F165 HydrophobicContact CD2-CD2 3.91Å; Y158-F165 AromaticContact CD2-CE2 3.93Å; Y158-F165 HydrophobicContact CD2-CE2 3.93Å; Y158-F165 HydrophobicContact CE1-CB 4.48Å; Y158-F165 HydrophobicContact CE1-CD2 4.12Å; Y158-F165 HydrophobicContact CE2-CD2 4Å; Y158-F165 HydrophobicContact CE2-CE2 4.33Å; Y158-F165 AromaticContact CG-CD2 3.92Å; Y158-F165 HydrophobicContact CG-CD2 3.92Å; Y158-F165 HydrophobicContact CG-CE2 4.11Å; Y158-A189 PolarHBondContact N-O 3.47Å; Y158-Y190 HydrophobicContact CD1-CD2 4.39Å; Y158-Y190 WeakPolarHBondContact O-CA 3.33Å; Y158-A191 PolarHBondContact O-N 3.02Å; Y158-I219 HydrophobicContact CD1-CG2 4.49Å; Y158-I219 HydrophobicContact CD2-CB 3.96Å; Y158-I219 HydrophobicContact CD2-CD1 3.62Å; Y158-I219 HydrophobicContact CD2-CG1 4.41Å; Y158-I219 HydrophobicContact CD2-CG2 3.99Å; Y158-I219 HydrophobicContact CE1-CG2 4.23Å; Y158-I219 HydrophobicContact CE2-CB 4.17Å; Y158-I219 HydrophobicContact CE2-CD1 3.72Å; Y158-I219 HydrophobicContact CE2-CG2 3.71Å; Y158-I219 HydrophobicContact CG-CB 4.29Å; Y158-I219 HydrophobicContact CG-CG2 4.37Å; Y158-D221 HydrophobicContact CE1-CB 3.71Å; Y158-D221 WeakPolarHBondContact OH-CB 3.44Å; Y158-D221 PolarHBondContact OH-OD2 2.91Å
159	I	98.8	Very high	97.2	Very high	2 Å²	2	40.3 Å²	40.3	1%	0.01	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.2	108.4	172.8	-60	175.7	0	0	0	108.3	A191 A193 L202 L203 L218 I219 V220 D221	I159-A191 WeakPolarHBondContact CA-O 3.41Å; I159-A193 HydrophobicContact CG2-CB 4.38Å; I159-L202 HydrophobicContact CD1-CB 4.08Å; I159-L202 HydrophobicContact CG2-CD1 3.96Å; I159-L203 HydrophobicContact CD1-CD2 3.7Å; I159-L218 HydrophobicContact CD1-CD1 4.12Å; I159-L218 HydrophobicContact CG1-CD1 4.38Å; I159-I219 PolarHBondContact N-O 3.26Å; I159-V220 HydrophobicContact CB-CG2 4.43Å; I159-V220 HydrophobicContact CG2-CG1 4.43Å; I159-V220 CarbonylContact O-C 3.54Å; I159-V220 WeakPolarHBondContact O-CA 3.27Å; I159-D221 PolarHBondContact O-N 3.33Å
160	D	98.6	Very high	97.3	Very high	0 Å²	0	34.9 Å²	34.9	0%	0	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.2	131.1	-178.5	-177.3	8	0	0	0	110.7	Y158 E162 G163 T164 F165 Y190 A191 R192 A193 D221	Y158-D160 HydrophobicContact CD1-CB 4.08Å; Y158-D160 HydrophobicContact CE1-CB 4.07Å; D160-E162 PolarHBondContact OD1-N 2.8Å; D160-G163 VanDerWaalsContact CG-N 3.3Å; D160-G163 PolarHBondContact OD1-N 3.05Å; D160-G163 VanDerWaalsContact OD2-C 3.24Å; D160-G163 WeakPolarHBondContact OD2-CA 3.4Å; D160-G163 PolarHBondContact OD2-N 3.16Å; D160-T164 PolarHBondContact OD1-N 3.37Å; D160-T164 PolarHBondContact OD2-N 2.95Å; D160-F165 PolarHBondContact OD2-N 3.39Å; D160-Y190 HydrophobicContact CB-CD2 4.44Å; D160-Y190 HydrophobicContact CB-CE2 3.44Å; D160-Y190 VanDerWaalsContact CB-CE2 3.44Å; D160-Y190 PolarHBondContact OD2-OH 3.48Å; D160-Y190 VanDerWaalsContact OD2-OH 3.05Å; D160-A191 PolarHBondContact N-O 3.08Å; D160-R192 CarbonylContact O-C 3.56Å; D160-R192 VanDerWaalsContact O-CA 3.27Å; D160-R192 WeakPolarHBondContact O-CA 3.36Å; D160-R192 WeakPolarHBondContact O-CG 3.3Å; D160-A193 PolarHBondContact O-N 3.42Å; D160-D221 CarbonylContact C-O 3.45Å; D160-D221 WeakPolarHBondContact CA-O 3.42Å
161	T	97.9	Very high	97.5	Very high	11 Å²	11	36.8 Å²	36.8	7%	0.067	18%	0.179	C	C	.	.	S	Bend	trans	-110	-16.3	176.4	64.4	0	0	0	0	112.6	A193 D221 S222 L226	T161-A193 HydrophobicContact CG2-CB 4.24Å; T161-D221 PolarHBondContact N-O 3.21Å; T161-D221 PolarHBondContact OG1-O 3.41Å; T161-S222 VanDerWaalsContact CG2-O 3.27Å; T161-S222 WeakPolarHBondContact CG2-O 3.48Å; T161-S222 PolarHBondContact OG1-N 2.96Å; T161-S222 PolarHBondContact OG1-O 3.37Å; T161-L226 HydrophobicContact CG2-CD1 3.65Å; T161-L226 HydrophobicContact CG2-CG 4.07Å
162	E	94.1	Very high	97.5	Very high	78 Å²	78	38 Å²	38	36%	0.364	19%	0.188	S	C	.	.	S	Bend	trans	-107.4	-12.9	-173.5	-61	-170.8	-150.3	0	0	112.5	D160 T164 S222 A225 Q267	D160-E162 PolarHBondContact OD1-N 2.8Å; E162-T164 HydrophobicContact CB-CG2 3.86Å; E162-S222 VanDerWaalsContact OE1-CB 3.29Å; E162-S222 WeakPolarHBondContact OE1-CB 3.4Å; E162-S222 PolarHBondContact OE1-OG 2.85Å; E162-A225 HydrophobicContact CG-CB 3.88Å; E162-Q267 PolarHBondContact OE1-NE2 3.11Å
163	G	95.9	Very high	97.7	Very high	13 Å²	13	37.9 Å²	37.9	13%	0.134	19%	0.188	C	C	.	.	S	Bend	trans	76	31.4	-177.7	0	0	0	0	0	112.7	D160 R166	D160-G163 VanDerWaalsContact CG-N 3.3Å; D160-G163 PolarHBondContact OD1-N 3.05Å; D160-G163 VanDerWaalsContact OD2-C 3.24Å; D160-G163 WeakPolarHBondContact OD2-CA 3.4Å; D160-G163 PolarHBondContact OD2-N 3.16Å; G163-R166 PolarHBondContact O-NH1 2.72Å; G163-R166 PolarHBondContact O-NH2 3.46Å
164	T	96	Very high	97.8	Very high	43 Å²	43	33.3 Å²	33.3	26%	0.264	17%	0.166	S	C	.	.			trans	-100.2	-4.3	-173.1	62.6	0	0	0	0	113.8	T133 D160 E162 R166	T133-T164 WeakPolarHBondContact CG2-OG1 3.49Å; D160-T164 PolarHBondContact OD1-N 3.37Å; D160-T164 PolarHBondContact OD2-N 2.95Å; E162-T164 HydrophobicContact CB-CG2 3.86Å; T164-R166 PolarHBondContact O-N 3.02Å
165	F	98.1	Very high	98	Very high	24 Å²	24	38.8 Å²	38.8	11%	0.105	19%	0.194	C	C	.	.			trans	-62.3	127.3	174.8	-172.9	-106.8	0	0	0	111.3	H137 Y158 D160 P167 L170 V188 Y190	H137-F165 AromaticContact CD2-CD2 3.91Å; H137-F165 AromaticContact NE2-CD2 3.75Å; Y158-F165 HydrophobicContact CD1-CD2 4.01Å; Y158-F165 AromaticContact CD2-CD2 3.91Å; Y158-F165 HydrophobicContact CD2-CD2 3.91Å; Y158-F165 AromaticContact CD2-CE2 3.93Å; Y158-F165 HydrophobicContact CD2-CE2 3.93Å; Y158-F165 HydrophobicContact CE1-CB 4.48Å; Y158-F165 HydrophobicContact CE1-CD2 4.12Å; Y158-F165 HydrophobicContact CE2-CD2 4Å; Y158-F165 HydrophobicContact CE2-CE2 4.33Å; Y158-F165 AromaticContact CG-CD2 3.92Å; Y158-F165 HydrophobicContact CG-CD2 3.92Å; Y158-F165 HydrophobicContact CG-CE2 4.11Å; D160-F165 PolarHBondContact OD2-N 3.39Å; F165-P167 HydrophobicContact CD1-CG 4.21Å; F165-P167 HydrophobicContact CE1-CG 3.83Å; F165-L170 HydrophobicContact CE2-CD1 3.97Å; F165-L170 HydrophobicContact CE2-CD2 4.02Å; F165-L170 HydrophobicContact CZ-CD1 4.32Å; F165-L170 HydrophobicContact CZ-CD2 3.78Å; F165-V188 HydrophobicContact CE2-CG1 4.4Å; F165-V188 HydrophobicContact CZ-CG1 4.16Å; F165-Y190 HydrophobicContact CB-CD2 3.92Å; F165-Y190 HydrophobicContact CB-CE2 3.36Å; F165-Y190 AromaticContact CD1-CD2 3.53Å; F165-Y190 HydrophobicContact CD1-CD2 3.53Å; F165-Y190 AromaticContact CD1-CE2 3.75Å; F165-Y190 HydrophobicContact CD1-CE2 3.75Å; F165-Y190 HydrophobicContact CD1-CG 4.06Å; F165-Y190 HydrophobicContact CD2-CD2 4.22Å; F165-Y190 HydrophobicContact CD2-CE2 4.48Å; F165-Y190 HydrophobicContact CE1-CD2 4.03Å; F165-Y190 HydrophobicContact CE1-CG 4.28Å; F165-Y190 AromaticContact CG-CD2 3.63Å; F165-Y190 HydrophobicContact CG-CD2 3.63Å; F165-Y190 AromaticContact CG-CE2 3.63Å; F165-Y190 HydrophobicContact CG-CE2 3.63Å
166	R	98.1	Very high	98	Very high	127 Å²	127	39.9 Å²	39.9	48%	0.479	20%	0.196	S	C	.	.			trans	-132.7	102	179.9	-66	-63	178.5	-83.1	-2.5	109.3	H137 G163 T164 E168 R169	H137-R166 PolarHBondContact NE2-N 3.42Å; G163-R166 PolarHBondContact O-NH1 2.72Å; G163-R166 PolarHBondContact O-NH2 3.46Å; T164-R166 PolarHBondContact O-N 3.02Å; R166-E168 PolarHBondContact O-N 2.94Å; R166-E168 VanDerWaalsContact O-N 3.13Å; R166-R169 HydrophobicContact CB-CG 4.05Å; R166-R169 WeakPolarHBondContact O-CB 3.36Å; R166-R169 PolarHBondContact O-N 3.46Å
167	P	97.9	Very high	97.9	Very high	47 Å²	47	42.7 Å²	42.7	31%	0.305	21%	0.207	S	C	.	.	H	α-helix	trans	-55.2	-30.1	-177.9	-26.5	34.3	0	0	0	114	F165 R169 L170 L171 L185	F165-P167 HydrophobicContact CD1-CG 4.21Å; F165-P167 HydrophobicContact CE1-CG 3.83Å; P167-R169 PolarHBondContact O-N 3.26Å; P167-L170 WeakPolarHBondContact O-CB 3.31Å; P167-L170 PolarHBondContact O-N 2.8Å; P167-L171 PolarHBondContact O-N 3.11Å; P167-L171 VanDerWaalsContact O-N 3.15Å; P167-L185 HydrophobicContact CB-CD2 3.96Å
168	E	98.1	Very high	97.9	Very high	124 Å²	124	45.5 Å²	45.5	58%	0.579	24%	0.238	S	C	*	.	H	α-helix	trans	-61.8	-26.6	177.9	-53.5	79	-173.3	0	0	112	R166 A172	R166-E168 PolarHBondContact O-N 2.94Å; R166-E168 VanDerWaalsContact O-N 3.13Å; E168-A172 PolarHBondContact O-N 3.14Å
169	R	98.1	Very high	97.8	Very high	55 Å²	55	47.8 Å²	47.8	21%	0.208	25%	0.25	C	S	.	.	H	α-helix	trans	-71.9	-33.8	173.3	-63.9	-60.7	-64	150.7	-3	112.1	H137 R166 P167 V173 N329 A330	H137-R169 HydrophobicContact CB-CB 4.34Å; R166-R169 HydrophobicContact CB-CG 4.05Å; R166-R169 WeakPolarHBondContact O-CB 3.36Å; R166-R169 PolarHBondContact O-N 3.46Å; P167-R169 PolarHBondContact O-N 3.26Å; R169-V173 WeakPolarHBondContact O-CG2 3.48Å; R169-V173 PolarHBondContact O-N 2.99Å; R169-N329 PolarHBondContact NH2-O 3.4Å; R169-A330 PolarHBondContact NH1-O 2.75Å
170	L	98.7	Very high	97.8	Very high	0 Å²	0	51.8 Å²	51.8	0%	0	28%	0.275	C	S	.	.	H	α-helix	trans	-68.6	-42	175.9	-82.2	58.2	0	0	0	110.2	H137 V141 F165 P167 A172 V173 A174 L185 V188	H137-L170 HydrophobicContact CB-CD1 3.92Å; V141-L170 HydrophobicContact CG2-CB 3.94Å; V141-L170 HydrophobicContact CG2-CG 3.87Å; F165-L170 HydrophobicContact CE2-CD1 3.97Å; F165-L170 HydrophobicContact CE2-CD2 4.02Å; F165-L170 HydrophobicContact CZ-CD1 4.32Å; F165-L170 HydrophobicContact CZ-CD2 3.78Å; P167-L170 WeakPolarHBondContact O-CB 3.31Å; P167-L170 PolarHBondContact O-N 2.8Å; L170-A172 VanDerWaalsContact C-N 3.33Å; L170-A172 PolarHBondContact O-N 3.39Å; L170-V173 PolarHBondContact O-N 2.84Å; L170-V173 VanDerWaalsContact O-N 3.11Å; L170-A174 WeakPolarHBondContact O-CB 3.43Å; L170-A174 PolarHBondContact O-N 3.04Å; L170-L185 HydrophobicContact CB-CD2 4.02Å; L170-L185 HydrophobicContact CD2-CD2 4.06Å; L170-V188 HydrophobicContact CD2-CB 4.3Å; L170-V188 HydrophobicContact CD2-CG1 4.37Å; L170-V188 HydrophobicContact CD2-CG2 3.83Å
171	L	98.7	Very high	97.8	Very high	64 Å²	64	52.4 Å²	52.4	34%	0.335	28%	0.281	S	S	.	.	H	α-helix	trans	-57.3	-45.3	175.6	-67.4	175.8	0	0	0	112	P167 V173 A174 D175 L185	P167-L171 PolarHBondContact O-N 3.11Å; P167-L171 VanDerWaalsContact O-N 3.15Å; L171-V173 VanDerWaalsContact C-N 3.27Å; L171-V173 PolarHBondContact O-N 3.29Å; L171-A174 WeakPolarHBondContact O-CB 3.48Å; L171-A174 PolarHBondContact O-N 3.08Å; L171-A174 VanDerWaalsContact O-N 3.15Å; L171-D175 PolarHBondContact O-N 3.03Å; L171-L185 HydrophobicContact CD1-CD1 4.37Å; L171-L185 HydrophobicContact CD2-CD1 3.78Å; L171-L185 HydrophobicContact CD2-CG 4.07Å; L171-L185 HydrophobicContact CG-CD1 4.12Å
172	A	98.4	Very high	97.8	Very high	24 Å²	24	55.2 Å²	55.2	20%	0.198	30%	0.301	C	S	.	.	H	α-helix	trans	-62.9	-32.5	177.5	0	0	0	0	0	113.4	E168 L170 A330	E168-A172 PolarHBondContact O-N 3.14Å; L170-A172 VanDerWaalsContact C-N 3.33Å; L170-A172 PolarHBondContact O-N 3.39Å; A172-A330 WeakPolarHBondContact CB-O 3.44Å
173	V	98.6	Very high	98	Very high	1 Å²	1	55.5 Å²	55.5	1%	0.006	31%	0.305	C	S	.	.	H	α-helix	trans	-76.1	-39.2	174.2	-179.1	0	0	0	0	110.5	T138 V141 R169 L170 L171 D175 R176 Y177	T138-V173 HydrophobicContact CG2-CG1 4.2Å; V141-V173 HydrophobicContact CB-CB 4.21Å; V141-V173 HydrophobicContact CB-CG1 3.7Å; V141-V173 HydrophobicContact CG1-CB 4.37Å; V141-V173 HydrophobicContact CG1-CG1 3.85Å; V141-V173 HydrophobicContact CG2-CB 4Å; V141-V173 HydrophobicContact CG2-CG1 4.05Å; R169-V173 WeakPolarHBondContact O-CG2 3.48Å; R169-V173 PolarHBondContact O-N 2.99Å; L170-V173 PolarHBondContact O-N 2.84Å; L170-V173 VanDerWaalsContact O-N 3.11Å; L171-V173 VanDerWaalsContact C-N 3.27Å; L171-V173 PolarHBondContact O-N 3.29Å; V173-D175 VanDerWaalsContact C-N 3.31Å; V173-D175 PolarHBondContact O-N 3.44Å; V173-R176 VanDerWaalsContact O-CB 3.31Å; V173-R176 WeakPolarHBondContact O-CB 3.44Å; V173-R176 PolarHBondContact O-N 3.18Å; V173-R176 VanDerWaalsContact O-N 3.16Å; V173-Y177 HydrophobicContact CG1-CD2 3.96Å; V173-Y177 HydrophobicContact CG1-CE2 3.79Å; V173-Y177 VanDerWaalsContact O-CD2 3.27Å; V173-Y177 WeakPolarHBondContact O-CD2 3.47Å; V173-Y177 PolarHBondContact O-N 2.82Å
174	A	98.5	Very high	98.1	Very high	0 Å²	0	55 Å²	55	0%	0	30%	0.3	C	S	.	.	H	α-helix	trans	-58.3	-44.3	176.2	0	0	0	0	0	111.4	V141 L170 L171 R176 Y177 G178 L179 V184	V141-A174 HydrophobicContact CG1-CB 4.47Å; L170-A174 WeakPolarHBondContact O-CB 3.43Å; L170-A174 PolarHBondContact O-N 3.04Å; L171-A174 WeakPolarHBondContact O-CB 3.48Å; L171-A174 PolarHBondContact O-N 3.08Å; L171-A174 VanDerWaalsContact O-N 3.15Å; A174-R176 VanDerWaalsContact C-N 3.27Å; A174-R176 PolarHBondContact O-N 2.91Å; A174-Y177 CarbonylContact O-C 3.53Å; A174-Y177 PolarHBondContact O-N 3.15Å; A174-Y177 VanDerWaalsContact O-N 3.08Å; A174-G178 PolarHBondContact O-N 2.79Å; A174-L179 HydrophobicContact CB-CB 4.18Å; A174-L179 PolarHBondContact O-N 3.26Å; A174-V184 HydrophobicContact CB-CB 4.26Å; A174-V184 HydrophobicContact CB-CG1 4.29Å; A174-V184 HydrophobicContact CB-CG2 3.88Å
175	D	98.3	Very high	98.2	Very high	124 Å²	124	55.5 Å²	55.5	66%	0.663	30%	0.3	S	S	*	.	H	α-helix	trans	-57.2	-40.4	176.5	-71.1	-20.6	0	0	0	111.9	L171 V173 Y177 G178	L171-D175 PolarHBondContact O-N 3.03Å; V173-D175 VanDerWaalsContact C-N 3.31Å; V173-D175 PolarHBondContact O-N 3.44Å; D175-Y177 VanDerWaalsContact C-N 3.27Å; D175-Y177 PolarHBondContact O-N 3.15Å; D175-G178 PolarHBondContact O-N 2.95Å
176	R	98.1	Very high	98.2	Very high	88 Å²	88	60.7 Å²	60.7	33%	0.332	33%	0.329	S	S	.	.	H	α-helix	trans	-60.1	-37.3	177.2	179.6	-178.1	165.8	-175	-6.9	112.8	G104 V173 A174 D331 V333	G104-R176 PolarHBondContact O-NH2 3.13Å; V173-R176 VanDerWaalsContact O-CB 3.31Å; V173-R176 WeakPolarHBondContact O-CB 3.44Å; V173-R176 PolarHBondContact O-N 3.18Å; V173-R176 VanDerWaalsContact O-N 3.16Å; A174-R176 VanDerWaalsContact C-N 3.27Å; A174-R176 PolarHBondContact O-N 2.91Å; R176-D331 HydrophobicContact CB-CB 4.14Å; R176-D331 WeakPolarHBondContact CD-OD2 3.17Å; R176-V333 PolarHBondContact NH1-O 2.96Å
