A0A077YXC6_TRITR Loading...

Dihydrolipoyllysine-residue succinyltransferase component of 2-oxoglutarate dehydrogenase complex, mitochondrial

Dihydrolipoamide succinyltransferase (E2) component of the 2-oxoglutarate dehydrogenase complex. The 2-oxoglutarate dehydrogenase complex catalyzes the overall conversion of 2-oxoglutarate to succinyl-CoA and CO(2). The 2-oxoglutarate dehydrogenase complex is mainly active in the mitochondrion. A fraction of the 2-oxoglutarate dehydrogenase complex also localizes in the nucleus and is required for lysine succinylation of histones: associates with KAT2A on chromatin and provides succinyl-CoA to histone succinyltransferase KAT2A.

AlphaFold DB , UniProt , Accession A0A077YXC6, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 393 aa.

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(Predicted Aligned Error values between residue pairs)

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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	52	Low	44.3	Very low	184 Å²	184	152.3 Å²	152.3	91%	0.906	68%	0.68	S	S	*	*				0	-52.3	0	-80.7	-106.1	-94.4	0	0	112.3	R3 L4 F5	M1-R3 PolarHBondContact O-N 2.92Å; M1-L4 PolarHBondContact O-N 2.86Å; M1-L4 VanDerWaalsContact O-N 3.07Å; M1-F5 PolarHBondContact O-N 3.36Å
2	E	41.4	Very low	44.2	Very low	174 Å²	174	145.4 Å²	145.4	81%	0.813	66%	0.664	S	S	*	*	H	α-helix	trans	-59	-37.1	179.5	-73.7	179.4	144	0	0	115.3	L4 F5 S6	E2-L4 VanDerWaalsContact C-N 3.25Å; E2-L4 PolarHBondContact O-N 3.34Å; E2-F5 PolarHBondContact O-N 3.23Å; E2-S6 PolarHBondContact O-N 2.82Å; E2-S6 VanDerWaalsContact O-N 3.08Å
3	R	40.6	Very low	44.6	Very low	225 Å²	225	144.2 Å²	144.2	85%	0.849	66%	0.66	S	S	*	*	H	α-helix	trans	-67	-21	176.1	-70.2	-174	-177.5	-173.9	1	114.2	M1 S6	M1-R3 PolarHBondContact O-N 2.92Å; R3-S6 PolarHBondContact O-OG 2.81Å
4	L	44.9	Very low	45.5	Very low	127 Å²	127	141.4 Å²	141.4	67%	0.665	65%	0.651	S	S	*	*	H	α-helix	trans	-84	-40.9	176	-90.2	145.5	0	0	0	110.9	M1 E2 R7 Q8	M1-L4 PolarHBondContact O-N 2.86Å; M1-L4 VanDerWaalsContact O-N 3.07Å; E2-L4 VanDerWaalsContact C-N 3.25Å; E2-L4 PolarHBondContact O-N 3.34Å; L4-R7 PolarHBondContact O-N 2.92Å; L4-Q8 PolarHBondContact O-N 3.24Å; L4-Q8 VanDerWaalsContact O-N 3.1Å
5	F	39.9	Very low	45.6	Very low	129 Å²	129	135.2 Å²	135.2	57%	0.566	63%	0.634	S	S	*	*	H	α-helix	trans	-63.3	-39	174.5	-90.8	-82.5	0	0	0	113.2	M1 E2 R7 Q8 R9	M1-F5 PolarHBondContact O-N 3.36Å; E2-F5 PolarHBondContact O-N 3.23Å; F5-R7 VanDerWaalsContact C-N 3.29Å; F5-R7 PolarHBondContact O-N 3.48Å; F5-Q8 PolarHBondContact O-N 3.49Å; F5-R9 PolarHBondContact O-N 2.87Å; F5-R9 VanDerWaalsContact O-N 3.14Å
6	S	48.5	Very low	45.5	Very low	56 Å²	56	129.9 Å²	129.9	39%	0.392	62%	0.621	S	S	.	*	H	α-helix	trans	-68.3	-29.9	176.8	73.4	0	0	0	0	112.8	E2 R3 R10	E2-S6 PolarHBondContact O-N 2.82Å; E2-S6 VanDerWaalsContact O-N 3.08Å; R3-S6 PolarHBondContact O-OG 2.81Å; S6-R10 WeakPolarHBondContact O-CG 3.34Å; S6-R10 PolarHBondContact O-N 3.1Å
7	R	41.8	Very low	45.5	Very low	193 Å²	193	125.9 Å²	125.9	73%	0.728	61%	0.614	S	S	*	*	H	α-helix	trans	-74.6	-39.9	177.7	-152	176.1	178.2	-168.1	-1.6	111.5	L4 F5 V11	L4-R7 PolarHBondContact O-N 2.92Å; F5-R7 VanDerWaalsContact C-N 3.29Å; F5-R7 PolarHBondContact O-N 3.48Å; R7-V11 WeakPolarHBondContact O-CG2 3.41Å; R7-V11 PolarHBondContact O-N 3Å
8	Q	39.6	Very low	45.5	Very low	142 Å²	142	124.8 Å²	124.8	66%	0.664	61%	0.611	S	S	*	*	H	α-helix	trans	-64.7	-41.5	173.2	-88.4	-175	-27.8	0	0	112.8	L4 F5 R10 V11 S12	L4-Q8 PolarHBondContact O-N 3.24Å; L4-Q8 VanDerWaalsContact O-N 3.1Å; F5-Q8 PolarHBondContact O-N 3.49Å; Q8-R10 PolarHBondContact O-N 2.77Å; Q8-V11 PolarHBondContact O-N 3.02Å; Q8-S12 PolarHBondContact O-N 2.92Å; Q8-S12 PolarHBondContact O-OG 3.37Å
9	R	40.8	Very low	45.4	Very low	179 Å²	179	125.5 Å²	125.5	68%	0.675	61%	0.613	S	S	*	*	H	α-helix	trans	-61.8	-42.3	175.8	-82.5	-173	177.4	-178	-0.2	113.2	F5 V11 S12 E13	F5-R9 PolarHBondContact O-N 2.87Å; F5-R9 VanDerWaalsContact O-N 3.14Å; R9-V11 VanDerWaalsContact C-N 3.32Å; R9-V11 PolarHBondContact O-N 3.41Å; R9-S12 WeakPolarHBondContact CA-OG 3.49Å; R9-S12 PolarHBondContact O-N 2.73Å; R9-S12 PolarHBondContact O-OG 3.22Å; R9-E13 WeakPolarHBondContact O-CG 3.33Å; R9-E13 PolarHBondContact O-N 2.9Å
10	R	46.6	Very low	45.3	Very low	170 Å²	170	125.8 Å²	125.8	64%	0.642	62%	0.617	S	S	*	*	H	α-helix	trans	-63.6	-36.9	175.6	-73.9	-173.9	-156.8	-171.6	4.2	112.4	S6 Q8 E13 I14	S6-R10 WeakPolarHBondContact O-CG 3.34Å; S6-R10 PolarHBondContact O-N 3.1Å; Q8-R10 PolarHBondContact O-N 2.77Å; R10-E13 PolarHBondContact O-N 3.11Å; R10-I14 WeakPolarHBondContact O-CB 3.48Å; R10-I14 WeakPolarHBondContact O-CD1 3.3Å; R10-I14 WeakPolarHBondContact O-CG1 3.16Å; R10-I14 PolarHBondContact O-N 3.18Å
11	V	51	Low	45.2	Very low	96 Å²	96	122.7 Å²	122.7	58%	0.582	61%	0.607	S	S	*	*	H	α-helix	trans	-66.9	-40.5	176.9	174.2	0	0	0	0	111.1	R7 Q8 R9 I14 A15	R7-V11 WeakPolarHBondContact O-CG2 3.41Å; R7-V11 PolarHBondContact O-N 3Å; Q8-V11 PolarHBondContact O-N 3.02Å; R9-V11 VanDerWaalsContact C-N 3.32Å; R9-V11 PolarHBondContact O-N 3.41Å; V11-I14 PolarHBondContact O-N 3.37Å; V11-A15 WeakPolarHBondContact O-CB 3.11Å; V11-A15 PolarHBondContact O-N 2.98Å
12	S	43.7	Very low	45.3	Very low	70 Å²	70	119 Å²	119	49%	0.49	59%	0.59	S	S	.	*	H	α-helix	trans	-67.4	-37.6	174.8	54.6	0	0	0	0	113.3	Q8 R9 A15 A16	Q8-S12 PolarHBondContact O-N 2.92Å; Q8-S12 PolarHBondContact O-OG 3.37Å; R9-S12 WeakPolarHBondContact CA-OG 3.49Å; R9-S12 PolarHBondContact O-N 2.73Å; R9-S12 PolarHBondContact O-OG 3.22Å; S12-A15 PolarHBondContact O-N 2.7Å; S12-A16 WeakPolarHBondContact O-CB 3.22Å; S12-A16 PolarHBondContact O-N 2.96Å
13	E	49.1	Very low	45.5	Very low	129 Å²	129	116.2 Å²	116.2	60%	0.603	58%	0.576	S	S	*	*	H	α-helix	trans	-68	-39.5	176.4	-75.1	171.8	175.8	0	0	111.8	R9 R10 A16 A17	R9-E13 WeakPolarHBondContact O-CG 3.33Å; R9-E13 PolarHBondContact O-N 2.9Å; R10-E13 PolarHBondContact O-N 3.11Å; E13-A16 PolarHBondContact O-N 2.95Å; E13-A17 WeakPolarHBondContact O-CB 3.28Å; E13-A17 PolarHBondContact O-N 2.92Å
14	I	56.7	Low	45.6	Very low	106 Å²	106	112 Å²	112	54%	0.544	56%	0.563	S	S	.	*	H	α-helix	trans	-67.1	-40.3	174.9	-67.8	164.5	0	0	0	110.8	R10 V11 A17 L18	R10-I14 WeakPolarHBondContact O-CB 3.48Å; R10-I14 WeakPolarHBondContact O-CD1 3.3Å; R10-I14 WeakPolarHBondContact O-CG1 3.16Å; R10-I14 PolarHBondContact O-N 3.18Å; V11-I14 PolarHBondContact O-N 3.37Å; I14-A17 PolarHBondContact O-N 2.94Å; I14-L18 HydrophobicContact CG2-CD1 4.4Å; I14-L18 WeakPolarHBondContact O-CB 3.33Å; I14-L18 PolarHBondContact O-N 2.85Å
15	A	47.1	Very low	45.7	Very low	48 Å²	48	110.9 Å²	110.9	40%	0.397	56%	0.558	S	S	.	*	H	α-helix	trans	-63.5	-43.5	175.3	0	0	0	0	0	112	V11 S12 L18 Q19	V11-A15 WeakPolarHBondContact O-CB 3.11Å; V11-A15 PolarHBondContact O-N 2.98Å; S12-A15 PolarHBondContact O-N 2.7Å; A15-L18 PolarHBondContact O-N 3.46Å; A15-Q19 WeakPolarHBondContact O-CB 3.1Å; A15-Q19 PolarHBondContact O-N 3.42Å
16	A	43.8	Very low	46	Very low	51 Å²	51	107.9 Å²	107.9	42%	0.421	55%	0.546	S	S	.	.	H	α-helix	trans	-63.7	-40.6	175	0	0	0	0	0	112.1	S12 E13 Q19 L20	S12-A16 WeakPolarHBondContact O-CB 3.22Å; S12-A16 PolarHBondContact O-N 2.96Å; E13-A16 PolarHBondContact O-N 2.95Å; A16-Q19 PolarHBondContact O-N 3.02Å; A16-L20 WeakPolarHBondContact O-CB 3.39Å; A16-L20 PolarHBondContact O-N 3.36Å
17	A	46.9	Very low	45.6	Very low	61 Å²	61	110.7 Å²	110.7	50%	0.504	56%	0.556	S	S	.	*	H	α-helix	trans	-68.7	-36.6	176.3	0	0	0	0	0	112.8	E13 I14 L20 S21	E13-A17 WeakPolarHBondContact O-CB 3.28Å; E13-A17 PolarHBondContact O-N 2.92Å; I14-A17 PolarHBondContact O-N 2.94Å; A17-L20 PolarHBondContact O-N 3.34Å; A17-S21 WeakPolarHBondContact O-CB 3.47Å; A17-S21 PolarHBondContact O-N 2.82Å
18	L	45.4	Very low	45.8	Very low	107 Å²	107	107.9 Å²	107.9	56%	0.56	56%	0.555	S	S	*	*	H	α-helix	trans	-65.6	-43.2	173	-123.7	90.3	0	0	0	111.2	I14 A15 L20 S21 I22	I14-L18 HydrophobicContact CG2-CD1 4.4Å; I14-L18 WeakPolarHBondContact O-CB 3.33Å; I14-L18 PolarHBondContact O-N 2.85Å; A15-L18 PolarHBondContact O-N 3.46Å; L18-L20 VanDerWaalsContact C-N 3.32Å; L18-L20 PolarHBondContact O-N 3.36Å; L18-S21 PolarHBondContact O-N 2.94Å; L18-I22 WeakPolarHBondContact O-CG1 3.49Å; L18-I22 PolarHBondContact O-N 3.04Å
19	Q	42.6	Very low	46.1	Very low	138 Å²	138	104.1 Å²	104.1	65%	0.645	54%	0.544	S	S	*	.	H	α-helix	trans	-61.2	-40.8	174.3	-83.4	171.8	-46.6	0	0	111.6	A15 A16 F23	A15-Q19 WeakPolarHBondContact O-CB 3.1Å; A15-Q19 PolarHBondContact O-N 3.42Å; A16-Q19 PolarHBondContact O-N 3.02Å; Q19-F23 VanDerWaalsContact O-CB 3.28Å; Q19-F23 WeakPolarHBondContact O-CB 3.35Å; Q19-F23 PolarHBondContact O-N 2.94Å
20	L	44.3	Very low	46.2	Very low	131 Å²	131	98.8 Å²	98.8	69%	0.686	55%	0.545	S	S	*	.	H	α-helix	trans	-65.2	-38.8	175.9	-135.5	84.7	0	0	0	112.3	A16 A17 L18 F23 F24	A16-L20 WeakPolarHBondContact O-CB 3.39Å; A16-L20 PolarHBondContact O-N 3.36Å; A17-L20 PolarHBondContact O-N 3.34Å; L18-L20 VanDerWaalsContact C-N 3.32Å; L18-L20 PolarHBondContact O-N 3.36Å; L20-F23 PolarHBondContact O-N 3.03Å; L20-F24 WeakPolarHBondContact O-CB 3.48Å; L20-F24 PolarHBondContact O-N 2.69Å
21	S	43.2	Very low	46.5	Very low	61 Å²	61	96.8 Å²	96.8	43%	0.427	54%	0.543	S	S	.	.	H	α-helix	trans	-66.8	-43.5	178.1	172.6	0	0	0	0	112.6	A17 L18 F23 F24 N25	A17-S21 WeakPolarHBondContact O-CB 3.47Å; A17-S21 PolarHBondContact O-N 2.82Å; L18-S21 PolarHBondContact O-N 2.94Å; S21-F23 VanDerWaalsContact C-N 3.33Å; S21-F24 PolarHBondContact O-N 3.19Å; S21-N25 WeakPolarHBondContact O-CB 3.27Å; S21-N25 PolarHBondContact O-N 2.97Å; S21-N25 PolarHBondContact O-ND2 3.47Å
22	I	52.9	Low	47.8	Very low	106 Å²	106	96.6 Å²	96.6	54%	0.544	54%	0.539	S	S	.	.	H	α-helix	trans	-64	-42.4	175.2	-64.8	165.1	0	0	0	109.9	L18 F24 N25 H26	L18-I22 WeakPolarHBondContact O-CG1 3.49Å; L18-I22 PolarHBondContact O-N 3.04Å; I22-F24 PolarHBondContact O-N 3.3Å; I22-N25 PolarHBondContact O-N 2.96Å; I22-H26 PolarHBondContact O-N 3.09Å
23	F	45.6	Very low	49.8	Very low	115 Å²	115	95.4 Å²	95.4	50%	0.504	53%	0.529	S	S	.	.	H	α-helix	trans	-62.8	-40.2	177	-162.1	-96.4	0	0	0	112.5	Q19 L20 S21 L27	Q19-F23 VanDerWaalsContact O-CB 3.28Å; Q19-F23 WeakPolarHBondContact O-CB 3.35Å; Q19-F23 PolarHBondContact O-N 2.94Å; L20-F23 PolarHBondContact O-N 3.03Å; S21-F23 VanDerWaalsContact C-N 3.33Å; F23-L27 PolarHBondContact O-N 3.31Å
24	F	43.9	Very low	51.7	Low	136 Å²	136	90.5 Å²	90.5	60%	0.596	51%	0.506	S	S	*	.	H	α-helix	trans	-72.6	-35.3	178.8	-151.8	-95.6	0	0	0	112.7	L20 S21 I22 L27 L28	L20-F24 WeakPolarHBondContact O-CB 3.48Å; L20-F24 PolarHBondContact O-N 2.69Å; S21-F24 PolarHBondContact O-N 3.19Å; I22-F24 PolarHBondContact O-N 3.3Å; F24-L27 PolarHBondContact O-N 3.03Å; F24-L28 HydrophobicContact CD1-CD1 3.91Å; F24-L28 HydrophobicContact CE1-CD1 3.93Å; F24-L28 PolarHBondContact O-N 2.83Å
25	N	45.4	Very low	53.3	Low	104 Å²	104	89.7 Å²	89.7	56%	0.556	50%	0.503	S	S	*	.	H	α-helix	trans	-69.1	-34.3	174.9	-82.1	-38.7	0	0	0	112.7	S21 I22 L28 S29	S21-N25 WeakPolarHBondContact O-CB 3.27Å; S21-N25 PolarHBondContact O-N 2.97Å; S21-N25 PolarHBondContact O-ND2 3.47Å; I22-N25 PolarHBondContact O-N 2.96Å; N25-L28 PolarHBondContact O-N 3.09Å; N25-S29 PolarHBondContact O-N 3.04Å; N25-S29 PolarHBondContact O-OG 2.66Å
26	H	46.8	Very low	55.3	Low	67 Å²	67	88 Å²	88	31%	0.31	49%	0.487	S	S	.	.	H	α-helix	trans	-71.1	-35.3	174.8	-111.3	22.7	0	0	0	113.2	I22 L28 S29	I22-H26 PolarHBondContact O-N 3.09Å; H26-L28 PolarHBondContact O-N 2.77Å; H26-S29 PolarHBondContact O-N 3.24Å; H26-S29 PolarHBondContact O-OG 2.87Å
27	L	39.9	Very low	57.6	Low	114 Å²	114	91 Å²	91	60%	0.597	49%	0.493	S	S	*	.	H	α-helix	trans	-64.8	-23.1	177.1	-148.4	82.8	0	0	0	113	F23 F24	F23-L27 PolarHBondContact O-N 3.31Å; F24-L27 PolarHBondContact O-N 3.03Å
28	L	45.6	Very low	59.5	Low	134 Å²	134	88.4 Å²	88.4	70%	0.702	47%	0.472	S	S	*	.	H	α-helix	trans	-93.6	-13.5	179.4	-72.7	164.7	0	0	0	113.6	F24 N25 H26	F24-L28 HydrophobicContact CD1-CD1 3.91Å; F24-L28 HydrophobicContact CE1-CD1 3.93Å; F24-L28 PolarHBondContact O-N 2.83Å; N25-L28 PolarHBondContact O-N 3.09Å; H26-L28 PolarHBondContact O-N 2.77Å
29	S	46	Very low	61.5	Low	63 Å²	63	84.9 Å²	84.9	44%	0.441	46%	0.456	S	S	.	.	T	Hydrogen-bonded Turn	trans	-101	1.4	-173.5	67	0	0	0	0	115.4	N25 H26 Q31	N25-S29 PolarHBondContact O-N 3.04Å; N25-S29 PolarHBondContact O-OG 2.66Å; H26-S29 PolarHBondContact O-N 3.24Å; H26-S29 PolarHBondContact O-OG 2.87Å; S29-Q31 PolarHBondContact O-N 3.18Å; S29-Q31 VanDerWaalsContact O-N 3.11Å
30	G	44.5	Very low	63.5	Low	68 Å²	68	82.8 Å²	82.8	70%	0.701	45%	0.453	S	S	*	.	T	Hydrogen-bonded Turn	trans	62.7	19	173.8	0	0	0	0	0	115.1
31	Q	53	Low	65.5	Low	128 Å²	128	77.9 Å²	77.9	60%	0.598	43%	0.426	S	S	*	.			trans	-108.8	86.3	174.7	-74.7	-174.1	-20.9	0	0	108.7	S29 V33	S29-Q31 PolarHBondContact O-N 3.18Å; S29-Q31 VanDerWaalsContact O-N 3.11Å; Q31-V33 PolarHBondContact O-N 3.07Å; Q31-V33 VanDerWaalsContact O-N 3.16Å
32	D	77.1	Confident	67.2	Low	91 Å²	91	77.9 Å²	77.9	49%	0.487	43%	0.43	S	S	.	.			trans	-74.9	7.1	178.3	-70.2	-28.3	0	0	0	113	R107 L108	D32-R107 HydrophobicContact CB-CG 4.36Å; D32-R107 CarbonylContact O-C 3.41Å; D32-R107 WeakPolarHBondContact O-CA 3.42Å; D32-L108 PolarHBondContact O-N 3.5Å
33	V	85.9	Confident	68.3	Low	46 Å²	46	83 Å²	83	28%	0.279	45%	0.451	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	124.5	-174.8	-178.4	0	0	0	0	109.3	Q31 E87 R105 L106 R107	Q31-V33 PolarHBondContact O-N 3.07Å; Q31-V33 VanDerWaalsContact O-N 3.16Å; V33-E87 WeakPolarHBondContact CG1-OE2 2.96Å; V33-E87 WeakPolarHBondContact CG2-OE2 3.36Å; V33-R105 HydrophobicContact CG1-CB 3.87Å; V33-R105 HydrophobicContact CG1-CG 4.05Å; V33-L106 WeakPolarHBondContact CA-O 3.41Å; V33-R107 HydrophobicContact CG2-CB 4.32Å; V33-R107 HydrophobicContact CG2-CG 4.28Å
34	I	88.7	Confident	69.9	Low	26 Å²	26	81 Å²	81	13%	0.133	45%	0.452	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	141.2	173.9	64.7	170.5	0	0	0	110.6	V36 P81 R105 L106 L108	I34-V36 HydrophobicContact CD1-CG2 4.3Å; I34-V36 HydrophobicContact CG1-CG2 4.26Å; I34-P81 HydrophobicContact CD1-CG 4Å; I34-R105 WeakPolarHBondContact O-CA 3.28Å; I34-L106 HydrophobicContact CD1-CB 4.5Å; I34-L106 HydrophobicContact CD1-CD2 4.29Å; I34-L106 HydrophobicContact CG1-CB 3.91Å; I34-L106 PolarHBondContact N-O 3.23Å; I34-L106 PolarHBondContact O-N 3.1Å; I34-L108 HydrophobicContact CD1-CD2 4.03Å; I34-L108 HydrophobicContact CG1-CD2 4.38Å; I34-L108 HydrophobicContact CG2-CD1 3.95Å; I34-L108 HydrophobicContact CG2-CG 4.33Å
35	D	90.8	Very high	71.7	Confident	88 Å²	88	75.3 Å²	75.3	47%	0.471	43%	0.427	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.5	127.1	169.7	-77.6	-28.2	0	0	0	108.8	L102 R105	D35-L102 HydrophobicContact CB-CD2 3.76Å; D35-R105 WeakPolarHBondContact OD1-CG 3.5Å; D35-R105 IonicContact OD1-NE 3.34Å; D35-R105 PolarHBondContact OD1-NE 2.78Å
36	V	89.8	Confident	73.4	Confident	12 Å²	12	75.9 Å²	75.9	7%	0.073	43%	0.434	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	119.2	-178.7	-174.4	0	0	0	0	110.7	I34 P81 L103 Y104 L106	I34-V36 HydrophobicContact CD1-CG2 4.3Å; I34-V36 HydrophobicContact CG1-CG2 4.26Å; V36-P81 HydrophobicContact CG1-CG 4.15Å; V36-P81 HydrophobicContact CG2-CG 3.82Å; V36-L103 PolarHBondContact O-N 3.42Å; V36-Y104 HydrophobicContact CB-CD1 4.1Å; V36-Y104 HydrophobicContact CB-CD2 4.18Å; V36-Y104 HydrophobicContact CB-CE1 3.77Å; V36-Y104 HydrophobicContact CB-CE2 3.86Å; V36-Y104 HydrophobicContact CB-CG 4.31Å; V36-Y104 HydrophobicContact CG1-CD1 4.41Å; V36-Y104 HydrophobicContact CG1-CE1 3.66Å; V36-Y104 HydrophobicContact CG1-CE2 4.28Å; V36-Y104 HydrophobicContact CG2-CD2 4.11Å; V36-Y104 HydrophobicContact CG2-CE1 4.42Å; V36-Y104 HydrophobicContact CG2-CE2 3.61Å; V36-Y104 PolarHBondContact N-O 2.95Å; V36-L106 HydrophobicContact CG2-CB 4.11Å
37	E	91.5	Very high	75.3	Confident	114 Å²	114	76.3 Å²	76.3	53%	0.533	44%	0.437	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.4	151.1	173.6	-67.3	178.6	-169.4	0	0	112	Q101 L102	E37-Q101 CarbonylContact C-O 3.6Å; E37-Q101 WeakPolarHBondContact CA-O 3.24Å; E37-L102 HydrophobicContact CG-CD2 3.69Å; E37-L102 HydrophobicContact CG-CG 4.38Å
38	G	86.9	Confident	77.6	Confident	7 Å²	7	70.9 Å²	70.9	7%	0.072	41%	0.408	C	S	.	.	P	Polyproline II helix	trans	-69.4	159.9	172	0	0	0	0	0	113.3	K100 Q101 L103	G38-K100 WeakPolarHBondContact O-CA 3.5Å; G38-K100 PolarHBondContact O-N 3.21Å; G38-Q101 PolarHBondContact N-O 2.61Å; G38-L103 VanDerWaalsContact CA-CD1 3.42Å
39	P	86.1	Confident	79.8	Confident	34 Å²	34	65.8 Å²	65.8	22%	0.221	38%	0.382	C	S	.	.	P	Polyproline II helix	trans	-64.1	162.1	177.9	27.4	-34.9	0	0	0	112.3	I69 V76 V78	P39-I69 HydrophobicContact CG-CD1 4Å; P39-V76 HydrophobicContact CB-CG1 3.83Å; P39-V76 HydrophobicContact CG-CB 4.32Å; P39-V76 HydrophobicContact CG-CG1 3.4Å; P39-V76 VanDerWaalsContact CG-CG1 3.4Å; P39-V78 HydrophobicContact CG-CG2 4.27Å
40	T	85.7	Confident	82	Confident	94 Å²	94	62.9 Å²	62.9	58%	0.577	36%	0.361	S	S	*	.	P	Polyproline II helix	trans	-74.9	141.9	167.9	50.6	0	0	0	0	110.6	K100	T40-K100 HydrophobicContact CG2-CD 4.35Å; T40-K100 HydrophobicContact CG2-CG 4.05Å
41	F	85.3	Confident	84.3	Confident	27 Å²	27	65.1 Å²	65.1	12%	0.118	35%	0.349	C	S	.	.	P	Polyproline II helix	trans	-93	167.8	172.7	-51.4	-36.7	0	0	0	111.6	I45 I69 T71 V76 A99	F41-I45 HydrophobicContact CB-CB 3.91Å; F41-I45 HydrophobicContact CB-CG2 4.01Å; F41-I45 WeakPolarHBondContact CB-O 3.48Å; F41-I45 HydrophobicContact CD2-CG2 4.08Å; F41-I45 HydrophobicContact CG-CG2 4.15Å; F41-I69 HydrophobicContact CE1-CB 4.49Å; F41-I69 HydrophobicContact CE1-CD1 4.05Å; F41-I69 HydrophobicContact CE1-CG2 3.92Å; F41-I69 HydrophobicContact CZ-CD1 4.19Å; F41-I69 HydrophobicContact CZ-CG2 3.86Å; F41-T71 HydrophobicContact CD1-CG2 4.38Å; F41-T71 HydrophobicContact CE1-CG2 4.47Å; F41-V76 HydrophobicContact CD1-CG2 4.14Å; F41-V76 HydrophobicContact CE1-CG2 4.44Å; F41-A99 HydrophobicContact CD2-CB 3.73Å; F41-A99 HydrophobicContact CE2-CB 4.04Å; F41-A99 VanDerWaalsContact CE2-N 3.28Å; F41-A99 HydrophobicContact CG-CB 4.15Å
42	A	79.7	Confident	86.2	Confident	62 Å²	62	60.5 Å²	60.5	51%	0.512	33%	0.326	S	S	.	.	P	Polyproline II helix	trans	-65.3	155.5	171.1	0	0	0	0	0	110.6	S44 I45	A42-S44 PolarHBondContact O-N 3.26Å; A42-I45 HydrophobicContact CB-CD1 4.37Å; A42-I45 PolarHBondContact O-N 3.04Å
43	E	75.1	Confident	86.8	Confident	213 Å²	213	59.8 Å²	59.8	100%	0.995	32%	0.321	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.3	-24.8	-173.6	-67	-176.5	170.5	0	0	114.8
44	S	80.8	Confident	87.1	Confident	73 Å²	73	59.1 Å²	59.1	51%	0.51	32%	0.315	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.3	1.1	179.6	63.4	0	0	0	0	115.4	A42 K73	A42-S44 PolarHBondContact O-N 3.26Å; S44-K73 PolarHBondContact OG-NZ 2.93Å
45	I	81.3	Confident	87.1	Confident	16 Å²	16	65.1 Å²	65.1	8%	0.082	34%	0.342	C	S	.	.			trans	-124.9	121.6	-172.4	-53.7	177.7	0	0	0	109.7	F41 A42 T71 D72 K73	F41-I45 HydrophobicContact CB-CB 3.91Å; F41-I45 HydrophobicContact CB-CG2 4.01Å; F41-I45 WeakPolarHBondContact CB-O 3.48Å; F41-I45 HydrophobicContact CD2-CG2 4.08Å; F41-I45 HydrophobicContact CG-CG2 4.15Å; A42-I45 HydrophobicContact CB-CD1 4.37Å; A42-I45 PolarHBondContact O-N 3.04Å; I45-T71 HydrophobicContact CD1-CG2 4.43Å; I45-T71 HydrophobicContact CG2-CG2 3.74Å; I45-D72 WeakPolarHBondContact CG1-OD1 3.22Å; I45-K73 HydrophobicContact CD1-CB 4.13Å; I45-K73 HydrophobicContact CD1-CD 4.31Å; I45-K73 HydrophobicContact CG1-CD 4.4Å
46	T	80.8	Confident	87.1	Confident	116 Å²	116	67.4 Å²	67.4	71%	0.712	35%	0.348	S	S	*	.			trans	-100.6	-31	-178.6	49.1	0	0	0	0	113.7
47	E	87.2	Confident	87	Confident	76 Å²	76	69.4 Å²	69.4	36%	0.355	37%	0.371	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.8	156.3	-174.1	58.9	175.5	-164.9	0	0	112	R96 V97	E47-R96 IonicContact OE1-CZ 2.85Å; E47-R96 VanDerWaalsContact OE1-CZ 3.31Å; E47-R96 IonicContact OE1-NE 2.69Å; E47-R96 IonicContact OE1-NH1 3.34Å; E47-R96 PolarHBondContact OE1-NH1 2.71Å; E47-R96 IonicContact OE1-NH2 3.31Å; E47-R96 WeakPolarHBondContact OE2-CD 3.44Å; E47-R96 IonicContact OE2-NH1 3.9Å; E47-R96 PolarHBondContact OE2-NH1 3.07Å; E47-V97 WeakPolarHBondContact CA-O 3.25Å
48	G	88.2	Confident	86.9	Confident	0 Å²	0	67.3 Å²	67.3	0%	0	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.9	162.6	171	0	0	0	0	0	111.9	E70 R96 V97	G48-E70 CarbonylContact C-O 3.52Å; G48-E70 VanDerWaalsContact CA-O 3.32Å; G48-E70 WeakPolarHBondContact CA-O 3.36Å; G48-R96 CarbonylContact O-C 3.59Å; G48-R96 WeakPolarHBondContact O-CA 3.5Å; G48-V97 PolarHBondContact N-O 3.37Å; G48-V97 WeakPolarHBondContact O-CG2 3.31Å; G48-V97 PolarHBondContact O-N 2.88Å
49	D	91.4	Very high	87	Confident	27 Å²	27	71 Å²	71	14%	0.144	38%	0.375	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91	124.4	175.7	-69.3	-12	0	0	0	109.4	I69 E70 D95 R96 R169	D49-I69 CarbonylContact O-C 3.49Å; D49-I69 WeakPolarHBondContact O-CA 3.24Å; D49-E70 PolarHBondContact N-O 3.2Å; D49-E70 PolarHBondContact O-N 3Å; D49-D95 WeakPolarHBondContact CA-O 3.16Å; D49-R96 VanDerWaalsContact OD1-CG 3.27Å; D49-R96 WeakPolarHBondContact OD1-CG 3.47Å; D49-R169 IonicContact OD1-CZ 2.86Å; D49-R169 IonicContact OD1-NE 2.67Å; D49-R169 IonicContact OD1-NH1 3.77Å; D49-R169 IonicContact OD1-NH2 2.8Å; D49-R169 PolarHBondContact OD1-NH2 3.47Å; D49-R169 WeakPolarHBondContact OD2-CD 3.16Å; D49-R169 IonicContact OD2-CZ 3.92Å; D49-R169 IonicContact OD2-NE 3.83Å; D49-R169 PolarHBondContact OD2-NE 2.81Å; D49-R169 IonicContact OD2-NH1 2.7Å; D49-R169 IonicContact OD2-NH2 3.33Å; D49-R169 PolarHBondContact OD2-NH2 2.92Å
50	I	92.5	Very high	87.2	Confident	2 Å²	2	69.4 Å²	69.4	1%	0.01	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.5	141.5	178.5	-168.3	164.9	0	0	0	111.8	W52 A67 E68 I69 V91 S92 G94 D95 V97 L103	I50-W52 HydrophobicContact CD1-CD2 4.44Å; I50-W52 HydrophobicContact CD1-CH2 4.02Å; I50-W52 HydrophobicContact CD1-CZ2 3.69Å; I50-A67 HydrophobicContact CD1-CB 3.99Å; I50-A67 HydrophobicContact CG1-CB 3.97Å; I50-E68 CarbonylContact C-O 3.41Å; I50-I69 HydrophobicContact CB-CG1 4.47Å; I50-I69 HydrophobicContact CG1-CG1 4.31Å; I50-V91 HydrophobicContact CD1-CG2 3.79Å; I50-V91 HydrophobicContact CG2-CB 4.43Å; I50-V91 HydrophobicContact CG2-CG2 3.84Å; I50-S92 WeakPolarHBondContact CG2-O 3.44Å; I50-G94 WeakPolarHBondContact O-CA 3.44Å; I50-G94 PolarHBondContact O-N 3.14Å; I50-D95 HydrophobicContact CG2-CB 4.41Å; I50-D95 PolarHBondContact N-O 2.78Å; I50-V97 HydrophobicContact CB-CG1 4.1Å; I50-V97 HydrophobicContact CB-CG2 4.15Å; I50-V97 HydrophobicContact CG2-CG1 4.04Å; I50-L103 HydrophobicContact CD1-CB 4.47Å; I50-L103 HydrophobicContact CD1-CD1 3.95Å; I50-L103 HydrophobicContact CD1-CD2 3.89Å; I50-L103 HydrophobicContact CD1-CG 4.32Å
51	R	91.6	Very high	87.3	Confident	116 Å²	116	70.9 Å²	70.9	44%	0.438	36%	0.363	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	118.1	170.9	-176.5	-178.6	176.2	-169.3	-4.9	110.2	A67 E68 D93	R51-A67 CarbonylContact O-C 3.55Å; R51-A67 WeakPolarHBondContact O-CA 3.42Å; R51-A67 WeakPolarHBondContact O-CB 3.23Å; R51-E68 PolarHBondContact N-O 3.1Å; R51-E68 PolarHBondContact O-N 3.03Å; R51-D93 WeakPolarHBondContact CA-OD1 3.27Å
52	W	93.2	Very high	87.4	Confident	30 Å²	30	71.7 Å²	71.7	11%	0.114	38%	0.375	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.8	132.1	178	-67.4	104.6	0	0	0	111.3	I50 V66 A67 L89 V91 D93 L103 Y104	I50-W52 HydrophobicContact CD1-CD2 4.44Å; I50-W52 HydrophobicContact CD1-CH2 4.02Å; I50-W52 HydrophobicContact CD1-CZ2 3.69Å; W52-V66 HydrophobicContact CE3-CG1 4.01Å; W52-V66 HydrophobicContact CZ3-CG1 3.71Å; W52-A67 HydrophobicContact CD2-CB 4.18Å; W52-A67 HydrophobicContact CE3-CB 3.64Å; W52-A67 HydrophobicContact CZ3-CB 3.89Å; W52-L89 HydrophobicContact CD2-CD1 3.96Å; W52-L89 HydrophobicContact CD2-CD2 4.05Å; W52-L89 HydrophobicContact CD2-CG 4.47Å; W52-L89 HydrophobicContact CE3-CD1 4.42Å; W52-L89 HydrophobicContact CE3-CD2 3.79Å; W52-L89 HydrophobicContact CG-CD1 4.09Å; W52-L89 HydrophobicContact CH2-CD2 3.73Å; W52-L89 HydrophobicContact CZ2-CB 3.98Å; W52-L89 HydrophobicContact CZ2-CD2 3.92Å; W52-L89 HydrophobicContact CZ2-CG 4.37Å; W52-L89 HydrophobicContact CZ3-CD2 3.66Å; W52-V91 HydrophobicContact CZ2-CG2 3.64Å; W52-V91 PolarHBondContact NE1-O 2.94Å; W52-D93 PolarHBondContact N-OD1 3.06Å; W52-L103 HydrophobicContact CH2-CB 4.09Å; W52-Y104 AromaticContact CH2-CD1 3.6Å; W52-Y104 HydrophobicContact CH2-CD1 3.6Å; W52-Y104 HydrophobicContact CH2-CG 4.01Å; W52-Y104 AromaticContact CZ3-CD1 3.77Å; W52-Y104 HydrophobicContact CZ3-CD1 3.77Å; W52-Y104 HydrophobicContact CZ3-CE1 4.4Å; W52-Y104 HydrophobicContact CZ3-CG 4.21Å
53	L	90.6	Very high	87.8	Confident	76 Å²	76	75.3 Å²	75.3	40%	0.398	39%	0.385	S	S	.	.	S	Bend	trans	-96.4	-20.8	170	-60.9	179.3	0	0	0	111.7	L65 V66 E68	L53-L65 HydrophobicContact CD1-CB 3.94Å; L53-V66 PolarHBondContact N-O 2.97Å; L53-E68 HydrophobicContact CD1-CG 3.95Å; L53-E68 HydrophobicContact CG-CG 4.36Å
54	K	91.2	Very high	88.5	Confident	33 Å²	33	67.9 Å²	67.9	14%	0.143	35%	0.351	C	S	.	.	S	Bend	trans	-123.6	152.4	-176.2	-61.6	-68.8	-174.2	171.7	0	110.7	E58 V60 E64 V66 L86	K54-E58 WeakPolarHBondContact CA-OE2 3.44Å; K54-E58 HydrophobicContact CD-CG 4.3Å; K54-E58 WeakPolarHBondContact CD-OE1 3.25Å; K54-E58 VanDerWaalsContact CD-OE2 3.31Å; K54-E58 WeakPolarHBondContact CD-OE2 3.2Å; K54-E58 IonicContact NZ-OE1 3.79Å; K54-E58 PolarHBondContact NZ-OE1 3.31Å; K54-V60 HydrophobicContact CB-CG1 4.38Å; K54-V60 HydrophobicContact CD-CG1 4.15Å; K54-V60 HydrophobicContact CG-CG1 3.92Å; K54-E64 WeakPolarHBondContact CE-OE1 3.42Å; K54-E64 IonicContact NZ-OE1 3.22Å; K54-E64 PolarHBondContact NZ-OE1 3.3Å; K54-V66 HydrophobicContact CB-CG1 4.14Å; K54-V66 HydrophobicContact CG-CG1 4.45Å; K54-V66 PolarHBondContact N-O 3.41Å; K54-L86 HydrophobicContact CB-CD1 3.43Å; K54-L86 VanDerWaalsContact CB-CD1 3.43Å; K54-L86 HydrophobicContact CG-CD1 4.42Å
55	Q	89.5	Confident	89	Confident	151 Å²	151	67 Å²	67	71%	0.706	34%	0.34	S	S	*	.			trans	-106.8	158.8	-178.2	-62.8	-177.8	37	0	0	112.3	G57 E58	Q55-G57 PolarHBondContact O-N 2.96Å; Q55-E58 PolarHBondContact N-OE2 2.98Å; Q55-E58 VanDerWaalsContact N-OE2 3.11Å; Q55-E58 WeakPolarHBondContact O-CB 3.31Å; Q55-E58 PolarHBondContact O-N 3.5Å
56	K	91.4	Very high	89.5	Confident	137 Å²	137	66.2 Å²	66.2	60%	0.596	34%	0.336	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.1	131	170	174.1	172.1	171.2	156.8	0	110.2	E87 L89	K56-E87 WeakPolarHBondContact CD-O 3.27Å; K56-E87 WeakPolarHBondContact CE-O 3.44Å; K56-E87 WeakPolarHBondContact CG-O 3.21Å; K56-E87 PolarHBondContact NZ-O 2.84Å; K56-L89 HydrophobicContact CB-CG 4.41Å
57	G	87.6	Confident	90.1	Very high	53 Å²	53	60.7 Å²	60.7	55%	0.546	30%	0.302	S	S	.	.	T	Hydrogen-bonded Turn	trans	90.3	-6.6	-176.8	0	0	0	0	0	114.6	Q55 L86	Q55-G57 PolarHBondContact O-N 2.96Å; G57-L86 PolarHBondContact N-O 2.75Å
58	E	89.5	Confident	90.3	Very high	70 Å²	70	58.1 Å²	58.1	33%	0.327	29%	0.29	S	S	.	.			trans	-78.7	140.3	177.9	-159.4	176.7	161.2	0	0	111.3	K54 Q55 L86	K54-E58 WeakPolarHBondContact CA-OE2 3.44Å; K54-E58 HydrophobicContact CD-CG 4.3Å; K54-E58 WeakPolarHBondContact CD-OE1 3.25Å; K54-E58 VanDerWaalsContact CD-OE2 3.31Å; K54-E58 WeakPolarHBondContact CD-OE2 3.2Å; K54-E58 IonicContact NZ-OE1 3.79Å; K54-E58 PolarHBondContact NZ-OE1 3.31Å; Q55-E58 PolarHBondContact N-OE2 2.98Å; Q55-E58 VanDerWaalsContact N-OE2 3.11Å; Q55-E58 WeakPolarHBondContact O-CB 3.31Å; Q55-E58 PolarHBondContact O-N 3.5Å; E58-L86 PolarHBondContact O-N 2.87Å
59	F	89.2	Confident	90.5	Very high	85 Å²	85	58.2 Å²	58.2	37%	0.373	29%	0.291	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.6	131.5	172.1	178.6	-93.9	0	0	0	109.9	K61 G84 V85 M111	F59-K61 HydrophobicContact CE1-CG 3.87Å; F59-G84 WeakPolarHBondContact CA-O 3.34Å; F59-G84 WeakPolarHBondContact CD2-O 3.3Å; F59-V85 HydrophobicContact CD2-CG2 4.15Å; F59-M111 HydrophobicContact CZ-CE 3.93Å
60	V	90.4	Very high	90.3	Very high	0 Å²	0	57.7 Å²	57.7	0%	0	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122	140.9	175.7	-64	0	0	0	0	109.6	K54 E64 V66 A80 S83 G84 L86 L106	K54-V60 HydrophobicContact CB-CG1 4.38Å; K54-V60 HydrophobicContact CD-CG1 4.15Å; K54-V60 HydrophobicContact CG-CG1 3.92Å; V60-E64 WeakPolarHBondContact CA-OE2 3.33Å; V60-E64 HydrophobicContact CB-CB 4.5Å; V60-V66 HydrophobicContact CG1-CG2 4.29Å; V60-V66 HydrophobicContact CG2-CG2 4.47Å; V60-A80 HydrophobicContact CB-CB 4.25Å; V60-A80 HydrophobicContact CG2-CB 3.77Å; V60-S83 CarbonylContact O-C 3.57Å; V60-S83 VanDerWaalsContact O-CA 3.28Å; V60-S83 WeakPolarHBondContact O-CA 3.04Å; V60-G84 PolarHBondContact N-O 2.93Å; V60-G84 PolarHBondContact O-N 3.49Å; V60-L86 HydrophobicContact CG1-CD1 3.99Å; V60-L86 HydrophobicContact CG1-CG 4.2Å; V60-L86 HydrophobicContact CG2-CD2 4.35Å; V60-L86 HydrophobicContact CG2-CG 4.38Å; V60-L106 HydrophobicContact CG2-CD1 3.64Å
61	K	87.9	Confident	90.1	Very high	126 Å²	126	58.1 Å²	58.1	55%	0.548	29%	0.29	S	S	.	.			trans	-82.8	158.4	171.2	-65.7	177.9	-177.3	176.4	0	110.2	F59 D63 E64 A80	F59-K61 HydrophobicContact CE1-CG 3.87Å; K61-D63 PolarHBondContact O-N 3.29Å; K61-E64 HydrophobicContact CB-CB 4.31Å; K61-E64 PolarHBondContact N-OE2 3.32Å; K61-E64 WeakPolarHBondContact O-CB 3.43Å; K61-E64 PolarHBondContact O-N 3.43Å; K61-A80 WeakPolarHBondContact O-CB 3.48Å
62	A	87.3	Confident	89.4	Confident	44 Å²	44	55.9 Å²	55.9	36%	0.364	29%	0.287	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53.6	137.4	167.6	0	0	0	0	0	110	E64 S83	A62-E64 PolarHBondContact O-N 3.48Å; A62-S83 PolarHBondContact N-OG 3Å
63	D	87.4	Confident	88.6	Confident	137 Å²	137	60.1 Å²	60.1	73%	0.733	31%	0.306	S	S	*	.	T	Hydrogen-bonded Turn	trans	65	6.7	-174.9	-55.2	-50.3	0	0	0	115.7	K61 A80	K61-D63 PolarHBondContact O-N 3.29Å; D63-A80 PolarHBondContact N-O 2.89Å
64	E	89.9	Confident	88.3	Confident	58 Å²	58	59.7 Å²	59.7	27%	0.271	31%	0.306	S	S	.	.			trans	-74.9	137.1	172.8	-168.9	172.4	174.6	0	0	110.7	K54 V60 K61 A62 V66 P79 A80	K54-E64 WeakPolarHBondContact CE-OE1 3.42Å; K54-E64 IonicContact NZ-OE1 3.22Å; K54-E64 PolarHBondContact NZ-OE1 3.3Å; V60-E64 WeakPolarHBondContact CA-OE2 3.33Å; V60-E64 HydrophobicContact CB-CB 4.5Å; K61-E64 HydrophobicContact CB-CB 4.31Å; K61-E64 PolarHBondContact N-OE2 3.32Å; K61-E64 WeakPolarHBondContact O-CB 3.43Å; K61-E64 PolarHBondContact O-N 3.43Å; A62-E64 PolarHBondContact O-N 3.48Å; E64-V66 PolarHBondContact O-N 2.92Å; E64-P79 CarbonylContact O-C 3.6Å; E64-P79 WeakPolarHBondContact O-CA 3.45Å; E64-A80 PolarHBondContact O-N 2.92Å
65	L	90.8	Very high	88	Confident	54 Å²	54	59.7 Å²	59.7	28%	0.283	31%	0.309	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.9	121.7	178.9	-67.9	176.1	0	0	0	111.1	L53 E77	L53-L65 HydrophobicContact CD1-CB 3.94Å; L65-E77 HydrophobicContact CD1-CG 4.31Å; L65-E77 HydrophobicContact CD2-CB 3.57Å; L65-E77 HydrophobicContact CD2-CG 3.78Å
66	V	92.4	Very high	88.1	Confident	0 Å²	0	53.9 Å²	53.9	0%	0	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.9	-40.5	-179.2	-171.3	0	0	0	0	111.2	W52 L53 K54 V60 E64 V78 A80 L86 Y104	W52-V66 HydrophobicContact CE3-CG1 4.01Å; W52-V66 HydrophobicContact CZ3-CG1 3.71Å; L53-V66 PolarHBondContact N-O 2.97Å; K54-V66 HydrophobicContact CB-CG1 4.14Å; K54-V66 HydrophobicContact CG-CG1 4.45Å; K54-V66 PolarHBondContact N-O 3.41Å; V60-V66 HydrophobicContact CG1-CG2 4.29Å; V60-V66 HydrophobicContact CG2-CG2 4.47Å; E64-V66 PolarHBondContact O-N 2.92Å; V66-V78 PolarHBondContact N-O 3.02Å; V66-A80 HydrophobicContact CG2-CB 3.66Å; V66-L86 HydrophobicContact CG1-CD1 3.76Å; V66-L86 HydrophobicContact CG1-CD2 3.67Å; V66-L86 HydrophobicContact CG1-CG 4.37Å; V66-Y104 HydrophobicContact CB-CE1 4.41Å; V66-Y104 HydrophobicContact CG1-CE1 4.21Å; V66-Y104 HydrophobicContact CG1-CE2 4.49Å
67	A	92.8	Very high	88	Confident	0 Å²	0	51 Å²	51	0%	0	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.3	168	179.6	0	0	0	0	0	111.5	I50 R51 W52 V78	I50-A67 HydrophobicContact CD1-CB 3.99Å; I50-A67 HydrophobicContact CG1-CB 3.97Å; R51-A67 CarbonylContact O-C 3.55Å; R51-A67 WeakPolarHBondContact O-CA 3.42Å; R51-A67 WeakPolarHBondContact O-CB 3.23Å; W52-A67 HydrophobicContact CD2-CB 4.18Å; W52-A67 HydrophobicContact CE3-CB 3.64Å; W52-A67 HydrophobicContact CZ3-CB 3.89Å; A67-V78 HydrophobicContact CB-CB 4.06Å; A67-V78 HydrophobicContact CB-CG2 4.21Å; A67-V78 PolarHBondContact N-O 3.45Å; A67-V78 WeakPolarHBondContact O-CB 3.22Å; A67-V78 PolarHBondContact O-N 2.8Å
68	E	92.2	Very high	88.3	Confident	22 Å²	22	48.6 Å²	48.6	10%	0.103	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	135.8	170.9	-68	-176	154.4	0	0	108.7	I50 R51 L53 T75 V76 R263	I50-E68 CarbonylContact C-O 3.41Å; R51-E68 PolarHBondContact N-O 3.1Å; R51-E68 PolarHBondContact O-N 3.03Å; L53-E68 HydrophobicContact CD1-CG 3.95Å; L53-E68 HydrophobicContact CG-CG 4.36Å; E68-T75 HydrophobicContact CB-CG2 3.71Å; E68-T75 HydrophobicContact CG-CG2 4.17Å; E68-V76 CarbonylContact C-O 3.39Å; E68-V76 WeakPolarHBondContact CA-O 3.24Å; E68-R263 IonicContact OE1-CZ 2.74Å; E68-R263 IonicContact OE1-NE 2.8Å; E68-R263 PolarHBondContact OE1-NE 2.7Å; E68-R263 IonicContact OE1-NH2 3.31Å; E68-R263 PolarHBondContact OE1-NH2 2.67Å
69	I	92	Very high	88.4	Confident	1 Å²	1	48.1 Å²	48.1	1%	0.005	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	111.1	174.9	-61	170.1	0	0	0	108.1	P39 F41 D49 I50 T71 T75 V76 V78 V97 L103	P39-I69 HydrophobicContact CG-CD1 4Å; F41-I69 HydrophobicContact CE1-CB 4.49Å; F41-I69 HydrophobicContact CE1-CD1 4.05Å; F41-I69 HydrophobicContact CE1-CG2 3.92Å; F41-I69 HydrophobicContact CZ-CD1 4.19Å; F41-I69 HydrophobicContact CZ-CG2 3.86Å; D49-I69 CarbonylContact O-C 3.49Å; D49-I69 WeakPolarHBondContact O-CA 3.24Å; I50-I69 HydrophobicContact CB-CG1 4.47Å; I50-I69 HydrophobicContact CG1-CG1 4.31Å; I69-T71 HydrophobicContact CG2-CG2 4.32Å; I69-T71 PolarHBondContact O-N 2.72Å; I69-T75 CarbonylContact O-C 3.56Å; I69-T75 WeakPolarHBondContact O-CA 3.4Å; I69-V76 HydrophobicContact CB-CB 4.38Å; I69-V76 PolarHBondContact N-O 2.81Å; I69-V76 PolarHBondContact O-N 2.83Å; I69-V78 HydrophobicContact CD1-CG2 3.73Å; I69-V78 HydrophobicContact CG1-CG2 3.79Å; I69-V97 HydrophobicContact CD1-CG2 3.81Å; I69-V97 HydrophobicContact CG1-CG2 3.96Å; I69-V97 HydrophobicContact CG2-CG2 3.88Å; I69-L103 HydrophobicContact CD1-CD1 4.27Å
70	E	87.3	Confident	88.4	Confident	16 Å²	16	44.1 Å²	44.1	8%	0.075	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80	109.5	174.5	-69.2	-171.5	-173.4	0	0	109.8	G48 D49 N168	G48-E70 CarbonylContact C-O 3.52Å; G48-E70 VanDerWaalsContact CA-O 3.32Å; G48-E70 WeakPolarHBondContact CA-O 3.36Å; D49-E70 PolarHBondContact N-O 3.2Å; D49-E70 PolarHBondContact O-N 3Å; E70-N168 PolarHBondContact OE1-ND2 3.41Å
71	T	87.4	Confident	88.2	Confident	11 Å²	11	46.9 Å²	46.9	7%	0.067	25%	0.251	C	S	.	.			trans	-93.7	178.2	172.9	70.3	0	0	0	0	111	F41 I45 I69 K73 T74 V76	F41-T71 HydrophobicContact CD1-CG2 4.38Å; F41-T71 HydrophobicContact CE1-CG2 4.47Å; I45-T71 HydrophobicContact CD1-CG2 4.43Å; I45-T71 HydrophobicContact CG2-CG2 3.74Å; I69-T71 HydrophobicContact CG2-CG2 4.32Å; I69-T71 PolarHBondContact O-N 2.72Å; T71-K73 PolarHBondContact O-N 2.67Å; T71-K73 PolarHBondContact OG1-N 3.31Å; T71-T74 WeakPolarHBondContact CB-O 3.19Å; T71-T74 PolarHBondContact N-O 2.87Å; T71-T74 PolarHBondContact OG1-N 2.99Å; T71-T74 PolarHBondContact OG1-O 2.89Å; T71-V76 HydrophobicContact CG2-CG2 4Å
72	D	77.7	Confident	88.2	Confident	69 Å²	69	44.7 Å²	44.7	37%	0.369	24%	0.243	S	C	.	.	S	Bend	trans	-64.5	-19.7	173.6	70.4	-29.1	0	0	0	113.5	I45 R173	I45-D72 WeakPolarHBondContact CG1-OD1 3.22Å; D72-R173 PolarHBondContact O-NH1 3.32Å; D72-R173 PolarHBondContact O-NH2 3.3Å
73	K	76.8	Confident	88.2	Confident	120 Å²	120	44 Å²	44	52%	0.522	24%	0.235	S	C	.	.	S	Bend	trans	-120	-35	-175.2	-70.2	173.2	-171.4	-177.1	0	113.9	S44 I45 T71	S44-K73 PolarHBondContact OG-NZ 2.93Å; I45-K73 HydrophobicContact CD1-CB 4.13Å; I45-K73 HydrophobicContact CD1-CD 4.31Å; I45-K73 HydrophobicContact CG1-CD 4.4Å; T71-K73 PolarHBondContact O-N 2.67Å; T71-K73 PolarHBondContact OG1-N 3.31Å
74	T	83.4	Confident	88.3	Confident	66 Å²	66	37.5 Å²	37.5	41%	0.405	20%	0.201	S	C	.	.			trans	-149.2	167.6	-172.5	-170.6	0	0	0	0	112.1	T71 V76	T71-T74 WeakPolarHBondContact CB-O 3.19Å; T71-T74 PolarHBondContact N-O 2.87Å; T71-T74 PolarHBondContact OG1-N 2.99Å; T71-T74 PolarHBondContact OG1-O 2.89Å; T74-V76 HydrophobicContact CG2-CG2 4.19Å
75	T	86.3	Confident	88.3	Confident	33 Å²	33	37 Å²	37	20%	0.202	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.5	124.3	169	-58.2	0	0	0	0	108.5	E68 I69	E68-T75 HydrophobicContact CB-CG2 3.71Å; E68-T75 HydrophobicContact CG-CG2 4.17Å; I69-T75 CarbonylContact O-C 3.56Å; I69-T75 WeakPolarHBondContact O-CA 3.4Å
76	V	89.9	Confident	88.3	Confident	29 Å²	29	34.4 Å²	34.4	18%	0.176	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100	127.4	178.5	-168.9	0	0	0	0	109.1	P39 F41 E68 I69 T71 T74	P39-V76 HydrophobicContact CB-CG1 3.83Å; P39-V76 HydrophobicContact CG-CB 4.32Å; P39-V76 HydrophobicContact CG-CG1 3.4Å; P39-V76 VanDerWaalsContact CG-CG1 3.4Å; F41-V76 HydrophobicContact CD1-CG2 4.14Å; F41-V76 HydrophobicContact CE1-CG2 4.44Å; E68-V76 CarbonylContact C-O 3.39Å; E68-V76 WeakPolarHBondContact CA-O 3.24Å; I69-V76 HydrophobicContact CB-CB 4.38Å; I69-V76 PolarHBondContact N-O 2.81Å; I69-V76 PolarHBondContact O-N 2.83Å; T71-V76 HydrophobicContact CG2-CG2 4Å; T74-V76 HydrophobicContact CG2-CG2 4.19Å
77	E	90.8	Very high	88.1	Confident	77 Å²	77	37.2 Å²	37.2	36%	0.36	20%	0.201	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.9	139.2	-179.6	-77.2	171.8	-162.3	0	0	111.6	L65 P79 R263	L65-E77 HydrophobicContact CD1-CG 4.31Å; L65-E77 HydrophobicContact CD2-CB 3.57Å; L65-E77 HydrophobicContact CD2-CG 3.78Å; E77-P79 VanDerWaalsContact O-CD 3.3Å; E77-P79 WeakPolarHBondContact O-CD 3.44Å; E77-R263 IonicContact OE1-CZ 3.63Å; E77-R263 IonicContact OE1-NH1 3.42Å; E77-R263 PolarHBondContact OE1-NH1 3.42Å; E77-R263 IonicContact OE1-NH2 2.72Å; E77-R263 PolarHBondContact OE1-NH2 3.39Å
78	V	92.1	Very high	88.1	Confident	2 Å²	2	40.6 Å²	40.6	1%	0.012	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	91.1	174.5	-171.7	0	0	0	0	109	P39 V66 A67 I69 L103 Y104	P39-V78 HydrophobicContact CG-CG2 4.27Å; V66-V78 PolarHBondContact N-O 3.02Å; A67-V78 HydrophobicContact CB-CB 4.06Å; A67-V78 HydrophobicContact CB-CG2 4.21Å; A67-V78 PolarHBondContact N-O 3.45Å; A67-V78 WeakPolarHBondContact O-CB 3.22Å; A67-V78 PolarHBondContact O-N 2.8Å; I69-V78 HydrophobicContact CD1-CG2 3.73Å; I69-V78 HydrophobicContact CG1-CG2 3.79Å; V78-L103 HydrophobicContact CG1-CD1 3.82Å; V78-L103 HydrophobicContact CG2-CD1 4.08Å; V78-Y104 HydrophobicContact CG1-CE1 4.14Å
79	P	91.6	Very high	88	Confident	60 Å²	60	42 Å²	42	39%	0.39	22%	0.224	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.5	153.5	176.3	32.2	-34.5	0	0	0	112.2	E64 E77	E64-P79 CarbonylContact O-C 3.6Å; E64-P79 WeakPolarHBondContact O-CA 3.45Å; E77-P79 VanDerWaalsContact O-CD 3.3Å; E77-P79 WeakPolarHBondContact O-CD 3.44Å
80	A	90.2	Very high	88	Confident	1 Å²	1	45 Å²	45	1%	0.008	24%	0.24	C	C	.	.			trans	-74.1	126	173.3	0	0	0	0	0	111.4	V60 K61 D63 E64 V66 H82 Y104	V60-A80 HydrophobicContact CB-CB 4.25Å; V60-A80 HydrophobicContact CG2-CB 3.77Å; K61-A80 WeakPolarHBondContact O-CB 3.48Å; D63-A80 PolarHBondContact N-O 2.89Å; E64-A80 PolarHBondContact O-N 2.92Å; V66-A80 HydrophobicContact CG2-CB 3.66Å; A80-H82 VanDerWaalsContact C-N 3.27Å; A80-H82 PolarHBondContact O-N 2.89Å; A80-Y104 WeakPolarHBondContact CA-OH 3.19Å
81	P	87.2	Confident	88.2	Confident	59 Å²	59	44.9 Å²	44.9	38%	0.383	24%	0.24	S	C	.	.	S	Bend	trans	-68.8	-25.6	-179.3	26.5	-34.2	0	0	0	113.2	I34 V36	I34-P81 HydrophobicContact CD1-CG 4Å; V36-P81 HydrophobicContact CG1-CG 4.15Å; V36-P81 HydrophobicContact CG2-CG 3.82Å
82	H	87.2	Confident	88.2	Confident	80 Å²	80	48 Å²	48	37%	0.37	26%	0.262	S	S	.	.	S	Bend	trans	-145.4	166.9	-179	-65.1	-68.5	0	0	0	110.8	A80 L106 L108	A80-H82 VanDerWaalsContact C-N 3.27Å; A80-H82 PolarHBondContact O-N 2.89Å; H82-L106 HydrophobicContact CB-CD2 4.24Å; H82-L106 WeakPolarHBondContact O-CD2 3.3Å; H82-L108 HydrophobicContact CB-CD2 3.3Å