177	Y	97.8	Very high	98.3	Very high	60 Å²	60	57.4 Å²	57.4	24%	0.235	32%	0.321	C	S	.	.	T	Hydrogen-bonded Turn	trans	-95.1	3.4	-179.2	-67.4	-77.4	0	0	0	113.1	G104 T142 L145 V173 A174 D175 L179	G104-Y177 VanDerWaalsContact CA-OH 3.31Å; G104-Y177 WeakPolarHBondContact CA-OH 3.49Å; T142-Y177 HydrophobicContact CG2-CE2 3.76Å; L145-Y177 HydrophobicContact CD1-CD1 3.71Å; L145-Y177 HydrophobicContact CD1-CE1 3.84Å; L145-Y177 HydrophobicContact CD1-CG 4.13Å; L145-Y177 HydrophobicContact CD2-CD1 4.31Å; L145-Y177 HydrophobicContact CD2-CG 4.25Å; V173-Y177 HydrophobicContact CG1-CD2 3.96Å; V173-Y177 HydrophobicContact CG1-CE2 3.79Å; V173-Y177 VanDerWaalsContact O-CD2 3.27Å; V173-Y177 WeakPolarHBondContact O-CD2 3.47Å; V173-Y177 PolarHBondContact O-N 2.82Å; A174-Y177 CarbonylContact O-C 3.53Å; A174-Y177 PolarHBondContact O-N 3.15Å; A174-Y177 VanDerWaalsContact O-N 3.08Å; D175-Y177 VanDerWaalsContact C-N 3.27Å; D175-Y177 PolarHBondContact O-N 3.15Å; Y177-L179 PolarHBondContact O-N 2.79Å
178	G	97.8	Very high	98.3	Very high	69 Å²	69	56 Å²	56	71%	0.711	31%	0.312	S	S	*	.	T	Hydrogen-bonded Turn	trans	66	25.7	-178.9	0	0	0	0	0	113.9	A174 D175	A174-G178 PolarHBondContact O-N 2.79Å; D175-G178 PolarHBondContact O-N 2.95Å
179	L	97.8	Very high	98.3	Very high	49 Å²	49	51.2 Å²	51.2	26%	0.257	29%	0.293	S	S	.	.			trans	-84.3	152.7	178.1	-60.6	177.3	0	0	0	111.2	V141 L145 A174 Y177 G181 V184	V141-L179 HydrophobicContact CG1-CD1 3.81Å; L145-L179 HydrophobicContact CD2-CD1 3.82Å; L145-L179 HydrophobicContact CD2-CD2 3.99Å; L145-L179 HydrophobicContact CD2-CG 4.18Å; A174-L179 HydrophobicContact CB-CB 4.18Å; A174-L179 PolarHBondContact O-N 3.26Å; Y177-L179 PolarHBondContact O-N 2.79Å; L179-G181 PolarHBondContact O-N 2.96Å; L179-V184 HydrophobicContact CB-CG2 3.61Å; L179-V184 HydrophobicContact CD1-CG2 3.74Å; L179-V184 HydrophobicContact CG-CG2 4.33Å
180	V	98.3	Very high	98.4	Very high	86 Å²	86	53.3 Å²	53.3	52%	0.521	30%	0.302	S	S	.	.			trans	-74	114.5	173.5	-178.1	0	0	0	0	108.9	S182 D183 V184	V180-S182 VanDerWaalsContact C-N 3.33Å; V180-S182 WeakPolarHBondContact CG1-OG 3.47Å; V180-S182 PolarHBondContact O-N 3.46Å; V180-D183 HydrophobicContact CB-CB 4.25Å; V180-D183 HydrophobicContact CG1-CB 4.49Å; V180-D183 PolarHBondContact O-N 3.04Å; V180-D183 VanDerWaalsContact O-N 3.11Å; V180-V184 PolarHBondContact O-N 3.47Å
181	G	98	Very high	98.4	Very high	14 Å²	14	54.7 Å²	54.7	14%	0.144	31%	0.313	C	S	.	.	H	α-helix	trans	-58.8	-35.8	-172.8	0	0	0	0	0	115.1	L179 L185	L179-G181 PolarHBondContact O-N 2.96Å; G181-L185 WeakPolarHBondContact O-CG 3.27Å; G181-L185 PolarHBondContact O-N 3.03Å; G181-L185 VanDerWaalsContact O-N 3.12Å
182	S	98.2	Very high	98.4	Very high	69 Å²	69	56.8 Å²	56.8	48%	0.483	32%	0.317	S	S	.	.	H	α-helix	trans	-61.4	-46.1	175.1	49	0	0	0	0	111.7	V180 V184 L185 D186	V180-S182 VanDerWaalsContact C-N 3.33Å; V180-S182 WeakPolarHBondContact CG1-OG 3.47Å; V180-S182 PolarHBondContact O-N 3.46Å; S182-V184 VanDerWaalsContact C-N 3.33Å; S182-V184 PolarHBondContact O-N 2.88Å; S182-L185 PolarHBondContact O-N 3.47Å; S182-D186 PolarHBondContact O-N 3.38Å
183	D	98.4	Very high	98.4	Very high	85 Å²	85	55.7 Å²	55.7	46%	0.455	31%	0.308	S	S	.	.	H	α-helix	trans	-68.4	-38.4	-175.8	-54.5	1	0	0	0	110.1	V180 L185 D186 N187	V180-D183 HydrophobicContact CB-CB 4.25Å; V180-D183 HydrophobicContact CG1-CB 4.49Å; V180-D183 PolarHBondContact O-N 3.04Å; V180-D183 VanDerWaalsContact O-N 3.11Å; D183-L185 VanDerWaalsContact C-N 3.34Å; D183-L185 PolarHBondContact O-N 3.23Å; D183-D186 PolarHBondContact O-N 2.99Å; D183-N187 WeakPolarHBondContact O-CB 3.4Å; D183-N187 VanDerWaalsContact O-CG 3.28Å; D183-N187 PolarHBondContact O-N 3.37Å; D183-N187 VanDerWaalsContact O-N 3.1Å; D183-N187 PolarHBondContact O-ND2 3.26Å; D183-N187 VanDerWaalsContact O-ND2 3.16Å
184	V	98.6	Very high	98.3	Very high	3 Å²	3	62 Å²	62	2%	0.018	34%	0.335	C	S	.	.	H	α-helix	trans	-59.5	-45	173.4	171.1	0	0	0	0	111.3	V141 Q144 A174 L179 V180 S182 N187 V188	V141-V184 HydrophobicContact CB-CG1 4.42Å; V141-V184 HydrophobicContact CG1-CG1 4.09Å; V141-V184 HydrophobicContact CG2-CG1 3.82Å; Q144-V184 PolarHBondContact NE2-O 2.98Å; A174-V184 HydrophobicContact CB-CB 4.26Å; A174-V184 HydrophobicContact CB-CG1 4.29Å; A174-V184 HydrophobicContact CB-CG2 3.88Å; L179-V184 HydrophobicContact CB-CG2 3.61Å; L179-V184 HydrophobicContact CD1-CG2 3.74Å; L179-V184 HydrophobicContact CG-CG2 4.33Å; V180-V184 PolarHBondContact O-N 3.47Å; S182-V184 VanDerWaalsContact C-N 3.33Å; S182-V184 PolarHBondContact O-N 2.88Å; V184-N187 PolarHBondContact O-N 3.18Å; V184-V188 WeakPolarHBondContact O-CG2 3.41Å
185	L	98.6	Very high	98.3	Very high	52 Å²	52	65.1 Å²	65.1	27%	0.272	35%	0.352	S	S	.	.	H	α-helix	trans	-68.5	-41.3	179.9	-70.2	-179.7	0	0	0	112.2	P167 L170 L171 G181 S182 D183 N187 V188	P167-L185 HydrophobicContact CB-CD2 3.96Å; L170-L185 HydrophobicContact CB-CD2 4.02Å; L170-L185 HydrophobicContact CD2-CD2 4.06Å; L171-L185 HydrophobicContact CD1-CD1 4.37Å; L171-L185 HydrophobicContact CD2-CD1 3.78Å; L171-L185 HydrophobicContact CD2-CG 4.07Å; L171-L185 HydrophobicContact CG-CD1 4.12Å; G181-L185 WeakPolarHBondContact O-CG 3.27Å; G181-L185 PolarHBondContact O-N 3.03Å; G181-L185 VanDerWaalsContact O-N 3.12Å; S182-L185 PolarHBondContact O-N 3.47Å; D183-L185 VanDerWaalsContact C-N 3.34Å; D183-L185 PolarHBondContact O-N 3.23Å; L185-N187 PolarHBondContact O-N 2.89Å; L185-V188 PolarHBondContact O-N 3.05Å; L185-V188 VanDerWaalsContact O-N 3.1Å
186	D	98.4	Very high	98.3	Very high	134 Å²	134	59.5 Å²	59.5	72%	0.717	32%	0.322	S	S	*	.	H	α-helix	trans	-64.5	-24.8	177.9	-73.8	-13.9	0	0	0	112.4	S182 D183	S182-D186 PolarHBondContact O-N 3.38Å; D183-D186 PolarHBondContact O-N 2.99Å
187	N	98.6	Very high	98.3	Very high	58 Å²	58	60.5 Å²	60.5	31%	0.31	33%	0.334	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.9	3.8	176.2	-74.8	-28.5	0	0	0	114.5	Q144 K155 A156 D183 V184 L185	Q144-N187 PolarHBondContact OE1-ND2 3.38Å; K155-N187 WeakPolarHBondContact CA-O 3.27Å; K155-N187 WeakPolarHBondContact CB-O 3.31Å; K155-N187 HydrophobicContact CG-CB 4.2Å; A156-N187 PolarHBondContact N-O 3.11Å; D183-N187 WeakPolarHBondContact O-CB 3.4Å; D183-N187 VanDerWaalsContact O-CG 3.28Å; D183-N187 PolarHBondContact O-N 3.37Å; D183-N187 VanDerWaalsContact O-N 3.1Å; D183-N187 PolarHBondContact O-ND2 3.26Å; D183-N187 VanDerWaalsContact O-ND2 3.16Å; V184-N187 PolarHBondContact O-N 3.18Å; L185-N187 PolarHBondContact O-N 2.89Å
188	V	98.8	Very high	98.3	Very high	17 Å²	17	60.1 Å²	60.1	10%	0.103	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	108	173.4	-174.9	0	0	0	0	110.9	A140 A156 F165 L170 V184 L185	A140-V188 HydrophobicContact CB-CG2 4.46Å; A156-V188 HydrophobicContact CB-CG1 4.35Å; A156-V188 HydrophobicContact CB-CG2 4.13Å; A156-V188 WeakPolarHBondContact O-CA 3.23Å; F165-V188 HydrophobicContact CE2-CG1 4.4Å; F165-V188 HydrophobicContact CZ-CG1 4.16Å; L170-V188 HydrophobicContact CD2-CB 4.3Å; L170-V188 HydrophobicContact CD2-CG1 4.37Å; L170-V188 HydrophobicContact CD2-CG2 3.83Å; V184-V188 WeakPolarHBondContact O-CG2 3.41Å; L185-V188 PolarHBondContact O-N 3.05Å; L185-V188 VanDerWaalsContact O-N 3.1Å
189	A	98.8	Very high	98.3	Very high	23 Å²	23	56.9 Å²	56.9	19%	0.19	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78	125.1	171.2	0	0	0	0	0	110.4	A156 M157 Y158 M209 Y215	A156-A189 PolarHBondContact O-N 3.18Å; M157-A189 CarbonylContact C-O 3.57Å; M157-A189 WeakPolarHBondContact CA-O 3.45Å; M157-A189 HydrophobicContact CG-CB 4.45Å; Y158-A189 PolarHBondContact N-O 3.47Å; A189-M209 HydrophobicContact CB-CE 3.82Å; A189-Y215 HydrophobicContact CB-CE1 4.24Å
190	Y	98.8	Very high	98.3	Very high	100 Å²	100	55.3 Å²	55.3	39%	0.392	29%	0.293	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	134.4	-179.1	172.7	-98.1	0	0	0	111.9	Y158 D160 F165 R192	Y158-Y190 HydrophobicContact CD1-CD2 4.39Å; Y158-Y190 WeakPolarHBondContact O-CA 3.33Å; D160-Y190 HydrophobicContact CB-CD2 4.44Å; D160-Y190 HydrophobicContact CB-CE2 3.44Å; D160-Y190 VanDerWaalsContact CB-CE2 3.44Å; D160-Y190 PolarHBondContact OD2-OH 3.48Å; D160-Y190 VanDerWaalsContact OD2-OH 3.05Å; F165-Y190 HydrophobicContact CB-CD2 3.92Å; F165-Y190 HydrophobicContact CB-CE2 3.36Å; F165-Y190 AromaticContact CD1-CD2 3.53Å; F165-Y190 HydrophobicContact CD1-CD2 3.53Å; F165-Y190 AromaticContact CD1-CE2 3.75Å; F165-Y190 HydrophobicContact CD1-CE2 3.75Å; F165-Y190 HydrophobicContact CD1-CG 4.06Å; F165-Y190 HydrophobicContact CD2-CD2 4.22Å; F165-Y190 HydrophobicContact CD2-CE2 4.48Å; F165-Y190 HydrophobicContact CE1-CD2 4.03Å; F165-Y190 HydrophobicContact CE1-CG 4.28Å; F165-Y190 AromaticContact CG-CD2 3.63Å; F165-Y190 HydrophobicContact CG-CD2 3.63Å; F165-Y190 AromaticContact CG-CE2 3.63Å; F165-Y190 HydrophobicContact CG-CE2 3.63Å; Y190-R192 HydrophobicContact CE1-CB 4.25Å
191	A	98.6	Very high	98.2	Very high	29 Å²	29	56.7 Å²	56.7	24%	0.24	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.6	142.3	168.8	0	0	0	0	0	111.1	Y158 I159 D160 L202	Y158-A191 PolarHBondContact O-N 3.02Å; I159-A191 WeakPolarHBondContact CA-O 3.41Å; D160-A191 PolarHBondContact N-O 3.08Å; A191-L202 HydrophobicContact CB-CD1 3.92Å; A191-L202 HydrophobicContact CB-CD2 3.75Å; A191-L202 HydrophobicContact CB-CG 4.45Å
192	R	98.6	Very high	98.2	Very high	107 Å²	107	56.5 Å²	56.5	40%	0.404	29%	0.29	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	117.6	173.8	-168.4	173.2	-178.2	179	2.7	111	D160 Y190 F194 H198	D160-R192 CarbonylContact O-C 3.56Å; D160-R192 VanDerWaalsContact O-CA 3.27Å; D160-R192 WeakPolarHBondContact O-CA 3.36Å; D160-R192 WeakPolarHBondContact O-CG 3.3Å; Y190-R192 HydrophobicContact CE1-CB 4.25Å; R192-F194 HydrophobicContact CB-CE2 4.18Å; R192-F194 HydrophobicContact CB-CZ 4.22Å; R192-F194 HydrophobicContact CG-CE1 4.23Å; R192-F194 HydrophobicContact CG-CE2 4.2Å; R192-F194 HydrophobicContact CG-CZ 3.94Å; R192-F194 WeakPolarHBondContact O-CD2 3.5Å; R192-F194 WeakPolarHBondContact O-CE2 3.4Å; R192-H198 PolarHBondContact O-CE1 2.81Å; R192-H198 VanDerWaalsContact O-CE1 3.3Å
193	A	98.3	Very high	98.2	Very high	1 Å²	1	53.3 Å²	53.3	1%	0.008	27%	0.267	C	S	.	.			trans	-87.2	140.1	172	0	0	0	0	0	110.6	I159 D160 T161 Q199 L202 L226	I159-A193 HydrophobicContact CG2-CB 4.38Å; D160-A193 PolarHBondContact O-N 3.42Å; T161-A193 HydrophobicContact CG2-CB 4.24Å; A193-Q199 HydrophobicContact CB-CB 3.85Å; A193-Q199 HydrophobicContact CB-CG 4.2Å; A193-L202 HydrophobicContact CB-CD1 3.83Å; A193-L226 HydrophobicContact CB-CD1 3.94Å
194	F	97.6	Very high	98	Very high	133 Å²	133	53.8 Å²	53.8	58%	0.583	26%	0.263	S	S	*	.			trans	-115.2	-13.5	-175.8	-67.6	-82.4	0	0	0	113.7	R192	R192-F194 HydrophobicContact CB-CE2 4.18Å; R192-F194 HydrophobicContact CB-CZ 4.22Å; R192-F194 HydrophobicContact CG-CE1 4.23Å; R192-F194 HydrophobicContact CG-CE2 4.2Å; R192-F194 HydrophobicContact CG-CZ 3.94Å; R192-F194 WeakPolarHBondContact O-CD2 3.5Å; R192-F194 WeakPolarHBondContact O-CE2 3.4Å
195	N	98	Very high	97.9	Very high	67 Å²	67	58.4 Å²	58.4	36%	0.358	29%	0.285	S	S	.	.	S	Bend	trans	-154.6	165.2	175.2	58.3	61.3	0	0	0	109.1	D197 H198 Q199 D230	N195-D197 VanDerWaalsContact C-N 3.34Å; N195-D197 PolarHBondContact O-N 3.3Å; N195-D197 PolarHBondContact OD1-N 3.09Å; N195-H198 PolarHBondContact O-N 2.82Å; N195-H198 VanDerWaalsContact OD1-CB 3.23Å; N195-H198 WeakPolarHBondContact OD1-CB 3.48Å; N195-H198 PolarHBondContact OD1-N 3.35Å; N195-Q199 PolarHBondContact O-N 3.34Å; N195-D230 WeakPolarHBondContact CA-OD2 3.37Å
196	T	98.1	Very high	97.8	Very high	5 Å²	5	56 Å²	56	3%	0.031	27%	0.272	C	S	.	.	H	α-helix	trans	-63.4	-33.7	-174.7	46.8	0	0	0	0	113.9	Q199 T200 L226 Y227 D230 Y231 H243	T196-Q199 PolarHBondContact O-N 3.2Å; T196-T200 PolarHBondContact O-N 3.34Å; T196-T200 PolarHBondContact O-OG1 2.8Å; T196-L226 HydrophobicContact CG2-CB 3.68Å; T196-Y227 HydrophobicContact CG2-CD1 3.8Å; T196-Y227 HydrophobicContact CG2-CD2 3.77Å; T196-Y227 HydrophobicContact CG2-CE1 3.98Å; T196-Y227 HydrophobicContact CG2-CE2 3.93Å; T196-Y227 HydrophobicContact CG2-CG 3.7Å; T196-D230 HydrophobicContact CG2-CB 4.14Å; T196-D230 WeakPolarHBondContact CG2-OD2 3.36Å; T196-D230 PolarHBondContact N-OD2 2.93Å; T196-D230 PolarHBondContact OG1-OD2 3.34Å; T196-D230 VanDerWaalsContact OG1-OD2 3.04Å; T196-Y231 HydrophobicContact CG2-CE2 4Å; T196-H243 PolarHBondContact O-CE1 3.23Å
197	D	98	Very high	97.7	Very high	109 Å²	109	49.6 Å²	49.6	58%	0.583	24%	0.238	S	C	*	.	H	α-helix	trans	-69	-44.8	176.4	-68	-35.1	0	0	0	111.7	N195 Q199 T200 Q201 H243	N195-D197 VanDerWaalsContact C-N 3.34Å; N195-D197 PolarHBondContact O-N 3.3Å; N195-D197 PolarHBondContact OD1-N 3.09Å; D197-Q199 VanDerWaalsContact C-N 3.3Å; D197-Q199 PolarHBondContact O-N 2.75Å; D197-T200 PolarHBondContact O-N 2.58Å; D197-Q201 PolarHBondContact O-N 2.84Å; D197-H243 IonicContact OD1-NE2 2.73Å
198	H	98.4	Very high	97.5	Very high	53 Å²	53	48.3 Å²	48.3	25%	0.245	24%	0.235	C	C	.	.	H	α-helix	trans	-61.5	-39.5	175.7	-178.4	-162.1	0	0	0	111	R192 N195 T200 Q201 L202	R192-H198 PolarHBondContact O-CE1 2.81Å; R192-H198 VanDerWaalsContact O-CE1 3.3Å; N195-H198 PolarHBondContact O-N 2.82Å; N195-H198 VanDerWaalsContact OD1-CB 3.23Å; N195-H198 WeakPolarHBondContact OD1-CB 3.48Å; N195-H198 PolarHBondContact OD1-N 3.35Å; H198-T200 VanDerWaalsContact C-N 3.3Å; H198-T200 PolarHBondContact O-N 2.61Å; H198-Q201 WeakPolarHBondContact O-CB 3.02Å; H198-Q201 PolarHBondContact O-N 3.36Å; H198-Q201 VanDerWaalsContact O-N 3.09Å; H198-L202 WeakPolarHBondContact O-CG 3.42Å; H198-L202 PolarHBondContact O-N 2.79Å