83	S	86.7	Confident	88.8	Confident	30 Å²	30	49.6 Å²	49.6	21%	0.21	27%	0.271	C	S	.	.	S	Bend	trans	-79.2	133.2	172	-56.7	0	0	0	0	110.3	V60 A62 T109	V60-S83 CarbonylContact O-C 3.57Å; V60-S83 VanDerWaalsContact O-CA 3.28Å; V60-S83 WeakPolarHBondContact O-CA 3.04Å; A62-S83 PolarHBondContact N-OG 3Å; S83-T109 PolarHBondContact O-N 2.88Å
84	G	89.6	Confident	89.2	Confident	0 Å²	0	46.1 Å²	46.1	0%	0	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	178.6	-173.3	-175.2	0	0	0	0	0	113.6	F59 V60 R107	F59-G84 WeakPolarHBondContact CA-O 3.34Å; F59-G84 WeakPolarHBondContact CD2-O 3.3Å; V60-G84 PolarHBondContact N-O 2.93Å; V60-G84 PolarHBondContact O-N 3.49Å; G84-R107 CarbonylContact C-O 3.45Å; G84-R107 WeakPolarHBondContact CA-O 3.37Å
85	V	89.6	Confident	89.5	Confident	47 Å²	47	46.2 Å²	46.2	29%	0.285	27%	0.267	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	131.8	176.9	-179.4	0	0	0	0	109.3	F59 E87 R107	F59-V85 HydrophobicContact CD2-CG2 4.15Å; V85-E87 PolarHBondContact O-N 3.23Å; V85-E87 VanDerWaalsContact O-N 3.08Å; V85-R107 PolarHBondContact N-O 2.57Å; V85-R107 PolarHBondContact O-N 3.35Å
86	L	90.6	Very high	89.6	Confident	0 Å²	0	51.5 Å²	51.5	0%	0	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.1	104.2	174.8	-65	170.4	0	0	0	109.6	K54 G57 E58 V60 V66 Y104 L106	K54-L86 HydrophobicContact CB-CD1 3.43Å; K54-L86 VanDerWaalsContact CB-CD1 3.43Å; K54-L86 HydrophobicContact CG-CD1 4.42Å; G57-L86 PolarHBondContact N-O 2.75Å; E58-L86 PolarHBondContact O-N 2.87Å; V60-L86 HydrophobicContact CG1-CD1 3.99Å; V60-L86 HydrophobicContact CG1-CG 4.2Å; V60-L86 HydrophobicContact CG2-CD2 4.35Å; V60-L86 HydrophobicContact CG2-CG 4.38Å; V66-L86 HydrophobicContact CG1-CD1 3.76Å; V66-L86 HydrophobicContact CG1-CD2 3.67Å; V66-L86 HydrophobicContact CG1-CG 4.37Å; L86-Y104 HydrophobicContact CD2-CD2 3.34Å; L86-Y104 HydrophobicContact CD2-CE2 3.44Å; L86-Y104 VanDerWaalsContact CD2-CE2 3.44Å; L86-Y104 HydrophobicContact CD2-CG 4.14Å; L86-L106 HydrophobicContact CD2-CD1 4.08Å
87	E	89.7	Confident	89.7	Confident	58 Å²	58	50.1 Å²	50.1	27%	0.271	28%	0.275	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.5	-39.8	-174.6	-178.8	170.6	-142.3	0	0	112.1	V33 K56 V85 R105 R107	V33-E87 WeakPolarHBondContact CG1-OE2 2.96Å; V33-E87 WeakPolarHBondContact CG2-OE2 3.36Å; K56-E87 WeakPolarHBondContact CD-O 3.27Å; K56-E87 WeakPolarHBondContact CE-O 3.44Å; K56-E87 WeakPolarHBondContact CG-O 3.21Å; K56-E87 PolarHBondContact NZ-O 2.84Å; V85-E87 PolarHBondContact O-N 3.23Å; V85-E87 VanDerWaalsContact O-N 3.08Å; E87-R105 HydrophobicContact CB-CB 4.23Å; E87-R105 PolarHBondContact N-O 3.34Å; E87-R107 IonicContact OE1-CZ 3.16Å; E87-R107 IonicContact OE1-NE 2.93Å; E87-R107 IonicContact OE1-NH2 2.75Å; E87-R107 PolarHBondContact OE1-NH2 2.96Å
88	E	91.3	Very high	89.6	Confident	72 Å²	72	48.7 Å²	48.7	34%	0.336	28%	0.276	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.2	134	-175.3	-170.3	170	-154.6	0	0	110.4	L90 Y104 R105	E88-L90 HydrophobicContact CG-CD2 4.16Å; E88-Y104 CarbonylContact O-C 3.57Å; E88-Y104 WeakPolarHBondContact O-CA 3.43Å; E88-Y104 WeakPolarHBondContact O-CB 3.41Å; E88-R105 HydrophobicContact CB-CB 4.26Å; E88-R105 PolarHBondContact O-N 3.07Å; E88-R105 IonicContact OE2-CZ 3.69Å; E88-R105 IonicContact OE2-NH1 2.8Å; E88-R105 PolarHBondContact OE2-NH1 2.83Å
89	L	91.9	Very high	89.4	Confident	50 Å²	50	50.6 Å²	50.6	26%	0.262	29%	0.292	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.3	117.5	168.9	-52.4	-178.6	0	0	0	106.7	W52 K56 V91	W52-L89 HydrophobicContact CD2-CD1 3.96Å; W52-L89 HydrophobicContact CD2-CD2 4.05Å; W52-L89 HydrophobicContact CD2-CG 4.47Å; W52-L89 HydrophobicContact CE3-CD1 4.42Å; W52-L89 HydrophobicContact CE3-CD2 3.79Å; W52-L89 HydrophobicContact CG-CD1 4.09Å; W52-L89 HydrophobicContact CH2-CD2 3.73Å; W52-L89 HydrophobicContact CZ2-CB 3.98Å; W52-L89 HydrophobicContact CZ2-CD2 3.92Å; W52-L89 HydrophobicContact CZ2-CG 4.37Å; W52-L89 HydrophobicContact CZ3-CD2 3.66Å; K56-L89 HydrophobicContact CB-CG 4.41Å; L89-V91 VanDerWaalsContact C-N 3.31Å
90	L	91	Very high	89.1	Confident	66 Å²	66	53.8 Å²	53.8	35%	0.346	30%	0.3	S	S	.	.	S	Bend	trans	-83.6	-12	-174.6	-60.3	172.1	0	0	0	112.6	E88 L102 L103	E88-L90 HydrophobicContact CG-CD2 4.16Å; L90-L102 HydrophobicContact CD1-CB 3.95Å; L90-L103 WeakPolarHBondContact CB-O 3.32Å; L90-L103 PolarHBondContact N-O 3.32Å
91	V	91	Very high	89.1	Confident	12 Å²	12	57.1 Å²	57.1	7%	0.073	32%	0.316	C	S	.	.	S	Bend	trans	-131.1	143.6	178.7	-65.1	0	0	0	0	109.9	I50 W52 L89 D95 V97 L103	I50-V91 HydrophobicContact CD1-CG2 3.79Å; I50-V91 HydrophobicContact CG2-CB 4.43Å; I50-V91 HydrophobicContact CG2-CG2 3.84Å; W52-V91 HydrophobicContact CZ2-CG2 3.64Å; W52-V91 PolarHBondContact NE1-O 2.94Å; L89-V91 VanDerWaalsContact C-N 3.31Å; V91-D95 HydrophobicContact CB-CB 4.35Å; V91-V97 HydrophobicContact CB-CG1 4.33Å; V91-V97 HydrophobicContact CG1-CG1 4.07Å; V91-V97 HydrophobicContact CG2-CG1 4.15Å; V91-L103 HydrophobicContact CG2-CD2 4.1Å
92	S	88.5	Confident	89.3	Confident	76 Å²	76	57.8 Å²	57.8	53%	0.531	32%	0.316	S	S	.	.			trans	-77.4	156.2	179.6	-49.5	0	0	0	0	110.9	I50 G94 D95	I50-S92 WeakPolarHBondContact CG2-O 3.44Å; S92-G94 PolarHBondContact O-N 3.49Å; S92-D95 WeakPolarHBondContact CA-OD2 3.43Å; S92-D95 VanDerWaalsContact CB-OD2 3.23Å; S92-D95 WeakPolarHBondContact CB-OD2 3.25Å; S92-D95 PolarHBondContact N-OD2 3.32Å; S92-D95 WeakPolarHBondContact O-CB 3.28Å; S92-D95 PolarHBondContact O-N 2.85Å; S92-D95 VanDerWaalsContact O-N 3.1Å; S92-D95 PolarHBondContact OG-OD2 2.85Å
93	D	88.5	Confident	89.6	Confident	104 Å²	104	54 Å²	54	56%	0.556	30%	0.298	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.4	122	172.3	-164.3	54.1	0	0	0	110.1	R51 W52	R51-D93 WeakPolarHBondContact CA-OD1 3.27Å; W52-D93 PolarHBondContact N-OD1 3.06Å
94	G	86.6	Confident	89.9	Confident	47 Å²	47	52.6 Å²	52.6	49%	0.485	29%	0.288	S	S	.	.	T	Hydrogen-bonded Turn	trans	91	1.9	-176	0	0	0	0	0	116.2	I50 S92	I50-G94 WeakPolarHBondContact O-CA 3.44Å; I50-G94 PolarHBondContact O-N 3.14Å; S92-G94 PolarHBondContact O-N 3.49Å
95	D	88.5	Confident	90	Very high	67 Å²	67	57 Å²	57	36%	0.358	31%	0.305	S	S	.	.			trans	-70.2	153.2	174.8	-78.4	-13.3	0	0	0	112.2	D49 I50 V91 S92	D49-D95 WeakPolarHBondContact CA-O 3.16Å; I50-D95 HydrophobicContact CG2-CB 4.41Å; I50-D95 PolarHBondContact N-O 2.78Å; V91-D95 HydrophobicContact CB-CB 4.35Å; S92-D95 WeakPolarHBondContact CA-OD2 3.43Å; S92-D95 VanDerWaalsContact CB-OD2 3.23Å; S92-D95 WeakPolarHBondContact CB-OD2 3.25Å; S92-D95 PolarHBondContact N-OD2 3.32Å; S92-D95 WeakPolarHBondContact O-CB 3.28Å; S92-D95 PolarHBondContact O-N 2.85Å; S92-D95 VanDerWaalsContact O-N 3.1Å; S92-D95 PolarHBondContact OG-OD2 2.85Å
96	R	89.5	Confident	90.1	Very high	144 Å²	144	54.7 Å²	54.7	54%	0.543	29%	0.291	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.8	125.5	172.6	-76.1	-176.1	178	-158.1	-5.5	110.6	E47 G48 D49	E47-R96 IonicContact OE1-CZ 2.85Å; E47-R96 VanDerWaalsContact OE1-CZ 3.31Å; E47-R96 IonicContact OE1-NE 2.69Å; E47-R96 IonicContact OE1-NH1 3.34Å; E47-R96 PolarHBondContact OE1-NH1 2.71Å; E47-R96 IonicContact OE1-NH2 3.31Å; E47-R96 WeakPolarHBondContact OE2-CD 3.44Å; E47-R96 IonicContact OE2-NH1 3.9Å; E47-R96 PolarHBondContact OE2-NH1 3.07Å; G48-R96 CarbonylContact O-C 3.59Å; G48-R96 WeakPolarHBondContact O-CA 3.5Å; D49-R96 VanDerWaalsContact OD1-CG 3.27Å; D49-R96 WeakPolarHBondContact OD1-CG 3.47Å
97	V	90.8	Very high	90	Very high	1 Å²	1	60.3 Å²	60.3	1%	0.006	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	134.7	179	-61.7	0	0	0	0	111.2	E47 G48 I50 I69 V91 L103	E47-V97 WeakPolarHBondContact CA-O 3.25Å; G48-V97 PolarHBondContact N-O 3.37Å; G48-V97 WeakPolarHBondContact O-CG2 3.31Å; G48-V97 PolarHBondContact O-N 2.88Å; I50-V97 HydrophobicContact CB-CG1 4.1Å; I50-V97 HydrophobicContact CB-CG2 4.15Å; I50-V97 HydrophobicContact CG2-CG1 4.04Å; I69-V97 HydrophobicContact CD1-CG2 3.81Å; I69-V97 HydrophobicContact CG1-CG2 3.96Å; I69-V97 HydrophobicContact CG2-CG2 3.88Å; V91-V97 HydrophobicContact CB-CG1 4.33Å; V91-V97 HydrophobicContact CG1-CG1 4.07Å; V91-V97 HydrophobicContact CG2-CG1 4.15Å; V97-L103 HydrophobicContact CB-CD2 4.09Å; V97-L103 HydrophobicContact CG1-CD2 3.76Å; V97-L103 HydrophobicContact CG2-CD2 4.45Å
98	A	90.1	Very high	89.8	Confident	46 Å²	46	59.2 Å²	59.2	38%	0.38	31%	0.308	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.9	162.1	171.8	0	0	0	0	0	111.2	K100 Q101	A98-K100 PolarHBondContact O-N 3.08Å; A98-Q101 HydrophobicContact CB-CB 4.45Å; A98-Q101 VanDerWaalsContact O-CB 3.24Å; A98-Q101 WeakPolarHBondContact O-CB 3.38Å; A98-Q101 PolarHBondContact O-N 3Å; A98-Q101 VanDerWaalsContact O-N 3.15Å
99	A	86.9	Confident	88.9	Confident	42 Å²	42	59 Å²	59	35%	0.347	31%	0.312	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.3	135.2	172.9	0	0	0	0	0	110.5	F41 Q101	F41-A99 HydrophobicContact CD2-CB 3.73Å; F41-A99 HydrophobicContact CE2-CB 4.04Å; F41-A99 VanDerWaalsContact CE2-N 3.28Å; F41-A99 HydrophobicContact CG-CB 4.15Å; A99-Q101 PolarHBondContact O-N 3.13Å
100	K	85.7	Confident	87	Confident	128 Å²	128	61 Å²	61	56%	0.557	33%	0.33	S	S	*	.	T	Hydrogen-bonded Turn	trans	61	14.7	-177.1	-51.8	-174.1	178.9	-174.4	0	115.8	G38 T40 A98	G38-K100 WeakPolarHBondContact O-CA 3.5Å; G38-K100 PolarHBondContact O-N 3.21Å; T40-K100 HydrophobicContact CG2-CD 4.35Å; T40-K100 HydrophobicContact CG2-CG 4.05Å; A98-K100 PolarHBondContact O-N 3.08Å
101	Q	90.1	Very high	84.6	Confident	70 Å²	70	64.3 Å²	64.3	33%	0.327	35%	0.345	S	S	.	.			trans	-66.6	142.3	171.7	-177.9	173.9	-26.6	0	0	110.3	E37 G38 A98 A99 L103	E37-Q101 CarbonylContact C-O 3.6Å; E37-Q101 WeakPolarHBondContact CA-O 3.24Å; G38-Q101 PolarHBondContact N-O 2.61Å; A98-Q101 HydrophobicContact CB-CB 4.45Å; A98-Q101 VanDerWaalsContact O-CB 3.24Å; A98-Q101 WeakPolarHBondContact O-CB 3.38Å; A98-Q101 PolarHBondContact O-N 3Å; A98-Q101 VanDerWaalsContact O-N 3.15Å; A99-Q101 PolarHBondContact O-N 3.13Å; Q101-L103 WeakPolarHBondContact O-CG 3.31Å; Q101-L103 PolarHBondContact O-N 2.95Å
102	L	91.7	Very high	81.7	Confident	74 Å²	74	71 Å²	71	39%	0.387	38%	0.38	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.8	126.4	172.9	-73.7	173.4	0	0	0	111.3	D35 E37 L90	D35-L102 HydrophobicContact CB-CD2 3.76Å; E37-L102 HydrophobicContact CG-CD2 3.69Å; E37-L102 HydrophobicContact CG-CG 4.38Å; L90-L102 HydrophobicContact CD1-CB 3.95Å
103	L	92.9	Very high	79	Confident	0 Å²	0	75.3 Å²	75.3	0%	0	39%	0.393	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	-44.7	-173.3	-60.7	-175	0	0	0	113.3	V36 G38 I50 W52 I69 V78 L90 V91 V97 Q101	V36-L103 PolarHBondContact O-N 3.42Å; G38-L103 VanDerWaalsContact CA-CD1 3.42Å; I50-L103 HydrophobicContact CD1-CB 4.47Å; I50-L103 HydrophobicContact CD1-CD1 3.95Å; I50-L103 HydrophobicContact CD1-CD2 3.89Å; I50-L103 HydrophobicContact CD1-CG 4.32Å; W52-L103 HydrophobicContact CH2-CB 4.09Å; I69-L103 HydrophobicContact CD1-CD1 4.27Å; V78-L103 HydrophobicContact CG1-CD1 3.82Å; V78-L103 HydrophobicContact CG2-CD1 4.08Å; L90-L103 WeakPolarHBondContact CB-O 3.32Å; L90-L103 PolarHBondContact N-O 3.32Å; V91-L103 HydrophobicContact CG2-CD2 4.1Å; V97-L103 HydrophobicContact CB-CD2 4.09Å; V97-L103 HydrophobicContact CG1-CD2 3.76Å; V97-L103 HydrophobicContact CG2-CD2 4.45Å; Q101-L103 WeakPolarHBondContact O-CG 3.31Å; Q101-L103 PolarHBondContact O-N 2.95Å
104	Y	93	Very high	76.3	Confident	0 Å²	0	79.8 Å²	79.8	0%	0	41%	0.408	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-157.2	162.9	-177.3	62.6	-82.6	0	0	0	112.7	V36 W52 V66 V78 A80 L86 E88 L106	V36-Y104 HydrophobicContact CB-CD1 4.1Å; V36-Y104 HydrophobicContact CB-CD2 4.18Å; V36-Y104 HydrophobicContact CB-CE1 3.77Å; V36-Y104 HydrophobicContact CB-CE2 3.86Å; V36-Y104 HydrophobicContact CB-CG 4.31Å; V36-Y104 HydrophobicContact CG1-CD1 4.41Å; V36-Y104 HydrophobicContact CG1-CE1 3.66Å; V36-Y104 HydrophobicContact CG1-CE2 4.28Å; V36-Y104 HydrophobicContact CG2-CD2 4.11Å; V36-Y104 HydrophobicContact CG2-CE1 4.42Å; V36-Y104 HydrophobicContact CG2-CE2 3.61Å; V36-Y104 PolarHBondContact N-O 2.95Å; W52-Y104 AromaticContact CH2-CD1 3.6Å; W52-Y104 HydrophobicContact CH2-CD1 3.6Å; W52-Y104 HydrophobicContact CH2-CG 4.01Å; W52-Y104 AromaticContact CZ3-CD1 3.77Å; W52-Y104 HydrophobicContact CZ3-CD1 3.77Å; W52-Y104 HydrophobicContact CZ3-CE1 4.4Å; W52-Y104 HydrophobicContact CZ3-CG 4.21Å; V66-Y104 HydrophobicContact CB-CE1 4.41Å; V66-Y104 HydrophobicContact CG1-CE1 4.21Å; V66-Y104 HydrophobicContact CG1-CE2 4.49Å; V78-Y104 HydrophobicContact CG1-CE1 4.14Å; A80-Y104 WeakPolarHBondContact CA-OH 3.19Å; L86-Y104 HydrophobicContact CD2-CD2 3.34Å; L86-Y104 HydrophobicContact CD2-CE2 3.44Å; L86-Y104 VanDerWaalsContact CD2-CE2 3.44Å; L86-Y104 HydrophobicContact CD2-CG 4.14Å; E88-Y104 CarbonylContact O-C 3.57Å; E88-Y104 WeakPolarHBondContact O-CA 3.43Å; E88-Y104 WeakPolarHBondContact O-CB 3.41Å; Y104-L106 HydrophobicContact CD2-CB 4.31Å; Y104-L106 HydrophobicContact CE2-CB 4.04Å; Y104-L106 HydrophobicContact CE2-CD1 4.4Å
105	R	91.9	Very high	73.4	Confident	92 Å²	92	80.7 Å²	80.7	35%	0.347	42%	0.417	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	130.7	169.1	-80.1	176.1	-167.7	150.9	-1	111	V33 I34 D35 E87 E88	V33-R105 HydrophobicContact CG1-CB 3.87Å; V33-R105 HydrophobicContact CG1-CG 4.05Å; I34-R105 WeakPolarHBondContact O-CA 3.28Å; D35-R105 WeakPolarHBondContact OD1-CG 3.5Å; D35-R105 IonicContact OD1-NE 3.34Å; D35-R105 PolarHBondContact OD1-NE 2.78Å; E87-R105 HydrophobicContact CB-CB 4.23Å; E87-R105 PolarHBondContact N-O 3.34Å; E88-R105 HydrophobicContact CB-CB 4.26Å; E88-R105 PolarHBondContact O-N 3.07Å; E88-R105 IonicContact OE2-CZ 3.69Å; E88-R105 IonicContact OE2-NH1 2.8Å; E88-R105 PolarHBondContact OE2-NH1 2.83Å
106	L	91	Very high	70.5	Confident	0 Å²	0	83 Å²	83	0%	0	44%	0.438	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	119.9	177.8	-174	72.6	0	0	0	109.7	V33 I34 V36 V60 H82 L86 Y104 L108	V33-L106 WeakPolarHBondContact CA-O 3.41Å; I34-L106 HydrophobicContact CD1-CB 4.5Å; I34-L106 HydrophobicContact CD1-CD2 4.29Å; I34-L106 HydrophobicContact CG1-CB 3.91Å; I34-L106 PolarHBondContact N-O 3.23Å; I34-L106 PolarHBondContact O-N 3.1Å; V36-L106 HydrophobicContact CG2-CB 4.11Å; V60-L106 HydrophobicContact CG2-CD1 3.64Å; H82-L106 HydrophobicContact CB-CD2 4.24Å; H82-L106 WeakPolarHBondContact O-CD2 3.3Å; L86-L106 HydrophobicContact CD2-CD1 4.08Å; Y104-L106 HydrophobicContact CD2-CB 4.31Å; Y104-L106 HydrophobicContact CE2-CB 4.04Å; Y104-L106 HydrophobicContact CE2-CD1 4.4Å; L106-L108 HydrophobicContact CD2-CD2 4.33Å; L106-L108 PolarHBondContact O-N 2.8Å
107	R	89.5	Confident	67.6	Low	117 Å²	117	80.9 Å²	80.9	44%	0.442	45%	0.446	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.1	112.4	170.5	-173.6	-178.7	-66.5	-129.5	2.5	109.7	D32 V33 G84 V85 E87	D32-R107 HydrophobicContact CB-CG 4.36Å; D32-R107 CarbonylContact O-C 3.41Å; D32-R107 WeakPolarHBondContact O-CA 3.42Å; V33-R107 HydrophobicContact CG2-CB 4.32Å; V33-R107 HydrophobicContact CG2-CG 4.28Å; G84-R107 CarbonylContact C-O 3.45Å; G84-R107 WeakPolarHBondContact CA-O 3.37Å; V85-R107 PolarHBondContact N-O 2.57Å; V85-R107 PolarHBondContact O-N 3.35Å; E87-R107 IonicContact OE1-CZ 3.16Å; E87-R107 IonicContact OE1-NE 2.93Å; E87-R107 IonicContact OE1-NH2 2.75Å; E87-R107 PolarHBondContact OE1-NH2 2.96Å
108	L	85.6	Confident	64.7	Low	36 Å²	36	88.9 Å²	88.9	19%	0.188	48%	0.483	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.3	138.8	177.8	-61.2	178	0	0	0	110.2	D32 I34 H82 L106	D32-L108 PolarHBondContact O-N 3.5Å; I34-L108 HydrophobicContact CD1-CD2 4.03Å; I34-L108 HydrophobicContact CG1-CD2 4.38Å; I34-L108 HydrophobicContact CG2-CD1 3.95Å; I34-L108 HydrophobicContact CG2-CG 4.33Å; H82-L108 HydrophobicContact CB-CD2 3.3Å; L106-L108 HydrophobicContact CD2-CD2 4.33Å; L106-L108 PolarHBondContact O-N 2.8Å
109	T	73.2	Confident	62	Low	68 Å²	68	93.4 Å²	93.4	42%	0.417	50%	0.5	S	S	.	.			trans	-116.2	125.6	172.5	-54.3	0	0	0	0	108.8	S83 M111	S83-T109 PolarHBondContact O-N 2.88Å; T109-M111 PolarHBondContact O-N 2.97Å
110	S	51.9	Low	59.3	Low	91 Å²	91	95.6 Å²	95.6	64%	0.636	52%	0.518	S	S	*	.			trans	-70.1	112.2	172.1	57.3	0	0	0	0	109.3	L112	S110-L112 PolarHBondContact O-N 2.78Å
111	M	39.8	Very low	56.5	Low	135 Å²	135	98.9 Å²	98.9	67%	0.665	54%	0.535	S	S	*	.			trans	-73.4	82.6	170	-82.4	-167.3	177.1	0	0	109.7	F59 T109	F59-M111 HydrophobicContact CZ-CE 3.93Å; T109-M111 PolarHBondContact O-N 2.97Å
112	L	31.2	Very low	53.7	Low	152 Å²	152	101.1 Å²	101.1	80%	0.796	56%	0.559	S	S	*	*			trans	-126.1	65.9	158.8	-89.5	163.3	0	0	0	108.5	S110	S110-L112 PolarHBondContact O-N 2.78Å
113	M	31	Very low	50.8	Low	167 Å²	167	106.8 Å²	106.8	82%	0.823	58%	0.583	S	S	*	*			trans	-139.7	99.1	169	-77.9	-72.3	159.8	0	0	110.2
114	K	30.7	Very low	48	Very low	199 Å²	199	113.7 Å²	113.7	87%	0.865	63%	0.625	S	S	*	*			trans	34.2	119.1	142.3	-61.4	172.5	178.5	177.4	0	116.5
115	G	26.7	Very low	44.9	Very low	66 Å²	66	117.1 Å²	117.1	68%	0.68	66%	0.66	S	S	*	*				98	114.2	55	0	0	0	0	0	110.3
116	S	28.4	Very low	42.1	Very low	114 Å²	114	121.9 Å²	121.9	80%	0.797	69%	0.689	S	S	*	*			trans	67.3	111.9	150.2	45.9	0	0	0	0	121.1
117	S	26.9	Very low	39.5	Very low	101 Å²	101	130.5 Å²	130.5	71%	0.706	73%	0.729	S	S	*	*				49.1	121.4	128.2	62.7	0	0	0	0	120.3
118	E	30.8	Very low	36.7	Very low	168 Å²	168	134.7 Å²	134.7	79%	0.785	75%	0.75	S	S	*	*				172.5	140	113.3	-102.6	-179.5	176.2	0	0	114.4
119	I	32.9	Very low	34.5	Very low	142 Å²	142	140.9 Å²	140.9	73%	0.728	78%	0.783	S	S	*	*			trans	78.2	101.1	150.5	-55.8	153.2	0	0	0	116.4
120	A	30.3	Very low	32.7	Very low	88 Å²	88	144.5 Å²	144.5	73%	0.727	80%	0.798	S	S	*	*				68.5	117.8	64.3	0	0	0	0	0	115.2
121	E	27	Very low	32.4	Very low	196 Å²	196	146.2 Å²	146.2	92%	0.916	81%	0.807	S	S	*	*			trans	-7.8	130.4	163.2	-63.2	171.1	157.9	0	0	119.2
122	S	32	Very low	32.1	Very low	118 Å²	118	149.4 Å²	149.4	83%	0.825	82%	0.818	S	S	*	*			trans	-156.2	125.4	136.4	51.7	0	0	0	0	111.9
123	Q	30.3	Very low	32.6	Very low	193 Å²	193	151.9 Å²	151.9	90%	0.902	82%	0.822	S	S	*	*			trans	-75.7	129.3	163.1	-65.4	176.3	-27.7	0	0	109.1
124	V	34.2	Very low	32.8	Very low	145 Å²	145	155.8 Å²	155.8	88%	0.879	83%	0.827	S	S	*	*			trans	-152.7	129	146.4	-175.8	0	0	0	0	108.6
125	G	28.1	Very low	33.3	Very low	72 Å²	72	157.9 Å²	157.9	74%	0.742	83%	0.83	S	S	*	*			trans	-71.6	162.8	179.6	0	0	0	0	0	114.3
126	M	33.6	Very low	33.9	Very low	192 Å²	192	164.9 Å²	164.9	95%	0.946	84%	0.842	S	S	*	*			trans	-122	121	170.1	-157.2	126	94.5	0	0	111
127	Q	36	Very low	34.3	Very low	181 Å²	181	165 Å²	165	85%	0.846	84%	0.843	S	S	*	*			trans	-64.5	154.7	174.1	-86.9	156.1	-21.9	0	0	113.3
128	K	31	Very low	34.9	Very low	204 Å²	204	170 Å²	170	89%	0.887	85%	0.851	S	S	*	*			trans	-48.8	134	166.9	-70.1	172.6	174.4	176.2	0	112.3
129	L	38.2	Very low	35.2	Very low	166 Å²	166	166.8 Å²	166.8	87%	0.869	85%	0.848	S	S	*	*			trans	-126.6	110.5	163.1	-96.5	140.9	0	0	0	109.9
130	I	36.2	Very low	35.5	Very low	144 Å²	144	170.5 Å²	170.5	74%	0.738	85%	0.852	S	S	*	*			trans	-94.2	130.3	163.3	-61.4	168	0	0	0	106.4
131	P	44.3	Very low	36	Very low	128 Å²	128	173.4 Å²	173.4	83%	0.831	86%	0.856	S	S	*	*			trans	-93	111.7	169.2	23.9	-12	0	0	0	111.1
132	K	35.3	Very low	36.8	Very low	202 Å²	202	169 Å²	169	88%	0.878	85%	0.846	S	S	*	*			trans	-90.9	123.7	156.4	-92.8	-179.6	176.7	172.1	0	108.4
133	K	41.4	Very low	37.1	Very low	204 Å²	204	169 Å²	169	89%	0.887	85%	0.846	S	S	*	*			trans	-146.3	102.6	151.7	-118.3	175.6	-175.4	174.1	0	111
134	R	34.1	Very low	37.4	Very low	248 Å²	248	163.1 Å²	163.1	94%	0.936	84%	0.838	S	S	*	*			trans	-75.1	129.4	159	-69.8	167.9	91	175.9	7.1	107.6
135	R	41.4	Very low	37.4	Very low	243 Å²	243	161.3 Å²	161.3	92%	0.917	83%	0.832	S	S	*	*			trans	-120.4	134.3	154.3	-85.3	-176.9	113.3	164.9	1.1	108.8
136	K	40.2	Very low	37.8	Very low	214 Å²	214	166.7 Å²	166.7	93%	0.93	84%	0.837	S	S	*	*			trans	-70.7	139.9	-175.5	-69.2	173	172.3	177	0	111.1
137	S	35.5	Very low	38	Very low	117 Å²	117	164.6 Å²	164.6	82%	0.818	83%	0.826	S	S	*	*			trans	-95.3	149.3	163.8	50.9	0	0	0	0	111.1
138	K	40.2	Very low	38.1	Very low	205 Å²	205	164.5 Å²	164.5	89%	0.891	83%	0.831	S	S	*	*			trans	-139.1	100.7	158.8	-87.7	-174.5	173	-177.8	0	104.8
139	S	37.9	Very low	38.4	Very low	101 Å²	101	165.4 Å²	165.4	71%	0.706	83%	0.828	S	S	*	*				69.1	112.6	89	88	0	0	0	0	115.2
140	R	38.8	Very low	38.5	Very low	219 Å²	219	165.5 Å²	165.5	83%	0.826	82%	0.822	S	S	*	*				179	111.8	119.9	-100	173.1	169.3	173.4	-4.4	108.4
141	N	40.6	Very low	38.8	Very low	149 Å²	149	162.5 Å²	162.5	80%	0.797	82%	0.819	S	S	*	*				77.9	135.7	107.6	-74	13.5	0	0	0	111.3
142	S	43	Very low	38.5	Very low	103 Å²	103	168 Å²	168	72%	0.72	82%	0.824	S	S	*	*			cis	-178.8	146.9	8.8	39.5	0	0	0	0	103.2
143	S	39.1	Very low	39.1	Very low	118 Å²	118	162.7 Å²	162.7	83%	0.825	81%	0.813	S	S	*	*				160	150.7	72.4	44	0	0	0	0	108.8
144	G	35.5	Very low	39.4	Very low	70 Å²	70	158.8 Å²	158.8	72%	0.722	81%	0.807	S	S	*	*			trans	97.3	104.7	162.7	0	0	0	0	0	113.4
145	S	35.2	Very low	40.2	Very low	108 Å²	108	155 Å²	155	76%	0.755	80%	0.799	S	S	*	*				103.8	130.3	54.3	60.3	0	0	0	0	110.8
146	E	37.3	Very low	41.1	Very low	184 Å²	184	149.4 Å²	149.4	86%	0.86	79%	0.787	S	S	*	*			trans	73.2	98.9	159.7	-66.3	171.8	153.2	0	0	118.8
147	E	37.4	Very low	41.8	Very low	149 Å²	149	145.5 Å²	145.5	70%	0.696	78%	0.781	S	S	*	*				170.2	76.4	129.4	-95.1	-169.6	-178.3	0	0	110.4	R149 K150	E147-R149 PolarHBondContact O-N 3.15Å; E147-K150 IonicContact OE2-NZ 3.58Å; E147-K150 PolarHBondContact OE2-NZ 3.41Å
148	D	37.2	Very low	43.5	Very low	178 Å²	178	142.4 Å²	142.4	95%	0.952	77%	0.767	S	S	*	*			trans	-79.8	61.9	169.4	-99.3	-25.4	0	0	0	111
149	R	37	Very low	44.8	Very low	223 Å²	223	140.1 Å²	140.1	84%	0.842	77%	0.765	S	S	*	*			trans	-157.6	86.9	164.4	-69.7	-169.7	-166	172.1	5.1	109.9	E147	E147-R149 PolarHBondContact O-N 3.15Å
150	K	41.4	Very low	46.7	Very low	169 Å²	169	144.8 Å²	144.8	74%	0.735	77%	0.767	S	S	*	*			trans	-167.2	117.1	154	-100.3	139.7	-165	172.1	0	111.3	E147	E147-K150 IonicContact OE2-NZ 3.58Å; E147-K150 PolarHBondContact OE2-NZ 3.41Å
151	A	41.5	Very low	48.8	Very low	81 Å²	81	140 Å²	140	67%	0.669	76%	0.762	S	S	*	*			trans	45.9	117.1	138.4	0	0	0	0	0	118.1	S153	A151-S153 PolarHBondContact O-N 3.2Å
152	Y	38.6	Very low	50.9	Low	242 Å²	242	141.5 Å²	141.5	95%	0.949	76%	0.764	S	S	*	*			trans	-58.3	78.7	146.2	-76.9	-93	0	0	0	109.3
153	S	47.7	Very low	53	Low	91 Å²	91	146.2 Å²	146.2	64%	0.636	77%	0.768	S	S	*	*			trans	-97.3	91.4	159.1	60.6	0	0	0	0	107.1	A151 E155	A151-S153 PolarHBondContact O-N 3.2Å; S153-E155 VanDerWaalsContact C-N 3.31Å; S153-E155 PolarHBondContact O-N 3.17Å
154	T	48.5	Very low	55.3	Low	123 Å²	123	152 Å²	152	76%	0.755	77%	0.772	S	S	*	*			trans	-66.7	95.7	161.9	41.9	0	0	0	0	107.7	I156	T154-I156 PolarHBondContact O-N 3.46Å
155	E	50.2	Low	57.9	Low	167 Å²	167	154.5 Å²	154.5	78%	0.78	77%	0.772	S	S	*	*			trans	-58	117.6	166.9	-75	-175.3	158.2	0	0	108.8	S153 T157	S153-E155 VanDerWaalsContact C-N 3.31Å; S153-E155 PolarHBondContact O-N 3.17Å; E155-T157 PolarHBondContact O-N 2.97Å; E155-T157 VanDerWaalsContact O-N 3.13Å
156	I	60.2	Low	60.5	Low	127 Å²	127	158.7 Å²	158.7	65%	0.651	78%	0.777	S	S	*	*			trans	-76.1	98.6	175	-60.6	171.7	0	0	0	107.3	T154 G158	T154-I156 PolarHBondContact O-N 3.46Å; I156-G158 PolarHBondContact O-N 2.6Å
157	T	54.4	Low	62.9	Low	132 Å²	132	154.4 Å²	154.4	81%	0.81	76%	0.759	S	S	*	*			trans	-84.4	103	173.7	57.6	0	0	0	0	110.4	E155	E155-T157 PolarHBondContact O-N 2.97Å; E155-T157 VanDerWaalsContact O-N 3.13Å
158	G	70.8	Confident	65.2	Low	52 Å²	52	150 Å²	150	54%	0.536	74%	0.74	S	S	.	*	S	Bend	trans	-171.7	152.7	169.8	0	0	0	0	0	109.2	I156 R160	I156-G158 PolarHBondContact O-N 2.6Å; G158-R160 PolarHBondContact O-N 2.88Å
159	D	67.9	Low	67.6	Low	157 Å²	157	146 Å²	146	84%	0.84	71%	0.711	S	S	*	*			trans	-63.2	103.6	175.2	-85	-29.3	0	0	0	109.2	T161	D159-T161 PolarHBondContact O-N 3Å
160	R	77.9	Confident	69.7	Low	199 Å²	199	139.2 Å²	139.2	75%	0.751	69%	0.692	S	S	*	*			trans	-80.2	55.6	-179.6	-63.3	177.4	64.4	95.2	2.7	110.8	G158	G158-R160 PolarHBondContact O-N 2.88Å
161	T	83	Confident	71.7	Confident	117 Å²	117	139.6 Å²	139.6	72%	0.718	69%	0.688	S	S	*	*			trans	-91.1	132.7	177.4	57.1	0	0	0	0	111.2	D159	D159-T161 PolarHBondContact O-N 3Å
162	E	85	Confident	74	Confident	182 Å²	182	137.7 Å²	137.7	85%	0.85	67%	0.673	S	S	*	*			trans	-104.4	141.8	172	-63.9	-179.5	-179.5	0	0	110
163	Y	86.7	Confident	76.4	Confident	201 Å²	201	132.8 Å²	132.8	79%	0.788	65%	0.653	S	S	*	*			trans	-127	142.2	168.7	65.4	-86.2	0	0	0	110.1	V165	Y163-V165 HydrophobicContact CD2-CG2 3.86Å; Y163-V165 HydrophobicContact CE2-CG2 3.86Å
164	R	88.2	Confident	78.2	Confident	241 Å²	241	132.1 Å²	132.1	91%	0.909	64%	0.644	S	S	*	*			trans	-102.8	134	-177.2	-65.9	-179.4	176.5	169.4	-1	110
165	V	89	Confident	80.1	Confident	121 Å²	121	128.5 Å²	128.5	73%	0.733	63%	0.627	S	S	*	*			trans	-123.5	131.3	173.3	-176.4	0	0	0	0	108.3	Y163	Y163-V165 HydrophobicContact CD2-CG2 3.86Å; Y163-V165 HydrophobicContact CE2-CG2 3.86Å
166	K	89.9	Confident	82.2	Confident	196 Å²	196	125.8 Å²	125.8	85%	0.852	61%	0.614	S	S	*	*	P	Polyproline II helix	trans	-69.4	138.6	177.9	-169.4	178.2	178.7	-175.7	0	109.9
167	I	88.1	Confident	83.6	Confident	95 Å²	95	125.9 Å²	125.9	49%	0.487	61%	0.607	S	S	.	*	P	Polyproline II helix	trans	-67.8	132.4	172.6	-166.9	168.3	0	0	0	109.9	R171 A172	I167-R171 HydrophobicContact CD1-CB 4.27Å; I167-R171 HydrophobicContact CD1-CG 3.93Å; I167-R171 HydrophobicContact CG1-CB 3.89Å; I167-R171 HydrophobicContact CG1-CG 3.96Å; I167-A172 HydrophobicContact CD1-CB 4.3Å; I167-A172 HydrophobicContact CG1-CB 4.43Å; I167-A172 HydrophobicContact CG2-CB 4.38Å
168	N	87.1	Confident	85.4	Confident	55 Å²	55	123.3 Å²	123.3	29%	0.294	59%	0.588	S	S	.	*	P	Polyproline II helix	trans	-74.7	161.4	174.4	77.6	-13.5	0	0	0	111.4	E70 L170 R171 A172	E70-N168 PolarHBondContact OE1-ND2 3.41Å; N168-L170 VanDerWaalsContact C-N 3.34Å; N168-L170 PolarHBondContact O-N 3.38Å; N168-R171 PolarHBondContact O-N 2.83Å; N168-R171 WeakPolarHBondContact OD1-CB 3.23Å; N168-R171 PolarHBondContact OD1-N 2.85Å; N168-A172 PolarHBondContact O-N 3.37Å
169	R	86.3	Confident	86.6	Confident	94 Å²	94	125.8 Å²	125.8	36%	0.355	58%	0.583	S	S	.	*	H	α-helix	trans	-62.7	-41.5	-174.5	-69.9	-171.9	-178.2	174.9	9.6	111.8	D49 R171 A172 R173	D49-R169 IonicContact OD1-CZ 2.86Å; D49-R169 IonicContact OD1-NE 2.67Å; D49-R169 IonicContact OD1-NH1 3.77Å; D49-R169 IonicContact OD1-NH2 2.8Å; D49-R169 PolarHBondContact OD1-NH2 3.47Å; D49-R169 WeakPolarHBondContact OD2-CD 3.16Å; D49-R169 IonicContact OD2-CZ 3.92Å; D49-R169 IonicContact OD2-NE 3.83Å; D49-R169 PolarHBondContact OD2-NE 2.81Å; D49-R169 IonicContact OD2-NH1 2.7Å; D49-R169 IonicContact OD2-NH2 3.33Å; D49-R169 PolarHBondContact OD2-NH2 2.92Å; R169-R171 PolarHBondContact O-N 2.81Å; R169-A172 PolarHBondContact O-N 3.22Å; R169-R173 PolarHBondContact O-N 3.17Å
170	L	80.7	Confident	87.8	Confident	82 Å²	82	121.6 Å²	121.6	43%	0.429	56%	0.561	S	S	.	*	H	α-helix	trans	-58.9	-48.2	178	-178.3	62.7	0	0	0	111.6	N168 A172 R173 V174	N168-L170 VanDerWaalsContact C-N 3.34Å; N168-L170 PolarHBondContact O-N 3.38Å; L170-A172 PolarHBondContact O-N 3.47Å; L170-R173 PolarHBondContact O-N 2.89Å; L170-V174 WeakPolarHBondContact O-CG2 3.42Å; L170-V174 PolarHBondContact O-N 2.9Å
171	R	84.1	Confident	88.6	Confident	176 Å²	176	112.2 Å²	112.2	66%	0.664	53%	0.526	S	S	*	.	H	α-helix	trans	-66.1	-38.6	178.6	-172.8	179.8	-71.9	-167.9	-3.3	111.7	I167 N168 R169 R173 V174 A175	I167-R171 HydrophobicContact CD1-CB 4.27Å; I167-R171 HydrophobicContact CD1-CG 3.93Å; I167-R171 HydrophobicContact CG1-CB 3.89Å; I167-R171 HydrophobicContact CG1-CG 3.96Å; N168-R171 PolarHBondContact O-N 2.83Å; N168-R171 WeakPolarHBondContact OD1-CB 3.23Å; N168-R171 PolarHBondContact OD1-N 2.85Å; R169-R171 PolarHBondContact O-N 2.81Å; R171-R173 VanDerWaalsContact C-N 3.35Å; R171-V174 PolarHBondContact O-N 2.88Å; R171-A175 VanDerWaalsContact O-CB 3.27Å; R171-A175 WeakPolarHBondContact O-CB 3.45Å; R171-A175 PolarHBondContact O-N 3.38Å
172	A	89.9	Confident	89.1	Confident	41 Å²	41	111.3 Å²	111.3	34%	0.339	51%	0.514	S	S	.	.	H	α-helix	trans	-61.1	-43.4	175.2	0	0	0	0	0	111.7	I167 N168 R169 L170 A175 Q176	I167-A172 HydrophobicContact CD1-CB 4.3Å; I167-A172 HydrophobicContact CG1-CB 4.43Å; I167-A172 HydrophobicContact CG2-CB 4.38Å; N168-A172 PolarHBondContact O-N 3.37Å; R169-A172 PolarHBondContact O-N 3.22Å; L170-A172 PolarHBondContact O-N 3.47Å; A172-A175 PolarHBondContact O-N 2.87Å; A172-Q176 PolarHBondContact O-N 3.47Å
173	R	88	Confident	89.6	Confident	140 Å²	140	107.6 Å²	107.6	53%	0.528	50%	0.5	S	S	.	.	H	α-helix	trans	-65	-44.7	176.6	-176.2	178.4	-68.2	165.8	-4.3	112.6	D72 R169 L170 R171 A175 Q176 R177	D72-R173 PolarHBondContact O-NH1 3.32Å; D72-R173 PolarHBondContact O-NH2 3.3Å; R169-R173 PolarHBondContact O-N 3.17Å; L170-R173 PolarHBondContact O-N 2.89Å; R171-R173 VanDerWaalsContact C-N 3.35Å; R173-A175 VanDerWaalsContact C-N 3.32Å; R173-A175 PolarHBondContact O-N 2.94Å; R173-Q176 PolarHBondContact O-N 3.06Å; R173-R177 PolarHBondContact O-N 2.83Å
174	V	85.8	Confident	90	Very high	76 Å²	76	101.4 Å²	101.4	46%	0.461	48%	0.483	S	S	.	.	H	α-helix	trans	-60.9	-44.4	175.5	172.3	0	0	0	0	110.3	L170 R171 Q176 R177 L178	L170-V174 WeakPolarHBondContact O-CG2 3.42Å; L170-V174 PolarHBondContact O-N 2.9Å; R171-V174 PolarHBondContact O-N 2.88Å; V174-Q176 PolarHBondContact O-N 2.78Å; V174-R177 PolarHBondContact O-N 3.15Å; V174-L178 HydrophobicContact CG1-CD1 3.95Å; V174-L178 HydrophobicContact CG1-CG 4.31Å; V174-L178 VanDerWaalsContact O-CG 3.28Å; V174-L178 WeakPolarHBondContact O-CG 3.4Å; V174-L178 PolarHBondContact O-N 3.39Å
175	A	89.7	Confident	90.4	Very high	48 Å²	48	91.1 Å²	91.1	40%	0.397	44%	0.444	S	S	.	.	H	α-helix	trans	-60.3	-44.3	177.7	0	0	0	0	0	112.1	R171 A172 R173 L178 K179	R171-A175 VanDerWaalsContact O-CB 3.27Å; R171-A175 WeakPolarHBondContact O-CB 3.45Å; R171-A175 PolarHBondContact O-N 3.38Å; A172-A175 PolarHBondContact O-N 2.87Å; R173-A175 VanDerWaalsContact C-N 3.32Å; R173-A175 PolarHBondContact O-N 2.94Å; A175-L178 PolarHBondContact O-N 3.39Å; A175-K179 WeakPolarHBondContact O-CB 3.34Å; A175-K179 PolarHBondContact O-N 3.03Å
176	Q	93.2	Very high	90.7	Very high	109 Å²	109	87.7 Å²	87.7	51%	0.509	43%	0.429	S	S	.	.	H	α-helix	trans	-60.5	-50.3	175.5	-171.4	60.6	52.5	0	0	111.1	A172 R173 V174 L178 K179 D180	A172-Q176 PolarHBondContact O-N 3.47Å; R173-Q176 PolarHBondContact O-N 3.06Å; V174-Q176 PolarHBondContact O-N 2.78Å; Q176-L178 VanDerWaalsContact C-N 3.32Å; Q176-L178 PolarHBondContact O-N 2.65Å; Q176-K179 CarbonylContact O-C 3.57Å; Q176-K179 PolarHBondContact O-N 3.35Å; Q176-D180 PolarHBondContact NE2-OD1 3.23Å; Q176-D180 PolarHBondContact O-N 2.81Å
177	R	90.7	Very high	91.1	Very high	130 Å²	130	81 Å²	81	49%	0.491	40%	0.401	S	S	.	.	H	α-helix	trans	-57.9	-41.3	178.6	-175	179.4	-179.2	176	3.1	112.8	R173 V174 K179 D180 S181 N327 P328	R173-R177 PolarHBondContact O-N 2.83Å; V174-R177 PolarHBondContact O-N 3.15Å; R177-K179 VanDerWaalsContact C-N 3.35Å; R177-D180 PolarHBondContact O-N 3.44Å; R177-S181 PolarHBondContact O-N 3.33Å; R177-N327 PolarHBondContact NH2-OD1 2.98Å; R177-P328 PolarHBondContact NH2-O 2.9Å
178	L	91.6	Very high	91.5	Very high	78 Å²	78	80.4 Å²	80.4	41%	0.408	40%	0.399	S	S	.	.	H	α-helix	trans	-65	-39.9	176.5	-70.4	173.5	0	0	0	111.5	V174 A175 Q176 S181 Q182 I325	V174-L178 HydrophobicContact CG1-CD1 3.95Å; V174-L178 HydrophobicContact CG1-CG 4.31Å; V174-L178 VanDerWaalsContact O-CG 3.28Å; V174-L178 WeakPolarHBondContact O-CG 3.4Å; V174-L178 PolarHBondContact O-N 3.39Å; A175-L178 PolarHBondContact O-N 3.39Å; Q176-L178 VanDerWaalsContact C-N 3.32Å; Q176-L178 PolarHBondContact O-N 2.65Å; L178-S181 WeakPolarHBondContact O-CB 3.39Å; L178-Q182 PolarHBondContact O-N 3.05Å; L178-I325 HydrophobicContact CD2-CB 4.24Å; L178-I325 HydrophobicContact CD2-CD1 4.06Å; L178-I325 HydrophobicContact CD2-CG2 4.09Å
179	K	94.7	Very high	92	Very high	103 Å²	103	79.3 Å²	79.3	45%	0.448	39%	0.394	S	S	.	.	H	α-helix	trans	-70.3	-38.9	177.6	-173.3	50.3	174.2	149.7	0	112	A175 Q176 R177 S181 Q182 N183	A175-K179 WeakPolarHBondContact O-CB 3.34Å; A175-K179 PolarHBondContact O-N 3.03Å; Q176-K179 CarbonylContact O-C 3.57Å; Q176-K179 PolarHBondContact O-N 3.35Å; R177-K179 VanDerWaalsContact C-N 3.35Å; K179-S181 VanDerWaalsContact C-N 3.33Å; K179-S181 PolarHBondContact O-N 3.21Å; K179-Q182 PolarHBondContact O-N 3.35Å; K179-N183 WeakPolarHBondContact CE-OD1 3.38Å; K179-N183 PolarHBondContact NZ-OD1 3.24Å; K179-N183 WeakPolarHBondContact O-CB 3.24Å; K179-N183 PolarHBondContact O-N 2.79Å; K179-N183 PolarHBondContact O-ND2 2.77Å
180	D	95.2	Very high	92.5	Very high	70 Å²	70	76.1 Å²	76.1	37%	0.374	39%	0.385	S	S	.	.	H	α-helix	trans	-62.2	-42	175.2	-63.6	-21.9	0	0	0	111.1	Q176 R177 Q182 N183 T184	Q176-D180 PolarHBondContact NE2-OD1 3.23Å; Q176-D180 PolarHBondContact O-N 2.81Å; R177-D180 PolarHBondContact O-N 3.44Å; D180-Q182 PolarHBondContact O-N 3.43Å; D180-N183 PolarHBondContact O-N 2.88Å; D180-T184 VanDerWaalsContact O-CB 3.3Å; D180-T184 WeakPolarHBondContact O-CB 3.38Å; D180-T184 PolarHBondContact O-N 2.88Å; D180-T184 PolarHBondContact O-OG1 2.82Å
181	S	94.2	Very high	93.3	Very high	1 Å²	1	75.9 Å²	75.9	1%	0.007	38%	0.38	C	S	.	.	H	α-helix	trans	-55.4	-50.6	172.4	-178.1	0	0	0	0	111.3	R177 L178 K179 N183 T184 Y185 I325 I326	R177-S181 PolarHBondContact O-N 3.33Å; L178-S181 WeakPolarHBondContact O-CB 3.39Å; K179-S181 VanDerWaalsContact C-N 3.33Å; K179-S181 PolarHBondContact O-N 3.21Å; S181-N183 VanDerWaalsContact C-N 3.32Å; S181-N183 PolarHBondContact O-N 3.44Å; S181-T184 PolarHBondContact O-N 2.95Å; S181-Y185 WeakPolarHBondContact O-CD2 3.45Å; S181-Y185 PolarHBondContact O-N 2.72Å; S181-Y185 VanDerWaalsContact OG-CD2 3.31Å; S181-Y185 WeakPolarHBondContact OG-CD2 3.4Å; S181-Y185 WeakPolarHBondContact OG-CE2 3.43Å; S181-I325 WeakPolarHBondContact OG-CG2 3.48Å; S181-I326 PolarHBondContact OG-O 2.93Å
182	Q	93.2	Very high	94	Very high	99 Å²	99	69.4 Å²	69.4	46%	0.463	36%	0.359	S	S	.	.	H	α-helix	trans	-64.8	-31.8	178.3	-72.1	-175.2	-22.7	0	0	114.1	L178 K179 D180 M187	L178-Q182 PolarHBondContact O-N 3.05Å; K179-Q182 PolarHBondContact O-N 3.35Å; D180-Q182 PolarHBondContact O-N 3.43Å; Q182-M187 HydrophobicContact CG-SD 4.21Å
183	N	95.2	Very high	94.3	Very high	104 Å²	104	70.8 Å²	70.8	56%	0.556	36%	0.358	S	S	*	.	H	α-helix	trans	-79.8	-24.4	178.4	-66.7	-19.7	0	0	0	112.1	K179 D180 S181	K179-N183 WeakPolarHBondContact CE-OD1 3.38Å; K179-N183 PolarHBondContact NZ-OD1 3.24Å; K179-N183 WeakPolarHBondContact O-CB 3.24Å; K179-N183 PolarHBondContact O-N 2.79Å; K179-N183 PolarHBondContact O-ND2 2.77Å; D180-N183 PolarHBondContact O-N 2.88Å; S181-N183 VanDerWaalsContact C-N 3.32Å; S181-N183 PolarHBondContact O-N 3.44Å
184	T	94.3	Very high	94.7	Very high	71 Å²	71	64.1 Å²	64.1	44%	0.436	33%	0.333	S	S	.	.	H	α-helix	trans	-86.1	-48	-178	-58	0	0	0	0	111.7	D180 S181 R365	D180-T184 VanDerWaalsContact O-CB 3.3Å; D180-T184 WeakPolarHBondContact O-CB 3.38Å; D180-T184 PolarHBondContact O-N 2.88Å; D180-T184 PolarHBondContact O-OG1 2.82Å; S181-T184 PolarHBondContact O-N 2.95Å; T184-R365 PolarHBondContact O-NE 2.85Å; T184-R365 PolarHBondContact O-NH1 2.79Å
185	Y	96.5	Very high	95.3	Very high	24 Å²	24	61.7 Å²	61.7	9%	0.094	32%	0.318	C	S	.	.	S	Bend	trans	-92.1	140.8	-170.6	-58.7	-59.2	0	0	0	112.4	S181 M187 I326 P328 P329 Q330 D363	S181-Y185 WeakPolarHBondContact O-CD2 3.45Å; S181-Y185 PolarHBondContact O-N 2.72Å; S181-Y185 VanDerWaalsContact OG-CD2 3.31Å; S181-Y185 WeakPolarHBondContact OG-CD2 3.4Å; S181-Y185 WeakPolarHBondContact OG-CE2 3.43Å; Y185-M187 PolarHBondContact O-N 2.77Å; Y185-I326 HydrophobicContact CD2-CB 4.08Å; Y185-I326 HydrophobicContact CD2-CD1 4.28Å; Y185-I326 HydrophobicContact CD2-CG2 4.13Å; Y185-I326 HydrophobicContact CE2-CB 4.14Å; Y185-I326 HydrophobicContact CE2-CG2 3.76Å; Y185-I326 HydrophobicContact CG-CD1 4.22Å; Y185-P328 HydrophobicContact CE2-CB 4.24Å; Y185-P328 HydrophobicContact CE2-CG 4Å; Y185-P328 WeakPolarHBondContact OH-CA 3.47Å; Y185-P328 WeakPolarHBondContact OH-CB 3.45Å; Y185-P329 WeakPolarHBondContact OH-CA 3.39Å; Y185-Q330 PolarHBondContact OH-O 2.94Å; Y185-Q330 VanDerWaalsContact OH-O 3.09Å; Y185-D363 HydrophobicContact CD1-CB 3.78Å; Y185-D363 WeakPolarHBondContact CD1-OD2 3.36Å; Y185-D363 HydrophobicContact CG-CB 4.35Å
186	A	96.6	Very high	95.6	Very high	50 Å²	50	59.4 Å²	59.4	41%	0.413	30%	0.299	S	S	.	.			trans	-81.9	74.8	166.2	0	0	0	0	0	108.8	L188 D363 H364 R365	A186-L188 PolarHBondContact O-N 3.41Å; A186-D363 PolarHBondContact N-OD1 2.9Å; A186-D363 VanDerWaalsContact N-OD1 3.1Å; A186-H364 HydrophobicContact CB-CB 4.22Å; A186-H364 WeakPolarHBondContact O-CB 3.41Å; A186-H364 PolarHBondContact O-N 3.45Å; A186-R365 HydrophobicContact CB-CG 3.81Å
187	M	96.8	Very high	95.8	Very high	54 Å²	54	55 Å²	55	27%	0.266	28%	0.28	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.1	123.5	-169.2	-51.1	-173	86.5	0	0	112.2	Q182 Y185 I325 I326 T361 Y362	Q182-M187 HydrophobicContact CG-SD 4.21Å; Y185-M187 PolarHBondContact O-N 2.77Å; M187-I325 HydrophobicContact CE-CG2 4.13Å; M187-I325 HydrophobicContact SD-CG2 4.47Å; M187-I326 HydrophobicContact CE-CB 3.63Å; M187-I326 HydrophobicContact CE-CD1 3.55Å; M187-I326 HydrophobicContact CE-CG1 3.38Å; M187-I326 HydrophobicContact CG-CD1 4.35Å; M187-T361 HydrophobicContact CB-CG2 4.12Å; M187-T361 HydrophobicContact CE-CG2 3.59Å; M187-Y362 WeakPolarHBondContact CA-O 3.39Å
188	L	97	Very high	96.1	Very high	84 Å²	84	50.6 Å²	50.6	44%	0.44	27%	0.271	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	146.7	166.4	-169.9	60.5	0	0	0	109.8	A186 T361 Y362	A186-L188 PolarHBondContact O-N 3.41Å; L188-T361 VanDerWaalsContact O-CA 3.31Å; L188-T361 WeakPolarHBondContact O-CA 3.42Å; L188-Y362 HydrophobicContact CB-CE1 4.27Å; L188-Y362 HydrophobicContact CB-CE2 4.13Å; L188-Y362 WeakPolarHBondContact CD2-OH 3.43Å; L188-Y362 PolarHBondContact N-O 2.8Å; L188-Y362 VanDerWaalsContact N-O 3.09Å; L188-Y362 VanDerWaalsContact O-CD1 3.23Å; L188-Y362 WeakPolarHBondContact O-CD1 3.46Å; L188-Y362 WeakPolarHBondContact O-CE1 3.41Å; L188-Y362 PolarHBondContact O-N 2.96Å
189	T	97.9	Very high	96.2	Very high	31 Å²	31	46.9 Å²	46.9	19%	0.19	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	130.7	176.6	-51.4	0	0	0	0	110.9	F191 T323 C359 L360 T361	T189-F191 HydrophobicContact CG2-CD2 4.31Å; T189-F191 HydrophobicContact CG2-CE1 4.01Å; T189-F191 HydrophobicContact CG2-CE2 3.67Å; T189-F191 HydrophobicContact CG2-CZ 3.5Å; T189-T323 HydrophobicContact CG2-CG2 3.98Å; T189-C359 HydrophobicContact CG2-CB 3.78Å; T189-L360 VanDerWaalsContact CA-O 3.27Å; T189-L360 WeakPolarHBondContact CA-O 3.28Å; T189-T361 PolarHBondContact OG1-OG1 3.42Å
190	T	97.7	Very high	96.3	Very high	27 Å²	27	43 Å²	43	17%	0.166	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	153.7	169.1	-173.1	0	0	0	0	110.7	C359 L360 Y362 A372 L376	T190-C359 CarbonylContact O-C 3.6Å; T190-C359 WeakPolarHBondContact O-CA 3.49Å; T190-C359 WeakPolarHBondContact O-CB 3.42Å; T190-L360 HydrophobicContact CG2-CB 4.13Å; T190-L360 PolarHBondContact N-O 3.37Å; T190-L360 PolarHBondContact O-N 2.92Å; T190-Y362 HydrophobicContact CG2-CE1 4.09Å; T190-A372 HydrophobicContact CG2-CB 4.29Å; T190-L376 HydrophobicContact CG2-CD2 3.94Å
191	F	97.7	Very high	96.3	Very high	77 Å²	77	43 Å²	43	34%	0.338	24%	0.242	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	144.8	-170.9	-61.2	-93.9	0	0	0	111.7	T189 F321 T323 I358 C359	T189-F191 HydrophobicContact CG2-CD2 4.31Å; T189-F191 HydrophobicContact CG2-CE1 4.01Å; T189-F191 HydrophobicContact CG2-CE2 3.67Å; T189-F191 HydrophobicContact CG2-CZ 3.5Å; F191-F321 HydrophobicContact CD1-CD2 4.48Å; F191-F321 HydrophobicContact CE1-CB 4.35Å; F191-F321 AromaticContact CE1-CD2 3.87Å; F191-F321 HydrophobicContact CE1-CD2 3.87Å; F191-F321 HydrophobicContact CE1-CG 4.47Å; F191-F321 HydrophobicContact CZ-CD2 4.35Å; F191-T323 HydrophobicContact CZ-CG2 3.75Å; F191-I358 WeakPolarHBondContact CA-O 3.31Å; F191-C359 HydrophobicContact CD1-CB 3.39Å; F191-C359 HydrophobicContact CE1-CB 3.5Å; F191-C359 VanDerWaalsContact CE1-CB 3.5Å; F191-C359 HydrophobicContact CG-CB 4.16Å; F191-C359 HydrophobicContact CZ-CB 4.35Å