199	Q	98.1	Very high	97.3	Very high	0 Å²	0	51.1 Å²	51.1	0%	0	25%	0.248	C	C	.	.	H	α-helix	trans	-58	-41.9	175.4	-168.3	-178.3	8.5	0	0	112.1	A193 N195 T196 D197 V220 L226 F247	A193-Q199 HydrophobicContact CB-CB 3.85Å; A193-Q199 HydrophobicContact CB-CG 4.2Å; N195-Q199 PolarHBondContact O-N 3.34Å; T196-Q199 PolarHBondContact O-N 3.2Å; D197-Q199 VanDerWaalsContact C-N 3.3Å; D197-Q199 PolarHBondContact O-N 2.75Å; Q199-V220 VanDerWaalsContact NE2-CG1 3.34Å; Q199-L226 HydrophobicContact CB-CD1 4.27Å; Q199-F247 HydrophobicContact CG-CE2 3.74Å; Q199-F247 HydrophobicContact CG-CZ 3.92Å
200	T	97.3	Very high	97.2	Very high	17 Å²	17	50.4 Å²	50.4	10%	0.104	24%	0.241	C	C	.	.	H	α-helix	trans	-68	-40.3	173.3	-56.7	0	0	0	0	111.7	T196 D197 H198 L202 L203 Y204 H243 M250	T196-T200 PolarHBondContact O-N 3.34Å; T196-T200 PolarHBondContact O-OG1 2.8Å; D197-T200 PolarHBondContact O-N 2.58Å; H198-T200 VanDerWaalsContact C-N 3.3Å; H198-T200 PolarHBondContact O-N 2.61Å; T200-L202 VanDerWaalsContact C-N 3.29Å; T200-L202 PolarHBondContact O-N 3.04Å; T200-L203 WeakPolarHBondContact O-CB 3.04Å; T200-L203 PolarHBondContact O-N 2.74Å; T200-L203 VanDerWaalsContact O-N 3.09Å; T200-Y204 HydrophobicContact CG2-CE2 4.26Å; T200-H243 PolarHBondContact OG1-CE1 3.12Å; T200-H243 VanDerWaalsContact OG1-CE1 3.23Å; T200-M250 HydrophobicContact CG2-CE 4.23Å; T200-M250 HydrophobicContact CG2-SD 3.64Å
201	Q	96.8	Very high	96.9	Very high	114 Å²	114	48 Å²	48	53%	0.533	24%	0.242	S	C	.	.	H	α-helix	trans	-60.5	-38.5	179.6	-170.2	176	2.1	0	0	112.5	D197 H198 L203 Y204 Q205	D197-Q201 PolarHBondContact O-N 2.84Å; H198-Q201 WeakPolarHBondContact O-CB 3.02Å; H198-Q201 PolarHBondContact O-N 3.36Å; H198-Q201 VanDerWaalsContact O-N 3.09Å; Q201-L203 PolarHBondContact O-N 3.46Å; Q201-Y204 PolarHBondContact O-N 2.84Å; Q201-Y204 VanDerWaalsContact O-N 3.11Å; Q201-Q205 PolarHBondContact O-N 3.01Å
202	L	98.3	Very high	96.6	Very high	11 Å²	11	54.5 Å²	54.5	6%	0.058	27%	0.267	C	S	.	.	H	α-helix	trans	-60.9	-26.7	176.7	-71.2	172.1	0	0	0	112.8	I159 A191 A193 H198 T200 Q205 A206	I159-L202 HydrophobicContact CD1-CB 4.08Å; I159-L202 HydrophobicContact CG2-CD1 3.96Å; A191-L202 HydrophobicContact CB-CD1 3.92Å; A191-L202 HydrophobicContact CB-CD2 3.75Å; A191-L202 HydrophobicContact CB-CG 4.45Å; A193-L202 HydrophobicContact CB-CD1 3.83Å; H198-L202 WeakPolarHBondContact O-CG 3.42Å; H198-L202 PolarHBondContact O-N 2.79Å; T200-L202 VanDerWaalsContact C-N 3.29Å; T200-L202 PolarHBondContact O-N 3.04Å; L202-Q205 PolarHBondContact O-N 3.3Å; L202-A206 WeakPolarHBondContact O-CB 3.35Å; L202-A206 PolarHBondContact O-N 2.95Å
203	L	97.5	Very high	96.4	Very high	2 Å²	2	51.5 Å²	51.5	1%	0.01	26%	0.263	C	S	.	.	H	α-helix	trans	-70.4	-29.7	175.8	-62.5	-170.8	0	0	0	113.3	I159 T200 Q201 A206 S207 L218 F247 M250 L251 L254	I159-L203 HydrophobicContact CD1-CD2 3.7Å; T200-L203 WeakPolarHBondContact O-CB 3.04Å; T200-L203 PolarHBondContact O-N 2.74Å; T200-L203 VanDerWaalsContact O-N 3.09Å; Q201-L203 PolarHBondContact O-N 3.46Å; L203-A206 WeakPolarHBondContact O-CB 3.27Å; L203-A206 PolarHBondContact O-N 2.87Å; L203-S207 PolarHBondContact O-N 3.14Å; L203-S207 PolarHBondContact O-OG 2.9Å; L203-L218 HydrophobicContact CD2-CD2 4.3Å; L203-F247 HydrophobicContact CD1-CD2 3.6Å; L203-F247 HydrophobicContact CD1-CE2 3.41Å; L203-F247 VanDerWaalsContact CD1-CE2 3.41Å; L203-F247 HydrophobicContact CD1-CZ 4.23Å; L203-F247 HydrophobicContact CD2-CE2 4.26Å; L203-F247 HydrophobicContact CG-CD2 4.33Å; L203-F247 HydrophobicContact CG-CE2 3.81Å; L203-M250 HydrophobicContact CB-CE 3.86Å; L203-M250 HydrophobicContact CD1-CB 3.75Å; L203-M250 HydrophobicContact CD1-CE 4.47Å; L203-L251 HydrophobicContact CD1-CD2 3.85Å; L203-L251 HydrophobicContact CD1-CG 4Å; L203-L251 HydrophobicContact CD2-CD2 3.66Å; L203-L251 HydrophobicContact CG-CD2 4.44Å; L203-L254 HydrophobicContact CB-CD1 4.27Å; L203-L254 HydrophobicContact CD2-CD1 4.05Å
204	Y	94.3	Very high	96.2	Very high	95 Å²	95	57.7 Å²	57.7	37%	0.373	29%	0.286	S	S	.	.	H	α-helix	trans	-71.6	-35.4	172.7	-64.6	-76.5	0	0	0	111.7	T200 Q201 A206 S207 A208 M250	T200-Y204 HydrophobicContact CG2-CE2 4.26Å; Q201-Y204 PolarHBondContact O-N 2.84Å; Q201-Y204 VanDerWaalsContact O-N 3.11Å; Y204-A206 VanDerWaalsContact C-N 3.33Å; Y204-S207 PolarHBondContact O-OG 3.01Å; Y204-A208 PolarHBondContact O-N 3.42Å; Y204-M250 HydrophobicContact CD1-CE 4.02Å; Y204-M250 HydrophobicContact CD2-CE 3.94Å; Y204-M250 HydrophobicContact CE1-CE 3.66Å; Y204-M250 HydrophobicContact CE2-CE 3.58Å; Y204-M250 HydrophobicContact CE2-SD 4.42Å; Y204-M250 HydrophobicContact CG-CE 4.15Å; Y204-M250 VanDerWaalsContact CZ-CE 3.42Å
205	Q	96.2	Very high	96.2	Very high	99 Å²	99	52.5 Å²	52.5	46%	0.463	26%	0.263	S	S	.	.	H	α-helix	trans	-68.4	-38.5	172.4	-63.8	177.7	1	0	0	110.6	Q201 L202 S207 A208 M209	Q201-Q205 PolarHBondContact O-N 3.01Å; L202-Q205 PolarHBondContact O-N 3.3Å; Q205-S207 PolarHBondContact O-N 2.74Å; Q205-A208 PolarHBondContact O-N 3.3Å; Q205-M209 WeakPolarHBondContact O-CG 3.45Å; Q205-M209 PolarHBondContact O-N 3.36Å
206	A	97.2	Very high	96.2	Very high	1 Å²	1	49.6 Å²	49.6	1%	0.008	25%	0.248	C	C	.	.	H	α-helix	trans	-57.6	-47	174.9	0	0	0	0	0	112.1	M157 L202 L203 Y204 A208 M209 M210 L254	M157-A206 HydrophobicContact CE-CB 3.95Å; M157-A206 HydrophobicContact SD-CB 3.27Å; M157-A206 WeakPolarHBondContact SD-CB 3.32Å; L202-A206 WeakPolarHBondContact O-CB 3.35Å; L202-A206 PolarHBondContact O-N 2.95Å; L203-A206 WeakPolarHBondContact O-CB 3.27Å; L203-A206 PolarHBondContact O-N 2.87Å; Y204-A206 VanDerWaalsContact C-N 3.33Å; A206-A208 VanDerWaalsContact C-N 3.3Å; A206-A208 PolarHBondContact O-N 3.1Å; A206-M209 PolarHBondContact O-N 3.42Å; A206-M210 WeakPolarHBondContact O-CB 3.43Å; A206-M210 VanDerWaalsContact O-CG 3.24Å; A206-M210 WeakPolarHBondContact O-CG 3.37Å; A206-M210 PolarHBondContact O-N 3.45Å; A206-L254 HydrophobicContact CB-CD1 4.4Å
207	S	95.2	Very high	96.3	Very high	1 Å²	1	49.3 Å²	49.3	1%	0.007	25%	0.246	C	C	.	.	H	α-helix	trans	-60.1	-38.9	177.3	50.4	0	0	0	0	112.8	H46 L203 Y204 Q205 M210 A211 F258	H46-S207 PolarHBondContact CD2-OG 3.36Å; L203-S207 PolarHBondContact O-N 3.14Å; L203-S207 PolarHBondContact O-OG 2.9Å; Y204-S207 PolarHBondContact O-OG 3.01Å; Q205-S207 PolarHBondContact O-N 2.74Å; S207-M210 PolarHBondContact O-N 2.92Å; S207-A211 PolarHBondContact O-N 2.79Å; S207-A211 VanDerWaalsContact O-N 3.1Å; S207-F258 WeakPolarHBondContact O-CZ 3.13Å
208	A	93.9	Very high	96.3	Very high	30 Å²	30	44.1 Å²	44.1	25%	0.248	22%	0.219	C	C	.	.	H	α-helix	trans	-64.1	-46.1	176.6	0	0	0	0	0	111.3	H46 Y204 Q205 A206 M210 A211 E212	H46-A208 PolarHBondContact CD2-N 3.4Å; Y204-A208 PolarHBondContact O-N 3.42Å; Q205-A208 PolarHBondContact O-N 3.3Å; A206-A208 VanDerWaalsContact C-N 3.3Å; A206-A208 PolarHBondContact O-N 3.1Å; A208-M210 VanDerWaalsContact C-N 3.35Å; A208-M210 PolarHBondContact O-N 2.86Å; A208-A211 PolarHBondContact O-N 2.83Å; A208-E212 PolarHBondContact O-N 2.9Å
209	M	96.2	Very high	96.3	Very high	76 Å²	76	41.6 Å²	41.6	37%	0.374	21%	0.207	S	C	.	.	H	α-helix	trans	-64.5	-38.1	178.1	-66.2	177.2	77.4	0	0	112.7	M157 A189 Q205 A206 A211 E212 S213 Y215	M157-M209 HydrophobicContact CE-CB 3.98Å; M157-M209 HydrophobicContact CE-CE 4.37Å; M157-M209 HydrophobicContact CE-SD 3.83Å; A189-M209 HydrophobicContact CB-CE 3.82Å; Q205-M209 WeakPolarHBondContact O-CG 3.45Å; Q205-M209 PolarHBondContact O-N 3.36Å; A206-M209 PolarHBondContact O-N 3.42Å; M209-A211 VanDerWaalsContact C-N 3.28Å; M209-A211 PolarHBondContact O-N 3.39Å; M209-E212 PolarHBondContact O-N 3.26Å; M209-S213 PolarHBondContact O-N 3.03Å; M209-S213 VanDerWaalsContact O-N 3.14Å; M209-Y215 HydrophobicContact CB-CE2 4.22Å; M209-Y215 WeakPolarHBondContact CE-OH 3.38Å
210	M	95.9	Very high	96.3	Very high	9 Å²	9	41.6 Å²	41.6	4%	0.044	21%	0.207	C	C	.	.	H	α-helix	trans	-71.3	-22.9	178.4	-68.6	177.6	178.6	0	0	112.9	M157 A206 S207 A208 S213 Y215 L218 L254 F258 V260	M157-M210 HydrophobicContact CE-CE 4.37Å; M157-M210 HydrophobicContact SD-CE 4.4Å; A206-M210 WeakPolarHBondContact O-CB 3.43Å; A206-M210 VanDerWaalsContact O-CG 3.24Å; A206-M210 WeakPolarHBondContact O-CG 3.37Å; A206-M210 PolarHBondContact O-N 3.45Å; S207-M210 PolarHBondContact O-N 2.92Å; A208-M210 VanDerWaalsContact C-N 3.35Å; A208-M210 PolarHBondContact O-N 2.86Å; M210-S213 VanDerWaalsContact O-O 3.11Å; M210-Y215 HydrophobicContact CB-CD2 4.41Å; M210-Y215 HydrophobicContact CG-CD2 3.82Å; M210-Y215 HydrophobicContact CG-CG 4.13Å; M210-L218 HydrophobicContact CE-CB 4.04Å; M210-L218 HydrophobicContact CE-CD2 4.26Å; M210-L254 HydrophobicContact SD-CD2 4.4Å; M210-F258 HydrophobicContact CB-CB 4.44Å; M210-F258 HydrophobicContact CB-CD1 3.43Å; M210-F258 VanDerWaalsContact CB-CD1 3.43Å; M210-F258 HydrophobicContact CB-CD2 3.96Å; M210-F258 HydrophobicContact CB-CE1 3.57Å; M210-F258 HydrophobicContact CB-CE2 4.04Å; M210-F258 HydrophobicContact CB-CG 3.67Å; M210-F258 HydrophobicContact CB-CZ 3.87Å; M210-F258 HydrophobicContact CG-CG 4.41Å; M210-F258 WeakPolarHBondContact O-CD1 3.48Å; M210-F258 WeakPolarHBondContact O-CE1 3.31Å; M210-F258 HydrophobicContact SD-CB 4.26Å; M210-F258 HydrophobicContact SD-CD2 3.83Å; M210-F258 HydrophobicContact SD-CE2 4.41Å; M210-F258 HydrophobicContact SD-CG 4.03Å; M210-V260 HydrophobicContact CE-CG1 4.27Å; M210-V260 HydrophobicContact CE-CG2 4.27Å; M210-V260 HydrophobicContact SD-CG1 4.22Å; M210-V260 HydrophobicContact SD-CG2 4.41Å
211	A	92.8	Very high	96.4	Very high	49 Å²	49	40.9 Å²	40.9	41%	0.405	20%	0.203	S	C	.	.	H	α-helix	trans	-75.3	-24.7	172.5	0	0	0	0	0	112.9	H46 S207 A208 M209 F258	H46-A211 HydrophobicContact CB-CB 3.7Å; S207-A211 PolarHBondContact O-N 2.79Å; S207-A211 VanDerWaalsContact O-N 3.1Å; A208-A211 PolarHBondContact O-N 2.83Å; M209-A211 VanDerWaalsContact C-N 3.28Å; M209-A211 PolarHBondContact O-N 3.39Å; A211-F258 HydrophobicContact CB-CE1 4.23Å
212	E	92	Very high	96.3	Very high	165 Å²	165	35.5 Å²	35.5	77%	0.771	18%	0.177	S	C	*	.	H	α-helix	trans	-92.8	-27.4	-179.6	-67.4	-179.6	-178.6	0	0	113.7	A208 M209	A208-E212 PolarHBondContact O-N 2.9Å; M209-E212 PolarHBondContact O-N 3.26Å
213	S	93.6	Very high	96.2	Very high	45 Å²	45	35 Å²	35	32%	0.315	18%	0.175	S	C	.	.	S	Bend	trans	-145.2	147.4	-175	-75.7	0	0	0	0	111	M209 M210 Y215	M209-S213 PolarHBondContact O-N 3.03Å; M209-S213 VanDerWaalsContact O-N 3.14Å; M210-S213 VanDerWaalsContact O-O 3.11Å; S213-Y215 VanDerWaalsContact O-CD2 3.3Å; S213-Y215 WeakPolarHBondContact O-CD2 3.39Å; S213-Y215 PolarHBondContact O-N 2.83Å
214	R	94.9	Very high	96.1	Very high	131 Å²	131	35 Å²	35	49%	0.494	18%	0.175	S	C	.	.			trans	-70.4	118.4	175.3	-171.6	-178.9	-178.7	-152.6	8.2	111.2	G152 E153 K155	G152-R214 PolarHBondContact O-NH2 2.78Å; E153-R214 VanDerWaalsContact CB-NH1 3.35Å; E153-R214 PolarHBondContact O-NH1 3.18Å; E153-R214 IonicContact OE2-NH1 2.69Å; K155-R214 PolarHBondContact N-O 3.42Å; K155-R214 VanDerWaalsContact N-O 3.13Å
215	Y	98	Very high	96.1	Very high	23 Å²	23	31.1 Å²	31.1	9%	0.09	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	147.8	165.2	-74.7	-98.5	0	0	0	109.1	K155 A156 M157 A189 M209 M210 S213 V260	K155-Y215 HydrophobicContact CB-CD1 3.58Å; K155-Y215 HydrophobicContact CB-CE1 3.55Å; K155-Y215 HydrophobicContact CB-CG 4.09Å; K155-Y215 HydrophobicContact CD-CE1 4.48Å; K155-Y215 CarbonylContact O-C 3.57Å; K155-Y215 WeakPolarHBondContact O-CA 3.36Å; K155-Y215 WeakPolarHBondContact O-CD1 3.37Å; A156-Y215 WeakPolarHBondContact O-CE1 3.37Å; M157-Y215 HydrophobicContact CB-CD1 4.06Å; M157-Y215 HydrophobicContact CB-CE1 4.14Å; M157-Y215 HydrophobicContact CE-CD1 4.41Å; M157-Y215 HydrophobicContact CE-CE1 4.03Å; M157-Y215 HydrophobicContact CE-CE2 4.46Å; A189-Y215 HydrophobicContact CB-CE1 4.24Å; M209-Y215 HydrophobicContact CB-CE2 4.22Å; M209-Y215 WeakPolarHBondContact CE-OH 3.38Å; M210-Y215 HydrophobicContact CB-CD2 4.41Å; M210-Y215 HydrophobicContact CG-CD2 3.82Å; M210-Y215 HydrophobicContact CG-CG 4.13Å; S213-Y215 VanDerWaalsContact O-CD2 3.3Å; S213-Y215 WeakPolarHBondContact O-CD2 3.39Å; S213-Y215 PolarHBondContact O-N 2.83Å; Y215-V260 WeakPolarHBondContact O-CG1 3.27Å
216	A	98	Very high	96.2	Very high	6 Å²	6	27.1 Å²	27.1	5%	0.05	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	-25.7	173.8	0	0	0	0	0	111.9	I101 C143 K155 A261	I101-A216 HydrophobicContact CD1-CB 4.45Å; C143-A216 HydrophobicContact CB-CB 4.13Å; K155-A216 PolarHBondContact O-N 3.37Å; A216-A261 PolarHBondContact O-N 2.87Å
217	L	98.8	Very high	96.1	Very high	0 Å²	0	27.4 Å²	27.4	0%	0	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.9	133.8	-169.4	-178.6	68.8	0	0	0	111.9	I101 L139 C143 A156 M157 I219 A261 V263	I101-L217 HydrophobicContact CD1-CB 4.25Å; I101-L217 HydrophobicContact CD1-CD1 4.36Å; L139-L217 HydrophobicContact CB-CD2 3.72Å; L139-L217 WeakPolarHBondContact O-CD2 3.29Å; C143-L217 HydrophobicContact CB-CB 3.87Å; C143-L217 HydrophobicContact CB-CD2 4.16Å; A156-L217 WeakPolarHBondContact CA-O 3.41Å; M157-L217 PolarHBondContact N-O 3.48Å; L217-I219 HydrophobicContact CD1-CG1 4.36Å; L217-I219 HydrophobicContact CD2-CD1 3.68Å; L217-I219 HydrophobicContact CD2-CG1 3.87Å; L217-I219 HydrophobicContact CG-CD1 4.28Å; L217-I219 HydrophobicContact CG-CG1 3.94Å; L217-A261 WeakPolarHBondContact CA-O 3.42Å; L217-A261 HydrophobicContact CD1-CB 3.84Å; L217-V263 HydrophobicContact CD1-CB 4.36Å; L217-V263 HydrophobicContact CD1-CG2 3.74Å
218	L	98.9	Very high	95.8	Very high	0 Å²	0	33.1 Å²	33.1	0%	0	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	118.7	167	172.9	61.4	0	0	0	109.6	M157 I159 L203 M210 L251 L254 A261 V262 V263	M157-L218 HydrophobicContact CB-CD1 3.82Å; M157-L218 HydrophobicContact CG-CD1 3.81Å; M157-L218 HydrophobicContact SD-CD1 3.98Å; I159-L218 HydrophobicContact CD1-CD1 4.12Å; I159-L218 HydrophobicContact CG1-CD1 4.38Å; L203-L218 HydrophobicContact CD2-CD2 4.3Å; M210-L218 HydrophobicContact CE-CB 4.04Å; M210-L218 HydrophobicContact CE-CD2 4.26Å; L218-L251 HydrophobicContact CD2-CD2 3.64Å; L218-L254 HydrophobicContact CD2-CD1 3.84Å; L218-A261 PolarHBondContact N-O 2.94Å; L218-V262 HydrophobicContact CB-CG2 4.4Å; L218-V262 HydrophobicContact CD2-CG2 4.4Å; L218-V262 WeakPolarHBondContact O-CA 3.25Å; L218-V263 PolarHBondContact O-N 2.88Å