192	N	97.2	Very high	96.2	Very high	41 Å²	41	46 Å²	46	22%	0.219	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.2	150.3	167.3	-78.7	170	0	0	0	110.1	Y357 I358 L376 K380	N192-Y357 WeakPolarHBondContact O-CA 3.24Å; N192-I358 HydrophobicContact CB-CD1 4.5Å; N192-I358 HydrophobicContact CB-CG1 4.05Å; N192-I358 PolarHBondContact N-O 2.79Å; N192-I358 PolarHBondContact O-N 2.93Å; N192-L376 HydrophobicContact CB-CD2 4.03Å; N192-L376 HydrophobicContact CB-CG 4.22Å; N192-K380 HydrophobicContact CB-CD 4.3Å
193	E	96.4	Very high	96.2	Very high	69 Å²	69	44.9 Å²	44.9	32%	0.322	25%	0.249	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.2	140.3	165.5	-168.7	169.3	-144.8	0	0	109	K342 M355 M356 Y357 K380	E193-K342 IonicContact OE1-NZ 3.03Å; E193-K342 PolarHBondContact OE1-NZ 3.02Å; E193-M355 HydrophobicContact CG-CB 4.25Å; E193-M355 HydrophobicContact CG-CE 3.7Å; E193-M356 CarbonylContact C-O 3.27Å; E193-M356 WeakPolarHBondContact CA-O 3.39Å; E193-Y357 HydrophobicContact CB-CD1 4Å; E193-Y357 HydrophobicContact CB-CE1 3.88Å; E193-Y357 HydrophobicContact CG-CD1 4.21Å; E193-Y357 HydrophobicContact CG-CE1 3.97Å; E193-K380 PolarHBondContact O-NZ 3.36Å
194	V	97.4	Very high	96.2	Very high	0 Å²	0	47.7 Å²	47.7	0%	0	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	129.9	-172	-174.8	0	0	0	0	109.4	M196 M355 M356 I358 K380 I383 E384	V194-M196 HydrophobicContact CG1-SD 4.09Å; V194-M196 PolarHBondContact O-N 3.22Å; V194-M355 WeakPolarHBondContact O-CA 2.93Å; V194-M356 PolarHBondContact N-O 2.93Å; V194-M356 PolarHBondContact O-N 3.36Å; V194-I358 HydrophobicContact CG2-CB 4.42Å; V194-I358 HydrophobicContact CG2-CD1 3.56Å; V194-I358 HydrophobicContact CG2-CG1 3.63Å; V194-I358 HydrophobicContact CG2-CG2 4Å; V194-K380 HydrophobicContact CG2-CB 4.15Å; V194-K380 HydrophobicContact CG2-CG 4.15Å; V194-I383 HydrophobicContact CG1-CB 3.93Å; V194-I383 HydrophobicContact CG1-CG2 3.56Å; V194-E384 HydrophobicContact CG1-CG 3.91Å
195	D	97.6	Very high	96.3	Very high	25 Å²	25	51.5 Å²	51.5	13%	0.134	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76	112.4	169	-175.5	-8.9	0	0	0	110	S197 R353 M355 E384	D195-S197 VanDerWaalsContact C-N 3.29Å; D195-S197 PolarHBondContact O-N 3.13Å; D195-S197 WeakPolarHBondContact OD1-CB 3.49Å; D195-S197 PolarHBondContact OD1-N 3.34Å; D195-S197 PolarHBondContact OD1-OG 2.81Å; D195-R353 IonicContact OD1-NE 2.66Å; D195-R353 IonicContact OD2-CZ 2.75Å; D195-R353 VanDerWaalsContact OD2-CZ 3.31Å; D195-R353 IonicContact OD2-NE 3.17Å; D195-R353 PolarHBondContact OD2-NE 3.48Å; D195-R353 IonicContact OD2-NH2 3.36Å; D195-R353 PolarHBondContact OD2-NH2 2.87Å; D195-M355 HydrophobicContact CB-CE 4.17Å; D195-M355 HydrophobicContact CB-SD 4.13Å; D195-E384 HydrophobicContact CB-CG 4.14Å; D195-E384 PolarHBondContact N-OE1 2.96Å; D195-E384 WeakPolarHBondContact O-CG 3.39Å
196	M	97.4	Very high	96.1	Very high	0 Å²	0	55.8 Å²	55.8	0%	0	28%	0.283	C	S	.	.			trans	-85.8	2.8	-178.7	-63.4	-62.4	-60.1	0	0	113.2	V194 A198 V199 V200 F224 I339 P354 M356 I383	V194-M196 HydrophobicContact CG1-SD 4.09Å; V194-M196 PolarHBondContact O-N 3.22Å; M196-A198 VanDerWaalsContact C-N 3.31Å; M196-A198 PolarHBondContact O-N 2.79Å; M196-V199 HydrophobicContact CE-CB 4.14Å; M196-V199 HydrophobicContact CE-CG1 4.18Å; M196-V199 PolarHBondContact O-N 2.87Å; M196-V200 HydrophobicContact CB-CG2 3.99Å; M196-V200 WeakPolarHBondContact O-CB 3.3Å; M196-V200 VanDerWaalsContact O-CG2 3.26Å; M196-V200 WeakPolarHBondContact O-CG2 3.39Å; M196-V200 PolarHBondContact O-N 2.91Å; M196-F224 HydrophobicContact CE-CE2 3.7Å; M196-F224 HydrophobicContact CE-CZ 3.69Å; M196-F224 HydrophobicContact SD-CE2 4.38Å; M196-F224 HydrophobicContact SD-CZ 3.76Å; M196-I339 HydrophobicContact CB-CG2 4.36Å; M196-I339 HydrophobicContact CE-CD1 4.18Å; M196-I339 HydrophobicContact CG-CD1 4.35Å; M196-I339 HydrophobicContact CG-CG1 4.27Å; M196-I339 HydrophobicContact CG-CG2 4.44Å; M196-P354 HydrophobicContact CB-CB 4.29Å; M196-P354 HydrophobicContact CB-CG 4.33Å; M196-P354 VanDerWaalsContact CB-O 3.28Å; M196-P354 WeakPolarHBondContact CB-O 3.26Å; M196-P354 PolarHBondContact N-O 2.73Å; M196-M356 HydrophobicContact CE-CE 4.11Å; M196-M356 HydrophobicContact CG-CB 3.71Å; M196-M356 HydrophobicContact CG-CE 4.45Å; M196-M356 HydrophobicContact SD-CB 4.09Å; M196-M356 HydrophobicContact SD-CE 4.18Å; M196-M356 HydrophobicContact SD-SD 4.39Å; M196-I383 HydrophobicContact CE-CG2 4.03Å; M196-I383 HydrophobicContact SD-CG2 3.51Å; M196-I383 VanDerWaalsContact SD-CG2 3.51Å
197	S	97.3	Very high	95.9	Very high	17 Å²	17	54.3 Å²	54.3	12%	0.119	27%	0.268	C	S	.	.	H	α-helix	trans	-54.3	-44	-172.2	-64.8	0	0	0	0	113.1	D195 S201 R353 P354	D195-S197 VanDerWaalsContact C-N 3.29Å; D195-S197 PolarHBondContact O-N 3.13Å; D195-S197 WeakPolarHBondContact OD1-CB 3.49Å; D195-S197 PolarHBondContact OD1-N 3.34Å; D195-S197 PolarHBondContact OD1-OG 2.81Å; S197-S201 WeakPolarHBondContact O-CB 3.5Å; S197-S201 PolarHBondContact O-N 2.88Å; S197-S201 PolarHBondContact O-OG 3.34Å; S197-R353 PolarHBondContact OG-NE 3.27Å; S197-R353 VanDerWaalsContact OG-NE 3.12Å; S197-P354 WeakPolarHBondContact OG-CD 3.35Å
198	A	95.9	Very high	95.8	Very high	37 Å²	37	56.8 Å²	56.8	31%	0.306	28%	0.283	S	S	.	.	H	α-helix	trans	-64.3	-50.1	-179.2	0	0	0	0	0	111.7	M196 S201 M202 E384 P386	M196-A198 VanDerWaalsContact C-N 3.31Å; M196-A198 PolarHBondContact O-N 2.79Å; A198-S201 PolarHBondContact O-N 2.63Å; A198-M202 WeakPolarHBondContact O-CB 3.39Å; A198-M202 PolarHBondContact O-N 3.32Å; A198-E384 VanDerWaalsContact CB-O 3.28Å; A198-E384 WeakPolarHBondContact CB-O 3.28Å; A198-P386 HydrophobicContact CB-CG 4.49Å
199	V	94.7	Very high	95.6	Very high	1 Å²	1	55.7 Å²	55.7	1%	0.006	29%	0.286	C	S	.	.	H	α-helix	trans	-67.4	-40.5	179.7	175.2	0	0	0	0	111.7	M196 M202 R203 F220 P223 I383 P386	M196-V199 HydrophobicContact CE-CB 4.14Å; M196-V199 HydrophobicContact CE-CG1 4.18Å; M196-V199 PolarHBondContact O-N 2.87Å; V199-M202 HydrophobicContact CG1-CE 4.5Å; V199-M202 PolarHBondContact O-N 2.71Å; V199-R203 WeakPolarHBondContact O-CB 3.34Å; V199-R203 PolarHBondContact O-N 3.35Å; V199-F220 HydrophobicContact CG1-CD1 3.75Å; V199-F220 HydrophobicContact CG1-CE1 4.09Å; V199-P223 HydrophobicContact CG1-CB 4.2Å; V199-P223 HydrophobicContact CG1-CG 3.8Å; V199-P223 HydrophobicContact CG2-CB 4.29Å; V199-I383 HydrophobicContact CG2-CG2 4.04Å; V199-I383 WeakPolarHBondContact CG2-O 3.31Å; V199-P386 HydrophobicContact CG2-CG 3.97Å
200	V	95.7	Very high	95.1	Very high	20 Å²	20	55.6 Å²	55.6	12%	0.121	28%	0.283	C	S	.	.	H	α-helix	trans	-62.6	-43.6	175.5	170.9	0	0	0	0	110.6	M196 R203 K204 F220 I339 P354	M196-V200 HydrophobicContact CB-CG2 3.99Å; M196-V200 WeakPolarHBondContact O-CB 3.3Å; M196-V200 VanDerWaalsContact O-CG2 3.26Å; M196-V200 WeakPolarHBondContact O-CG2 3.39Å; M196-V200 PolarHBondContact O-N 2.91Å; V200-R203 PolarHBondContact O-N 2.83Å; V200-K204 HydrophobicContact CG1-CD 4.23Å; V200-K204 WeakPolarHBondContact O-CG 3.5Å; V200-K204 PolarHBondContact O-N 2.97Å; V200-F220 HydrophobicContact CG2-CE1 3.93Å; V200-F220 HydrophobicContact CG2-CZ 4.1Å; V200-I339 HydrophobicContact CG2-CD1 4.48Å; V200-P354 HydrophobicContact CB-CG 4.48Å; V200-P354 HydrophobicContact CG2-CB 4.34Å; V200-P354 HydrophobicContact CG2-CG 4.23Å
201	S	95.9	Very high	94.7	Very high	71 Å²	71	57.9 Å²	57.9	50%	0.497	29%	0.292	S	S	.	.	H	α-helix	trans	-66.8	-43.9	178	-61.2	0	0	0	0	112	S197 A198 R203 K204 K205	S197-S201 WeakPolarHBondContact O-CB 3.5Å; S197-S201 PolarHBondContact O-N 2.88Å; S197-S201 PolarHBondContact O-OG 3.34Å; A198-S201 PolarHBondContact O-N 2.63Å; S201-R203 VanDerWaalsContact C-N 3.31Å; S201-R203 PolarHBondContact O-N 3.46Å; S201-K204 PolarHBondContact O-N 2.95Å; S201-K205 WeakPolarHBondContact O-CB 3.4Å; S201-K205 PolarHBondContact O-N 3.22Å
202	M	92.8	Very high	94.5	Very high	64 Å²	64	63 Å²	63	32%	0.315	31%	0.314	S	S	.	.	H	α-helix	trans	-55.8	-47.9	172.8	-178.8	-169.7	73.9	0	0	110.6	A198 V199 K205 Y206 P223	A198-M202 WeakPolarHBondContact O-CB 3.39Å; A198-M202 PolarHBondContact O-N 3.32Å; V199-M202 HydrophobicContact CG1-CE 4.5Å; V199-M202 PolarHBondContact O-N 2.71Å; M202-K205 PolarHBondContact O-N 2.98Å; M202-Y206 HydrophobicContact CG-CD2 3.88Å; M202-Y206 HydrophobicContact CG-CE2 4.33Å; M202-Y206 VanDerWaalsContact O-CD2 3.27Å; M202-Y206 WeakPolarHBondContact O-CD2 3.41Å; M202-Y206 PolarHBondContact O-N 2.85Å; M202-P223 HydrophobicContact CE-CG 4.22Å
203	R	92.1	Very high	94.1	Very high	76 Å²	76	70.1 Å²	70.1	29%	0.287	34%	0.338	S	S	.	.	H	α-helix	trans	-61.2	-49	179	-172.9	-177.4	176.3	-93.2	-5.3	111.7	V199 V200 S201 K205 Y206 N207 L218 F220	V199-R203 WeakPolarHBondContact O-CB 3.34Å; V199-R203 PolarHBondContact O-N 3.35Å; V200-R203 PolarHBondContact O-N 2.83Å; S201-R203 VanDerWaalsContact C-N 3.31Å; S201-R203 PolarHBondContact O-N 3.46Å; R203-K205 VanDerWaalsContact C-N 3.29Å; R203-K205 PolarHBondContact O-N 3.39Å; R203-Y206 PolarHBondContact O-N 3.39Å; R203-N207 HydrophobicContact CG-CB 4.48Å; R203-N207 WeakPolarHBondContact O-CB 3.35Å; R203-N207 PolarHBondContact O-N 2.94Å; R203-L218 HydrophobicContact CB-CD2 4.34Å; R203-L218 WeakPolarHBondContact CD-O 3.22Å; R203-L218 HydrophobicContact CG-CB 4.37Å; R203-L218 HydrophobicContact CG-CD2 4.26Å; R203-L218 HydrophobicContact CG-CG 4.42Å; R203-L218 PolarHBondContact NE-O 3.45Å; R203-F220 HydrophobicContact CB-CE1 4.24Å
204	K	95.5	Very high	93.6	Very high	163 Å²	163	70 Å²	70	71%	0.709	33%	0.334	S	S	*	.	H	α-helix	trans	-56.9	-42.2	177.3	-75.6	176.9	179.6	178.6	0	112	V200 S201	V200-K204 HydrophobicContact CG1-CD 4.23Å; V200-K204 WeakPolarHBondContact O-CG 3.5Å; V200-K204 PolarHBondContact O-N 2.97Å; S201-K204 PolarHBondContact O-N 2.95Å
205	K	95.8	Very high	92.9	Very high	151 Å²	151	73 Å²	73	66%	0.657	37%	0.366	S	S	*	.	H	α-helix	trans	-70.6	-40.4	-177.4	-174.4	175.2	178.9	-171.5	0	113.4	S201 M202 R203	S201-K205 WeakPolarHBondContact O-CB 3.4Å; S201-K205 PolarHBondContact O-N 3.22Å; M202-K205 PolarHBondContact O-N 2.98Å; R203-K205 VanDerWaalsContact C-N 3.29Å; R203-K205 PolarHBondContact O-N 3.39Å
206	Y	93.4	Very high	92.3	Very high	113 Å²	113	72.7 Å²	72.7	44%	0.443	37%	0.365	S	S	.	.	H	α-helix	trans	-109.9	-10.9	-168.2	-62.1	-67.6	0	0	0	115	M202 R203 D208 A209 F210	M202-Y206 HydrophobicContact CG-CD2 3.88Å; M202-Y206 HydrophobicContact CG-CE2 4.33Å; M202-Y206 VanDerWaalsContact O-CD2 3.27Å; M202-Y206 WeakPolarHBondContact O-CD2 3.41Å; M202-Y206 PolarHBondContact O-N 2.85Å; R203-Y206 PolarHBondContact O-N 3.39Å; Y206-D208 VanDerWaalsContact C-N 3.34Å; Y206-D208 PolarHBondContact O-N 3.5Å; Y206-A209 PolarHBondContact O-N 2.92Å; Y206-F210 WeakPolarHBondContact O-CB 3.4Å; Y206-F210 PolarHBondContact O-N 3.25Å
207	N	92	Very high	91.8	Very high	19 Å²	19	79 Å²	79	10%	0.102	39%	0.392	C	S	.	.	H	α-helix	trans	-54.7	-45.1	-173.8	176.9	80.6	0	0	0	113.4	R203 F210 Q211 L218	R203-N207 HydrophobicContact CG-CB 4.48Å; R203-N207 WeakPolarHBondContact O-CB 3.35Å; R203-N207 PolarHBondContact O-N 2.94Å; N207-F210 PolarHBondContact O-N 2.84Å; N207-Q211 VanDerWaalsContact O-CB 3.31Å; N207-Q211 WeakPolarHBondContact O-CB 3.12Å; N207-Q211 PolarHBondContact O-N 3.29Å; N207-L218 HydrophobicContact CB-CB 4.28Å; N207-L218 PolarHBondContact OD1-N 3.33Å
208	D	94.1	Very high	91.2	Very high	107 Å²	107	78.7 Å²	78.7	57%	0.572	39%	0.389	S	S	*	.	H	α-helix	trans	-71.6	-41.3	-174.8	-64.9	-7.2	0	0	0	112	Y206 F210 Q211 K212	Y206-D208 VanDerWaalsContact C-N 3.34Å; Y206-D208 PolarHBondContact O-N 3.5Å; D208-F210 VanDerWaalsContact C-N 3.33Å; D208-Q211 PolarHBondContact O-N 3.06Å; D208-K212 WeakPolarHBondContact O-CB 3.46Å; D208-K212 VanDerWaalsContact O-CG 3.25Å; D208-K212 WeakPolarHBondContact O-CG 3.3Å; D208-K212 PolarHBondContact O-N 3.49Å
209	A	93	Very high	90.8	Very high	61 Å²	61	78.5 Å²	78.5	50%	0.504	39%	0.391	S	S	.	.	H	α-helix	trans	-64.1	-41.1	174.2	0	0	0	0	0	111.2	Y206 K212 R213	Y206-A209 PolarHBondContact O-N 2.92Å; A209-K212 PolarHBondContact O-N 3.48Å; A209-R213 WeakPolarHBondContact O-CB 3.49Å; A209-R213 PolarHBondContact O-N 3.42Å
210	F	88.2	Confident	90.5	Very high	28 Å²	28	81.4 Å²	81.4	12%	0.123	40%	0.404	C	S	.	.	H	α-helix	trans	-63.4	-47.4	176.7	-171.3	-93.6	0	0	0	111.3	Y206 N207 D208 K212 R213 Y214 V216 L218 I281 F284	Y206-F210 WeakPolarHBondContact O-CB 3.4Å; Y206-F210 PolarHBondContact O-N 3.25Å; N207-F210 PolarHBondContact O-N 2.84Å; D208-F210 VanDerWaalsContact C-N 3.33Å; F210-K212 PolarHBondContact O-N 2.9Å; F210-R213 PolarHBondContact O-N 2.87Å; F210-Y214 HydrophobicContact CD1-CD2 4.41Å; F210-Y214 AromaticContact CD2-CD2 3.59Å; F210-Y214 HydrophobicContact CD2-CD2 3.59Å; F210-Y214 AromaticContact CD2-CE2 3.76Å; F210-Y214 HydrophobicContact CD2-CE2 3.76Å; F210-Y214 AromaticContact CE2-CD2 3.7Å; F210-Y214 HydrophobicContact CE2-CD2 3.7Å; F210-Y214 AromaticContact CE2-CE2 3.88Å; F210-Y214 HydrophobicContact CE2-CE2 3.88Å; F210-Y214 AromaticContact CG-CD2 3.96Å; F210-Y214 HydrophobicContact CG-CD2 3.96Å; F210-Y214 HydrophobicContact CZ-CD2 4.15Å; F210-Y214 WeakPolarHBondContact O-CB 3.27Å; F210-Y214 VanDerWaalsContact O-CD2 3.28Å; F210-Y214 WeakPolarHBondContact O-CD2 3.42Å; F210-Y214 PolarHBondContact O-N 2.73Å; F210-V216 VanDerWaalsContact CD1-O 3.27Å; F210-V216 WeakPolarHBondContact CD1-O 3.21Å; F210-V216 HydrophobicContact CE1-CG2 3.81Å; F210-V216 HydrophobicContact CZ-CG2 4.48Å; F210-L218 HydrophobicContact CD1-CB 3.94Å; F210-L218 HydrophobicContact CD1-CD1 3.97Å; F210-L218 HydrophobicContact CD2-CD1 3.99Å; F210-L218 HydrophobicContact CE1-CB 4.44Å; F210-L218 HydrophobicContact CE1-CD1 3.99Å; F210-L218 HydrophobicContact CE2-CD1 4.01Å; F210-L218 HydrophobicContact CG-CB 4.31Å; F210-L218 HydrophobicContact CG-CD1 3.98Å; F210-L218 HydrophobicContact CZ-CD1 4.02Å; F210-I281 HydrophobicContact CD2-CD1 4.41Å; F210-I281 HydrophobicContact CE1-CD1 4.49Å; F210-I281 HydrophobicContact CE2-CD1 3.39Å; F210-I281 HydrophobicContact CZ-CD1 3.43Å; F210-I281 VanDerWaalsContact CZ-CD1 3.43Å; F210-F284 HydrophobicContact CE1-CB 4.44Å; F210-F284 HydrophobicContact CE1-CD1 4.17Å; F210-F284 HydrophobicContact CE1-CD2 4.34Å; F210-F284 HydrophobicContact CE1-CG 4.09Å; F210-F284 HydrophobicContact CE2-CD2 4.03Å; F210-F284 HydrophobicContact CE2-CE2 4.14Å; F210-F284 HydrophobicContact CZ-CB 4.02Å; F210-F284 HydrophobicContact CZ-CD1 4.03Å; F210-F284 AromaticContact CZ-CD2 3.42Å; F210-F284 HydrophobicContact CZ-CD2 3.42Å; F210-F284 VanDerWaalsContact CZ-CD2 3.42Å; F210-F284 HydrophobicContact CZ-CE1 4.33Å; F210-F284 AromaticContact CZ-CE2 3.85Å; F210-F284 HydrophobicContact CZ-CE2 3.85Å; F210-F284 AromaticContact CZ-CG 3.57Å; F210-F284 HydrophobicContact CZ-CG 3.57Å; F210-F284 HydrophobicContact CZ-CZ 4.29Å
211	Q	89.5	Confident	90.3	Very high	75 Å²	75	82 Å²	82	35%	0.35	41%	0.406	S	S	.	.	H	α-helix	trans	-64.3	-41.2	177.8	-173.1	179.5	-16.2	0	0	112.1	N207 D208 R213 G215 V216 K217	N207-Q211 VanDerWaalsContact O-CB 3.31Å; N207-Q211 WeakPolarHBondContact O-CB 3.12Å; N207-Q211 PolarHBondContact O-N 3.29Å; D208-Q211 PolarHBondContact O-N 3.06Å; Q211-R213 VanDerWaalsContact C-N 3.34Å; Q211-R213 PolarHBondContact O-N 3.16Å; Q211-G215 VanDerWaalsContact O-CA 3.26Å; Q211-G215 WeakPolarHBondContact O-CA 3.43Å; Q211-G215 PolarHBondContact O-N 3.38Å; Q211-V216 VanDerWaalsContact CA-O 3.28Å; Q211-V216 WeakPolarHBondContact CA-O 3.47Å; Q211-K217 HydrophobicContact CG-CG 4.42Å
212	K	92.6	Very high	90	Very high	186 Å²	186	78.8 Å²	78.8	81%	0.809	38%	0.384	S	S	*	.	H	α-helix	trans	-62.7	-40.3	175.4	-76.2	174.6	-178	-179.9	0	112.4	D208 A209 F210	D208-K212 WeakPolarHBondContact O-CB 3.46Å; D208-K212 VanDerWaalsContact O-CG 3.25Å; D208-K212 WeakPolarHBondContact O-CG 3.3Å; D208-K212 PolarHBondContact O-N 3.49Å; A209-K212 PolarHBondContact O-N 3.48Å; F210-K212 PolarHBondContact O-N 2.9Å
213	R	88.9	Confident	89.9	Confident	190 Å²	190	76.4 Å²	76.4	72%	0.717	37%	0.373	S	S	*	.	H	α-helix	trans	-77.6	-36.6	-176.8	-174.6	171	179.6	-178.3	0.8	113.1	A209 F210 Q211	A209-R213 WeakPolarHBondContact O-CB 3.49Å; A209-R213 PolarHBondContact O-N 3.42Å; F210-R213 PolarHBondContact O-N 2.87Å; Q211-R213 VanDerWaalsContact C-N 3.34Å; Q211-R213 PolarHBondContact O-N 3.16Å
214	Y	85.3	Confident	90	Very high	65 Å²	65	72.8 Å²	72.8	26%	0.255	36%	0.359	S	S	.	.	H	α-helix	trans	-120.7	-4.3	-167.3	-56.4	-69.6	0	0	0	114.4	F210 V216 I281 F285	F210-Y214 HydrophobicContact CD1-CD2 4.41Å; F210-Y214 AromaticContact CD2-CD2 3.59Å; F210-Y214 HydrophobicContact CD2-CD2 3.59Å; F210-Y214 AromaticContact CD2-CE2 3.76Å; F210-Y214 HydrophobicContact CD2-CE2 3.76Å; F210-Y214 AromaticContact CE2-CD2 3.7Å; F210-Y214 HydrophobicContact CE2-CD2 3.7Å; F210-Y214 AromaticContact CE2-CE2 3.88Å; F210-Y214 HydrophobicContact CE2-CE2 3.88Å; F210-Y214 AromaticContact CG-CD2 3.96Å; F210-Y214 HydrophobicContact CG-CD2 3.96Å; F210-Y214 HydrophobicContact CZ-CD2 4.15Å; F210-Y214 WeakPolarHBondContact O-CB 3.27Å; F210-Y214 VanDerWaalsContact O-CD2 3.28Å; F210-Y214 WeakPolarHBondContact O-CD2 3.42Å; F210-Y214 PolarHBondContact O-N 2.73Å; Y214-V216 PolarHBondContact O-N 2.89Å; Y214-I281 HydrophobicContact CD1-CD1 3.34Å; Y214-I281 HydrophobicContact CD1-CG1 3.66Å; Y214-I281 HydrophobicContact CD2-CD1 3.27Å; Y214-I281 HydrophobicContact CD2-CG1 4.45Å; Y214-I281 HydrophobicContact CE1-CD1 3.46Å; Y214-I281 VanDerWaalsContact CE1-CD1 3.46Å; Y214-I281 HydrophobicContact CE1-CG1 3.72Å; Y214-I281 HydrophobicContact CE2-CD1 3.42Å; Y214-I281 VanDerWaalsContact CE2-CD1 3.42Å; Y214-I281 HydrophobicContact CG-CD1 3.24Å; Y214-I281 HydrophobicContact CG-CG1 4.03Å; Y214-I281 VanDerWaalsContact CZ-CD1 3.49Å; Y214-F285 HydrophobicContact CD1-CE2 4.46Å; Y214-F285 WeakPolarHBondContact O-CE1 3.46Å; Y214-F285 WeakPolarHBondContact O-CZ 3.28Å
215	G	83.5	Confident	90	Very high	65 Å²	65	65 Å²	65	67%	0.67	33%	0.326	S	S	*	.	S	Bend	trans	73.2	1.7	179.1	0	0	0	0	0	115	Q211	Q211-G215 VanDerWaalsContact O-CA 3.26Å; Q211-G215 WeakPolarHBondContact O-CA 3.43Å; Q211-G215 PolarHBondContact O-N 3.38Å
216	V	84.6	Confident	89.8	Confident	17 Å²	17	59.7 Å²	59.7	10%	0.103	30%	0.302	C	S	.	.	S	Bend	trans	-125	145.9	-177.4	-68.2	0	0	0	0	111.5	F210 Q211 Y214 F285 V288	F210-V216 VanDerWaalsContact CD1-O 3.27Å; F210-V216 WeakPolarHBondContact CD1-O 3.21Å; F210-V216 HydrophobicContact CE1-CG2 3.81Å; F210-V216 HydrophobicContact CZ-CG2 4.48Å; Q211-V216 VanDerWaalsContact CA-O 3.28Å; Q211-V216 WeakPolarHBondContact CA-O 3.47Å; Y214-V216 PolarHBondContact O-N 2.89Å; V216-F285 HydrophobicContact CG1-CD1 4.17Å; V216-F285 HydrophobicContact CG1-CE1 4.05Å; V216-F285 HydrophobicContact CG2-CD1 4.43Å; V216-F285 HydrophobicContact CG2-CE1 4.12Å; V216-V288 HydrophobicContact CB-CG2 4.24Å; V216-V288 HydrophobicContact CG1-CB 4.31Å; V216-V288 HydrophobicContact CG1-CG1 3.98Å; V216-V288 HydrophobicContact CG1-CG2 4.15Å
217	K	86.1	Confident	89.9	Confident	132 Å²	132	54.3 Å²	54.3	57%	0.574	28%	0.281	S	S	*	.			trans	-75.3	147.5	176.7	-73.5	-176.4	179.1	-179.8	0	110.9	Q211 G219	Q211-K217 HydrophobicContact CG-CG 4.42Å; K217-G219 PolarHBondContact O-N 3.4Å; K217-G219 VanDerWaalsContact O-N 3.15Å
218	L	86	Confident	90.1	Very high	11 Å²	11	53.4 Å²	53.4	6%	0.058	28%	0.276	C	S	.	.			trans	-75	105.9	176.3	-169.2	69.3	0	0	0	109.1	R203 N207 F210 F284	R203-L218 HydrophobicContact CB-CD2 4.34Å; R203-L218 WeakPolarHBondContact CD-O 3.22Å; R203-L218 HydrophobicContact CG-CB 4.37Å; R203-L218 HydrophobicContact CG-CD2 4.26Å; R203-L218 HydrophobicContact CG-CG 4.42Å; R203-L218 PolarHBondContact NE-O 3.45Å; N207-L218 HydrophobicContact CB-CB 4.28Å; N207-L218 PolarHBondContact OD1-N 3.33Å; F210-L218 HydrophobicContact CD1-CB 3.94Å; F210-L218 HydrophobicContact CD1-CD1 3.97Å; F210-L218 HydrophobicContact CD2-CD1 3.99Å; F210-L218 HydrophobicContact CE1-CB 4.44Å; F210-L218 HydrophobicContact CE1-CD1 3.99Å; F210-L218 HydrophobicContact CE2-CD1 4.01Å; F210-L218 HydrophobicContact CG-CB 4.31Å; F210-L218 HydrophobicContact CG-CD1 3.98Å; F210-L218 HydrophobicContact CZ-CD1 4.02Å; L218-F284 HydrophobicContact CD1-CD1 4.36Å; L218-F284 HydrophobicContact CD1-CE1 3.39Å; L218-F284 HydrophobicContact CD1-CE2 3.94Å; L218-F284 HydrophobicContact CD1-CZ 3.17Å; L218-F284 HydrophobicContact CG-CE1 4.25Å; L218-F284 HydrophobicContact CG-CZ 4.32Å
219	G	86.2	Confident	90.1	Very high	34 Å²	34	48.5 Å²	48.5	35%	0.351	25%	0.25	S	S	.	.			trans	-83.6	161	179.8	0	0	0	0	0	113.6	K217 S222	K217-G219 PolarHBondContact O-N 3.4Å; K217-G219 VanDerWaalsContact O-N 3.15Å; G219-S222 PolarHBondContact O-OG 2.97Å
220	F	89.3	Confident	90.2	Very high	61 Å²	61	47.7 Å²	47.7	27%	0.268	24%	0.235	S	C	.	.	S	Bend	trans	-80.5	-20.9	173.7	-70.4	-66.3	0	0	0	113.4	V199 V200 R203 S222 P223 F224 I339	V199-F220 HydrophobicContact CG1-CD1 3.75Å; V199-F220 HydrophobicContact CG1-CE1 4.09Å; V200-F220 HydrophobicContact CG2-CE1 3.93Å; V200-F220 HydrophobicContact CG2-CZ 4.1Å; R203-F220 HydrophobicContact CB-CE1 4.24Å; F220-S222 PolarHBondContact O-N 3.23Å; F220-P223 VanDerWaalsContact O-CD 3.28Å; F220-P223 WeakPolarHBondContact O-CD 3.22Å; F220-F224 VanDerWaalsContact O-CD2 3.28Å; F220-F224 WeakPolarHBondContact O-CD2 3.47Å; F220-I339 HydrophobicContact CD1-CD1 4.45Å; F220-I339 HydrophobicContact CD2-CD1 4.37Å; F220-I339 HydrophobicContact CE1-CD1 4.34Å; F220-I339 HydrophobicContact CE2-CD1 4.24Å; F220-I339 HydrophobicContact CG-CD1 4.46Å; F220-I339 HydrophobicContact CZ-CD1 4.22Å
221	M	91.1	Very high	90.6	Very high	33 Å²	33	46.4 Å²	46.4	16%	0.163	23%	0.229	C	C	.	.	H	α-helix	trans	-61.8	-40.3	-177.2	-74.5	-55.8	-53.5	0	0	113.1	F224 V225 V257 L287 I311 N313 I336	M221-F224 CarbonylContact O-C 3.59Å; M221-F224 WeakPolarHBondContact O-CA 3.22Å; M221-F224 WeakPolarHBondContact O-CB 3.34Å; M221-F224 PolarHBondContact O-N 2.82Å; M221-V225 WeakPolarHBondContact O-CG2 3.46Å; M221-V225 PolarHBondContact O-N 3.17Å; M221-V257 HydrophobicContact CE-CG1 3.86Å; M221-L287 HydrophobicContact CB-CD1 4.04Å; M221-I311 HydrophobicContact CE-CB 4.47Å; M221-I311 HydrophobicContact CE-CG2 3.76Å; M221-N313 HydrophobicContact SD-CB 4Å; M221-N313 PolarHBondContact SD-ND2 3.34Å; M221-I336 HydrophobicContact CE-CD1 4.04Å; M221-I336 HydrophobicContact SD-CD1 3.53Å; M221-I336 VanDerWaalsContact SD-CD1 3.53Å
222	S	89.3	Confident	90.9	Very high	4 Å²	4	43 Å²	43	3%	0.028	21%	0.213	C	C	.	.	H	α-helix	trans	-65.9	-39.4	-173.6	42.8	0	0	0	0	114.4	G219 F220 F224 V225 K226 F284	G219-S222 PolarHBondContact O-OG 2.97Å; F220-S222 PolarHBondContact O-N 3.23Å; S222-F224 VanDerWaalsContact C-N 3.26Å; S222-F224 PolarHBondContact O-N 3.46Å; S222-V225 PolarHBondContact O-N 3.19Å; S222-K226 PolarHBondContact O-N 2.9Å; S222-F284 WeakPolarHBondContact OG-CD1 3.45Å; S222-F284 WeakPolarHBondContact OG-CE1 3.41Å; S222-F284 WeakPolarHBondContact OG-CZ 3.2Å
223	P	91.6	Very high	91	Very high	14 Å²	14	39.5 Å²	39.5	9%	0.091	20%	0.2	C	C	.	.	H	α-helix	trans	-51.8	-43.1	165	-29.2	29.6	0	0	0	113.5	V199 M202 F220 K226 A227 I383	V199-P223 HydrophobicContact CG1-CB 4.2Å; V199-P223 HydrophobicContact CG1-CG 3.8Å; V199-P223 HydrophobicContact CG2-CB 4.29Å; M202-P223 HydrophobicContact CE-CG 4.22Å; F220-P223 VanDerWaalsContact O-CD 3.28Å; F220-P223 WeakPolarHBondContact O-CD 3.22Å; P223-K226 PolarHBondContact O-N 3.28Å; P223-A227 VanDerWaalsContact O-CB 3.23Å; P223-A227 WeakPolarHBondContact O-CB 3.5Å; P223-A227 PolarHBondContact O-N 3.37Å; P223-I383 HydrophobicContact CB-CD1 3.84Å
224	F	94.5	Very high	91.2	Very high	0 Å²	0	34.3 Å²	34.3	0%	0	19%	0.186	C	C	.	.	H	α-helix	trans	-71.3	-40.5	179.6	-75	-75.4	0	0	0	112.9	M196 F220 M221 S222 K226 A227 A228 I336 M356 I358 I379 I383	M196-F224 HydrophobicContact CE-CE2 3.7Å; M196-F224 HydrophobicContact CE-CZ 3.69Å; M196-F224 HydrophobicContact SD-CE2 4.38Å; M196-F224 HydrophobicContact SD-CZ 3.76Å; F220-F224 VanDerWaalsContact O-CD2 3.28Å; F220-F224 WeakPolarHBondContact O-CD2 3.47Å; M221-F224 CarbonylContact O-C 3.59Å; M221-F224 WeakPolarHBondContact O-CA 3.22Å; M221-F224 WeakPolarHBondContact O-CB 3.34Å; M221-F224 PolarHBondContact O-N 2.82Å; S222-F224 VanDerWaalsContact C-N 3.26Å; S222-F224 PolarHBondContact O-N 3.46Å; F224-K226 VanDerWaalsContact C-N 3.33Å; F224-K226 PolarHBondContact O-N 2.94Å; F224-A227 PolarHBondContact O-N 3.15Å; F224-A228 VanDerWaalsContact O-CB 3.23Å; F224-A228 WeakPolarHBondContact O-CB 3.35Å; F224-A228 PolarHBondContact O-N 3.11Å; F224-I336 HydrophobicContact CD1-CG2 3.83Å; F224-I336 HydrophobicContact CD2-CD1 4Å; F224-I336 HydrophobicContact CE1-CG2 4.02Å; F224-I336 HydrophobicContact CE2-CD1 4.44Å; F224-I336 HydrophobicContact CG-CD1 4.24Å; F224-I336 HydrophobicContact CG-CG2 4.18Å; F224-M356 HydrophobicContact CE1-SD 4.14Å; F224-M356 HydrophobicContact CE2-CE 3.91Å; F224-M356 HydrophobicContact CE2-SD 4Å; F224-M356 HydrophobicContact CZ-CE 3.86Å; F224-M356 HydrophobicContact CZ-SD 3.41Å; F224-M356 WeakPolarHBondContact CZ-SD 3.22Å; F224-I358 HydrophobicContact CE1-CG2 4Å; F224-I379 HydrophobicContact CD1-CG2 4.49Å; F224-I383 HydrophobicContact CD1-CD1 3.82Å; F224-I383 HydrophobicContact CD1-CG1 3.98Å; F224-I383 HydrophobicContact CD2-CD1 4.49Å; F224-I383 HydrophobicContact CE1-CD1 3.93Å; F224-I383 HydrophobicContact CE1-CG1 3.77Å; F224-I383 HydrophobicContact CE1-CG2 4.39Å; F224-I383 HydrophobicContact CG-CD1 4.12Å; F224-I383 HydrophobicContact CZ-CD1 4.3Å; F224-I383 HydrophobicContact CZ-CG1 4.36Å; F224-I383 HydrophobicContact CZ-CG2 4.26Å
225	V	94.7	Very high	91.8	Very high	0 Å²	0	32.7 Å²	32.7	0%	0	18%	0.181	C	C	.	.	H	α-helix	trans	-59.1	-48.1	173.2	177.5	0	0	0	0	109.5	M221 S222 A228 T229 I255 V257 L270 V273 L283 L287 I311	M221-V225 WeakPolarHBondContact O-CG2 3.46Å; M221-V225 PolarHBondContact O-N 3.17Å; S222-V225 PolarHBondContact O-N 3.19Å; V225-A228 PolarHBondContact O-N 2.88Å; V225-T229 PolarHBondContact O-N 2.72Å; V225-T229 PolarHBondContact O-OG1 2.64Å; V225-I255 HydrophobicContact CG1-CD1 3.74Å; V225-I255 HydrophobicContact CG1-CG2 4.49Å; V225-V257 HydrophobicContact CG2-CG2 4.44Å; V225-L270 HydrophobicContact CG1-CD1 4.02Å; V225-L270 HydrophobicContact CG2-CD1 4.13Å; V225-V273 HydrophobicContact CG1-CG1 3.64Å; V225-L283 HydrophobicContact CB-CD1 4.14Å; V225-L283 HydrophobicContact CB-CD2 3.98Å; V225-L283 HydrophobicContact CG1-CD1 3.69Å; V225-L283 HydrophobicContact CG1-CD2 3.97Å; V225-L283 HydrophobicContact CG1-CG 4.48Å; V225-L283 HydrophobicContact CG2-CD1 4.34Å; V225-L287 HydrophobicContact CG2-CD1 4.39Å; V225-I311 HydrophobicContact CB-CD1 4.47Å; V225-I311 HydrophobicContact CG2-CD1 4.05Å
226	K	92.2	Very high	92.4	Very high	39 Å²	39	32.7 Å²	32.7	17%	0.17	17%	0.169	C	C	.	.	H	α-helix	trans	-65.6	-40.5	178.3	-78.4	-60.6	-173.9	-172.2	0	113.7	S222 P223 F224 A228 T229 Y230 V273 M276 L283 M389	S222-K226 PolarHBondContact O-N 2.9Å; P223-K226 PolarHBondContact O-N 3.28Å; F224-K226 VanDerWaalsContact C-N 3.33Å; F224-K226 PolarHBondContact O-N 2.94Å; K226-A228 VanDerWaalsContact C-N 3.33Å; K226-T229 PolarHBondContact O-N 3.2Å; K226-Y230 WeakPolarHBondContact O-CB 3.34Å; K226-Y230 PolarHBondContact O-N 2.86Å; K226-V273 PolarHBondContact NZ-O 3.38Å; K226-V273 VanDerWaalsContact NZ-O 3.17Å; K226-M276 PolarHBondContact NZ-O 2.83Å; K226-L283 HydrophobicContact CD-CD2 4.38Å; K226-L283 HydrophobicContact CG-CD2 3.89Å; K226-M389 VanDerWaalsContact C-SD 3.6Å; K226-M389 HydrophobicContact CB-SD 3.82Å
227	A	95	Very high	93	Very high	0 Å²	0	33.2 Å²	33.2	0%	0	17%	0.171	C	C	.	.	H	α-helix	trans	-64.6	-39.9	175.9	0	0	0	0	0	111.5	P223 F224 Y230 A231 I379 A382 I383 M389	P223-A227 VanDerWaalsContact O-CB 3.23Å; P223-A227 WeakPolarHBondContact O-CB 3.5Å; P223-A227 PolarHBondContact O-N 3.37Å; F224-A227 PolarHBondContact O-N 3.15Å; A227-Y230 PolarHBondContact O-N 3.29Å; A227-A231 WeakPolarHBondContact O-CB 3.43Å; A227-A231 PolarHBondContact O-N 3.22Å; A227-I379 HydrophobicContact CB-CG2 4.08Å; A227-A382 HydrophobicContact CB-CB 3.81Å; A227-I383 HydrophobicContact CB-CD1 3.82Å; A227-I383 HydrophobicContact CB-CG1 4Å; A227-M389 VanDerWaalsContact CA-SD 3.58Å; A227-M389 HydrophobicContact CB-SD 4Å; A227-M389 PolarHBondContact N-SD 3.37Å; A227-M389 VanDerWaalsContact N-SD 3.4Å
228	A	96.4	Very high	93.6	Very high	0 Å²	0	27 Å²	27	0%	0	14%	0.144	C	C	.	.	H	α-helix	trans	-64.8	-46.6	174.5	0	0	0	0	0	111.3	F224 V225 K226 Y230 A231 L232 I255 F309 I311 I379	F224-A228 VanDerWaalsContact O-CB 3.23Å; F224-A228 WeakPolarHBondContact O-CB 3.35Å; F224-A228 PolarHBondContact O-N 3.11Å; V225-A228 PolarHBondContact O-N 2.88Å; K226-A228 VanDerWaalsContact C-N 3.33Å; A228-Y230 VanDerWaalsContact C-N 3.34Å; A228-Y230 PolarHBondContact O-N 3.03Å; A228-A231 PolarHBondContact O-N 2.88Å; A228-L232 WeakPolarHBondContact O-CB 3.46Å; A228-L232 WeakPolarHBondContact O-CG 3.37Å; A228-L232 PolarHBondContact O-N 3.34Å; A228-I255 HydrophobicContact CB-CD1 4.39Å; A228-F309 HydrophobicContact CB-CE1 4.27Å; A228-I311 HydrophobicContact CB-CD1 3.96Å; A228-I379 HydrophobicContact CB-CD1 4.23Å
229	T	94.9	Very high	94.2	Very high	4 Å²	4	26.6 Å²	26.6	3%	0.025	14%	0.142	C	C	.	.	H	α-helix	trans	-57.2	-47.6	174.8	-55.9	0	0	0	0	111.6	V225 K226 A231 L232 Q233 I253 I255 V273 E274	V225-T229 PolarHBondContact O-N 2.72Å; V225-T229 PolarHBondContact O-OG1 2.64Å; K226-T229 PolarHBondContact O-N 3.2Å; T229-A231 VanDerWaalsContact C-N 3.35Å; T229-A231 PolarHBondContact O-N 3.41Å; T229-L232 PolarHBondContact O-N 2.75Å; T229-Q233 WeakPolarHBondContact O-CG 3.2Å; T229-Q233 PolarHBondContact O-N 2.89Å; T229-I253 HydrophobicContact CG2-CD1 3.9Å; T229-I253 HydrophobicContact CG2-CG2 4.28Å; T229-I255 VanDerWaalsContact OG1-CD1 3.31Å; T229-I255 WeakPolarHBondContact OG1-CD1 3.48Å; T229-V273 HydrophobicContact CG2-CB 4.46Å; T229-V273 HydrophobicContact CG2-CG1 4.37Å; T229-V273 WeakPolarHBondContact OG1-CG1 3.4Å; T229-E274 HydrophobicContact CG2-CB 3.92Å
230	Y	94.1	Very high	94.7	Very high	44 Å²	44	25 Å²	25	17%	0.173	13%	0.125	C	C	.	.	H	α-helix	trans	-58.5	-45.7	176.8	176.8	-108	0	0	0	111.8	K226 A227 A228 Q233 D234 T378 A382 I388 M389 L393	K226-Y230 WeakPolarHBondContact O-CB 3.34Å; K226-Y230 PolarHBondContact O-N 2.86Å; A227-Y230 PolarHBondContact O-N 3.29Å; A228-Y230 VanDerWaalsContact C-N 3.34Å; A228-Y230 PolarHBondContact O-N 3.03Å; Y230-Q233 PolarHBondContact O-N 3.03Å; Y230-D234 PolarHBondContact O-N 2.75Å; Y230-T378 HydrophobicContact CD1-CG2 3.79Å; Y230-T378 HydrophobicContact CE1-CG2 3.68Å; Y230-A382 HydrophobicContact CD1-CB 4.41Å; Y230-I388 HydrophobicContact CE1-CG2 3.88Å; Y230-M389 HydrophobicContact CD1-CG 4.37Å; Y230-M389 HydrophobicContact CG-CG 4.26Å; Y230-L393 PolarHBondContact OH-N 2.92Å; Y230-L393 PolarHBondContact OH-O 3.49Å
231	A	96.5	Very high	95.1	Very high	0 Å²	0	22.4 Å²	22.4	0%	0	12%	0.115	C	C	.	.	H	α-helix	trans	-68.8	-32.3	177.8	0	0	0	0	0	113.4	A227 A228 T229 Q233 D234 Q235 F375 T378 I379	A227-A231 WeakPolarHBondContact O-CB 3.43Å; A227-A231 PolarHBondContact O-N 3.22Å; A228-A231 PolarHBondContact O-N 2.88Å; T229-A231 VanDerWaalsContact C-N 3.35Å; T229-A231 PolarHBondContact O-N 3.41Å; A231-Q233 VanDerWaalsContact C-N 3.34Å; A231-D234 PolarHBondContact O-N 2.91Å; A231-Q235 PolarHBondContact O-N 2.94Å; A231-F375 HydrophobicContact CB-CD2 3.61Å; A231-F375 HydrophobicContact CB-CE2 3.52Å; A231-F375 HydrophobicContact CB-CG 4.32Å; A231-F375 HydrophobicContact CB-CZ 4.19Å; A231-T378 HydrophobicContact CB-CG2 3.83Å; A231-I379 HydrophobicContact CB-CD1 4.36Å; A231-I379 HydrophobicContact CB-CG1 3.65Å
232	L	97	Very high	95.4	Very high	3 Å²	3	23.7 Å²	23.7	2%	0.016	12%	0.122	C	C	.	.	H	α-helix	trans	-69.7	-32.9	175.9	-73.5	168.4	0	0	0	111.4	A228 T229 Q235 P236 V238 N239 I253 F309 F375	A228-L232 WeakPolarHBondContact O-CB 3.46Å; A228-L232 WeakPolarHBondContact O-CG 3.37Å; A228-L232 PolarHBondContact O-N 3.34Å; T229-L232 PolarHBondContact O-N 2.75Å; L232-Q235 CarbonylContact O-C 3.56Å; L232-Q235 VanDerWaalsContact O-C 3.27Å; L232-P236 WeakPolarHBondContact O-CA 3.46Å; L232-V238 HydrophobicContact CD2-CB 4.02Å; L232-V238 HydrophobicContact CD2-CG1 3.87Å; L232-N239 HydrophobicContact CD2-CB 3.92Å; L232-I253 HydrophobicContact CB-CD1 3.64Å; L232-I253 HydrophobicContact CB-CG1 4.21Å; L232-I253 HydrophobicContact CD1-CD1 4.43Å; L232-I253 HydrophobicContact CD1-CG1 4.35Å; L232-I253 HydrophobicContact CD1-CG2 3.54Å; L232-F309 HydrophobicContact CD1-CB 3.97Å; L232-F309 HydrophobicContact CD1-CD1 4.26Å; L232-F309 HydrophobicContact CD1-CD2 4.49Å; L232-F309 HydrophobicContact CD1-CG 4Å; L232-F309 HydrophobicContact CD2-CD2 3.98Å; L232-F309 HydrophobicContact CD2-CE2 4.35Å; L232-F309 HydrophobicContact CD2-CG 4.32Å; L232-F375 HydrophobicContact CB-CE2 4.38Å; L232-F375 HydrophobicContact CD2-CE2 3.59Å; L232-F375 HydrophobicContact CD2-CZ 3.99Å; L232-F375 HydrophobicContact CG-CE2 3.68Å; L232-F375 HydrophobicContact CG-CZ 4.09Å
233	Q	94.2	Very high	95.6	Very high	114 Å²	114	27.9 Å²	27.9	53%	0.533	14%	0.143	S	C	.	.	H	α-helix	trans	-68.4	-36.7	172.6	-68.7	177.8	-58	0	0	111.9	T229 Y230 A231 I253	T229-Q233 WeakPolarHBondContact O-CG 3.2Å; T229-Q233 PolarHBondContact O-N 2.89Å; Y230-Q233 PolarHBondContact O-N 3.03Å; A231-Q233 VanDerWaalsContact C-N 3.34Å; Q233-I253 HydrophobicContact CG-CD1 3.72Å
234	D	93.7	Very high	95.6	Very high	81 Å²	81	36.4 Å²	36.4	43%	0.433	18%	0.182	S	C	.	.	H	α-helix	trans	-74.4	-34.2	175.4	-177.6	69.7	0	0	0	112.9	Y230 A231 P236	Y230-D234 PolarHBondContact O-N 2.75Å; A231-D234 PolarHBondContact O-N 2.91Å; D234-P236 WeakPolarHBondContact O-CD 3.33Å
235	Q	96.1	Very high	95.4	Very high	30 Å²	30	40 Å²	40	14%	0.14	22%	0.219	C	C	.	.			trans	-122.9	74.4	179.4	-58	-60.5	-38.1	0	0	112	A231 L232 I237 V238 T374 F375	A231-Q235 PolarHBondContact O-N 2.94Å; L232-Q235 CarbonylContact O-C 3.56Å; L232-Q235 VanDerWaalsContact O-C 3.27Å; Q235-I237 PolarHBondContact O-N 2.97Å; Q235-I237 VanDerWaalsContact O-N 3.1Å; Q235-V238 HydrophobicContact CB-CG2 4Å; Q235-V238 WeakPolarHBondContact O-CB 3.49Å; Q235-V238 PolarHBondContact O-N 3.37Å; Q235-T374 HydrophobicContact CG-CG2 4.44Å; Q235-F375 HydrophobicContact CB-CB 4.45Å; Q235-F375 HydrophobicContact CB-CD2 4.22Å; Q235-F375 HydrophobicContact CG-CB 4.25Å
236	P	96.6	Very high	95.5	Very high	66 Å²	66	46.8 Å²	46.8	43%	0.429	25%	0.251	S	S	.	.	G	3₁₀ helix	trans	-58.9	-27.2	-175.4	-26.5	35	0	0	0	114.8	L232 D234 V238 N239 A240	L232-P236 WeakPolarHBondContact O-CA 3.46Å; D234-P236 WeakPolarHBondContact O-CD 3.33Å; P236-V238 PolarHBondContact O-N 3.25Å; P236-N239 WeakPolarHBondContact O-CB 3.36Å; P236-N239 PolarHBondContact O-N 3.17Å; P236-A240 PolarHBondContact O-N 3.33Å
237	I	97.8	Very high	95.7	Very high	27 Å²	27	49 Å²	49	14%	0.138	26%	0.264	C	S	.	.	G	3₁₀ helix	trans	-59.2	-30.3	176.9	-171.3	66	0	0	0	112.6	Q235 N239 A240 Y249 L366 E371	Q235-I237 PolarHBondContact O-N 2.97Å; Q235-I237 VanDerWaalsContact O-N 3.1Å; I237-N239 PolarHBondContact O-N 3.11Å; I237-A240 HydrophobicContact CD1-CB 4.42Å; I237-A240 WeakPolarHBondContact O-CB 3.43Å; I237-A240 PolarHBondContact O-N 3.33Å; I237-Y249 HydrophobicContact CB-CE1 4.35Å; I237-Y249 HydrophobicContact CD1-CE1 3.81Å; I237-Y249 WeakPolarHBondContact CD1-OH 3.46Å; I237-L366 HydrophobicContact CD1-CD1 3.61Å; I237-L366 HydrophobicContact CD1-CG 3.98Å; I237-L366 HydrophobicContact CG1-CD1 4.5Å; I237-L366 HydrophobicContact CG1-CG 4.36Å; I237-E371 HydrophobicContact CG2-CB 3.99Å; I237-E371 HydrophobicContact CG2-CG 3.78Å
238	V	98.2	Very high	95.8	Very high	1 Å²	1	51.7 Å²	51.7	1%	0.006	28%	0.28	C	S	.	.	G	3₁₀ helix	trans	-69.5	-25.3	177.9	-178.7	0	0	0	0	111.6	L232 Q235 P236 F309 A332 I367 F375	L232-V238 HydrophobicContact CD2-CB 4.02Å; L232-V238 HydrophobicContact CD2-CG1 3.87Å; Q235-V238 HydrophobicContact CB-CG2 4Å; Q235-V238 WeakPolarHBondContact O-CB 3.49Å; Q235-V238 PolarHBondContact O-N 3.37Å; P236-V238 PolarHBondContact O-N 3.25Å; V238-F309 HydrophobicContact CG1-CD2 4.39Å; V238-F309 HydrophobicContact CG1-CE2 3.94Å; V238-A332 HydrophobicContact CG1-CB 3.89Å; V238-I367 HydrophobicContact CB-CD1 4.41Å; V238-I367 HydrophobicContact CG1-CD1 4.33Å; V238-I367 HydrophobicContact CG2-CD1 4.46Å; V238-I367 HydrophobicContact CG2-CG2 4.37Å; V238-F375 HydrophobicContact CB-CD2 4.07Å; V238-F375 HydrophobicContact CB-CE2 4.29Å; V238-F375 HydrophobicContact CB-CG 4.49Å; V238-F375 HydrophobicContact CG1-CD1 4.34Å; V238-F375 HydrophobicContact CG1-CD2 3.97Å; V238-F375 HydrophobicContact CG1-CE1 4.28Å; V238-F375 HydrophobicContact CG1-CE2 3.92Å; V238-F375 HydrophobicContact CG1-CG 4.17Å; V238-F375 HydrophobicContact CG1-CZ 4.06Å; V238-F375 HydrophobicContact CG2-CB 4.04Å; V238-F375 HydrophobicContact CG2-CD2 3.95Å; V238-F375 HydrophobicContact CG2-CG 4.04Å
239	N	98	Very high	95.9	Very high	3 Å²	3	58.2 Å²	58.2	2%	0.016	31%	0.306	C	S	.	.	G	3₁₀ helix	trans	-90.7	-7.9	176.2	-159.1	42.6	0	0	0	113.3	L232 P236 I237 R250 F252 T308	L232-N239 HydrophobicContact CD2-CB 3.92Å; P236-N239 WeakPolarHBondContact O-CB 3.36Å; P236-N239 PolarHBondContact O-N 3.17Å; I237-N239 PolarHBondContact O-N 3.11Å; N239-R250 PolarHBondContact ND2-O 3.35Å; N239-R250 VanDerWaalsContact ND2-O 3.07Å; N239-F252 PolarHBondContact ND2-O 2.68Å; N239-T308 WeakPolarHBondContact OD1-CB 3.33Å; N239-T308 PolarHBondContact OD1-OG1 3.17Å
240	A	98	Very high	95.9	Very high	0 Å²	0	60.4 Å²	60.4	0%	0	31%	0.313	C	S	.	.			trans	-79.2	166.8	-179.4	0	0	0	0	0	111.5	P236 I237 I247 V248 Y249 S331 L366	P236-A240 PolarHBondContact O-N 3.33Å; I237-A240 HydrophobicContact CD1-CB 4.42Å; I237-A240 WeakPolarHBondContact O-CB 3.43Å; I237-A240 PolarHBondContact O-N 3.33Å; A240-I247 HydrophobicContact CB-CG2 4.06Å; A240-V248 CarbonylContact C-O 3.59Å; A240-V248 WeakPolarHBondContact CA-O 3.24Å; A240-V248 WeakPolarHBondContact CB-O 3.35Å; A240-Y249 HydrophobicContact CB-CD1 3.86Å; A240-Y249 HydrophobicContact CB-CE1 4.18Å; A240-Y249 HydrophobicContact CB-CG 4.19Å; A240-S331 VanDerWaalsContact O-CB 3.22Å; A240-S331 WeakPolarHBondContact O-CB 3.08Å; A240-S331 PolarHBondContact O-OG 3.29Å; A240-L366 VanDerWaalsContact C-CD2 3.49Å; A240-L366 HydrophobicContact CB-CD2 4.01Å; A240-L366 VanDerWaalsContact O-CD2 3.24Å; A240-L366 WeakPolarHBondContact O-CD2 3.39Å
241	V	97.3	Very high	95.8	Very high	8 Å²	8	67.4 Å²	67.4	5%	0.048	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.9	155.1	174.6	-62.8	0	0	0	0	111.4	I247 V248 P329 S331	V241-I247 WeakPolarHBondContact O-CA 3.45Å; V241-V248 HydrophobicContact CG2-CB 3.91Å; V241-V248 PolarHBondContact N-O 3.03Å; V241-V248 PolarHBondContact O-N 3.23Å; V241-P329 WeakPolarHBondContact CG1-O 3.28Å; V241-S331 WeakPolarHBondContact CA-OG 3.35Å
242	I	96.5	Very high	95.8	Very high	60 Å²	60	71.4 Å²	71.4	31%	0.308	37%	0.365	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.2	121.6	166	-60.1	171.6	0	0	0	107.2	E246 R365 L366	I242-E246 WeakPolarHBondContact CA-O 3.46Å; I242-R365 HydrophobicContact CD1-CB 3.56Å; I242-L366 HydrophobicContact CD1-CB 4.02Å; I242-L366 HydrophobicContact CG1-CB 4.09Å; I242-L366 HydrophobicContact CG1-CD1 4.22Å
243	D	94.8	Very high	95.7	Very high	91 Å²	91	71.6 Å²	71.6	49%	0.487	37%	0.366	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.2	127.8	176.8	-165.5	19	0	0	0	109.4	G245 E246 V248	D243-G245 PolarHBondContact O-N 3.42Å; D243-E246 PolarHBondContact N-O 2.96Å; D243-E246 WeakPolarHBondContact O-CA 3.17Å; D243-E246 PolarHBondContact O-N 3.31Å; D243-V248 HydrophobicContact CB-CG2 3.86Å
244	E	91.5	Very high	95.8	Very high	193 Å²	193	66.5 Å²	66.5	90%	0.902	34%	0.342	S	S	*	.	T	Hydrogen-bonded Turn	trans	46.5	30	-179.4	-58.7	-170.7	166.2	0	0	116.1
245	G	90	Very high	96	Very high	75 Å²	75	62.6 Å²	62.6	77%	0.773	32%	0.322	S	S	*	.	T	Hydrogen-bonded Turn	trans	88.1	-0.7	-179.1	0	0	0	0	0	114.8	D243	D243-G245 PolarHBondContact O-N 3.42Å