219	I	98.9	Very high	95.7	Very high	0 Å²	0	36.3 Å²	36.3	0%	0	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	133.1	175.6	-63.2	162.7	0	0	0	109.8	C136 A140 M157 Y158 I159 L217 D221 V263	C136-I219 HydrophobicContact CB-CD1 4.12Å; C136-I219 HydrophobicContact CB-CG2 3.96Å; C136-I219 VanDerWaalsContact O-CD1 3.27Å; C136-I219 WeakPolarHBondContact O-CD1 3.45Å; A140-I219 HydrophobicContact CB-CD1 4.08Å; M157-I219 PolarHBondContact O-N 3.49Å; Y158-I219 HydrophobicContact CD1-CG2 4.49Å; Y158-I219 HydrophobicContact CD2-CB 3.96Å; Y158-I219 HydrophobicContact CD2-CD1 3.62Å; Y158-I219 HydrophobicContact CD2-CG1 4.41Å; Y158-I219 HydrophobicContact CD2-CG2 3.99Å; Y158-I219 HydrophobicContact CE1-CG2 4.23Å; Y158-I219 HydrophobicContact CE2-CB 4.17Å; Y158-I219 HydrophobicContact CE2-CD1 3.72Å; Y158-I219 HydrophobicContact CE2-CG2 3.71Å; Y158-I219 HydrophobicContact CG-CB 4.29Å; Y158-I219 HydrophobicContact CG-CG2 4.37Å; I159-I219 PolarHBondContact N-O 3.26Å; L217-I219 HydrophobicContact CD1-CG1 4.36Å; L217-I219 HydrophobicContact CD2-CD1 3.68Å; L217-I219 HydrophobicContact CD2-CG1 3.87Å; L217-I219 HydrophobicContact CG-CD1 4.28Å; L217-I219 HydrophobicContact CG-CG1 3.94Å; I219-D221 HydrophobicContact CG2-CB 4.13Å; I219-V263 CarbonylContact C-O 3.46Å; I219-V263 VanDerWaalsContact CA-O 3.31Å; I219-V263 WeakPolarHBondContact CA-O 3.07Å; I219-V263 HydrophobicContact CG1-CB 4.35Å
220	V	98.8	Very high	95.6	Very high	0 Å²	0	35.7 Å²	35.7	0%	0	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	103.9	166.6	-171.3	0	0	0	0	109.5	I159 Q199 A223 F247 L251 V263 I264 T265	I159-V220 HydrophobicContact CB-CG2 4.43Å; I159-V220 HydrophobicContact CG2-CG1 4.43Å; I159-V220 CarbonylContact O-C 3.54Å; I159-V220 WeakPolarHBondContact O-CA 3.27Å; Q199-V220 VanDerWaalsContact NE2-CG1 3.34Å; V220-A223 HydrophobicContact CG1-CB 4.15Å; V220-A223 PolarHBondContact O-N 3.07Å; V220-F247 HydrophobicContact CG1-CE1 4.44Å; V220-F247 HydrophobicContact CG1-CZ 4.01Å; V220-F247 HydrophobicContact CG2-CZ 4.29Å; V220-L251 HydrophobicContact CG2-CD1 4.37Å; V220-L251 HydrophobicContact CG2-CD2 4.04Å; V220-V263 PolarHBondContact N-O 3.3Å; V220-I264 HydrophobicContact CB-CG2 4.12Å; V220-I264 HydrophobicContact CG2-CG2 4.39Å; V220-T265 PolarHBondContact O-N 3.19Å
221	D	98.2	Very high	95.5	Very high	2 Å²	2	37.3 Å²	37.3	1%	0.011	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	99.2	-174.7	-168	18	0	0	0	111.7	T133 Y158 I159 D160 T161 I219 T265	T133-D221 WeakPolarHBondContact CB-OD2 3.49Å; T133-D221 VanDerWaalsContact CG2-OD2 3.31Å; T133-D221 WeakPolarHBondContact CG2-OD2 3.27Å; T133-D221 PolarHBondContact OG1-OD2 2.8Å; Y158-D221 HydrophobicContact CE1-CB 3.71Å; Y158-D221 WeakPolarHBondContact OH-CB 3.44Å; Y158-D221 PolarHBondContact OH-OD2 2.91Å; I159-D221 PolarHBondContact O-N 3.33Å; D160-D221 CarbonylContact C-O 3.45Å; D160-D221 WeakPolarHBondContact CA-O 3.42Å; T161-D221 PolarHBondContact N-O 3.21Å; T161-D221 PolarHBondContact OG1-O 3.41Å; I219-D221 HydrophobicContact CG2-CB 4.13Å; D221-T265 HydrophobicContact CB-CG2 4.21Å; D221-T265 WeakPolarHBondContact OD1-CB 3.33Å; D221-T265 VanDerWaalsContact OD1-CG2 3.28Å; D221-T265 WeakPolarHBondContact OD1-CG2 3.48Å; D221-T265 PolarHBondContact OD1-OG1 3.35Å
222	S	95.6	Very high	95.4	Very high	0 Å²	0	38.8 Å²	38.8	0%	0	20%	0.195	C	C	.	.	T	Hydrogen-bonded Turn	cis	-102.8	152.2	-9.3	70.7	0	0	0	0	112.4	T161 E162 T224 A225 T265	T161-S222 VanDerWaalsContact CG2-O 3.27Å; T161-S222 WeakPolarHBondContact CG2-O 3.48Å; T161-S222 PolarHBondContact OG1-N 2.96Å; T161-S222 PolarHBondContact OG1-O 3.37Å; E162-S222 VanDerWaalsContact OE1-CB 3.29Å; E162-S222 WeakPolarHBondContact OE1-CB 3.4Å; E162-S222 PolarHBondContact OE1-OG 2.85Å; S222-T224 PolarHBondContact O-N 3.24Å; S222-A225 WeakPolarHBondContact OG-CB 3.19Å; S222-A225 PolarHBondContact OG-N 2.79Å; S222-T265 WeakPolarHBondContact CA-OG1 3.4Å; S222-T265 VanDerWaalsContact CB-O 3.3Å; S222-T265 WeakPolarHBondContact CB-O 3.45Å; S222-T265 WeakPolarHBondContact CB-OG1 3.38Å
223	A	95.9	Very high	95.3	Very high	1 Å²	1	34 Å²	34	1%	0.008	19%	0.19	C	C	.	.	S	Bend	trans	-65.3	-23.9	178.3	0	0	0	0	0	112.5	V220 Y227 F247 I264 T265	V220-A223 HydrophobicContact CG1-CB 4.15Å; V220-A223 PolarHBondContact O-N 3.07Å; A223-Y227 VanDerWaalsContact O-CD2 3.32Å; A223-Y227 WeakPolarHBondContact O-CD2 3.45Å; A223-F247 HydrophobicContact CB-CE1 4.31Å; A223-I264 HydrophobicContact CB-CB 3.92Å; A223-I264 HydrophobicContact CB-CD1 4.44Å; A223-I264 HydrophobicContact CB-CG2 4.22Å; A223-T265 PolarHBondContact N-O 2.97Å
224	T	94.9	Very high	95.2	Very high	1 Å²	1	43.1 Å²	43.1	1%	0.006	22%	0.217	C	C	.	.	S	Bend	trans	-110.4	-12.5	-170	59.5	0	0	0	0	115.6	S222 L226 Y227 R228 N266 I286 L291	S222-T224 PolarHBondContact O-N 3.24Å; T224-L226 PolarHBondContact O-N 3.4Å; T224-Y227 PolarHBondContact O-N 2.87Å; T224-R228 PolarHBondContact O-N 2.93Å; T224-N266 WeakPolarHBondContact CB-OD1 3.42Å; T224-N266 HydrophobicContact CG2-CB 4.46Å; T224-N266 VanDerWaalsContact CG2-OD1 3.25Å; T224-N266 WeakPolarHBondContact CG2-OD1 3.44Å; T224-N266 PolarHBondContact OG1-OD1 3.37Å; T224-I286 HydrophobicContact CG2-CG2 4.48Å; T224-L291 HydrophobicContact CG2-CD2 4.03Å
225	A	95.2	Very high	95.2	Very high	15 Å²	15	40.6 Å²	40.6	12%	0.124	23%	0.232	C	C	.	.	H	α-helix	trans	-57.2	-51.5	-172.9	0	0	0	0	0	112.7	E162 S222 Y227 R228	E162-A225 HydrophobicContact CG-CB 3.88Å; S222-A225 WeakPolarHBondContact OG-CB 3.19Å; S222-A225 PolarHBondContact OG-N 2.79Å; A225-Y227 VanDerWaalsContact C-N 3.31Å; A225-Y227 PolarHBondContact O-N 3.45Å; A225-R228 WeakPolarHBondContact O-CB 3.41Å; A225-R228 PolarHBondContact O-N 2.96Å; A225-R228 VanDerWaalsContact O-N 3.13Å
226	L	96.9	Very high	95.1	Very high	15 Å²	15	43.8 Å²	43.8	8%	0.079	25%	0.248	C	C	.	.	H	α-helix	trans	-64.6	-36	-178	-58.5	172.3	0	0	0	111.9	T161 A193 T196 Q199 T224 R228 T229 D230	T161-L226 HydrophobicContact CG2-CD1 3.65Å; T161-L226 HydrophobicContact CG2-CG 4.07Å; A193-L226 HydrophobicContact CB-CD1 3.94Å; T196-L226 HydrophobicContact CG2-CB 3.68Å; Q199-L226 HydrophobicContact CB-CD1 4.27Å; T224-L226 PolarHBondContact O-N 3.4Å; L226-R228 PolarHBondContact O-N 3.04Å; L226-R228 VanDerWaalsContact O-N 3.11Å; L226-T229 PolarHBondContact O-N 2.84Å; L226-T229 VanDerWaalsContact O-N 3.15Å; L226-T229 PolarHBondContact O-OG1 3.38Å; L226-D230 WeakPolarHBondContact O-CB 3.35Å; L226-D230 PolarHBondContact O-N 3.48Å
227	Y	95.8	Very high	94.9	Very high	7 Å²	7	47 Å²	47	3%	0.027	26%	0.264	C	S	.	.	H	α-helix	trans	-64.3	-16.5	177	-73.1	-88.4	0	0	0	114.1	T196 A223 T224 A225 Y231 R240 H243 L244 F247	T196-Y227 HydrophobicContact CG2-CD1 3.8Å; T196-Y227 HydrophobicContact CG2-CD2 3.77Å; T196-Y227 HydrophobicContact CG2-CE1 3.98Å; T196-Y227 HydrophobicContact CG2-CE2 3.93Å; T196-Y227 HydrophobicContact CG2-CG 3.7Å; A223-Y227 VanDerWaalsContact O-CD2 3.32Å; A223-Y227 WeakPolarHBondContact O-CD2 3.45Å; T224-Y227 PolarHBondContact O-N 2.87Å; A225-Y227 VanDerWaalsContact C-N 3.31Å; A225-Y227 PolarHBondContact O-N 3.45Å; Y227-Y231 HydrophobicContact CD1-CD2 4.06Å; Y227-Y231 AromaticContact CD1-CE2 3.75Å; Y227-Y231 HydrophobicContact CD1-CE2 3.75Å; Y227-Y231 HydrophobicContact CE1-CE2 4.15Å; Y227-R240 HydrophobicContact CD1-CG 3.89Å; Y227-R240 WeakPolarHBondContact O-CD 3.49Å; Y227-H243 HydrophobicContact CE1-CB 4.13Å; Y227-H243 AromaticContact CE1-ND1 3.27Å; Y227-H243 VanDerWaalsContact CE1-ND1 3.27Å; Y227-H243 WeakPolarHBondContact CE1-ND1 3.37Å; Y227-H243 AromaticContact CZ-ND1 3.43Å; Y227-H243 PolarHBondContact OH-CE1 2.83Å; Y227-H243 PolarHBondContact OH-ND1 2.94Å; Y227-L244 HydrophobicContact CD1-CB 4.2Å; Y227-L244 HydrophobicContact CD2-CD1 4.22Å; Y227-L244 HydrophobicContact CE1-CB 3.79Å; Y227-L244 HydrophobicContact CE1-CD1 4.38Å; Y227-L244 HydrophobicContact CE2-CD1 3.9Å; Y227-F247 VanDerWaalsContact OH-CB 3.29Å; Y227-F247 WeakPolarHBondContact OH-CB 3.5Å
228	R	89.1	Confident	94.7	Very high	120 Å²	120	51.9 Å²	51.9	45%	0.453	30%	0.298	S	S	.	.	H	α-helix	trans	-78.7	-30.7	176.1	-65.5	180	70	163.9	-0.6	112.8	T224 A225 L226 Q267 I286	T224-R228 PolarHBondContact O-N 2.93Å; A225-R228 WeakPolarHBondContact O-CB 3.41Å; A225-R228 PolarHBondContact O-N 2.96Å; A225-R228 VanDerWaalsContact O-N 3.13Å; L226-R228 PolarHBondContact O-N 3.04Å; L226-R228 VanDerWaalsContact O-N 3.11Å; R228-Q267 VanDerWaalsContact CD-OE1 3.28Å; R228-I286 VanDerWaalsContact CD-CD1 3.46Å; R228-I286 HydrophobicContact CG-CD1 4.02Å; R228-I286 HydrophobicContact CG-CG2 4.5Å
229	T	90.4	Very high	94.6	Very high	98 Å²	98	54.7 Å²	54.7	60%	0.601	32%	0.321	S	S	*	.	H	α-helix	trans	-103.2	-37.7	-172.4	49.5	0	0	0	0	111.8	L226 Y231	L226-T229 PolarHBondContact O-N 2.84Å; L226-T229 VanDerWaalsContact O-N 3.15Å; L226-T229 PolarHBondContact O-OG1 3.38Å; T229-Y231 VanDerWaalsContact C-N 3.26Å; T229-Y231 PolarHBondContact O-N 3.26Å
230	D	94.9	Very high	94.5	Very high	62 Å²	62	57.6 Å²	57.6	33%	0.332	33%	0.332	S	S	.	.	S	Bend	trans	-71.4	-24.9	-177	-68.2	12.4	0	0	0	112.1	N195 T196 L226	N195-D230 WeakPolarHBondContact CA-OD2 3.37Å; T196-D230 HydrophobicContact CG2-CB 4.14Å; T196-D230 WeakPolarHBondContact CG2-OD2 3.36Å; T196-D230 PolarHBondContact N-OD2 2.93Å; T196-D230 PolarHBondContact OG1-OD2 3.34Å; T196-D230 VanDerWaalsContact OG1-OD2 3.04Å; L226-D230 WeakPolarHBondContact O-CB 3.35Å; L226-D230 PolarHBondContact O-N 3.48Å
231	Y	94.9	Very high	94.5	Very high	43 Å²	43	59 Å²	59	17%	0.169	34%	0.338	C	S	.	.	S	Bend	trans	-120.2	119.1	178.6	-59.8	-87.7	0	0	0	110.9	T196 Y227 T229 E236 A239 R240 H243	T196-Y231 HydrophobicContact CG2-CE2 4Å; Y227-Y231 HydrophobicContact CD1-CD2 4.06Å; Y227-Y231 AromaticContact CD1-CE2 3.75Å; Y227-Y231 HydrophobicContact CD1-CE2 3.75Å; Y227-Y231 HydrophobicContact CE1-CE2 4.15Å; T229-Y231 VanDerWaalsContact C-N 3.26Å; T229-Y231 PolarHBondContact O-N 3.26Å; Y231-E236 VanDerWaalsContact CA-OE2 3.24Å; Y231-E236 WeakPolarHBondContact CA-OE2 3.19Å; Y231-E236 HydrophobicContact CD1-CB 4.37Å; Y231-A239 HydrophobicContact CE1-CB 4.39Å; Y231-R240 HydrophobicContact CD1-CB 3.89Å; Y231-R240 HydrophobicContact CD1-CG 4.48Å; Y231-R240 HydrophobicContact CD2-CB 3.97Å; Y231-R240 HydrophobicContact CD2-CG 3.64Å; Y231-R240 HydrophobicContact CE1-CB 4.47Å; Y231-R240 HydrophobicContact CE2-CG 4.28Å; Y231-R240 HydrophobicContact CG-CB 3.6Å; Y231-R240 HydrophobicContact CG-CG 3.74Å; Y231-H243 WeakPolarHBondContact OH-CB 3.41Å
232	S	90.7	Very high	94.4	Very high	81 Å²	81	60.5 Å²	60.5	57%	0.566	35%	0.354	S	S	*	.			trans	-115.6	134.4	-171	-75.9	0	0	0	0	113.5	E236	S232-E236 PolarHBondContact N-OE2 3.43Å
233	G	89.4	Confident	94.6	Very high	64 Å²	64	61.1 Å²	61.1	66%	0.66	36%	0.357	S	S	*	.	T	Hydrogen-bonded Turn	trans	72.2	-176.7	174.1	0	0	0	0	0	114.7
234	R	90.4	Very high	94.6	Very high	237 Å²	237	61.2 Å²	61.2	89%	0.894	36%	0.358	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.6	-26.8	-176	-66.8	-174	-176.8	-172.5	1.5	113.4	E236 L237	R234-E236 VanDerWaalsContact C-N 3.32Å; R234-E236 PolarHBondContact O-N 2.87Å; R234-L237 VanDerWaalsContact O-CB 3.31Å; R234-L237 WeakPolarHBondContact O-CB 3.44Å; R234-L237 PolarHBondContact O-N 3.3Å
235	G	95.1	Very high	94.8	Very high	78 Å²	78	62.3 Å²	62.3	80%	0.804	37%	0.369	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.3	-32.9	-177.5	0	0	0	0	0	113.5
236	E	96	Very high	94.9	Very high	89 Å²	89	69 Å²	69	42%	0.416	39%	0.391	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.3	0.4	-178	-64.5	-177.9	-177.7	0	0	113.4	Y231 S232 R234 S238 A239 R240	Y231-E236 VanDerWaalsContact CA-OE2 3.24Å; Y231-E236 WeakPolarHBondContact CA-OE2 3.19Å; Y231-E236 HydrophobicContact CD1-CB 4.37Å; S232-E236 PolarHBondContact N-OE2 3.43Å; R234-E236 VanDerWaalsContact C-N 3.32Å; R234-E236 PolarHBondContact O-N 2.87Å; E236-S238 VanDerWaalsContact C-N 3.29Å; E236-S238 PolarHBondContact O-N 3.44Å; E236-A239 PolarHBondContact O-N 3.18Å; E236-R240 WeakPolarHBondContact O-CB 3.47Å; E236-R240 PolarHBondContact O-N 2.83Å
237	L	93.6	Very high	94.9	Very high	75 Å²	75	68.2 Å²	68.2	39%	0.393	39%	0.387	S	S	.	.	H	α-helix	trans	-56.6	-43	-177.1	179.6	60.3	0	0	0	112	R234 R240 Q241	R234-L237 VanDerWaalsContact O-CB 3.31Å; R234-L237 WeakPolarHBondContact O-CB 3.44Å; R234-L237 PolarHBondContact O-N 3.3Å; L237-R240 PolarHBondContact O-N 3.4Å; L237-Q241 HydrophobicContact CD1-CG 4.06Å; L237-Q241 HydrophobicContact CG-CG 4.44Å; L237-Q241 WeakPolarHBondContact O-CB 3.39Å; L237-Q241 VanDerWaalsContact O-CG 3.24Å; L237-Q241 WeakPolarHBondContact O-CG 3.17Å; L237-Q241 PolarHBondContact O-N 3.45Å
238	S	95.9	Very high	95	Very high	101 Å²	101	68 Å²	68	71%	0.706	39%	0.387	S	S	*	.	H	α-helix	trans	-63.6	-46.7	179.3	-175.4	0	0	0	0	111.9	E236 Q241 G242	E236-S238 VanDerWaalsContact C-N 3.29Å; E236-S238 PolarHBondContact O-N 3.44Å; S238-Q241 PolarHBondContact O-N 3.41Å; S238-G242 PolarHBondContact O-N 2.9Å
239	A	96.7	Very high	95.4	Very high	59 Å²	59	70.1 Å²	70.1	49%	0.488	39%	0.394	S	S	.	.	H	α-helix	trans	-62.7	-44.9	178	0	0	0	0	0	111.5	Y231 E236 Q241 G242 H243	Y231-A239 HydrophobicContact CE1-CB 4.39Å; E236-A239 PolarHBondContact O-N 3.18Å; A239-Q241 PolarHBondContact O-N 3.37Å; A239-G242 PolarHBondContact O-N 3.3Å; A239-H243 WeakPolarHBondContact O-CB 3.48Å; A239-H243 PolarHBondContact O-N 3.27Å