246	E	96.3	Very high	96	Very high	144 Å²	144	61.2 Å²	61.2	67%	0.673	32%	0.315	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-104.7	160.1	174	-58.9	-169	143.6	0	0	111.4	I242 D243	I242-E246 WeakPolarHBondContact CA-O 3.46Å; D243-E246 PolarHBondContact N-O 2.96Å; D243-E246 WeakPolarHBondContact O-CA 3.17Å; D243-E246 PolarHBondContact O-N 3.31Å
247	I	97.4	Very high	96	Very high	86 Å²	86	58.4 Å²	58.4	44%	0.441	30%	0.297	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.2	115.3	172.1	-60	174	0	0	0	108.6	A240 V241 Y249 L366	A240-I247 HydrophobicContact CB-CG2 4.06Å; V241-I247 WeakPolarHBondContact O-CA 3.45Å; I247-Y249 HydrophobicContact CB-CE2 4.19Å; I247-Y249 HydrophobicContact CG2-CD2 3.9Å; I247-Y249 HydrophobicContact CG2-CE2 3.45Å; I247-Y249 VanDerWaalsContact CG2-CE2 3.45Å; I247-L366 HydrophobicContact CB-CD1 4.28Å; I247-L366 HydrophobicContact CD1-CD1 3.77Å; I247-L366 HydrophobicContact CG1-CD1 3.8Å; I247-L366 HydrophobicContact CG2-CD1 3.53Å
248	V	97.5	Very high	95.7	Very high	56 Å²	56	57.9 Å²	57.9	34%	0.339	30%	0.297	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97	108.6	177.2	-177	0	0	0	0	109.7	A240 V241 D243	A240-V248 CarbonylContact C-O 3.59Å; A240-V248 WeakPolarHBondContact CA-O 3.24Å; A240-V248 WeakPolarHBondContact CB-O 3.35Å; V241-V248 HydrophobicContact CG2-CB 3.91Å; V241-V248 PolarHBondContact N-O 3.03Å; V241-V248 PolarHBondContact O-N 3.23Å; D243-V248 HydrophobicContact CB-CG2 3.86Å
249	Y	97.3	Very high	95.3	Very high	137 Å²	137	58.6 Å²	58.6	54%	0.537	30%	0.301	S	S	.	.			trans	-83.2	132.3	171.9	-68.8	-94.2	0	0	0	110.7	I237 A240 I247	I237-Y249 HydrophobicContact CB-CE1 4.35Å; I237-Y249 HydrophobicContact CD1-CE1 3.81Å; I237-Y249 WeakPolarHBondContact CD1-OH 3.46Å; A240-Y249 HydrophobicContact CB-CD1 3.86Å; A240-Y249 HydrophobicContact CB-CE1 4.18Å; A240-Y249 HydrophobicContact CB-CG 4.19Å; I247-Y249 HydrophobicContact CB-CE2 4.19Å; I247-Y249 HydrophobicContact CG2-CD2 3.9Å; I247-Y249 HydrophobicContact CG2-CE2 3.45Å; I247-Y249 VanDerWaalsContact CG2-CE2 3.45Å
250	R	95.6	Very high	94.7	Very high	49 Å²	49	60.8 Å²	60.8	19%	0.185	32%	0.319	C	S	.	.			trans	-108.8	125.4	179.2	-61.1	178.2	-174.5	152.5	-7.2	110.3	N239 F252	N239-R250 PolarHBondContact ND2-O 3.35Å; N239-R250 VanDerWaalsContact ND2-O 3.07Å; R250-F252 HydrophobicContact CB-CD1 4.47Å; R250-F252 HydrophobicContact CB-CE1 4.21Å; R250-F252 HydrophobicContact CB-CZ 4.42Å; R250-F252 HydrophobicContact CG-CE1 4.37Å; R250-F252 HydrophobicContact CG-CZ 4.34Å
251	Q	92.2	Very high	94.1	Very high	191 Å²	191	61.5 Å²	61.5	89%	0.893	32%	0.324	S	S	*	.	S	Bend	trans	-82.4	-21.6	179.2	-65.8	-177.6	-6.6	0	0	113.1
252	F	95.6	Very high	93.5	Very high	85 Å²	85	66 Å²	66	37%	0.373	35%	0.353	S	S	.	.	S	Bend	trans	-92.1	150.1	174.5	61.4	-87.1	0	0	0	110.7	N239 R250 D254 T308	N239-F252 PolarHBondContact ND2-O 2.68Å; R250-F252 HydrophobicContact CB-CD1 4.47Å; R250-F252 HydrophobicContact CB-CE1 4.21Å; R250-F252 HydrophobicContact CB-CZ 4.42Å; R250-F252 HydrophobicContact CG-CE1 4.37Å; R250-F252 HydrophobicContact CG-CZ 4.34Å; F252-D254 HydrophobicContact CD2-CB 4.48Å; F252-T308 HydrophobicContact CD2-CG2 3.84Å; F252-T308 HydrophobicContact CE2-CG2 3.35Å; F252-T308 HydrophobicContact CZ-CG2 4.09Å
253	I	96.3	Very high	92.7	Very high	7 Å²	7	67 Å²	67	4%	0.036	35%	0.353	C	S	.	.			trans	-117.5	102.4	179.4	-65.5	168.5	0	0	0	108.6	T229 L232 Q233 I255 N272 V273 E274	T229-I253 HydrophobicContact CG2-CD1 3.9Å; T229-I253 HydrophobicContact CG2-CG2 4.28Å; L232-I253 HydrophobicContact CB-CD1 3.64Å; L232-I253 HydrophobicContact CB-CG1 4.21Å; L232-I253 HydrophobicContact CD1-CD1 4.43Å; L232-I253 HydrophobicContact CD1-CG1 4.35Å; L232-I253 HydrophobicContact CD1-CG2 3.54Å; Q233-I253 HydrophobicContact CG-CD1 3.72Å; I253-I255 HydrophobicContact CG2-CD1 3.85Å; I253-I255 HydrophobicContact CG2-CG1 3.74Å; I253-N272 PolarHBondContact O-N 3.4Å; I253-V273 HydrophobicContact CG2-CB 4.48Å; I253-V273 WeakPolarHBondContact O-CG2 3.23Å; I253-V273 PolarHBondContact O-N 3.41Å; I253-E274 WeakPolarHBondContact CA-OE2 3.36Å; I253-E274 WeakPolarHBondContact CB-OE2 3.32Å; I253-E274 HydrophobicContact CD1-CB 4.19Å; I253-E274 PolarHBondContact N-OE2 2.86Å
254	D	96.3	Very high	92.1	Very high	6 Å²	6	64.4 Å²	64.4	3%	0.032	35%	0.348	C	S	.	.			trans	-104.6	114.3	174.2	-70.8	-5.9	0	0	0	109.7	F252 V269 L270 R271 N272 T308 F309	F252-D254 HydrophobicContact CD2-CB 4.48Å; D254-V269 HydrophobicContact CB-CG1 3.75Å; D254-L270 CarbonylContact C-O 3.53Å; D254-L270 WeakPolarHBondContact CA-O 3.23Å; D254-R271 VanDerWaalsContact OD1-CA 3.27Å; D254-R271 WeakPolarHBondContact OD1-CA 3.31Å; D254-R271 WeakPolarHBondContact OD2-CD 3.2Å; D254-R271 IonicContact OD2-CZ 3.94Å; D254-R271 IonicContact OD2-NE 2.77Å; D254-R271 IonicContact OD2-NH1 3.69Å; D254-R271 PolarHBondContact OD2-NH1 3.43Å; D254-N272 PolarHBondContact OD1-N 3.35Å; D254-T308 HydrophobicContact CB-CG2 4.14Å; D254-T308 PolarHBondContact N-OG1 3.24Å; D254-T308 VanDerWaalsContact N-OG1 3.08Å; D254-T308 PolarHBondContact O-N 2.83Å; D254-T308 PolarHBondContact O-OG1 2.85Å; D254-F309 PolarHBondContact O-N 3.24Å; D254-F309 VanDerWaalsContact O-N 3.14Å
255	I	96.8	Very high	91.7	Very high	0 Å²	0	60.9 Å²	60.9	0%	0	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	109.2	-173.3	-64.2	176.3	0	0	0	110.5	V225 A228 T229 I253 V257 L270 V273 F309 I311	V225-I255 HydrophobicContact CG1-CD1 3.74Å; V225-I255 HydrophobicContact CG1-CG2 4.49Å; A228-I255 HydrophobicContact CB-CD1 4.39Å; T229-I255 VanDerWaalsContact OG1-CD1 3.31Å; T229-I255 WeakPolarHBondContact OG1-CD1 3.48Å; I253-I255 HydrophobicContact CG2-CD1 3.85Å; I253-I255 HydrophobicContact CG2-CG1 3.74Å; I255-V257 HydrophobicContact CG2-CG2 4.04Å; I255-L270 PolarHBondContact N-O 3.49Å; I255-L270 PolarHBondContact O-N 3.41Å; I255-V273 HydrophobicContact CB-CG2 4.18Å; I255-V273 HydrophobicContact CD1-CB 4.33Å; I255-V273 HydrophobicContact CD1-CG1 4.3Å; I255-V273 HydrophobicContact CD1-CG2 4.28Å; I255-V273 HydrophobicContact CG1-CG2 4.18Å; I255-F309 CarbonylContact C-O 3.53Å; I255-F309 WeakPolarHBondContact CA-O 3.49Å; I255-I311 HydrophobicContact CG2-CD1 3.77Å; I255-I311 HydrophobicContact CG2-CG1 3.89Å
256	S	96.7	Very high	91.6	Very high	1 Å²	1	58.6 Å²	58.6	1%	0.007	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66	126.7	164.6	-75.1	0	0	0	0	110.5	P268 F309 T310 I311 Q330	S256-P268 CarbonylContact C-O 3.52Å; S256-P268 VanDerWaalsContact CA-O 3.3Å; S256-P268 WeakPolarHBondContact CA-O 3.18Å; S256-F309 WeakPolarHBondContact CB-O 3.35Å; S256-F309 PolarHBondContact N-O 2.85Å; S256-T310 VanDerWaalsContact CB-OG1 3.24Å; S256-T310 WeakPolarHBondContact CB-OG1 3.39Å; S256-T310 CarbonylContact O-C 3.55Å; S256-T310 VanDerWaalsContact O-CA 3.31Å; S256-T310 WeakPolarHBondContact O-CA 3.31Å; S256-I311 PolarHBondContact O-N 3.09Å; S256-Q330 PolarHBondContact OG-NE2 2.86Å
257	V	95.1	Very high	91.5	Very high	7 Å²	7	53 Å²	53	4%	0.042	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	118.1	177.2	-179.7	0	0	0	0	109.5	M221 V225 I255 V259 P268 L270 L287	M221-V257 HydrophobicContact CE-CG1 3.86Å; V225-V257 HydrophobicContact CG2-CG2 4.44Å; I255-V257 HydrophobicContact CG2-CG2 4.04Å; V257-V259 HydrophobicContact CG1-CG2 4.34Å; V257-V259 PolarHBondContact O-N 3.28Å; V257-P268 PolarHBondContact N-O 2.93Å; V257-P268 WeakPolarHBondContact O-CD 3.41Å; V257-P268 WeakPolarHBondContact O-CG 3.18Å; V257-L270 HydrophobicContact CG2-CD1 3.83Å; V257-L270 HydrophobicContact CG2-CG 4.45Å; V257-L287 HydrophobicContact CB-CD2 4.36Å; V257-L287 HydrophobicContact CG1-CD2 4.17Å; V257-L287 HydrophobicContact CG2-CD2 3.99Å
258	A	92.6	Very high	91.3	Very high	16 Å²	16	49 Å²	49	13%	0.132	26%	0.262	C	S	.	.			trans	-72.8	120.2	-179.5	0	0	0	0	0	110.8	L265 I311	A258-L265 HydrophobicContact CB-CD1 4.06Å; A258-L265 HydrophobicContact CB-CD2 4.35Å; A258-L265 HydrophobicContact CB-CG 4.45Å; A258-I311 PolarHBondContact N-O 2.94Å
259	V	89.7	Confident	91.2	Very high	16 Å²	16	46.4 Å²	46.4	10%	0.097	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	132.7	-177.9	-179.6	0	0	0	0	109.9	V257 V266 P268 F291 A294	V257-V259 HydrophobicContact CG1-CG2 4.34Å; V257-V259 PolarHBondContact O-N 3.28Å; V259-V266 HydrophobicContact CB-CG2 4.25Å; V259-V266 PolarHBondContact N-O 3.11Å; V259-V266 WeakPolarHBondContact O-CG2 3.4Å; V259-V266 PolarHBondContact O-N 2.86Å; V259-V266 VanDerWaalsContact O-O 3.1Å; V259-P268 HydrophobicContact CG2-CG 3.94Å; V259-F291 HydrophobicContact CG1-CD2 3.82Å; V259-A294 HydrophobicContact CB-CB 4.29Å; V259-A294 HydrophobicContact CG1-CB 3.61Å
260	A	85.4	Confident	91.1	Very high	48 Å²	48	39.9 Å²	39.9	40%	0.397	22%	0.22	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.5	127.6	174.3	0	0	0	0	0	111	F317	A260-F317 HydrophobicContact CB-CZ 3.81Å
261	S	86.2	Confident	90.9	Very high	16 Å²	16	42 Å²	42	11%	0.112	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	164.5	171.4	77	0	0	0	0	110.9	R263 G264 A294	S261-R263 PolarHBondContact O-N 2.88Å; S261-R263 PolarHBondContact OG-N 3.46Å; S261-G264 WeakPolarHBondContact CA-O 3.45Å; S261-G264 PolarHBondContact N-O 3.46Å; S261-G264 PolarHBondContact O-N 3.37Å; S261-G264 VanDerWaalsContact O-N 3.13Å; S261-G264 VanDerWaalsContact O-O 3.08Å; S261-G264 PolarHBondContact OG-N 3Å; S261-G264 PolarHBondContact OG-O 3.41Å; S261-A294 WeakPolarHBondContact CB-O 3.13Å
262	P	84	Confident	91	Very high	101 Å²	101	36.4 Å²	36.4	66%	0.656	20%	0.204	S	C	*	.	T	Hydrogen-bonded Turn	trans	-57.5	-29.9	172.7	-25.6	35.4	0	0	0	113.9
263	R	79.2	Confident	90.8	Very high	81 Å²	81	32.3 Å²	32.3	31%	0.306	19%	0.186	S	C	.	.	T	Hydrogen-bonded Turn	trans	-85.1	-10.2	178.5	-73.8	-173.6	172.8	140.2	9.1	114.1	E68 E77 S261	E68-R263 IonicContact OE1-CZ 2.74Å; E68-R263 IonicContact OE1-NE 2.8Å; E68-R263 PolarHBondContact OE1-NE 2.7Å; E68-R263 IonicContact OE1-NH2 3.31Å; E68-R263 PolarHBondContact OE1-NH2 2.67Å; E77-R263 IonicContact OE1-CZ 3.63Å; E77-R263 IonicContact OE1-NH1 3.42Å; E77-R263 PolarHBondContact OE1-NH1 3.42Å; E77-R263 IonicContact OE1-NH2 2.72Å; E77-R263 PolarHBondContact OE1-NH2 3.39Å; S261-R263 PolarHBondContact O-N 2.88Å; S261-R263 PolarHBondContact OG-N 3.46Å
264	G	81.9	Confident	90.5	Very high	37 Å²	37	34 Å²	34	38%	0.381	19%	0.194	S	C	.	.	E	Extended strand (participates in β ladder)	trans	138.5	-148.5	-180	0	0	0	0	0	112.6	S261	S261-G264 WeakPolarHBondContact CA-O 3.45Å; S261-G264 PolarHBondContact N-O 3.46Å; S261-G264 PolarHBondContact O-N 3.37Å; S261-G264 VanDerWaalsContact O-N 3.13Å; S261-G264 VanDerWaalsContact O-O 3.08Å; S261-G264 PolarHBondContact OG-N 3Å; S261-G264 PolarHBondContact OG-O 3.41Å
265	L	83.8	Confident	90.1	Very high	119 Å²	119	37.4 Å²	37.4	62%	0.623	22%	0.219	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-90.7	126.2	177.4	-168.3	72.1	0	0	0	109.5	A258 V267	A258-L265 HydrophobicContact CB-CD1 4.06Å; A258-L265 HydrophobicContact CB-CD2 4.35Å; A258-L265 HydrophobicContact CB-CG 4.45Å; L265-V267 HydrophobicContact CG-CG2 4.47Å
266	V	88.9	Confident	89.3	Confident	28 Å²	28	38.4 Å²	38.4	17%	0.17	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116	151.7	169.7	-63.8	0	0	0	0	109.4	V259 A294 L299 M304	V259-V266 HydrophobicContact CB-CG2 4.25Å; V259-V266 PolarHBondContact N-O 3.11Å; V259-V266 WeakPolarHBondContact O-CG2 3.4Å; V259-V266 PolarHBondContact O-N 2.86Å; V259-V266 VanDerWaalsContact O-O 3.1Å; V266-A294 HydrophobicContact CG2-CB 3.5Å; V266-L299 HydrophobicContact CB-CD2 4.2Å; V266-L299 HydrophobicContact CG2-CD2 4.14Å; V266-M304 HydrophobicContact CB-SD 4.01Å; V266-M304 HydrophobicContact CG1-SD 4.25Å
267	V	92.7	Very high	87.5	Confident	27 Å²	27	42.6 Å²	42.6	16%	0.164	25%	0.252	C	S	.	.			trans	-132.2	75.5	-171.2	-169.1	0	0	0	0	110	L265 M304 T310	L265-V267 HydrophobicContact CG-CG2 4.47Å; V267-M304 WeakPolarHBondContact O-CA 3.41Å; V267-T310 HydrophobicContact CG1-CG2 4.49Å
268	P	94.6	Very high	85.4	Confident	2 Å²	2	47 Å²	47	1%	0.013	28%	0.28	C	S	.	.			trans	-58.3	153.8	171.2	25.3	-37.8	0	0	0	112.4	S256 V257 V259 Y290 L299 D303	S256-P268 CarbonylContact C-O 3.52Å; S256-P268 VanDerWaalsContact CA-O 3.3Å; S256-P268 WeakPolarHBondContact CA-O 3.18Å; V257-P268 PolarHBondContact N-O 2.93Å; V257-P268 WeakPolarHBondContact O-CD 3.41Å; V257-P268 WeakPolarHBondContact O-CG 3.18Å; V259-P268 HydrophobicContact CG2-CG 3.94Å; P268-Y290 HydrophobicContact CB-CD1 3.96Å; P268-Y290 HydrophobicContact CB-CD2 3.55Å; P268-Y290 HydrophobicContact CB-CE1 4.4Å; P268-Y290 HydrophobicContact CB-CE2 4.02Å; P268-Y290 HydrophobicContact CB-CG 3.49Å; P268-Y290 VanDerWaalsContact CB-CG 3.49Å; P268-Y290 HydrophobicContact CG-CD2 4.21Å; P268-Y290 HydrophobicContact CG-CG 4.09Å; P268-L299 HydrophobicContact CB-CD1 4.3Å; P268-L299 HydrophobicContact CB-CD2 3.89Å; P268-L299 HydrophobicContact CG-CD2 4.26Å; P268-D303 CarbonylContact C-O 3.55Å; P268-D303 VanDerWaalsContact CA-O 3.24Å; P268-D303 WeakPolarHBondContact CA-O 3.01Å
269	V	95.3	Very high	83.7	Confident	0 Å²	0	53.4 Å²	53.4	0%	0	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	116.4	-176.2	-176.7	0	0	0	0	110.3	D254 Y290 D303	D254-V269 HydrophobicContact CB-CG1 3.75Å; V269-Y290 PolarHBondContact O-OH 3.08Å; V269-D303 PolarHBondContact N-O 3.11Å
270	L	94	Very high	82.6	Confident	1 Å²	1	55 Å²	55	1%	0.005	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.8	122.3	167.8	-60.6	165.4	0	0	0	108.6	V225 D254 I255 V257 V273 L283 E286 L287 Y290	V225-L270 HydrophobicContact CG1-CD1 4.02Å; V225-L270 HydrophobicContact CG2-CD1 4.13Å; D254-L270 CarbonylContact C-O 3.53Å; D254-L270 WeakPolarHBondContact CA-O 3.23Å; I255-L270 PolarHBondContact N-O 3.49Å; I255-L270 PolarHBondContact O-N 3.41Å; V257-L270 HydrophobicContact CG2-CD1 3.83Å; V257-L270 HydrophobicContact CG2-CG 4.45Å; L270-V273 HydrophobicContact CB-CG2 3.64Å; L270-V273 WeakPolarHBondContact O-CG2 3.38Å; L270-L283 HydrophobicContact CD1-CD1 3.45Å; L270-L283 VanDerWaalsContact CD1-CD1 3.45Å; L270-L283 HydrophobicContact CD2-CD1 4.23Å; L270-L283 HydrophobicContact CG-CD1 4.41Å; L270-E286 HydrophobicContact CD2-CB 3.59Å; L270-E286 WeakPolarHBondContact CD2-OE2 3.37Å; L270-L287 HydrophobicContact CD1-CD2 3.82Å; L270-L287 HydrophobicContact CD1-CG 4.14Å; L270-L287 HydrophobicContact CD2-CD2 4.41Å; L270-L287 HydrophobicContact CD2-CG 4.35Å; L270-Y290 HydrophobicContact CD2-CD2 4.09Å; L270-Y290 HydrophobicContact CD2-CE2 3.95Å
271	R	92.7	Very high	81.8	Confident	92 Å²	92	53.7 Å²	53.7	35%	0.347	30%	0.301	S	S	.	.			trans	-92.7	143.1	-173.7	-61.2	-67.8	-171.6	177.6	0.7	112.4	D254 V273 M276 E305 G306	D254-R271 VanDerWaalsContact OD1-CA 3.27Å; D254-R271 WeakPolarHBondContact OD1-CA 3.31Å; D254-R271 WeakPolarHBondContact OD2-CD 3.2Å; D254-R271 IonicContact OD2-CZ 3.94Å; D254-R271 IonicContact OD2-NE 2.77Å; D254-R271 IonicContact OD2-NH1 3.69Å; D254-R271 PolarHBondContact OD2-NH1 3.43Å; R271-V273 VanDerWaalsContact C-N 3.29Å; R271-V273 PolarHBondContact O-N 2.89Å; R271-M276 WeakPolarHBondContact O-CE 3.42Å; R271-E305 VanDerWaalsContact CZ-O 3.27Å; R271-E305 PolarHBondContact NH1-O 3.16Å; R271-E305 PolarHBondContact NH2-O 3.12Å; R271-G306 PolarHBondContact NH1-O 2.93Å
272	N	92.5	Very high	81.1	Confident	74 Å²	74	58.3 Å²	58.3	40%	0.396	32%	0.32	S	S	.	.			trans	48.4	47.2	172.8	-54.6	-64.3	0	0	0	113.1	I253 D254 E274 S275	I253-N272 PolarHBondContact O-N 3.4Å; D254-N272 PolarHBondContact OD1-N 3.35Å; N272-E274 WeakPolarHBondContact CA-OE1 3.48Å; N272-E274 VanDerWaalsContact CA-OE2 3.3Å; N272-E274 WeakPolarHBondContact CA-OE2 3.42Å; N272-E274 WeakPolarHBondContact CB-OE1 3.31Å; N272-E274 PolarHBondContact O-N 3.35Å; N272-E274 VanDerWaalsContact O-N 3.15Å; N272-S275 WeakPolarHBondContact O-CB 3.19Å; N272-S275 PolarHBondContact O-N 3.37Å; N272-S275 PolarHBondContact O-OG 3.46Å
273	V	92.6	Very high	80.8	Confident	0 Å²	0	53.5 Å²	53.5	0%	0	29%	0.288	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63.1	-25.5	-171.4	-174	0	0	0	0	112.5	V225 K226 T229 I253 I255 L270 R271 S275 M276	V225-V273 HydrophobicContact CG1-CG1 3.64Å; K226-V273 PolarHBondContact NZ-O 3.38Å; K226-V273 VanDerWaalsContact NZ-O 3.17Å; T229-V273 HydrophobicContact CG2-CB 4.46Å; T229-V273 HydrophobicContact CG2-CG1 4.37Å; T229-V273 WeakPolarHBondContact OG1-CG1 3.4Å; I253-V273 HydrophobicContact CG2-CB 4.48Å; I253-V273 WeakPolarHBondContact O-CG2 3.23Å; I253-V273 PolarHBondContact O-N 3.41Å; I255-V273 HydrophobicContact CB-CG2 4.18Å; I255-V273 HydrophobicContact CD1-CB 4.33Å; I255-V273 HydrophobicContact CD1-CG1 4.3Å; I255-V273 HydrophobicContact CD1-CG2 4.28Å; I255-V273 HydrophobicContact CG1-CG2 4.18Å; L270-V273 HydrophobicContact CB-CG2 3.64Å; L270-V273 WeakPolarHBondContact O-CG2 3.38Å; R271-V273 VanDerWaalsContact C-N 3.29Å; R271-V273 PolarHBondContact O-N 2.89Å; V273-S275 VanDerWaalsContact C-N 3.28Å; V273-S275 PolarHBondContact O-N 3.02Å; V273-M276 HydrophobicContact CB-SD 4.5Å; V273-M276 HydrophobicContact CG1-SD 4.34Å; V273-M276 HydrophobicContact CG2-SD 4.46Å; V273-M276 WeakPolarHBondContact O-CB 2.99Å; V273-M276 PolarHBondContact O-N 3.38Å
274	E	90.2	Very high	80.8	Confident	42 Å²	42	50.4 Å²	50.4	20%	0.196	28%	0.277	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.8	-35.1	172.7	75.1	-64.7	154.8	0	0	112.6	T229 I253 N272 M276	T229-E274 HydrophobicContact CG2-CB 3.92Å; I253-E274 WeakPolarHBondContact CA-OE2 3.36Å; I253-E274 WeakPolarHBondContact CB-OE2 3.32Å; I253-E274 HydrophobicContact CD1-CB 4.19Å; I253-E274 PolarHBondContact N-OE2 2.86Å; N272-E274 WeakPolarHBondContact CA-OE1 3.48Å; N272-E274 VanDerWaalsContact CA-OE2 3.3Å; N272-E274 WeakPolarHBondContact CA-OE2 3.42Å; N272-E274 WeakPolarHBondContact CB-OE1 3.31Å; N272-E274 PolarHBondContact O-N 3.35Å; N272-E274 VanDerWaalsContact O-N 3.15Å; E274-M276 VanDerWaalsContact C-N 3.31Å
275	S	86.8	Confident	80.8	Confident	78 Å²	78	52.8 Å²	52.8	55%	0.545	28%	0.277	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.1	-17.1	177.1	77.2	0	0	0	0	112.8	N272 V273 S277	N272-S275 WeakPolarHBondContact O-CB 3.19Å; N272-S275 PolarHBondContact O-N 3.37Å; N272-S275 PolarHBondContact O-OG 3.46Å; V273-S275 VanDerWaalsContact C-N 3.28Å; V273-S275 PolarHBondContact O-N 3.02Å; S275-S277 PolarHBondContact O-N 3.06Å
276	M	81.4	Confident	80.8	Confident	21 Å²	21	50 Å²	50	10%	0.103	26%	0.261	C	S	.	.	T	Hydrogen-bonded Turn	trans	-74.9	21.9	177.4	-59.4	179.4	172.2	0	0	113	K226 R271 V273 E274 T278 L283 E286	K226-M276 PolarHBondContact NZ-O 2.83Å; R271-M276 WeakPolarHBondContact O-CE 3.42Å; V273-M276 HydrophobicContact CB-SD 4.5Å; V273-M276 HydrophobicContact CG1-SD 4.34Å; V273-M276 HydrophobicContact CG2-SD 4.46Å; V273-M276 WeakPolarHBondContact O-CB 2.99Å; V273-M276 PolarHBondContact O-N 3.38Å; E274-M276 VanDerWaalsContact C-N 3.31Å; M276-T278 PolarHBondContact O-N 2.92Å; M276-L283 HydrophobicContact SD-CB 4.34Å; M276-E286 WeakPolarHBondContact CE-OE1 3.49Å; M276-E286 WeakPolarHBondContact CE-OE2 3.17Å
277	S	57.3	Low	80.6	Confident	88 Å²	88	50 Å²	50	62%	0.615	26%	0.26	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.8	-33.2	-170.5	56.2	0	0	0	0	113.3	S275 W279	S275-S277 PolarHBondContact O-N 3.06Å; S277-W279 PolarHBondContact O-N 3.2Å
278	T	51.3	Low	80.3	Confident	101 Å²	101	51.6 Å²	51.6	62%	0.62	27%	0.27	S	S	*	.	S	Bend	trans	-76.3	-26.5	-174.8	-40.8	0	0	0	0	113.3	M276	M276-T278 PolarHBondContact O-N 2.92Å
279	W	56.6	Low	80.1	Confident	149 Å²	149	55.9 Å²	55.9	56%	0.564	29%	0.289	S	S	*	.			trans	-142.6	91.4	-174.9	-43	93.7	0	0	0	110.8	S277 I281 F282	S277-W279 PolarHBondContact O-N 3.2Å; W279-I281 HydrophobicContact CB-CB 4.44Å; W279-I281 HydrophobicContact CB-CG2 3.65Å; W279-I281 PolarHBondContact O-N 3.28Å; W279-F282 HydrophobicContact CB-CD2 3.64Å; W279-F282 HydrophobicContact CB-CE2 3.93Å; W279-F282 AromaticContact CD1-CD2 3.97Å; W279-F282 AromaticContact CD1-CE2 3.59Å; W279-F282 HydrophobicContact CG-CD2 4.07Å; W279-F282 AromaticContact CG-CE2 3.88Å; W279-F282 HydrophobicContact CG-CE2 3.88Å; W279-F282 PolarHBondContact O-N 3.28Å