240	R	97	Very high	95.7	Very high	61 Å²	61	66.5 Å²	66.5	23%	0.23	37%	0.371	C	S	.	.	H	α-helix	trans	-56.5	-50	174.5	-171.9	-167.2	75.6	-166.5	7.9	111.8	Y227 Y231 E236 L237 H243 L244	Y227-R240 HydrophobicContact CD1-CG 3.89Å; Y227-R240 WeakPolarHBondContact O-CD 3.49Å; Y231-R240 HydrophobicContact CD1-CB 3.89Å; Y231-R240 HydrophobicContact CD1-CG 4.48Å; Y231-R240 HydrophobicContact CD2-CB 3.97Å; Y231-R240 HydrophobicContact CD2-CG 3.64Å; Y231-R240 HydrophobicContact CE1-CB 4.47Å; Y231-R240 HydrophobicContact CE2-CG 4.28Å; Y231-R240 HydrophobicContact CG-CB 3.6Å; Y231-R240 HydrophobicContact CG-CG 3.74Å; E236-R240 WeakPolarHBondContact O-CB 3.47Å; E236-R240 PolarHBondContact O-N 2.83Å; L237-R240 PolarHBondContact O-N 3.4Å; R240-H243 PolarHBondContact O-N 2.64Å; R240-L244 WeakPolarHBondContact O-CB 3.49Å; R240-L244 PolarHBondContact O-N 3.07Å
241	Q	97.1	Very high	95.9	Very high	29 Å²	29	63.5 Å²	63.5	14%	0.136	36%	0.355	C	S	.	.	H	α-helix	trans	-64.9	-39.5	-179.7	-75	-48.8	113.5	0	0	111.7	L237 S238 A239 G245 G287 I290	L237-Q241 HydrophobicContact CD1-CG 4.06Å; L237-Q241 HydrophobicContact CG-CG 4.44Å; L237-Q241 WeakPolarHBondContact O-CB 3.39Å; L237-Q241 VanDerWaalsContact O-CG 3.24Å; L237-Q241 WeakPolarHBondContact O-CG 3.17Å; L237-Q241 PolarHBondContact O-N 3.45Å; S238-Q241 PolarHBondContact O-N 3.41Å; A239-Q241 PolarHBondContact O-N 3.37Å; Q241-G245 PolarHBondContact O-N 2.82Å; Q241-G287 PolarHBondContact NE2-O 2.91Å; Q241-I290 HydrophobicContact CB-CD1 3.6Å; Q241-I290 HydrophobicContact CG-CD1 4.24Å; Q241-I290 VanDerWaalsContact O-CD1 3.31Å; Q241-I290 WeakPolarHBondContact O-CD1 3.48Å
242	G	97.6	Very high	95.9	Very high	34 Å²	34	63.5 Å²	63.5	35%	0.351	36%	0.358	S	S	.	.	H	α-helix	trans	-65	-39.9	174.7	0	0	0	0	0	113.1	S238 A239 R246	S238-G242 PolarHBondContact O-N 2.9Å; A239-G242 PolarHBondContact O-N 3.3Å; G242-R246 PolarHBondContact O-N 3.28Å
243	H	98.1	Very high	96.1	Very high	14 Å²	14	61.1 Å²	61.1	7%	0.065	34%	0.336	C	S	.	.	H	α-helix	trans	-69.4	-46.5	176.3	-169.4	-94.8	0	0	0	111.8	T196 D197 T200 Y227 Y231 A239 R240 G245 R246 F247	T196-H243 PolarHBondContact O-CE1 3.23Å; D197-H243 IonicContact OD1-NE2 2.73Å; T200-H243 PolarHBondContact OG1-CE1 3.12Å; T200-H243 VanDerWaalsContact OG1-CE1 3.23Å; Y227-H243 HydrophobicContact CE1-CB 4.13Å; Y227-H243 AromaticContact CE1-ND1 3.27Å; Y227-H243 VanDerWaalsContact CE1-ND1 3.27Å; Y227-H243 WeakPolarHBondContact CE1-ND1 3.37Å; Y227-H243 AromaticContact CZ-ND1 3.43Å; Y227-H243 PolarHBondContact OH-CE1 2.83Å; Y227-H243 PolarHBondContact OH-ND1 2.94Å; Y231-H243 WeakPolarHBondContact OH-CB 3.41Å; A239-H243 WeakPolarHBondContact O-CB 3.48Å; A239-H243 PolarHBondContact O-N 3.27Å; R240-H243 PolarHBondContact O-N 2.64Å; H243-G245 VanDerWaalsContact C-N 3.32Å; H243-G245 PolarHBondContact O-N 3.31Å; H243-R246 PolarHBondContact O-N 2.94Å; H243-F247 PolarHBondContact O-N 2.99Å; H243-F247 VanDerWaalsContact O-N 3.07Å
244	L	97.9	Very high	96.5	Very high	2 Å²	2	58.3 Å²	58.3	1%	0.01	31%	0.306	C	S	.	.	H	α-helix	trans	-59.3	-42	176.1	179.7	62.3	0	0	0	111.9	Y227 R240 R246 F247 L248	Y227-L244 HydrophobicContact CD1-CB 4.2Å; Y227-L244 HydrophobicContact CD2-CD1 4.22Å; Y227-L244 HydrophobicContact CE1-CB 3.79Å; Y227-L244 HydrophobicContact CE1-CD1 4.38Å; Y227-L244 HydrophobicContact CE2-CD1 3.9Å; R240-L244 WeakPolarHBondContact O-CB 3.49Å; R240-L244 PolarHBondContact O-N 3.07Å; L244-R246 VanDerWaalsContact C-N 3.32Å; L244-R246 PolarHBondContact O-N 3.15Å; L244-F247 HydrophobicContact CD1-CD1 4.48Å; L244-F247 PolarHBondContact O-N 3.41Å; L244-L248 HydrophobicContact CD1-CD1 4.01Å; L244-L248 HydrophobicContact CD1-CG 4.08Å; L244-L248 HydrophobicContact CD2-CD1 4.47Å; L244-L248 HydrophobicContact CG-CD1 3.81Å; L244-L248 HydrophobicContact CG-CG 4.32Å; L244-L248 VanDerWaalsContact O-CG 3.3Å; L244-L248 WeakPolarHBondContact O-CG 3.42Å; L244-L248 PolarHBondContact O-N 2.85Å
245	G	97.9	Very high	96.8	Very high	24 Å²	24	47 Å²	47	25%	0.247	26%	0.263	C	S	.	.	H	α-helix	trans	-60.6	-39.6	177.2	0	0	0	0	0	113.1	Q241 H243 R249	Q241-G245 PolarHBondContact O-N 2.82Å; H243-G245 VanDerWaalsContact C-N 3.32Å; H243-G245 PolarHBondContact O-N 3.31Å; G245-R249 WeakPolarHBondContact O-CB 3.36Å; G245-R249 PolarHBondContact O-N 2.85Å
246	R	96.8	Very high	96.7	Very high	155 Å²	155	47.3 Å²	47.3	59%	0.585	25%	0.247	S	C	*	.	H	α-helix	trans	-65.7	-45.1	174.4	-71.9	-170	-63.9	-96.4	5.7	111.9	G242 H243 L244 L248 R249 M250	G242-R246 PolarHBondContact O-N 3.28Å; H243-R246 PolarHBondContact O-N 2.94Å; L244-R246 VanDerWaalsContact C-N 3.32Å; L244-R246 PolarHBondContact O-N 3.15Å; R246-L248 PolarHBondContact O-N 2.77Å; R246-R249 PolarHBondContact O-N 2.95Å; R246-M250 WeakPolarHBondContact O-CG 3.28Å; R246-M250 PolarHBondContact O-N 3.1Å
247	F	98.3	Very high	96.5	Very high	0 Å²	0	43.5 Å²	43.5	0%	0	23%	0.229	C	C	.	.	H	α-helix	trans	-58.3	-48.2	177.4	176.3	-103.4	0	0	0	112.1	Q199 L203 V220 A223 Y227 H243 L244 R249 M250 L251	Q199-F247 HydrophobicContact CG-CE2 3.74Å; Q199-F247 HydrophobicContact CG-CZ 3.92Å; L203-F247 HydrophobicContact CD1-CD2 3.6Å; L203-F247 HydrophobicContact CD1-CE2 3.41Å; L203-F247 VanDerWaalsContact CD1-CE2 3.41Å; L203-F247 HydrophobicContact CD1-CZ 4.23Å; L203-F247 HydrophobicContact CD2-CE2 4.26Å; L203-F247 HydrophobicContact CG-CD2 4.33Å; L203-F247 HydrophobicContact CG-CE2 3.81Å; V220-F247 HydrophobicContact CG1-CE1 4.44Å; V220-F247 HydrophobicContact CG1-CZ 4.01Å; V220-F247 HydrophobicContact CG2-CZ 4.29Å; A223-F247 HydrophobicContact CB-CE1 4.31Å; Y227-F247 VanDerWaalsContact OH-CB 3.29Å; Y227-F247 WeakPolarHBondContact OH-CB 3.5Å; H243-F247 PolarHBondContact O-N 2.99Å; H243-F247 VanDerWaalsContact O-N 3.07Å; L244-F247 HydrophobicContact CD1-CD1 4.48Å; L244-F247 PolarHBondContact O-N 3.41Å; F247-R249 VanDerWaalsContact C-N 3.33Å; F247-R249 PolarHBondContact O-N 2.97Å; F247-M250 WeakPolarHBondContact O-CB 3.42Å; F247-M250 PolarHBondContact O-N 3.28Å; F247-L251 HydrophobicContact CD1-CD1 4.18Å; F247-L251 HydrophobicContact CE1-CD1 3.58Å; F247-L251 HydrophobicContact CE1-CG 4.24Å; F247-L251 HydrophobicContact CZ-CD1 3.92Å; F247-L251 HydrophobicContact CZ-CD2 4.43Å; F247-L251 HydrophobicContact CZ-CG 4.23Å; F247-L251 PolarHBondContact O-N 3.05Å
248	L	98.2	Very high	96.6	Very high	3 Å²	3	41.1 Å²	41.1	2%	0.016	22%	0.215	C	C	.	.	H	α-helix	trans	-65.4	-35.3	178.1	-65.6	167.8	0	0	0	112.6	L244 R246 M250 L251 L252 I264 I290 L291 A294	L244-L248 HydrophobicContact CD1-CD1 4.01Å; L244-L248 HydrophobicContact CD1-CG 4.08Å; L244-L248 HydrophobicContact CD2-CD1 4.47Å; L244-L248 HydrophobicContact CG-CD1 3.81Å; L244-L248 HydrophobicContact CG-CG 4.32Å; L244-L248 VanDerWaalsContact O-CG 3.3Å; L244-L248 WeakPolarHBondContact O-CG 3.42Å; L244-L248 PolarHBondContact O-N 2.85Å; R246-L248 PolarHBondContact O-N 2.77Å; L248-M250 VanDerWaalsContact C-N 3.34Å; L248-L251 HydrophobicContact CD2-CD1 4.34Å; L248-L251 PolarHBondContact O-N 2.89Å; L248-L252 PolarHBondContact O-N 3.15Å; L248-I264 HydrophobicContact CD2-CD1 4.17Å; L248-I290 HydrophobicContact CD1-CG2 4.09Å; L248-L291 HydrophobicContact CD1-CB 4.23Å; L248-L291 HydrophobicContact CD1-CD1 3.59Å; L248-L291 HydrophobicContact CD2-CD1 3.46Å; L248-L291 VanDerWaalsContact CD2-CD1 3.46Å; L248-L291 HydrophobicContact CG-CD1 4.16Å; L248-A294 HydrophobicContact CB-CB 3.93Å; L248-A294 HydrophobicContact CD1-CB 3.89Å; L248-A294 HydrophobicContact CG-CB 4.39Å
249	R	96.7	Very high	96.5	Very high	163 Å²	163	38.2 Å²	38.2	62%	0.615	20%	0.201	S	C	*	.	H	α-helix	trans	-65.3	-37.5	173.9	-178.8	59.8	175	-176.6	4.2	112	G245 R246 F247 L252 R253	G245-R249 WeakPolarHBondContact O-CB 3.36Å; G245-R249 PolarHBondContact O-N 2.85Å; R246-R249 PolarHBondContact O-N 2.95Å; F247-R249 VanDerWaalsContact C-N 3.33Å; F247-R249 PolarHBondContact O-N 2.97Å; R249-L252 PolarHBondContact O-N 3.33Å; R249-R253 PolarHBondContact O-N 2.7Å
250	M	96.7	Very high	96.6	Very high	22 Å²	22	35.4 Å²	35.4	11%	0.108	18%	0.178	C	C	.	.	H	α-helix	trans	-66.7	-41.3	174.7	-71.4	176.4	68.7	0	0	111.7	T200 L203 Y204 R246 F247 L248 L252 R253 L254	T200-M250 HydrophobicContact CG2-CE 4.23Å; T200-M250 HydrophobicContact CG2-SD 3.64Å; L203-M250 HydrophobicContact CB-CE 3.86Å; L203-M250 HydrophobicContact CD1-CB 3.75Å; L203-M250 HydrophobicContact CD1-CE 4.47Å; Y204-M250 HydrophobicContact CD1-CE 4.02Å; Y204-M250 HydrophobicContact CD2-CE 3.94Å; Y204-M250 HydrophobicContact CE1-CE 3.66Å; Y204-M250 HydrophobicContact CE2-CE 3.58Å; Y204-M250 HydrophobicContact CE2-SD 4.42Å; Y204-M250 HydrophobicContact CG-CE 4.15Å; Y204-M250 VanDerWaalsContact CZ-CE 3.42Å; R246-M250 WeakPolarHBondContact O-CG 3.28Å; R246-M250 PolarHBondContact O-N 3.1Å; F247-M250 WeakPolarHBondContact O-CB 3.42Å; F247-M250 PolarHBondContact O-N 3.28Å; L248-M250 VanDerWaalsContact C-N 3.34Å; M250-L252 VanDerWaalsContact C-N 3.34Å; M250-L252 PolarHBondContact O-N 2.52Å; M250-R253 WeakPolarHBondContact O-CB 3.32Å; M250-R253 PolarHBondContact O-N 2.85Å; M250-L254 WeakPolarHBondContact O-CG 3.37Å; M250-L254 PolarHBondContact O-N 3.26Å
251	L	98.1	Very high	96.6	Very high	0 Å²	0	32.5 Å²	32.5	0%	0	17%	0.167	C	C	.	.	H	α-helix	trans	-58.6	-45.3	173.3	-74	179.7	0	0	0	112.3	I121 L203 L218 V220 F247 L248 R253 L254 A255 V262 I264	I121-L251 HydrophobicContact CD1-CB 4Å; L203-L251 HydrophobicContact CD1-CD2 3.85Å; L203-L251 HydrophobicContact CD1-CG 4Å; L203-L251 HydrophobicContact CD2-CD2 3.66Å; L203-L251 HydrophobicContact CG-CD2 4.44Å; L218-L251 HydrophobicContact CD2-CD2 3.64Å; V220-L251 HydrophobicContact CG2-CD1 4.37Å; V220-L251 HydrophobicContact CG2-CD2 4.04Å; F247-L251 HydrophobicContact CD1-CD1 4.18Å; F247-L251 HydrophobicContact CE1-CD1 3.58Å; F247-L251 HydrophobicContact CE1-CG 4.24Å; F247-L251 HydrophobicContact CZ-CD1 3.92Å; F247-L251 HydrophobicContact CZ-CD2 4.43Å; F247-L251 HydrophobicContact CZ-CG 4.23Å; F247-L251 PolarHBondContact O-N 3.05Å; L248-L251 HydrophobicContact CD2-CD1 4.34Å; L248-L251 PolarHBondContact O-N 2.89Å; L251-R253 VanDerWaalsContact C-N 3.32Å; L251-R253 PolarHBondContact O-N 3.39Å; L251-L254 PolarHBondContact O-N 2.88Å; L251-A255 PolarHBondContact O-N 2.94Å; L251-V262 HydrophobicContact CB-CG1 4.23Å; L251-V262 HydrophobicContact CD1-CG1 4.24Å; L251-V262 HydrophobicContact CD2-CG1 4.1Å; L251-V262 HydrophobicContact CG-CG1 4.44Å; L251-I264 HydrophobicContact CD1-CG2 3.81Å
252	L	96.8	Very high	96.7	Very high	43 Å²	43	31.1 Å²	31.1	23%	0.225	16%	0.161	C	C	.	.	H	α-helix	trans	-62.9	-41	177	-177.4	62.5	0	0	0	111.1	I121 L248 R249 M250 L254 A255 D256	I121-L252 HydrophobicContact CD1-CB 4.01Å; L248-L252 PolarHBondContact O-N 3.15Å; R249-L252 PolarHBondContact O-N 3.33Å; M250-L252 VanDerWaalsContact C-N 3.34Å; M250-L252 PolarHBondContact O-N 2.52Å; L252-L254 VanDerWaalsContact C-N 3.34Å; L252-L254 PolarHBondContact O-N 2.79Å; L252-A255 WeakPolarHBondContact O-CB 3.33Å; L252-A255 PolarHBondContact O-N 3.4Å; L252-A255 VanDerWaalsContact O-N 3.15Å; L252-D256 PolarHBondContact O-N 3.44Å
253	R	94.9	Very high	96.8	Very high	31 Å²	31	29.5 Å²	29.5	12%	0.117	14%	0.144	C	C	.	.	H	α-helix	trans	-59.1	-44.7	175	-170.6	177.3	75.9	-173.4	4.5	111.7	E58 R249 M250 L251 A255 D256 E257	E58-R253 IonicContact OE1-NH1 2.75Å; E58-R253 PolarHBondContact OE1-NH1 2.81Å; R249-R253 PolarHBondContact O-N 2.7Å; M250-R253 WeakPolarHBondContact O-CB 3.32Å; M250-R253 PolarHBondContact O-N 2.85Å; L251-R253 VanDerWaalsContact C-N 3.32Å; L251-R253 PolarHBondContact O-N 3.39Å; R253-A255 VanDerWaalsContact C-N 3.29Å; R253-A255 PolarHBondContact O-N 3Å; R253-D256 PolarHBondContact O-N 3.2Å; R253-E257 WeakPolarHBondContact O-CB 3.35Å; R253-E257 PolarHBondContact O-N 3.13Å
254	L	96.6	Very high	96.8	Very high	4 Å²	4	28.9 Å²	28.9	2%	0.021	14%	0.141	C	C	.	.	H	α-helix	trans	-61.5	-39.2	176.2	-68.2	175.4	0	0	0	111.9	L203 A206 M210 L218 M250 L251 L252 F258	L203-L254 HydrophobicContact CB-CD1 4.27Å; L203-L254 HydrophobicContact CD2-CD1 4.05Å; A206-L254 HydrophobicContact CB-CD1 4.4Å; M210-L254 HydrophobicContact SD-CD2 4.4Å; L218-L254 HydrophobicContact CD2-CD1 3.84Å; M250-L254 WeakPolarHBondContact O-CG 3.37Å; M250-L254 PolarHBondContact O-N 3.26Å; L251-L254 PolarHBondContact O-N 2.88Å; L252-L254 VanDerWaalsContact C-N 3.34Å; L252-L254 PolarHBondContact O-N 2.79Å; L254-F258 HydrophobicContact CD2-CD2 3.96Å; L254-F258 HydrophobicContact CD2-CE2 3.74Å; L254-F258 PolarHBondContact O-N 3.3Å
255	A	96.5	Very high	96.8	Very high	0 Å²	0	28.8 Å²	28.8	0%	0	14%	0.141	C	C	.	.	H	α-helix	trans	-63.6	-46.4	176	0	0	0	0	0	111.7	L251 L252 R253 G259 V262	L251-A255 PolarHBondContact O-N 2.94Å; L252-A255 WeakPolarHBondContact O-CB 3.33Å; L252-A255 PolarHBondContact O-N 3.4Å; L252-A255 VanDerWaalsContact O-N 3.15Å; R253-A255 VanDerWaalsContact C-N 3.29Å; R253-A255 PolarHBondContact O-N 3Å; A255-G259 WeakPolarHBondContact O-CA 3.3Å; A255-G259 PolarHBondContact O-N 2.88Å; A255-V262 HydrophobicContact CB-CG2 3.84Å
256	D	92.5	Very high	96.8	Very high	85 Å²	85	27.7 Å²	27.7	46%	0.455	13%	0.129	S	C	.	.	H	α-helix	trans	-69.1	-36.2	179.9	-66.4	-27.6	0	0	0	112.6	L252 R253	L252-D256 PolarHBondContact O-N 3.44Å; R253-D256 PolarHBondContact O-N 3.2Å
257	E	92.9	Very high	96.6	Very high	8 Å²	8	22.1 Å²	22.1	4%	0.037	11%	0.11	C	C	.	.	H	α-helix	trans	-77.6	-50	-175.8	-179.9	178.9	167.6	0	0	112.3	T47 E49 R253	T47-E257 WeakPolarHBondContact CB-OE1 3.49Å; T47-E257 HydrophobicContact CG2-CG 4.08Å; T47-E257 WeakPolarHBondContact CG2-OE1 3Å; T47-E257 VanDerWaalsContact OG1-CG 3.28Å; T47-E257 WeakPolarHBondContact OG1-CG 3.29Å; T47-E257 PolarHBondContact OG1-OE1 3.39Å; E49-E257 HydrophobicContact CB-CG 4.24Å; R253-E257 WeakPolarHBondContact O-CB 3.35Å; R253-E257 PolarHBondContact O-N 3.13Å
258	F	94.8	Very high	96.4	Very high	25 Å²	25	23.2 Å²	23.2	11%	0.11	12%	0.117	C	C	.	.	H	α-helix	trans	-100.9	-5.4	-173.9	-62.2	-80.7	0	0	0	113.1	P21 T47 S207 M210 A211 L254 V260	P21-F258 HydrophobicContact CB-CD1 4.25Å; P21-F258 HydrophobicContact CB-CE1 4.28Å; P21-F258 HydrophobicContact CG-CD1 3.63Å; P21-F258 HydrophobicContact CG-CE1 3.92Å; T47-F258 HydrophobicContact CG2-CE1 3.8Å; T47-F258 HydrophobicContact CG2-CZ 3.8Å; S207-F258 WeakPolarHBondContact O-CZ 3.13Å; M210-F258 HydrophobicContact CB-CB 4.44Å; M210-F258 HydrophobicContact CB-CD1 3.43Å; M210-F258 VanDerWaalsContact CB-CD1 3.43Å; M210-F258 HydrophobicContact CB-CD2 3.96Å; M210-F258 HydrophobicContact CB-CE1 3.57Å; M210-F258 HydrophobicContact CB-CE2 4.04Å; M210-F258 HydrophobicContact CB-CG 3.67Å; M210-F258 HydrophobicContact CB-CZ 3.87Å; M210-F258 HydrophobicContact CG-CG 4.41Å; M210-F258 WeakPolarHBondContact O-CD1 3.48Å; M210-F258 WeakPolarHBondContact O-CE1 3.31Å; M210-F258 HydrophobicContact SD-CB 4.26Å; M210-F258 HydrophobicContact SD-CD2 3.83Å; M210-F258 HydrophobicContact SD-CE2 4.41Å; M210-F258 HydrophobicContact SD-CG 4.03Å; A211-F258 HydrophobicContact CB-CE1 4.23Å; L254-F258 HydrophobicContact CD2-CD2 3.96Å; L254-F258 HydrophobicContact CD2-CE2 3.74Å; L254-F258 PolarHBondContact O-N 3.3Å; F258-V260 HydrophobicContact CB-CG1 3.91Å; F258-V260 PolarHBondContact O-N 3.44Å
259	G	94.8	Very high	96	Very high	40 Å²	40	25.3 Å²	25.3	41%	0.412	13%	0.129	S	C	.	.			trans	64.6	26.4	-176.4	0	0	0	0	0	113.1	T118 A255	T118-G259 VanDerWaalsContact CB-O 3.31Å; T118-G259 WeakPolarHBondContact CB-O 3.14Å; A255-G259 WeakPolarHBondContact O-CA 3.3Å; A255-G259 PolarHBondContact O-N 2.88Å
260	V	97.6	Very high	95.4	Very high	0 Å²	0	20.9 Å²	20.9	0%	0	13%	0.127	C	C	.	.			trans	-82.6	147.7	-180	-62.2	0	0	0	0	111.5	G119 M210 Y215 F258 V262	G119-V260 PolarHBondContact N-O 3.07Å; M210-V260 HydrophobicContact CE-CG1 4.27Å; M210-V260 HydrophobicContact CE-CG2 4.27Å; M210-V260 HydrophobicContact SD-CG1 4.22Å; M210-V260 HydrophobicContact SD-CG2 4.41Å; Y215-V260 WeakPolarHBondContact O-CG1 3.27Å; F258-V260 HydrophobicContact CB-CG1 3.91Å; F258-V260 PolarHBondContact O-N 3.44Å; V260-V262 HydrophobicContact CG2-CG2 4.14Å
261	A	98.6	Very high	94.5	Very high	0 Å²	0	22.8 Å²	22.8	0%	0	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.1	130.3	163.4	0	0	0	0	0	109.4	I101 I116 T118 A216 L217 L218	I101-A261 HydrophobicContact CD1-CB 3.77Å; I116-A261 HydrophobicContact CG2-CB 4.1Å; T118-A261 HydrophobicContact CG2-CB 3.98Å; A216-A261 PolarHBondContact O-N 2.87Å; L217-A261 WeakPolarHBondContact CA-O 3.42Å; L217-A261 HydrophobicContact CD1-CB 3.84Å; L218-A261 PolarHBondContact N-O 2.94Å
262	V	98.9	Very high	93.1	Very high	1 Å²	1	29.6 Å²	29.6	1%	0.006	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	118.9	173.5	179.4	0	0	0	0	109.3	S120 I121 T122 L218 L251 A255 V260 I264	S120-V262 PolarHBondContact O-N 3.34Å; I121-V262 WeakPolarHBondContact CA-O 3.32Å; I121-V262 HydrophobicContact CG1-CB 4.1Å; I121-V262 HydrophobicContact CG1-CG1 4.18Å; T122-V262 PolarHBondContact N-O 2.88Å; L218-V262 HydrophobicContact CB-CG2 4.4Å; L218-V262 HydrophobicContact CD2-CG2 4.4Å; L218-V262 WeakPolarHBondContact O-CA 3.25Å; L251-V262 HydrophobicContact CB-CG1 4.23Å; L251-V262 HydrophobicContact CD1-CG1 4.24Å; L251-V262 HydrophobicContact CD2-CG1 4.1Å; L251-V262 HydrophobicContact CG-CG1 4.44Å; A255-V262 HydrophobicContact CB-CG2 3.84Å; V260-V262 HydrophobicContact CG2-CG2 4.14Å; V262-I264 HydrophobicContact CG1-CG2 4.09Å
263	V	98.9	Very high	91.9	Very high	0 Å²	0	31.2 Å²	31.2	0%	0	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114	120.2	177.5	176.3	0	0	0	0	109.3	I116 T122 M124 L139 L217 L218 I219 V220	I116-V263 HydrophobicContact CG2-CG2 3.72Å; T122-V263 WeakPolarHBondContact O-CA 3.3Å; M124-V263 HydrophobicContact CE-CG1 3.34Å; M124-V263 HydrophobicContact SD-CG1 4.37Å; L139-V263 HydrophobicContact CD1-CG1 4.42Å; L139-V263 HydrophobicContact CD1-CG2 4.28Å; L217-V263 HydrophobicContact CD1-CB 4.36Å; L217-V263 HydrophobicContact CD1-CG2 3.74Å; L218-V263 PolarHBondContact O-N 2.88Å; I219-V263 CarbonylContact C-O 3.46Å; I219-V263 VanDerWaalsContact CA-O 3.31Å; I219-V263 WeakPolarHBondContact CA-O 3.07Å; I219-V263 HydrophobicContact CG1-CB 4.35Å; V220-V263 PolarHBondContact N-O 3.3Å
264	I	98.8	Very high	90.4	Very high	0 Å²	0	32.6 Å²	32.6	0%	0	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115	137.9	176.2	65.6	178.2	0	0	0	110.1	I121 T122 E123 M124 V220 A223 L248 L251 V262 L291	I121-I264 HydrophobicContact CG2-CD1 3.81Å; I121-I264 HydrophobicContact CG2-CG1 4.09Å; I121-I264 HydrophobicContact CG2-CG2 4.48Å; T122-I264 PolarHBondContact O-N 2.96Å; E123-I264 CarbonylContact C-O 3.57Å; E123-I264 WeakPolarHBondContact CA-O 3.38Å; E123-I264 HydrophobicContact CB-CD1 4.19Å; E123-I264 HydrophobicContact CB-CG1 3.89Å; E123-I264 HydrophobicContact CG-CD1 4.31Å; E123-I264 HydrophobicContact CG-CG1 4.09Å; M124-I264 PolarHBondContact N-O 2.94Å; V220-I264 HydrophobicContact CB-CG2 4.12Å; V220-I264 HydrophobicContact CG2-CG2 4.39Å; A223-I264 HydrophobicContact CB-CB 3.92Å; A223-I264 HydrophobicContact CB-CD1 4.44Å; A223-I264 HydrophobicContact CB-CG2 4.22Å; L248-I264 HydrophobicContact CD2-CD1 4.17Å; L251-I264 HydrophobicContact CD1-CG2 3.81Å; V262-I264 HydrophobicContact CG1-CG2 4.09Å; I264-L291 HydrophobicContact CD1-CD1 3.68Å
265	T	98.6	Very high	88.8	Confident	0 Å²	0	35.4 Å²	35.4	0%	0	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.1	149.5	168.7	78.7	0	0	0	0	110.3	M124 K132 C136 V220 D221 S222 A223	M124-T265 HydrophobicContact CE-CG2 4.01Å; M124-T265 CarbonylContact O-C 3.53Å; M124-T265 WeakPolarHBondContact O-CA 3.38Å; K132-T265 HydrophobicContact CB-CG2 4.11Å; C136-T265 WeakPolarHBondContact SG-CG2 3.41Å; V220-T265 PolarHBondContact O-N 3.19Å; D221-T265 HydrophobicContact CB-CG2 4.21Å; D221-T265 WeakPolarHBondContact OD1-CB 3.33Å; D221-T265 VanDerWaalsContact OD1-CG2 3.28Å; D221-T265 WeakPolarHBondContact OD1-CG2 3.48Å; D221-T265 PolarHBondContact OD1-OG1 3.35Å; S222-T265 WeakPolarHBondContact CA-OG1 3.4Å; S222-T265 VanDerWaalsContact CB-O 3.3Å; S222-T265 WeakPolarHBondContact CB-O 3.45Å; S222-T265 WeakPolarHBondContact CB-OG1 3.38Å; A223-T265 PolarHBondContact N-O 2.97Å
266	N	96.9	Very high	87.1	Confident	1 Å²	1	36.3 Å²	36.3	1%	0.005	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.4	155.8	178.7	-172.5	11.6	0	0	0	110.9	E123 M124 F125 K132 T224 I286 L291	E123-N266 HydrophobicContact CG-CB 4.15Å; E123-N266 WeakPolarHBondContact OE1-CB 3.36Å; E123-N266 PolarHBondContact OE1-ND2 3.11Å; M124-N266 PolarHBondContact O-N 3.15Å; F125-N266 WeakPolarHBondContact CA-O 3.42Å; F125-N266 HydrophobicContact CB-CB 3.93Å; K132-N266 VanDerWaalsContact CD-O 3.31Å; K132-N266 WeakPolarHBondContact CD-O 3.45Å; K132-N266 VanDerWaalsContact CE-O 3.32Å; K132-N266 WeakPolarHBondContact CE-O 3.42Å; T224-N266 WeakPolarHBondContact CB-OD1 3.42Å; T224-N266 HydrophobicContact CG2-CB 4.46Å; T224-N266 VanDerWaalsContact CG2-OD1 3.25Å; T224-N266 WeakPolarHBondContact CG2-OD1 3.44Å; T224-N266 PolarHBondContact OG1-OD1 3.37Å; N266-I286 PolarHBondContact ND2-N 3Å; N266-I286 PolarHBondContact ND2-O 3.14Å; N266-L291 HydrophobicContact CB-CD2 4.45Å; N266-L291 WeakPolarHBondContact ND2-CD2 3.32Å
267	Q	93.3	Very high	85.6	Confident	38 Å²	38	40.2 Å²	40.2	18%	0.178	26%	0.259	C	S	.	.			trans	-100.1	162.4	178.2	-59.2	175.7	-2.9	0	0	110.1	E162 R228 I286	E162-Q267 PolarHBondContact OE1-NE2 3.11Å; R228-Q267 VanDerWaalsContact CD-OE1 3.28Å; Q267-I286 HydrophobicContact CB-CD1 3.84Å; Q267-I286 WeakPolarHBondContact O-CG1 3.46Å; Q267-I286 PolarHBondContact O-N 3.21Å
268	V	93.4	Very high	84.3	Confident	24 Å²	24	48.8 Å²	48.8	15%	0.145	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	153.7	174	-64.3	0	0	0	0	111.1	F125 E127 K283 K284	F125-V268 HydrophobicContact CD2-CG1 3.74Å; F125-V268 HydrophobicContact CE2-CG1 4.5Å; E127-V268 HydrophobicContact CB-CG2 4.42Å; E127-V268 HydrophobicContact CG-CG2 3.73Å; V268-K283 HydrophobicContact CB-CB 4.45Å; V268-K283 HydrophobicContact CG2-CD 4.28Å; V268-K284 WeakPolarHBondContact CA-O 3.49Å
269	V	88.9	Confident	83	Confident	46 Å²	46	50.4 Å²	50.4	28%	0.279	31%	0.311	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124	147.6	170	-69.5	0	0	0	0	110	K284 I286	V269-K284 HydrophobicContact CG2-CG 3.81Å; V269-K284 PolarHBondContact N-O 3.4Å; V269-K284 PolarHBondContact O-N 2.82Å; V269-I286 HydrophobicContact CG1-CD1 3.67Å; V269-I286 HydrophobicContact CG1-CG1 3.69Å; V269-I286 HydrophobicContact CG2-CG1 4.25Å
270	A	85.2	Confident	81.6	Confident	70 Å²	70	54 Å²	54	58%	0.579	34%	0.336	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-71	137.9	171.5	0	0	0	0	0	110.3
271	Q	77.6	Confident	80.3	Confident	63 Å²	63	56.6 Å²	56.6	29%	0.294	35%	0.35	S	S	.	.			trans	-88.8	120.2	167.7	-170.4	168.4	-14.5	0	0	107.7	D273 A276 P282	Q271-D273 WeakPolarHBondContact CG-OD1 3.43Å; Q271-D273 WeakPolarHBondContact CG-OD2 3.33Å; Q271-D273 PolarHBondContact NE2-OD1 3.04Å; Q271-D273 PolarHBondContact NE2-OD2 2.75Å; Q271-A276 WeakPolarHBondContact O-CB 3.27Å; Q271-P282 VanDerWaalsContact CB-O 3.3Å; Q271-P282 WeakPolarHBondContact CB-O 3.48Å; Q271-P282 PolarHBondContact N-O 3.27Å
272	V	68.7	Low	79.4	Confident	142 Å²	142	58.7 Å²	58.7	86%	0.861	36%	0.364	S	S	*	.			trans	-110.4	19.8	-175.2	-65.5	0	0	0	0	112.4
273	D	71.6	Confident	78.8	Confident	78 Å²	78	61.9 Å²	61.9	42%	0.417	38%	0.378	S	S	.	.	S	Bend	trans	-86	168.4	177.1	62.8	21.9	0	0	0	112.2	Q271 A275 A276	Q271-D273 WeakPolarHBondContact CG-OD1 3.43Å; Q271-D273 WeakPolarHBondContact CG-OD2 3.33Å; Q271-D273 PolarHBondContact NE2-OD1 3.04Å; Q271-D273 PolarHBondContact NE2-OD2 2.75Å; D273-A275 PolarHBondContact O-N 2.82Å; D273-A275 VanDerWaalsContact O-N 3.13Å; D273-A275 PolarHBondContact OD1-N 2.94Å; D273-A276 WeakPolarHBondContact O-CB 3.48Å; D273-A276 PolarHBondContact O-N 2.8Å; D273-A276 PolarHBondContact OD1-N 2.86Å
274	G	63.2	Low	78.4	Confident	60 Å²	60	66.7 Å²	66.7	62%	0.619	40%	0.399	S	S	*	.	G	3₁₀ helix	trans	-62.7	-18.7	-177.8	0	0	0	0	0	114.4	A276	G274-A276 VanDerWaalsContact C-N 3.34Å
275	A	63.1	Low	78.2	Confident	62 Å²	62	67.6 Å²	67.6	51%	0.512	40%	0.404	S	S	.	.	G	3₁₀ helix	trans	-76.6	-22.9	174.8	0	0	0	0	0	112.3	D273 M277 F278 S279	D273-A275 PolarHBondContact O-N 2.82Å; D273-A275 VanDerWaalsContact O-N 3.13Å; D273-A275 PolarHBondContact OD1-N 2.94Å; A275-M277 PolarHBondContact O-N 3.38Å; A275-F278 PolarHBondContact O-N 2.94Å; A275-F278 VanDerWaalsContact O-N 3.12Å; A275-S279 PolarHBondContact O-N 2.82Å
276	A	61.2	Low	77.9	Confident	19 Å²	19	68.7 Å²	68.7	16%	0.157	41%	0.41	C	S	.	.	G	3₁₀ helix	trans	-62.6	-23	176.7	0	0	0	0	0	113.5	Q271 D273 G274 F278 S279 P282	Q271-A276 WeakPolarHBondContact O-CB 3.27Å; D273-A276 WeakPolarHBondContact O-CB 3.48Å; D273-A276 PolarHBondContact O-N 2.8Å; D273-A276 PolarHBondContact OD1-N 2.86Å; G274-A276 VanDerWaalsContact C-N 3.34Å; A276-F278 PolarHBondContact O-N 3.23Å; A276-S279 PolarHBondContact O-N 3.08Å; A276-P282 HydrophobicContact CB-CB 3.93Å
277	M	60.8	Low	77.6	Confident	167 Å²	167	68.8 Å²	68.8	82%	0.823	41%	0.412	S	S	*	.	G	3₁₀ helix	trans	-64.5	-21.3	174.7	-96.9	-170.4	-126.7	0	0	113.7	A275	A275-M277 PolarHBondContact O-N 3.38Å
278	F	66.1	Low	77.6	Confident	189 Å²	189	69 Å²	69	83%	0.829	42%	0.424	S	S	*	.	G	3₁₀ helix	trans	-112.7	2	-179.2	-57.2	-75	0	0	0	112.9	A275 A276	A275-F278 PolarHBondContact O-N 2.94Å; A275-F278 VanDerWaalsContact O-N 3.12Å; A276-F278 PolarHBondContact O-N 3.23Å
279	S	66.2	Low	77.6	Confident	58 Å²	58	73.8 Å²	73.8	41%	0.406	45%	0.449	S	S	.	.			trans	-91.5	127.2	174.6	-173.9	0	0	0	0	110.5	A275 A276 D281	A275-S279 PolarHBondContact O-N 2.82Å; A276-S279 PolarHBondContact O-N 3.08Å; S279-D281 PolarHBondContact O-N 2.94Å; S279-D281 PolarHBondContact OG-O 2.69Å; S279-D281 VanDerWaalsContact OG-O 3.09Å
280	A	65.3	Low	77.8	Confident	115 Å²	115	74.6 Å²	74.6	95%	0.95	45%	0.451	S	S	*	.	S	Bend	trans	-65.4	-25.3	176.7	0	0	0	0	0	113
281	D	71.1	Confident	78.3	Confident	55 Å²	55	71.2 Å²	71.2	29%	0.294	42%	0.423	S	S	.	.	S	Bend	trans	-136.6	98.6	171.7	-163.9	-1.2	0	0	0	109.1	S279 K283 Y300	S279-D281 PolarHBondContact O-N 2.94Å; S279-D281 PolarHBondContact OG-O 2.69Å; S279-D281 VanDerWaalsContact OG-O 3.09Å; D281-K283 PolarHBondContact O-N 3.49Å; D281-K283 WeakPolarHBondContact OD1-CG 3.33Å; D281-K283 IonicContact OD1-NZ 3.74Å; D281-K283 PolarHBondContact OD1-NZ 2.85Å; D281-K283 IonicContact OD2-NZ 2.79Å; D281-Y300 PolarHBondContact OD2-OH 3.39Å
282	P	80.3	Confident	79.1	Confident	45 Å²	45	69.1 Å²	69.1	29%	0.292	42%	0.417	S	S	.	.			trans	-78.3	29.9	-174.9	34	-37.2	0	0	0	112.1	Q271 A276	Q271-P282 VanDerWaalsContact CB-O 3.3Å; Q271-P282 WeakPolarHBondContact CB-O 3.48Å; Q271-P282 PolarHBondContact N-O 3.27Å; A276-P282 HydrophobicContact CB-CB 3.93Å
283	K	85.6	Confident	80.2	Confident	68 Å²	68	70.2 Å²	70.2	30%	0.296	41%	0.412	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	139.6	-175.6	-60.6	-174.4	-151.5	99.2	0	110.5	E127 V268 D281	E127-K283 HydrophobicContact CG-CD 3.72Å; E127-K283 VanDerWaalsContact OE1-CE 3.24Å; E127-K283 WeakPolarHBondContact OE1-CE 3.35Å; E127-K283 IonicContact OE1-NZ 2.84Å; E127-K283 WeakPolarHBondContact OE2-CE 3.36Å; E127-K283 IonicContact OE2-NZ 2.87Å; E127-K283 PolarHBondContact OE2-NZ 3.18Å; V268-K283 HydrophobicContact CB-CB 4.45Å; V268-K283 HydrophobicContact CG2-CD 4.28Å; D281-K283 PolarHBondContact O-N 3.49Å; D281-K283 WeakPolarHBondContact OD1-CG 3.33Å; D281-K283 IonicContact OD1-NZ 3.74Å; D281-K283 PolarHBondContact OD1-NZ 2.85Å; D281-K283 IonicContact OD2-NZ 2.79Å
284	K	90.5	Very high	81.3	Confident	101 Å²	101	67.8 Å²	67.8	44%	0.439	40%	0.402	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	144.1	174.7	64.4	-176.3	-179.4	-176.4	0	111.6	V268 V269	V268-K284 WeakPolarHBondContact CA-O 3.49Å; V269-K284 HydrophobicContact CG2-CG 3.81Å; V269-K284 PolarHBondContact N-O 3.4Å; V269-K284 PolarHBondContact O-N 2.82Å
285	P	93.8	Very high	82.8	Confident	18 Å²	18	65.1 Å²	65.1	12%	0.117	37%	0.374	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.6	151	172	25.6	-32	0	0	0	111.3	F125	F125-P285 HydrophobicContact CB-CB 4.25Å; F125-P285 HydrophobicContact CD1-CB 4.37Å; F125-P285 HydrophobicContact CD2-CB 3.81Å; F125-P285 HydrophobicContact CD2-CG 4.22Å; F125-P285 HydrophobicContact CE2-CB 4.18Å; F125-P285 HydrophobicContact CE2-CG 4.08Å; F125-P285 HydrophobicContact CG-CB 3.9Å; F125-P285 HydrophobicContact CZ-CG 4.23Å
286	I	92.5	Very high	84.4	Confident	23 Å²	23	64.3 Å²	64.3	12%	0.118	36%	0.363	C	S	.	.	T	Hydrogen-bonded Turn	trans	-77.2	161.2	175.4	-60.5	175.1	0	0	0	109.8	T224 R228 N266 Q267 V269 L291	T224-I286 HydrophobicContact CG2-CG2 4.48Å; R228-I286 VanDerWaalsContact CD-CD1 3.46Å; R228-I286 HydrophobicContact CG-CD1 4.02Å; R228-I286 HydrophobicContact CG-CG2 4.5Å; N266-I286 PolarHBondContact ND2-N 3Å; N266-I286 PolarHBondContact ND2-O 3.14Å; Q267-I286 HydrophobicContact CB-CD1 3.84Å; Q267-I286 WeakPolarHBondContact O-CG1 3.46Å; Q267-I286 PolarHBondContact O-N 3.21Å; V269-I286 HydrophobicContact CG1-CD1 3.67Å; V269-I286 HydrophobicContact CG1-CG1 3.69Å; V269-I286 HydrophobicContact CG2-CG1 4.25Å; I286-L291 VanDerWaalsContact O-CD2 3.22Å; I286-L291 WeakPolarHBondContact O-CD2 3.31Å
287	G	91.8	Very high	86.2	Confident	4 Å²	4	64.2 Å²	64.2	4%	0.041	36%	0.361	C	S	.	.	T	Hydrogen-bonded Turn	trans	100.5	-19.9	176.3	0	0	0	0	0	114.5	Q241	Q241-G287 PolarHBondContact NE2-O 2.91Å
288	G	92.6	Very high	88	Confident	42 Å²	42	57 Å²	57	43%	0.433	32%	0.324	S	S	.	.	H	α-helix	trans	61.4	-153.2	176.1	0	0	0	0	0	112.9	I290 L291 A292	G288-I290 VanDerWaalsContact C-N 3.25Å; G288-I290 PolarHBondContact O-N 2.9Å; G288-L291 PolarHBondContact O-N 3.33Å; G288-A292 WeakPolarHBondContact O-CB 3.5Å; G288-A292 PolarHBondContact O-N 3.46Å; G288-A292 VanDerWaalsContact O-N 3.09Å
289	N	92.6	Very high	89.5	Confident	125 Å²	125	48.1 Å²	48.1	67%	0.668	29%	0.286	S	S	*	.	H	α-helix	trans	-63.3	-29.3	-172.5	-63.1	-6.9	0	0	0	113.6	A292 H293	N289-A292 PolarHBondContact O-N 2.83Å; N289-H293 PolarHBondContact O-CD2 3.39Å; N289-H293 PolarHBondContact O-N 3.09Å
290	I	94.9	Very high	91.1	Very high	62 Å²	62	46.5 Å²	46.5	32%	0.318	27%	0.271	S	S	.	.	H	α-helix	trans	-63.2	-50	179.6	-64.9	-171.3	0	0	0	110.6	Q241 L248 G288 A292 A294	Q241-I290 HydrophobicContact CB-CD1 3.6Å; Q241-I290 HydrophobicContact CG-CD1 4.24Å; Q241-I290 VanDerWaalsContact O-CD1 3.31Å; Q241-I290 WeakPolarHBondContact O-CD1 3.48Å; L248-I290 HydrophobicContact CD1-CG2 4.09Å; G288-I290 VanDerWaalsContact C-N 3.25Å; G288-I290 PolarHBondContact O-N 2.9Å; I290-A292 VanDerWaalsContact C-N 3.33Å; I290-A294 WeakPolarHBondContact O-CB 3.33Å; I290-A294 PolarHBondContact O-N 3.43Å; I290-A294 VanDerWaalsContact O-N 3.15Å
291	L	95.5	Very high	92.6	Very high	0 Å²	0	41 Å²	41	0%	0	23%	0.226	C	C	.	.	H	α-helix	trans	-67.6	-38.6	177.5	-175.1	69.7	0	0	0	111.5	T224 L248 I264 N266 I286 G288 H293 A294 S295	T224-L291 HydrophobicContact CG2-CD2 4.03Å; L248-L291 HydrophobicContact CD1-CB 4.23Å; L248-L291 HydrophobicContact CD1-CD1 3.59Å; L248-L291 HydrophobicContact CD2-CD1 3.46Å; L248-L291 VanDerWaalsContact CD2-CD1 3.46Å; L248-L291 HydrophobicContact CG-CD1 4.16Å; I264-L291 HydrophobicContact CD1-CD1 3.68Å; N266-L291 HydrophobicContact CB-CD2 4.45Å; N266-L291 WeakPolarHBondContact ND2-CD2 3.32Å; I286-L291 VanDerWaalsContact O-CD2 3.22Å; I286-L291 WeakPolarHBondContact O-CD2 3.31Å; G288-L291 PolarHBondContact O-N 3.33Å; L291-H293 VanDerWaalsContact C-N 3.35Å; L291-H293 PolarHBondContact O-N 2.71Å; L291-A294 PolarHBondContact O-N 3.32Å; L291-S295 PolarHBondContact O-N 3.23Å; L291-S295 VanDerWaalsContact O-N 3.1Å; L291-S295 PolarHBondContact O-OG 2.97Å
292	A	93.7	Very high	93.8	Very high	19 Å²	19	42.7 Å²	42.7	16%	0.157	23%	0.228	C	C	.	.	H	α-helix	trans	-58.8	-43.6	179.1	0	0	0	0	0	112.8	G288 N289 I290	G288-A292 WeakPolarHBondContact O-CB 3.5Å; G288-A292 PolarHBondContact O-N 3.46Å; G288-A292 VanDerWaalsContact O-N 3.09Å; N289-A292 PolarHBondContact O-N 2.83Å; I290-A292 VanDerWaalsContact C-N 3.33Å
293	H	92.5	Very high	94.6	Very high	164 Å²	164	45.5 Å²	45.5	76%	0.759	24%	0.235	S	C	*	.	H	α-helix	trans	-80.9	-24.7	179.6	-72.1	-59.6	0	0	0	113.9	N289 L291	N289-H293 PolarHBondContact O-CD2 3.39Å; N289-H293 PolarHBondContact O-N 3.09Å; L291-H293 VanDerWaalsContact C-N 3.35Å; L291-H293 PolarHBondContact O-N 2.71Å
294	A	94.6	Very high	95	Very high	27 Å²	27	43.3 Å²	43.3	22%	0.223	23%	0.232	C	C	.	.	H	α-helix	trans	-77.8	-29.3	179	0	0	0	0	0	112.7	L248 I290 L291	L248-A294 HydrophobicContact CB-CB 3.93Å; L248-A294 HydrophobicContact CD1-CB 3.89Å; L248-A294 HydrophobicContact CG-CB 4.39Å; I290-A294 WeakPolarHBondContact O-CB 3.33Å; I290-A294 PolarHBondContact O-N 3.43Å; I290-A294 VanDerWaalsContact O-N 3.15Å; L291-A294 PolarHBondContact O-N 3.32Å
295	S	94.9	Very high	95.1	Very high	4 Å²	4	49.4 Å²	49.4	3%	0.028	25%	0.252	C	S	.	.			trans	-84.4	124.9	-180	-49.8	0	0	0	0	109.5	E123 L291	E123-S295 PolarHBondContact OE2-OG 3.09Å; L291-S295 PolarHBondContact O-N 3.23Å; L291-S295 VanDerWaalsContact O-N 3.1Å; L291-S295 PolarHBondContact O-OG 2.97Å
296	T	96.8	Very high	95.1	Very high	46 Å²	46	51.6 Å²	51.6	28%	0.282	28%	0.278	S	S	.	.	S	Bend	trans	-77.3	-44	-178.3	-52.6	0	0	0	0	111.4	S120 I121 P317	S120-T296 WeakPolarHBondContact OG-CB 3.46Å; S120-T296 WeakPolarHBondContact OG-CG2 3.47Å; S120-T296 PolarHBondContact OG-OG1 3.42Å; I121-T296 PolarHBondContact O-N 2.98Å; T296-P317 HydrophobicContact CG2-CG 3.74Å; T296-P317 WeakPolarHBondContact O-CD 3.43Å
297	T	98.3	Very high	95.2	Very high	16 Å²	16	55.3 Å²	55.3	10%	0.098	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	132.4	177.1	-62.9	0	0	0	0	109.2	I121 T122 E123 L299 D315	I121-T297 PolarHBondContact O-N 3.05Å; T122-T297 CarbonylContact C-O 3.58Å; T122-T297 WeakPolarHBondContact CA-O 3.41Å; E123-T297 PolarHBondContact N-O 2.82Å; T297-L299 HydrophobicContact CG2-CD2 3.97Å; T297-L299 HydrophobicContact CG2-CG 4.46Å; T297-D315 CarbonylContact C-O 3.59Å; T297-D315 WeakPolarHBondContact CA-O 3.44Å
298	R	98.5	Very high	95.4	Very high	16 Å²	16	56.1 Å²	56.1	6%	0.06	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124	123.2	-176.2	-52.5	-178.5	71.8	-172.1	4.5	109.9	E123 F125 Y314 D315	E123-R298 HydrophobicContact CB-CG 4.35Å; E123-R298 CarbonylContact O-C 3.57Å; E123-R298 WeakPolarHBondContact O-CA 3.28Å; E123-R298 IonicContact OE1-NH2 2.8Å; E123-R298 PolarHBondContact OE1-NH2 2.93Å; E123-R298 IonicContact OE2-CZ 3.93Å; E123-R298 IonicContact OE2-NE 2.72Å; E123-R298 PolarHBondContact OE2-NE 3.33Å; E123-R298 IonicContact OE2-NH2 2.72Å; E123-R298 PolarHBondContact OE2-NH2 3.47Å; F125-R298 HydrophobicContact CE1-CB 4.33Å; R298-Y314 WeakPolarHBondContact O-CA 3.09Å; R298-Y314 WeakPolarHBondContact O-CB 3.22Å; R298-Y314 PolarHBondContact O-N 2.94Å; R298-D315 HydrophobicContact CB-CB 4Å; R298-D315 HydrophobicContact CG-CB 3.96Å; R298-D315 PolarHBondContact N-O 2.9Å; R298-D315 PolarHBondContact O-N 2.95Å
299	L	98.5	Very high	95.7	Very high	3 Å²	3	54.9 Å²	54.9	2%	0.016	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	119	-176.2	-55.2	-177.8	0	0	0	109.9	L112 I116 T122 E123 M124 F125 T297 I313	L112-L299 HydrophobicContact CD1-CD1 4.44Å; L112-L299 HydrophobicContact CD2-CD1 4.19Å; L112-L299 HydrophobicContact CD2-CD2 3.77Å; I116-L299 HydrophobicContact CD1-CD1 4.45Å; T122-L299 HydrophobicContact CG2-CD1 3.99Å; T122-L299 HydrophobicContact CG2-CG 4.23Å; E123-L299 PolarHBondContact O-N 2.86Å; M124-L299 WeakPolarHBondContact CA-O 3.1Å; M124-L299 HydrophobicContact CG-CB 4.31Å; M124-L299 HydrophobicContact CG-CD1 4.29Å; F125-L299 WeakPolarHBondContact CD1-O 3.48Å; F125-L299 PolarHBondContact N-O 3.48Å; T297-L299 HydrophobicContact CG2-CD2 3.97Å; T297-L299 HydrophobicContact CG2-CG 4.46Å; L299-I313 HydrophobicContact CD2-CG1 4.13Å
300	Y	98.1	Very high	95.9	Very high	23 Å²	23	50.1 Å²	50.1	9%	0.09	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.9	116.5	174.1	177.7	-137.2	0	0	0	110.5	F125 D281 R302 C311 K312	F125-Y300 AromaticContact CD2-CD2 3.75Å; F125-Y300 HydrophobicContact CD2-CD2 3.75Å; F125-Y300 HydrophobicContact CD2-CE2 4.44Å; F125-Y300 AromaticContact CE2-CD2 3.4Å; F125-Y300 HydrophobicContact CE2-CD2 3.4Å; F125-Y300 VanDerWaalsContact CE2-CD2 3.4Å; F125-Y300 HydrophobicContact CE2-CE2 4.17Å; F125-Y300 AromaticContact CE2-CG 3.9Å; F125-Y300 HydrophobicContact CE2-CG 3.9Å; F125-Y300 HydrophobicContact CZ-CD2 4.06Å; F125-Y300 HydrophobicContact CZ-CG 4.11Å; D281-Y300 PolarHBondContact OD2-OH 3.39Å; Y300-R302 HydrophobicContact CE1-CB 4.46Å; Y300-C311 WeakPolarHBondContact O-CA 3.39Å; Y300-K312 PolarHBondContact N-O 2.9Å; Y300-K312 PolarHBondContact O-N 2.85Å
301	L	98.3	Very high	96.1	Very high	1 Å²	1	47.2 Å²	47.2	1%	0.005	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102	126.8	178.6	-52.8	-171.5	0	0	0	111	F125 G126 T130 K132 I310 C311 F326	F125-L301 PolarHBondContact O-N 2.91Å; G126-L301 WeakPolarHBondContact CA-O 3.44Å; T130-L301 VanDerWaalsContact CG2-O 3.31Å; T130-L301 WeakPolarHBondContact CG2-O 3.5Å; K132-L301 HydrophobicContact CG-CD1 3.88Å; L301-I310 WeakPolarHBondContact CA-O 3.24Å; L301-C311 HydrophobicContact CD2-CB 3.66Å; L301-F326 HydrophobicContact CD1-CZ 4.48Å; L301-F326 HydrophobicContact CD2-CE1 4.17Å; L301-F326 HydrophobicContact CD2-CZ 4.42Å
302	R	96.4	Very high	96.2	Very high	90 Å²	90	49.8 Å²	49.8	34%	0.34	25%	0.252	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	156.7	174.5	66	-173	179.4	115.6	-4.2	112.1	Y300 R309 I310 E323	Y300-R302 HydrophobicContact CE1-CB 4.46Å; R302-R309 WeakPolarHBondContact O-CA 3.41Å; R302-I310 HydrophobicContact CG-CB 3.8Å; R302-I310 HydrophobicContact CG-CG2 4.37Å; R302-I310 PolarHBondContact N-O 2.91Å; R302-I310 PolarHBondContact O-N 3.2Å; R302-E323 IonicContact CZ-OE2 2.75Å; R302-E323 IonicContact NE-OE2 3Å; R302-E323 IonicContact NH2-OE1 3.93Å; R302-E323 IonicContact NH2-OE2 3.98Å; R302-E323 PolarHBondContact NH2-OE2 3Å
303	K	95.6	Very high	96.5	Very high	104 Å²	104	49 Å²	49	45%	0.452	25%	0.245	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.3	130.6	-179.1	-166.9	-177.8	173.8	-169.5	0	110.7
304	G	94.2	Very high	96.6	Very high	22 Å²	22	46.4 Å²	46.4	23%	0.227	23%	0.23	C	C	.	.			trans	-91.8	-149.7	169.7	0	0	0	0	0	112.2	T308	G304-T308 CarbonylContact C-O 3.57Å; G304-T308 VanDerWaalsContact CA-O 3.27Å; G304-T308 WeakPolarHBondContact CA-O 3.31Å; G304-T308 PolarHBondContact N-O 3.37Å
305	R	93.1	Very high	96.8	Very high	228 Å²	228	48.7 Å²	48.7	86%	0.86	24%	0.238	S	C	*	.	S	Bend	trans	-90.9	133.5	176.3	-67.9	-176.1	179.2	-179.5	0.8	109.9	E307 T308	R305-E307 PolarHBondContact O-N 3.19Å; R305-T308 PolarHBondContact N-OG1 2.82Å; R305-T308 VanDerWaalsContact N-OG1 3.1Å; R305-T308 PolarHBondContact O-N 3.27Å; R305-T308 PolarHBondContact O-OG1 2.89Å
306	G	93.4	Very high	96.9	Very high	65 Å²	65	49.5 Å²	49.5	67%	0.67	24%	0.244	S	C	*	.	T	Hydrogen-bonded Turn	trans	58.6	-120.3	179.2	0	0	0	0	0	113	R309	G306-R309 PolarHBondContact O-NH1 3.09Å; G306-R309 VanDerWaalsContact O-NH1 3.08Å
307	E	94.5	Very high	96.8	Very high	100 Å²	100	52.1 Å²	52.1	47%	0.467	26%	0.261	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.1	-11.4	179.1	63.9	-166.7	-163.9	0	0	114.1	R305 R309 A327 I328	R305-E307 PolarHBondContact O-N 3.19Å; E307-R309 PolarHBondContact O-NH1 2.91Å; E307-A327 HydrophobicContact CG-CB 4.38Å; E307-I328 PolarHBondContact O-N 3.09Å
308	T	97.2	Very high	96.5	Very high	22 Å²	22	55.4 Å²	55.4	14%	0.135	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.2	151.3	-178.4	73.9	0	0	0	0	112.9	G304 R305 M325 F326 A336	G304-T308 CarbonylContact C-O 3.57Å; G304-T308 VanDerWaalsContact CA-O 3.27Å; G304-T308 WeakPolarHBondContact CA-O 3.31Å; G304-T308 PolarHBondContact N-O 3.37Å; R305-T308 PolarHBondContact N-OG1 2.82Å; R305-T308 VanDerWaalsContact N-OG1 3.1Å; R305-T308 PolarHBondContact O-N 3.27Å; R305-T308 PolarHBondContact O-OG1 2.89Å; T308-M325 HydrophobicContact CG2-CG 4.48Å; T308-M325 HydrophobicContact CG2-SD 3.88Å; T308-F326 CarbonylContact C-O 3.56Å; T308-F326 VanDerWaalsContact CA-O 3.27Å; T308-F326 WeakPolarHBondContact CA-O 3.18Å; T308-A336 HydrophobicContact CG2-CB 3.89Å
309	R	97.9	Very high	96.4	Very high	16 Å²	16	55.7 Å²	55.7	6%	0.06	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.3	155.7	178.3	-60.8	-60.9	178.3	-81.1	-10.4	108	R129 T130 R302 G306 E307 M325 F326 I328	R129-R309 PolarHBondContact O-NE 2.98Å; R129-R309 PolarHBondContact O-NH2 3.1Å; T130-R309 WeakPolarHBondContact O-CD 3.44Å; T130-R309 WeakPolarHBondContact O-CG 3.33Å; R302-R309 WeakPolarHBondContact O-CA 3.41Å; G306-R309 PolarHBondContact O-NH1 3.09Å; G306-R309 VanDerWaalsContact O-NH1 3.08Å; E307-R309 PolarHBondContact O-NH1 2.91Å; R309-M325 WeakPolarHBondContact O-CA 3.26Å; R309-M325 WeakPolarHBondContact O-CG 3.24Å; R309-F326 HydrophobicContact CB-CD1 3.89Å; R309-F326 HydrophobicContact CB-CD2 4.1Å; R309-F326 HydrophobicContact CB-CE1 3.39Å; R309-F326 HydrophobicContact CB-CE2 3.65Å; R309-F326 HydrophobicContact CB-CG 4.23Å; R309-F326 HydrophobicContact CB-CZ 3.28Å; R309-F326 HydrophobicContact CG-CE1 4.48Å; R309-F326 HydrophobicContact CG-CE2 3.96Å; R309-F326 HydrophobicContact CG-CZ 3.92Å; R309-F326 PolarHBondContact N-O 3.34Å; R309-F326 PolarHBondContact O-N 2.91Å; R309-I328 HydrophobicContact CG-CD1 3.98Å; R309-I328 HydrophobicContact CG-CG1 4.2Å
310	I	98	Very high	96.2	Very high	24 Å²	24	59.6 Å²	59.6	12%	0.123	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	128.9	178.1	-58	169.3	0	0	0	107.1	L301 R302 E323 A324	L301-I310 WeakPolarHBondContact CA-O 3.24Å; R302-I310 HydrophobicContact CG-CB 3.8Å; R302-I310 HydrophobicContact CG-CG2 4.37Å; R302-I310 PolarHBondContact N-O 2.91Å; R302-I310 PolarHBondContact O-N 3.2Å; I310-E323 HydrophobicContact CG2-CB 4.12Å; I310-E323 WeakPolarHBondContact CG2-OE2 3.22Å; I310-A324 WeakPolarHBondContact CA-O 3.31Å
311	C	98.4	Very high	96.1	Very high	1 Å²	1	65.2 Å²	65.2	1%	0.007	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	128.3	171.2	-179.2	0	0	0	0	108.6	L108 L111 Y300 L301 E323 A324 F326	L108-C311 HydrophobicContact CD2-CB 3.43Å; L108-C311 VanDerWaalsContact CD2-CB 3.43Å; L111-C311 HydrophobicContact CD2-CB 4.22Å; Y300-C311 WeakPolarHBondContact O-CA 3.39Å; L301-C311 HydrophobicContact CD2-CB 3.66Å; C311-E323 CarbonylContact O-C 3.58Å; C311-E323 VanDerWaalsContact O-CA 3.22Å; C311-E323 WeakPolarHBondContact O-CA 3.31Å; C311-A324 PolarHBondContact N-O 3.02Å; C311-A324 PolarHBondContact O-N 2.79Å; C311-F326 HydrophobicContact CB-CD1 4.26Å; C311-F326 HydrophobicContact CB-CE1 4.05Å
312	K	98.1	Very high	96.1	Very high	55 Å²	55	67 Å²	67	24%	0.239	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	134.4	172.1	179.8	178.7	179.3	-171.7	0	109.3	Y300 Y314 E321 A322 E323	Y300-K312 PolarHBondContact N-O 2.9Å; Y300-K312 PolarHBondContact O-N 2.85Å; K312-Y314 PolarHBondContact O-N 2.83Å; K312-E321 VanDerWaalsContact CE-OE2 3.26Å; K312-E321 WeakPolarHBondContact CE-OE2 3.5Å; K312-E321 IonicContact NZ-OE2 3.26Å; K312-E321 PolarHBondContact NZ-OE2 3.23Å; K312-A322 WeakPolarHBondContact CA-O 3.43Å; K312-E323 HydrophobicContact CB-CG 3.82Å; K312-E323 HydrophobicContact CD-CG 4.28Å; K312-E323 HydrophobicContact CG-CG 3.84Å
313	I	98.3	Very high	96.1	Very high	2 Å²	2	67.4 Å²	67.4	1%	0.01	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.7	114.5	165.1	-63.8	168.5	0	0	0	107.6	L111 L299 L319 A322	L111-I313 HydrophobicContact CD1-CD1 3.62Å; L111-I313 HydrophobicContact CD1-CG1 3.99Å; L111-I313 HydrophobicContact CD2-CG1 4.14Å; L111-I313 HydrophobicContact CG-CD1 3.73Å; L111-I313 HydrophobicContact CG-CG1 3.92Å; L111-I313 WeakPolarHBondContact O-CD1 3.45Å; L299-I313 HydrophobicContact CD2-CG1 4.13Å; I313-L319 HydrophobicContact CD1-CB 3.71Å; I313-L319 HydrophobicContact CD1-CD1 3.85Å; I313-L319 HydrophobicContact CD1-CG 4.4Å; I313-L319 HydrophobicContact CG2-CB 4.45Å; I313-A322 PolarHBondContact N-O 2.6Å
314	Y	96.6	Very high	96.2	Very high	110 Å²	110	63 Å²	63	43%	0.431	34%	0.343	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.3	-36.6	-179	-168.3	-89.9	0	0	0	111.9	F125 R298 K312	F125-Y314 HydrophobicContact CE1-CD1 4.18Å; F125-Y314 HydrophobicContact CE1-CD2 4.36Å; F125-Y314 AromaticContact CE1-CG 3.9Å; F125-Y314 HydrophobicContact CE1-CG 3.9Å; F125-Y314 HydrophobicContact CZ-CD1 4.01Å; F125-Y314 AromaticContact CZ-CD2 3.6Å; F125-Y314 HydrophobicContact CZ-CD2 3.6Å; F125-Y314 HydrophobicContact CZ-CE1 4.4Å; F125-Y314 AromaticContact CZ-CE2 4Å; F125-Y314 HydrophobicContact CZ-CE2 4Å; F125-Y314 AromaticContact CZ-CG 3.59Å; F125-Y314 HydrophobicContact CZ-CG 3.59Å; R298-Y314 WeakPolarHBondContact O-CA 3.09Å; R298-Y314 WeakPolarHBondContact O-CB 3.22Å; R298-Y314 PolarHBondContact O-N 2.94Å; K312-Y314 PolarHBondContact O-N 2.83Å
315	D	96.8	Very high	96.4	Very high	75 Å²	75	66.2 Å²	66.2	40%	0.401	35%	0.353	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.9	138.9	177	-171.4	20.9	0	0	0	109	T297 R298	T297-D315 CarbonylContact C-O 3.59Å; T297-D315 WeakPolarHBondContact CA-O 3.44Å; R298-D315 HydrophobicContact CB-CB 4Å; R298-D315 HydrophobicContact CG-CB 3.96Å; R298-D315 PolarHBondContact N-O 2.9Å; R298-D315 PolarHBondContact O-N 2.95Å
316	S	97.2	Very high	96.7	Very high	20 Å²	20	55.3 Å²	55.3	14%	0.14	31%	0.312	C	S	.	.			trans	-165.5	142.2	176.7	-178.2	0	0	0	0	109.7	C318 L319	S316-C318 VanDerWaalsContact C-N 3.27Å; S316-C318 PolarHBondContact O-N 3.43Å; S316-L319 WeakPolarHBondContact OG-CB 3.27Å; S316-L319 PolarHBondContact OG-N 2.74Å
317	P	94.9	Very high	96.9	Very high	101 Å²	101	52.2 Å²	52.2	66%	0.656	28%	0.28	S	S	*	.	S	Bend	trans	-70.6	-21.6	177.4	29.1	-37.7	0	0	0	113.7	T296	T296-P317 HydrophobicContact CG2-CG 3.74Å; T296-P317 WeakPolarHBondContact O-CD 3.43Å
318	C	92.8	Very high	97	Very high	86 Å²	86	49 Å²	49	58%	0.581	27%	0.266	S	S	*	.	S	Bend	trans	-128.3	-23.9	-171.9	58.4	0	0	0	0	114.3	S316	S316-C318 VanDerWaalsContact C-N 3.27Å; S316-C318 PolarHBondContact O-N 3.43Å
319	L	95.6	Very high	97	Very high	21 Å²	21	48.9 Å²	48.9	11%	0.11	26%	0.264	C	S	.	.	P	Polyproline II helix	trans	-94.5	134	-176	-54.9	174	0	0	0	111.3	L112 Q113 I313 S316	L112-L319 HydrophobicContact CD2-CD1 4.13Å; Q113-L319 HydrophobicContact CB-CD2 4.1Å; Q113-L319 VanDerWaalsContact CD-CD2 3.43Å; Q113-L319 HydrophobicContact CG-CD2 3.7Å; I313-L319 HydrophobicContact CD1-CB 3.71Å; I313-L319 HydrophobicContact CD1-CD1 3.85Å; I313-L319 HydrophobicContact CD1-CG 4.4Å; I313-L319 HydrophobicContact CG2-CB 4.45Å; S316-L319 WeakPolarHBondContact OG-CB 3.27Å; S316-L319 PolarHBondContact OG-N 2.74Å
320	P	95.8	Very high	97	Very high	86 Å²	86	52.1 Å²	52.1	56%	0.558	30%	0.295	S	S	*	.	P	Polyproline II helix	trans	-69.6	157.4	173.8	30.9	-34.9	0	0	0	111.2	A322	P320-A322 PolarHBondContact O-N 2.75Å; P320-A322 VanDerWaalsContact O-N 3.09Å
321	E	95.7	Very high	96.9	Very high	140 Å²	140	53.7 Å²	53.7	65%	0.654	30%	0.303	S	S	*	.	S	Bend	trans	-59.8	116.6	170.2	-75.9	-165.2	-149.9	0	0	110.5	K312	K312-E321 VanDerWaalsContact CE-OE2 3.26Å; K312-E321 WeakPolarHBondContact CE-OE2 3.5Å; K312-E321 IonicContact NZ-OE2 3.26Å; K312-E321 PolarHBondContact NZ-OE2 3.23Å
322	A	97.3	Very high	96.9	Very high	40 Å²	40	53.7 Å²	53.7	33%	0.331	30%	0.303	S	S	.	.			trans	-149.2	165.7	177.6	0	0	0	0	0	110.3	L111 K312 I313 P320	L111-A322 HydrophobicContact CD1-CB 3.45Å; L111-A322 VanDerWaalsContact CD1-CB 3.45Å; K312-A322 WeakPolarHBondContact CA-O 3.43Å; I313-A322 PolarHBondContact N-O 2.6Å; P320-A322 PolarHBondContact O-N 2.75Å; P320-A322 VanDerWaalsContact O-N 3.09Å
323	E	97.6	Very high	96.9	Very high	98 Å²	98	51 Å²	51	46%	0.458	29%	0.292	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	146.6	176.5	-58	-165.7	167.1	0	0	110.8	R302 I310 C311 K312	R302-E323 IonicContact CZ-OE2 2.75Å; R302-E323 IonicContact NE-OE2 3Å; R302-E323 IonicContact NH2-OE1 3.93Å; R302-E323 IonicContact NH2-OE2 3.98Å; R302-E323 PolarHBondContact NH2-OE2 3Å; I310-E323 HydrophobicContact CG2-CB 4.12Å; I310-E323 WeakPolarHBondContact CG2-OE2 3.22Å; C311-E323 CarbonylContact O-C 3.58Å; C311-E323 VanDerWaalsContact O-CA 3.22Å; C311-E323 WeakPolarHBondContact O-CA 3.31Å; K312-E323 HydrophobicContact CB-CG 3.82Å; K312-E323 HydrophobicContact CD-CG 4.28Å; K312-E323 HydrophobicContact CG-CG 3.84Å
324	A	97.9	Very high	96.9	Very high	10 Å²	10	51 Å²	51	8%	0.083	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135	152.4	169.1	0	0	0	0	0	110.6	E107 L108 L111 I310 C311	E107-A324 HydrophobicContact CB-CB 4.3Å; E107-A324 WeakPolarHBondContact O-CB 3.34Å; L108-A324 HydrophobicContact CD2-CB 4.39Å; L111-A324 HydrophobicContact CB-CB 3.84Å; L111-A324 HydrophobicContact CD2-CB 3.83Å; L111-A324 HydrophobicContact CG-CB 4.27Å; I310-A324 WeakPolarHBondContact CA-O 3.31Å; C311-A324 PolarHBondContact N-O 3.02Å; C311-A324 PolarHBondContact O-N 2.79Å
325	M	97.8	Very high	96.9	Very high	90 Å²	90	48.2 Å²	48.2	44%	0.443	29%	0.285	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.3	140.1	175.7	-167.1	178.3	-57.1	0	0	109.9	T308 R309 A336	T308-M325 HydrophobicContact CG2-CG 4.48Å; T308-M325 HydrophobicContact CG2-SD 3.88Å; R309-M325 WeakPolarHBondContact O-CA 3.26Å; R309-M325 WeakPolarHBondContact O-CG 3.24Å; M325-A336 HydrophobicContact CG-CB 4.46Å; M325-A336 HydrophobicContact SD-CB 4.28Å
326	F	98	Very high	96.5	Very high	0 Å²	0	46.3 Å²	46.3	0%	0	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.4	167.6	171.9	69.3	-83.2	0	0	0	110.1	L108 L301 T308 R309 C311 I328 V333	L108-F326 HydrophobicContact CD1-CB 3.88Å; L108-F326 HydrophobicContact CD1-CD1 3.96Å; L108-F326 HydrophobicContact CD1-CD2 4.33Å; L108-F326 HydrophobicContact CD1-CG 3.82Å; L108-F326 HydrophobicContact CD2-CB 4.43Å; L108-F326 HydrophobicContact CD2-CD1 3.87Å; L108-F326 HydrophobicContact CD2-CG 4.42Å; L108-F326 HydrophobicContact CG-CB 3.95Å; L108-F326 HydrophobicContact CG-CD1 4.19Å; L108-F326 HydrophobicContact CG-CG 4.24Å; L301-F326 HydrophobicContact CD1-CZ 4.48Å; L301-F326 HydrophobicContact CD2-CE1 4.17Å; L301-F326 HydrophobicContact CD2-CZ 4.42Å; T308-F326 CarbonylContact C-O 3.56Å; T308-F326 VanDerWaalsContact CA-O 3.27Å; T308-F326 WeakPolarHBondContact CA-O 3.18Å; R309-F326 HydrophobicContact CB-CD1 3.89Å; R309-F326 HydrophobicContact CB-CD2 4.1Å; R309-F326 HydrophobicContact CB-CE1 3.39Å; R309-F326 HydrophobicContact CB-CE2 3.65Å; R309-F326 HydrophobicContact CB-CG 4.23Å; R309-F326 HydrophobicContact CB-CZ 3.28Å; R309-F326 HydrophobicContact CG-CE1 4.48Å; R309-F326 HydrophobicContact CG-CE2 3.96Å; R309-F326 HydrophobicContact CG-CZ 3.92Å; R309-F326 PolarHBondContact N-O 3.34Å; R309-F326 PolarHBondContact O-N 2.91Å; C311-F326 HydrophobicContact CB-CD1 4.26Å; C311-F326 HydrophobicContact CB-CE1 4.05Å; F326-I328 HydrophobicContact CE2-CG1 4.34Å; F326-V333 HydrophobicContact CB-CG1 4.43Å; F326-V333 HydrophobicContact CD2-CG1 3.67Å; F326-V333 HydrophobicContact CD2-CG2 4.4Å; F326-V333 HydrophobicContact CE2-CG1 4.28Å; F326-V333 HydrophobicContact CE2-CG2 4.32Å; F326-V333 HydrophobicContact CG-CG1 4.36Å
327	A	98.1	Very high	95.9	Very high	0 Å²	0	52.7 Å²	52.7	0%	0	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	151.1	176.4	0	0	0	0	0	111.7	E307 V333 G334	E307-A327 HydrophobicContact CG-CB 4.38Å; A327-V333 WeakPolarHBondContact O-CA 3.24Å; A327-G334 PolarHBondContact N-O 3.27Å; A327-G334 PolarHBondContact O-N 3.36Å
328	I	97.8	Very high	94.4	Very high	33 Å²	33	59.3 Å²	59.3	17%	0.169	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.9	104.2	170.1	-57.4	173.3	0	0	0	107.1	Q134 E307 R309 F326	Q134-I328 HydrophobicContact CB-CD1 4.43Å; Q134-I328 HydrophobicContact CB-CG2 4.2Å; Q134-I328 HydrophobicContact CG-CD1 4.31Å; Q134-I328 HydrophobicContact CG-CG2 3.9Å; E307-I328 PolarHBondContact O-N 3.09Å; R309-I328 HydrophobicContact CG-CD1 3.98Å; R309-I328 HydrophobicContact CG-CG1 4.2Å; F326-I328 HydrophobicContact CE2-CG1 4.34Å
329	N	97.1	Very high	94.5	Very high	18 Å²	18	58 Å²	58	10%	0.096	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.2	172.9	-177	-60	-34.2	0	0	0	111.4	R169 D331 G332	R169-N329 PolarHBondContact NH2-O 3.4Å; N329-D331 WeakPolarHBondContact CB-OD1 3.3Å; N329-D331 PolarHBondContact O-N 3.26Å; N329-G332 WeakPolarHBondContact CA-O 3.42Å; N329-G332 WeakPolarHBondContact CB-O 3.32Å; N329-G332 PolarHBondContact N-O 3.35Å; N329-G332 PolarHBondContact O-N 3.18Å
330	A	96.8	Very high	94.4	Very high	84 Å²	84	59.9 Å²	59.9	69%	0.694	33%	0.333	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.7	-32.2	175	0	0	0	0	0	112.1	R169 A172	R169-A330 PolarHBondContact NH1-O 2.75Å; A172-A330 WeakPolarHBondContact CB-O 3.44Å
331	D	96.9	Very high	94.3	Very high	57 Å²	57	58.4 Å²	58.4	31%	0.305	32%	0.321	S	S	.	.	T	Hydrogen-bonded Turn	trans	-101.8	20.9	-177.2	63.9	-24.8	0	0	0	113.5	R176 N329	R176-D331 HydrophobicContact CB-CB 4.14Å; R176-D331 WeakPolarHBondContact CD-OD2 3.17Å; N329-D331 WeakPolarHBondContact CB-OD1 3.3Å; N329-D331 PolarHBondContact O-N 3.26Å
332	G	97.4	Very high	94.2	Very high	1 Å²	1	53.6 Å²	53.6	1%	0.01	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	110.4	-161.3	173.9	0	0	0	0	0	114.7	N329	N329-G332 WeakPolarHBondContact CA-O 3.42Å; N329-G332 WeakPolarHBondContact CB-O 3.32Å; N329-G332 PolarHBondContact N-O 3.35Å; N329-G332 PolarHBondContact O-N 3.18Å
333	V	98.3	Very high	94.1	Very high	0 Å²	0	54.5 Å²	54.5	0%	0	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.2	131.4	171.9	169.5	0	0	0	0	109.9	G104 L108 Q134 L135 T138 R176 F326 A327	G104-V333 CarbonylContact C-O 3.59Å; L108-V333 HydrophobicContact CD1-CG1 4.09Å; Q134-V333 HydrophobicContact CB-CG2 4.37Å; L135-V333 HydrophobicContact CB-CG2 4.19Å; L135-V333 HydrophobicContact CD1-CB 4.25Å; L135-V333 HydrophobicContact CD1-CG1 4.11Å; L135-V333 HydrophobicContact CD1-CG2 4.2Å; T138-V333 HydrophobicContact CG2-CB 4.26Å; T138-V333 PolarHBondContact OG1-N 2.73Å; R176-V333 PolarHBondContact NH1-O 2.96Å; F326-V333 HydrophobicContact CB-CG1 4.43Å; F326-V333 HydrophobicContact CD2-CG1 3.67Å; F326-V333 HydrophobicContact CD2-CG2 4.4Å; F326-V333 HydrophobicContact CE2-CG1 4.28Å; F326-V333 HydrophobicContact CE2-CG2 4.32Å; F326-V333 HydrophobicContact CG-CG1 4.36Å; A327-V333 WeakPolarHBondContact O-CA 3.24Å
334	G	97.8	Very high	93.8	Very high	1 Å²	1	51.6 Å²	51.6	1%	0.01	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-153	-171.9	176.7	0	0	0	0	0	112.2	A327	A327-G334 PolarHBondContact N-O 3.27Å; A327-G334 PolarHBondContact O-N 3.36Å
335	D	96.6	Very high	93.5	Very high	52 Å²	52	54.6 Å²	54.6	28%	0.278	30%	0.303	S	S	.	.	P	Polyproline II helix	trans	-70.9	151.5	177.1	-57.6	-43.1	0	0	0	110.9	S105 K106 E107 K337	S105-D335 WeakPolarHBondContact CA-OD1 3.48Å; S105-D335 WeakPolarHBondContact CB-OD1 3.18Å; S105-D335 PolarHBondContact OG-OD1 3.12Å; K106-D335 WeakPolarHBondContact CB-OD2 3.46Å; K106-D335 PolarHBondContact N-OD1 3.22Å; K106-D335 PolarHBondContact N-OD2 3.13Å; E107-D335 PolarHBondContact N-OD1 2.99Å; D335-K337 PolarHBondContact O-N 3.46Å
336	A	89.7	Confident	93.2	Very high	35 Å²	35	51.8 Å²	51.8	29%	0.289	29%	0.292	S	S	.	.	P	Polyproline II helix	trans	-64.4	132	173.2	0	0	0	0	0	109.5	T308 M325	T308-A336 HydrophobicContact CG2-CB 3.89Å; M325-A336 HydrophobicContact CG-CB 4.46Å; M325-A336 HydrophobicContact SD-CB 4.28Å
337	K	83.7	Confident	92.8	Very high	153 Å²	153	56.2 Å²	56.2	67%	0.665	32%	0.317	S	S	*	.	P	Polyproline II helix	trans	-72.8	139.6	171.3	-62.8	178.3	-177.4	176.2	0	108.7	D335	D335-K337 PolarHBondContact O-N 3.46Å
338	D	63.3	Low	92.3	Very high	240 Å²	240	61.3 Å²	61.3	100%	1.283	35%	0.346	S	S	*	.			trans	-59	0	171.1	-67.1	-38.5	0	0	0	111.8

Retrieved 338 of 338 residues in 450.1 ms (Link to these results)

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