280	A	67	Low	79.9	Confident	49 Å²	49	56.9 Å²	56.9	41%	0.405	29%	0.293	S	S	.	.	H	α-helix	trans	-45.4	-25.3	165.8	0	0	0	0	0	112	F282 L283 F284	A280-F282 PolarHBondContact O-N 3.35Å; A280-L283 WeakPolarHBondContact O-CB 3.33Å; A280-L283 PolarHBondContact O-N 3Å; A280-F284 HydrophobicContact CB-CD2 4.47Å; A280-F284 HydrophobicContact CB-CE2 4.03Å; A280-F284 WeakPolarHBondContact O-CD2 3.31Å; A280-F284 PolarHBondContact O-N 2.97Å; A280-F284 VanDerWaalsContact O-N 3.16Å
281	I	69.2	Low	79.5	Confident	21 Å²	21	61.5 Å²	61.5	11%	0.108	31%	0.314	C	S	.	.	H	α-helix	trans	-54.7	-42.1	174.6	-149.3	74.3	0	0	0	115.5	F210 Y214 W279 L283 F284 F285	F210-I281 HydrophobicContact CD2-CD1 4.41Å; F210-I281 HydrophobicContact CE1-CD1 4.49Å; F210-I281 HydrophobicContact CE2-CD1 3.39Å; F210-I281 HydrophobicContact CZ-CD1 3.43Å; F210-I281 VanDerWaalsContact CZ-CD1 3.43Å; Y214-I281 HydrophobicContact CD1-CD1 3.34Å; Y214-I281 HydrophobicContact CD1-CG1 3.66Å; Y214-I281 HydrophobicContact CD2-CD1 3.27Å; Y214-I281 HydrophobicContact CD2-CG1 4.45Å; Y214-I281 HydrophobicContact CE1-CD1 3.46Å; Y214-I281 VanDerWaalsContact CE1-CD1 3.46Å; Y214-I281 HydrophobicContact CE1-CG1 3.72Å; Y214-I281 HydrophobicContact CE2-CD1 3.42Å; Y214-I281 VanDerWaalsContact CE2-CD1 3.42Å; Y214-I281 HydrophobicContact CG-CD1 3.24Å; Y214-I281 HydrophobicContact CG-CG1 4.03Å; Y214-I281 VanDerWaalsContact CZ-CD1 3.49Å; W279-I281 HydrophobicContact CB-CB 4.44Å; W279-I281 HydrophobicContact CB-CG2 3.65Å; W279-I281 PolarHBondContact O-N 3.28Å; I281-L283 VanDerWaalsContact C-N 3.33Å; I281-L283 PolarHBondContact O-N 2.94Å; I281-F284 WeakPolarHBondContact O-CB 3.41Å; I281-F284 PolarHBondContact O-N 3.12Å; I281-F284 VanDerWaalsContact O-N 3.12Å; I281-F285 HydrophobicContact CD1-CE2 4.34Å; I281-F285 HydrophobicContact CG1-CD2 3.84Å; I281-F285 HydrophobicContact CG1-CE2 3.48Å; I281-F285 VanDerWaalsContact CG1-CE2 3.48Å; I281-F285 HydrophobicContact CG1-CZ 4.48Å; I281-F285 VanDerWaalsContact O-CD2 3.25Å; I281-F285 WeakPolarHBondContact O-CD2 3.3Å; I281-F285 PolarHBondContact O-N 3.36Å
282	F	70.4	Confident	79.4	Confident	113 Å²	113	62.7 Å²	62.7	50%	0.496	32%	0.322	S	S	.	.	H	α-helix	trans	-65.6	-43.8	-177.6	-75.5	-62.1	0	0	0	110	W279 A280 F284 F285 E286	W279-F282 HydrophobicContact CB-CD2 3.64Å; W279-F282 HydrophobicContact CB-CE2 3.93Å; W279-F282 AromaticContact CD1-CD2 3.97Å; W279-F282 AromaticContact CD1-CE2 3.59Å; W279-F282 HydrophobicContact CG-CD2 4.07Å; W279-F282 AromaticContact CG-CE2 3.88Å; W279-F282 HydrophobicContact CG-CE2 3.88Å; W279-F282 PolarHBondContact O-N 3.28Å; A280-F282 PolarHBondContact O-N 3.35Å; F282-F284 VanDerWaalsContact C-N 3.28Å; F282-F284 PolarHBondContact O-N 3.39Å; F282-F285 PolarHBondContact O-N 3.41Å; F282-F285 VanDerWaalsContact O-N 3.1Å; F282-E286 PolarHBondContact O-N 3.49Å
283	L	78.9	Confident	79.3	Confident	0 Å²	0	60.8 Å²	60.8	0%	0	31%	0.31	C	S	.	.	H	α-helix	trans	-55.9	-41.2	172.3	172.6	64.1	0	0	0	112.3	V225 K226 L270 M276 A280 I281 L287	V225-L283 HydrophobicContact CB-CD1 4.14Å; V225-L283 HydrophobicContact CB-CD2 3.98Å; V225-L283 HydrophobicContact CG1-CD1 3.69Å; V225-L283 HydrophobicContact CG1-CD2 3.97Å; V225-L283 HydrophobicContact CG1-CG 4.48Å; V225-L283 HydrophobicContact CG2-CD1 4.34Å; K226-L283 HydrophobicContact CD-CD2 4.38Å; K226-L283 HydrophobicContact CG-CD2 3.89Å; L270-L283 HydrophobicContact CD1-CD1 3.45Å; L270-L283 VanDerWaalsContact CD1-CD1 3.45Å; L270-L283 HydrophobicContact CD2-CD1 4.23Å; L270-L283 HydrophobicContact CG-CD1 4.41Å; M276-L283 HydrophobicContact SD-CB 4.34Å; A280-L283 WeakPolarHBondContact O-CB 3.33Å; A280-L283 PolarHBondContact O-N 3Å; I281-L283 VanDerWaalsContact C-N 3.33Å; I281-L283 PolarHBondContact O-N 2.94Å; L283-L287 HydrophobicContact CD1-CD1 3.85Å; L283-L287 HydrophobicContact CD1-CG 4.08Å; L283-L287 HydrophobicContact CG-CD1 4.04Å; L283-L287 WeakPolarHBondContact O-CB 3.28Å; L283-L287 WeakPolarHBondContact O-CD1 3.27Å; L283-L287 VanDerWaalsContact O-CG 3.24Å; L283-L287 WeakPolarHBondContact O-CG 3.26Å; L283-L287 PolarHBondContact O-N 3.5Å
284	F	78.8	Confident	79.2	Confident	16 Å²	16	60.9 Å²	60.9	7%	0.07	31%	0.311	C	S	.	.	H	α-helix	trans	-64.2	-45.4	175	-74.5	-78.9	0	0	0	112.4	F210 L218 S222 A280 I281 F282 V288	F210-F284 HydrophobicContact CE1-CB 4.44Å; F210-F284 HydrophobicContact CE1-CD1 4.17Å; F210-F284 HydrophobicContact CE1-CD2 4.34Å; F210-F284 HydrophobicContact CE1-CG 4.09Å; F210-F284 HydrophobicContact CE2-CD2 4.03Å; F210-F284 HydrophobicContact CE2-CE2 4.14Å; F210-F284 HydrophobicContact CZ-CB 4.02Å; F210-F284 HydrophobicContact CZ-CD1 4.03Å; F210-F284 AromaticContact CZ-CD2 3.42Å; F210-F284 HydrophobicContact CZ-CD2 3.42Å; F210-F284 VanDerWaalsContact CZ-CD2 3.42Å; F210-F284 HydrophobicContact CZ-CE1 4.33Å; F210-F284 AromaticContact CZ-CE2 3.85Å; F210-F284 HydrophobicContact CZ-CE2 3.85Å; F210-F284 AromaticContact CZ-CG 3.57Å; F210-F284 HydrophobicContact CZ-CG 3.57Å; F210-F284 HydrophobicContact CZ-CZ 4.29Å; L218-F284 HydrophobicContact CD1-CD1 4.36Å; L218-F284 HydrophobicContact CD1-CE1 3.39Å; L218-F284 HydrophobicContact CD1-CE2 3.94Å; L218-F284 HydrophobicContact CD1-CZ 3.17Å; L218-F284 HydrophobicContact CG-CE1 4.25Å; L218-F284 HydrophobicContact CG-CZ 4.32Å; S222-F284 WeakPolarHBondContact OG-CD1 3.45Å; S222-F284 WeakPolarHBondContact OG-CE1 3.41Å; S222-F284 WeakPolarHBondContact OG-CZ 3.2Å; A280-F284 HydrophobicContact CB-CD2 4.47Å; A280-F284 HydrophobicContact CB-CE2 4.03Å; A280-F284 WeakPolarHBondContact O-CD2 3.31Å; A280-F284 PolarHBondContact O-N 2.97Å; A280-F284 VanDerWaalsContact O-N 3.16Å; I281-F284 WeakPolarHBondContact O-CB 3.41Å; I281-F284 PolarHBondContact O-N 3.12Å; I281-F284 VanDerWaalsContact O-N 3.12Å; F282-F284 VanDerWaalsContact C-N 3.28Å; F282-F284 PolarHBondContact O-N 3.39Å; F284-V288 WeakPolarHBondContact O-CB 3.4Å; F284-V288 VanDerWaalsContact O-CG2 3.24Å; F284-V288 WeakPolarHBondContact O-CG2 3.49Å; F284-V288 PolarHBondContact O-N 3.33Å
285	F	81.6	Confident	79.1	Confident	87 Å²	87	64.4 Å²	64.4	38%	0.382	33%	0.325	S	S	.	.	H	α-helix	trans	-64.1	-44.1	179.8	-79.7	-63.3	0	0	0	111.9	Y214 V216 I281 F282 V288 H289	Y214-F285 HydrophobicContact CD1-CE2 4.46Å; Y214-F285 WeakPolarHBondContact O-CE1 3.46Å; Y214-F285 WeakPolarHBondContact O-CZ 3.28Å; V216-F285 HydrophobicContact CG1-CD1 4.17Å; V216-F285 HydrophobicContact CG1-CE1 4.05Å; V216-F285 HydrophobicContact CG2-CD1 4.43Å; V216-F285 HydrophobicContact CG2-CE1 4.12Å; I281-F285 HydrophobicContact CD1-CE2 4.34Å; I281-F285 HydrophobicContact CG1-CD2 3.84Å; I281-F285 HydrophobicContact CG1-CE2 3.48Å; I281-F285 VanDerWaalsContact CG1-CE2 3.48Å; I281-F285 HydrophobicContact CG1-CZ 4.48Å; I281-F285 VanDerWaalsContact O-CD2 3.25Å; I281-F285 WeakPolarHBondContact O-CD2 3.3Å; I281-F285 PolarHBondContact O-N 3.36Å; F282-F285 PolarHBondContact O-N 3.41Å; F282-F285 VanDerWaalsContact O-N 3.1Å; F285-V288 PolarHBondContact O-N 2.75Å; F285-H289 VanDerWaalsContact O-CB 3.26Å; F285-H289 WeakPolarHBondContact O-CB 3.43Å; F285-H289 PolarHBondContact O-N 2.66Å
286	E	83.5	Confident	79.4	Confident	61 Å²	61	63.9 Å²	63.9	29%	0.285	32%	0.316	S	S	.	.	H	α-helix	trans	-64.5	-45.8	178.3	-73.4	-176.4	-169.6	0	0	112	L270 M276 F282 V288 H289 Y290	L270-E286 HydrophobicContact CD2-CB 3.59Å; L270-E286 WeakPolarHBondContact CD2-OE2 3.37Å; M276-E286 WeakPolarHBondContact CE-OE1 3.49Å; M276-E286 WeakPolarHBondContact CE-OE2 3.17Å; F282-E286 PolarHBondContact O-N 3.49Å; E286-V288 VanDerWaalsContact C-N 3.3Å; E286-V288 PolarHBondContact O-N 2.92Å; E286-H289 WeakPolarHBondContact O-CB 3.43Å; E286-H289 PolarHBondContact O-N 2.86Å; E286-Y290 WeakPolarHBondContact O-CD2 3.32Å; E286-Y290 PolarHBondContact O-N 3Å
287	L	85.8	Confident	79.7	Confident	27 Å²	27	65.2 Å²	65.2	14%	0.141	32%	0.323	C	S	.	.	H	α-helix	trans	-58.3	-42.8	175.4	-78.1	171.4	0	0	0	112.1	M221 V225 V257 L270 L283 F291	M221-L287 HydrophobicContact CB-CD1 4.04Å; V225-L287 HydrophobicContact CG2-CD1 4.39Å; V257-L287 HydrophobicContact CB-CD2 4.36Å; V257-L287 HydrophobicContact CG1-CD2 4.17Å; V257-L287 HydrophobicContact CG2-CD2 3.99Å; L270-L287 HydrophobicContact CD1-CD2 3.82Å; L270-L287 HydrophobicContact CD1-CG 4.14Å; L270-L287 HydrophobicContact CD2-CD2 4.41Å; L270-L287 HydrophobicContact CD2-CG 4.35Å; L283-L287 HydrophobicContact CD1-CD1 3.85Å; L283-L287 HydrophobicContact CD1-CG 4.08Å; L283-L287 HydrophobicContact CG-CD1 4.04Å; L283-L287 WeakPolarHBondContact O-CB 3.28Å; L283-L287 WeakPolarHBondContact O-CD1 3.27Å; L283-L287 VanDerWaalsContact O-CG 3.24Å; L283-L287 WeakPolarHBondContact O-CG 3.26Å; L283-L287 PolarHBondContact O-N 3.5Å; L287-F291 WeakPolarHBondContact O-CB 3.39Å; L287-F291 PolarHBondContact O-N 2.74Å
288	V	86.6	Confident	81.3	Confident	61 Å²	61	68.1 Å²	68.1	37%	0.37	33%	0.325	S	S	.	.	H	α-helix	trans	-69	-41	177.7	171.3	0	0	0	0	111.1	V216 F284 F285 E286 F291 F292	V216-V288 HydrophobicContact CB-CG2 4.24Å; V216-V288 HydrophobicContact CG1-CB 4.31Å; V216-V288 HydrophobicContact CG1-CG1 3.98Å; V216-V288 HydrophobicContact CG1-CG2 4.15Å; F284-V288 WeakPolarHBondContact O-CB 3.4Å; F284-V288 VanDerWaalsContact O-CG2 3.24Å; F284-V288 WeakPolarHBondContact O-CG2 3.49Å; F284-V288 PolarHBondContact O-N 3.33Å; F285-V288 PolarHBondContact O-N 2.75Å; E286-V288 VanDerWaalsContact C-N 3.3Å; E286-V288 PolarHBondContact O-N 2.92Å; V288-F291 PolarHBondContact O-N 2.9Å; V288-F292 WeakPolarHBondContact O-CB 3.47Å; V288-F292 PolarHBondContact O-N 3.16Å
289	H	89.1	Confident	83.1	Confident	92 Å²	92	64.3 Å²	64.3	43%	0.426	30%	0.301	S	S	.	.	H	α-helix	trans	-58.2	-52.9	176	178.1	78.2	0	0	0	110.6	F285 E286 F291 F292 Q293	F285-H289 VanDerWaalsContact O-CB 3.26Å; F285-H289 WeakPolarHBondContact O-CB 3.43Å; F285-H289 PolarHBondContact O-N 2.66Å; E286-H289 WeakPolarHBondContact O-CB 3.43Å; E286-H289 PolarHBondContact O-N 2.86Å; H289-F291 VanDerWaalsContact C-N 3.33Å; H289-F291 PolarHBondContact O-N 3.48Å; H289-F292 WeakPolarHBondContact O-CB 3.24Å; H289-F292 PolarHBondContact O-N 2.83Å; H289-F292 VanDerWaalsContact O-N 3.09Å; H289-Q293 PolarHBondContact CE1-NE2 3.32Å; H289-Q293 VanDerWaalsContact CE1-NE2 3.34Å; H289-Q293 WeakPolarHBondContact O-CG 3.34Å; H289-Q293 PolarHBondContact O-N 2.8Å
290	Y	91.3	Very high	84.7	Confident	22 Å²	22	59.7 Å²	59.7	9%	0.086	29%	0.29	C	S	.	.	H	α-helix	trans	-63.8	-37	178.9	-69	-35.2	0	0	0	113.1	P268 V269 L270 E286 F292 Q293 A294 L299 D303	P268-Y290 HydrophobicContact CB-CD1 3.96Å; P268-Y290 HydrophobicContact CB-CD2 3.55Å; P268-Y290 HydrophobicContact CB-CE1 4.4Å; P268-Y290 HydrophobicContact CB-CE2 4.02Å; P268-Y290 HydrophobicContact CB-CG 3.49Å; P268-Y290 VanDerWaalsContact CB-CG 3.49Å; P268-Y290 HydrophobicContact CG-CD2 4.21Å; P268-Y290 HydrophobicContact CG-CG 4.09Å; V269-Y290 PolarHBondContact O-OH 3.08Å; L270-Y290 HydrophobicContact CD2-CD2 4.09Å; L270-Y290 HydrophobicContact CD2-CE2 3.95Å; E286-Y290 WeakPolarHBondContact O-CD2 3.32Å; E286-Y290 PolarHBondContact O-N 3Å; Y290-F292 VanDerWaalsContact C-N 3.32Å; Y290-F292 PolarHBondContact O-N 3.03Å; Y290-Q293 PolarHBondContact O-N 2.87Å; Y290-A294 WeakPolarHBondContact O-CB 3.43Å; Y290-A294 PolarHBondContact O-N 2.91Å; Y290-L299 HydrophobicContact CD1-CD1 3.48Å; Y290-L299 VanDerWaalsContact CD1-CD1 3.48Å; Y290-L299 HydrophobicContact CE1-CD1 4.02Å; Y290-L299 HydrophobicContact CG-CD1 4.32Å; Y290-D303 HydrophobicContact CE1-CB 3.94Å; Y290-D303 PolarHBondContact OH-OD1 2.9Å; Y290-D303 VanDerWaalsContact OH-OD1 3.06Å
291	F	86.9	Confident	85.7	Confident	98 Å²	98	61.6 Å²	61.6	43%	0.43	29%	0.292	S	S	.	.	H	α-helix	trans	-62	-40.3	172.6	-177.5	-102.1	0	0	0	112.5	V259 L287 V288 H289 K295	V259-F291 HydrophobicContact CG1-CD2 3.82Å; L287-F291 WeakPolarHBondContact O-CB 3.39Å; L287-F291 PolarHBondContact O-N 2.74Å; V288-F291 PolarHBondContact O-N 2.9Å; H289-F291 VanDerWaalsContact C-N 3.33Å; H289-F291 PolarHBondContact O-N 3.48Å; F291-K295 HydrophobicContact CD1-CD 4.17Å; F291-K295 HydrophobicContact CE1-CD 3.69Å; F291-K295 HydrophobicContact CE1-CG 4.49Å; F291-K295 VanDerWaalsContact CE1-NZ 3.3Å; F291-K295 HydrophobicContact CZ-CD 4.05Å; F291-K295 WeakPolarHBondContact O-CG 3.44Å; F291-K295 PolarHBondContact O-N 2.86Å; F291-K295 VanDerWaalsContact O-N 3.1Å
292	F	89.9	Confident	86.7	Confident	117 Å²	117	67.9 Å²	67.9	51%	0.513	32%	0.321	S	S	.	.	H	α-helix	trans	-66.3	-48.7	175.3	-179.9	-100.6	0	0	0	111.5	V288 H289 Y290 A294 K295 I296	V288-F292 WeakPolarHBondContact O-CB 3.47Å; V288-F292 PolarHBondContact O-N 3.16Å; H289-F292 WeakPolarHBondContact O-CB 3.24Å; H289-F292 PolarHBondContact O-N 2.83Å; H289-F292 VanDerWaalsContact O-N 3.09Å; Y290-F292 VanDerWaalsContact C-N 3.32Å; Y290-F292 PolarHBondContact O-N 3.03Å; F292-A294 VanDerWaalsContact C-N 3.33Å; F292-A294 PolarHBondContact O-N 3.35Å; F292-K295 WeakPolarHBondContact O-CB 3.46Å; F292-K295 PolarHBondContact O-N 2.91Å; F292-K295 VanDerWaalsContact O-N 3.12Å; F292-I296 HydrophobicContact CD1-CD1 4.08Å; F292-I296 HydrophobicContact CE1-CD1 3.59Å; F292-I296 HydrophobicContact CE2-CG2 4.31Å; F292-I296 HydrophobicContact CZ-CD1 4.14Å; F292-I296 HydrophobicContact CZ-CG2 4.2Å; F292-I296 WeakPolarHBondContact O-CG1 3.3Å; F292-I296 PolarHBondContact O-N 2.84Å; F292-I296 VanDerWaalsContact O-N 3.11Å
293	Q	91.2	Very high	87.8	Confident	34 Å²	34	64.5 Å²	64.5	16%	0.159	31%	0.308	C	S	.	.	H	α-helix	trans	-60.2	-41.6	178.4	-66.6	-56.8	-19.2	0	0	112.3	H289 Y290 K295 I296 N297 K298 L299	H289-Q293 PolarHBondContact CE1-NE2 3.32Å; H289-Q293 VanDerWaalsContact CE1-NE2 3.34Å; H289-Q293 WeakPolarHBondContact O-CG 3.34Å; H289-Q293 PolarHBondContact O-N 2.8Å; Y290-Q293 PolarHBondContact O-N 2.87Å; Q293-K295 PolarHBondContact O-N 3.34Å; Q293-I296 CarbonylContact O-C 3.55Å; Q293-I296 PolarHBondContact O-N 2.85Å; Q293-N297 PolarHBondContact O-N 3.36Å; Q293-K298 PolarHBondContact O-N 2.89Å; Q293-K298 VanDerWaalsContact OE1-CB 3.27Å; Q293-K298 PolarHBondContact OE1-O 2.94Å; Q293-L299 HydrophobicContact CB-CB 4.19Å; Q293-L299 HydrophobicContact CB-CD1 3.9Å
294	A	89.9	Confident	88.3	Confident	1 Å²	1	67.4 Å²	67.4	1%	0.008	32%	0.323	C	S	.	.	H	α-helix	trans	-60.9	-43.3	174.2	0	0	0	0	0	111.7	V259 S261 V266 Y290 F292 I296 N297	V259-A294 HydrophobicContact CB-CB 4.29Å; V259-A294 HydrophobicContact CG1-CB 3.61Å; S261-A294 WeakPolarHBondContact CB-O 3.13Å; V266-A294 HydrophobicContact CG2-CB 3.5Å; Y290-A294 WeakPolarHBondContact O-CB 3.43Å; Y290-A294 PolarHBondContact O-N 2.91Å; F292-A294 VanDerWaalsContact C-N 3.33Å; F292-A294 PolarHBondContact O-N 3.35Å; A294-I296 VanDerWaalsContact C-N 3.32Å; A294-I296 PolarHBondContact O-N 2.86Å; A294-N297 PolarHBondContact O-N 2.89Å
295	K	89.1	Confident	88.8	Confident	116 Å²	116	72.4 Å²	72.4	50%	0.504	35%	0.346	S	S	.	.	H	α-helix	trans	-63	-36.1	178.4	-85	-174.5	164.1	-175.7	0	113.7	F291 F292 Q293	F291-K295 HydrophobicContact CD1-CD 4.17Å; F291-K295 HydrophobicContact CE1-CD 3.69Å; F291-K295 HydrophobicContact CE1-CG 4.49Å; F291-K295 VanDerWaalsContact CE1-NZ 3.3Å; F291-K295 HydrophobicContact CZ-CD 4.05Å; F291-K295 WeakPolarHBondContact O-CG 3.44Å; F291-K295 PolarHBondContact O-N 2.86Å; F291-K295 VanDerWaalsContact O-N 3.1Å; F292-K295 WeakPolarHBondContact O-CB 3.46Å; F292-K295 PolarHBondContact O-N 2.91Å; F292-K295 VanDerWaalsContact O-N 3.12Å; Q293-K295 PolarHBondContact O-N 3.34Å
296	I	91.4	Very high	89.3	Confident	67 Å²	67	70.8 Å²	70.8	34%	0.344	35%	0.354	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.1	7.4	179.4	69.3	173	0	0	0	113	F292 Q293 A294 K298	F292-I296 HydrophobicContact CD1-CD1 4.08Å; F292-I296 HydrophobicContact CE1-CD1 3.59Å; F292-I296 HydrophobicContact CE2-CG2 4.31Å; F292-I296 HydrophobicContact CZ-CD1 4.14Å; F292-I296 HydrophobicContact CZ-CG2 4.2Å; F292-I296 WeakPolarHBondContact O-CG1 3.3Å; F292-I296 PolarHBondContact O-N 2.84Å; F292-I296 VanDerWaalsContact O-N 3.11Å; Q293-I296 CarbonylContact O-C 3.55Å; Q293-I296 PolarHBondContact O-N 2.85Å; A294-I296 VanDerWaalsContact C-N 3.32Å; A294-I296 PolarHBondContact O-N 2.86Å; I296-K298 VanDerWaalsContact C-N 3.25Å; I296-K298 HydrophobicContact CD1-CB 4.02Å; I296-K298 HydrophobicContact CD1-CD 3.79Å; I296-K298 HydrophobicContact CD1-CG 4.02Å; I296-K298 HydrophobicContact CG1-CB 3.9Å; I296-K298 HydrophobicContact CG1-CD 4.28Å; I296-K298 HydrophobicContact CG1-CG 3.95Å; I296-K298 PolarHBondContact O-N 2.81Å
297	N	87.7	Confident	89.9	Confident	49 Å²	49	68.2 Å²	68.2	26%	0.262	34%	0.344	S	S	.	.	T	Hydrogen-bonded Turn	trans	54.1	33	-177.1	-59.6	-48.9	0	0	0	114.8	Q293 A294	Q293-N297 PolarHBondContact O-N 3.36Å; A294-N297 PolarHBondContact O-N 2.89Å
298	K	90.5	Very high	90.4	Very high	149 Å²	149	67 Å²	67	65%	0.648	34%	0.337	S	S	*	.			trans	-112.6	21	179.2	-65.4	-169.2	-176.5	-175.6	0	113.6	Q293 I296 P300	Q293-K298 PolarHBondContact O-N 2.89Å; Q293-K298 VanDerWaalsContact OE1-CB 3.27Å; Q293-K298 PolarHBondContact OE1-O 2.94Å; I296-K298 VanDerWaalsContact C-N 3.25Å; I296-K298 HydrophobicContact CD1-CB 4.02Å; I296-K298 HydrophobicContact CD1-CD 3.79Å; I296-K298 HydrophobicContact CD1-CG 4.02Å; I296-K298 HydrophobicContact CG1-CB 3.9Å; I296-K298 HydrophobicContact CG1-CD 4.28Å; I296-K298 HydrophobicContact CG1-CG 3.95Å; I296-K298 PolarHBondContact O-N 2.81Å; K298-P300 VanDerWaalsContact O-CD 3.26Å; K298-P300 WeakPolarHBondContact O-CD 3.18Å
299	L	89.3	Confident	91	Very high	21 Å²	21	64.1 Å²	64.1	11%	0.11	32%	0.32	C	S	.	.			trans	-72.3	118.7	175.9	-169	69	0	0	0	109.5	V266 P268 Y290 Q293 D303 M304	V266-L299 HydrophobicContact CB-CD2 4.2Å; V266-L299 HydrophobicContact CG2-CD2 4.14Å; P268-L299 HydrophobicContact CB-CD1 4.3Å; P268-L299 HydrophobicContact CB-CD2 3.89Å; P268-L299 HydrophobicContact CG-CD2 4.26Å; Y290-L299 HydrophobicContact CD1-CD1 3.48Å; Y290-L299 VanDerWaalsContact CD1-CD1 3.48Å; Y290-L299 HydrophobicContact CE1-CD1 4.02Å; Y290-L299 HydrophobicContact CG-CD1 4.32Å; Q293-L299 HydrophobicContact CB-CB 4.19Å; Q293-L299 HydrophobicContact CB-CD1 3.9Å; L299-D303 HydrophobicContact CD1-CB 4.05Å; L299-D303 HydrophobicContact CG-CB 4.35Å; L299-M304 HydrophobicContact CD2-CG 3.56Å; L299-M304 HydrophobicContact CD2-SD 3.76Å; L299-M304 HydrophobicContact CG-CG 4.12Å; L299-M304 HydrophobicContact CG-SD 4.42Å
300	P	90.4	Very high	91.4	Very high	52 Å²	52	59.9 Å²	59.9	34%	0.338	30%	0.301	S	S	.	.			trans	-59.5	152.3	175.7	-21.9	33.4	0	0	0	112.3	K298 E302 D303	K298-P300 VanDerWaalsContact O-CD 3.26Å; K298-P300 WeakPolarHBondContact O-CD 3.18Å; P300-E302 VanDerWaalsContact C-N 3.29Å; P300-E302 PolarHBondContact O-N 3.43Å; P300-D303 VanDerWaalsContact CD-OD2 3.27Å; P300-D303 WeakPolarHBondContact CD-OD2 3.41Å; P300-D303 WeakPolarHBondContact CG-OD2 3.12Å; P300-D303 PolarHBondContact O-N 3.18Å
301	I	87.7	Confident	91.7	Very high	90 Å²	90	58.9 Å²	58.9	46%	0.462	30%	0.297	S	S	.	.	S	Bend	trans	-64.5	-38.5	176.9	-63.9	172.1	0	0	0	110.7	D303 M304 E305	I301-D303 PolarHBondContact O-N 2.84Å; I301-M304 HydrophobicContact CG1-CE 4.33Å; I301-M304 WeakPolarHBondContact O-CA 3.46Å; I301-M304 WeakPolarHBondContact O-CB 3.37Å; I301-M304 PolarHBondContact O-N 3.12Å; I301-E305 HydrophobicContact CG2-CG 4.37Å; I301-E305 PolarHBondContact O-N 3.1Å
302	E	91.2	Very high	92.1	Very high	152 Å²	152	55.7 Å²	55.7	71%	0.71	29%	0.287	S	S	*	.	G	3₁₀ helix	trans	-56.6	-34.8	178.8	-58	156.1	-122.3	0	0	112.6	P300 M304	P300-E302 VanDerWaalsContact C-N 3.29Å; P300-E302 PolarHBondContact O-N 3.43Å; E302-M304 PolarHBondContact O-N 2.8Å
303	D	92.4	Very high	92.2	Very high	42 Å²	42	52 Å²	52	23%	0.225	27%	0.272	C	S	.	.	G	3₁₀ helix	trans	-74.5	-10.7	177.4	-79.7	-36	0	0	0	112.7	P268 V269 Y290 L299 P300 I301	P268-D303 CarbonylContact C-O 3.55Å; P268-D303 VanDerWaalsContact CA-O 3.24Å; P268-D303 WeakPolarHBondContact CA-O 3.01Å; V269-D303 PolarHBondContact N-O 3.11Å; Y290-D303 HydrophobicContact CE1-CB 3.94Å; Y290-D303 PolarHBondContact OH-OD1 2.9Å; Y290-D303 VanDerWaalsContact OH-OD1 3.06Å; L299-D303 HydrophobicContact CD1-CB 4.05Å; L299-D303 HydrophobicContact CG-CB 4.35Å; P300-D303 VanDerWaalsContact CD-OD2 3.27Å; P300-D303 WeakPolarHBondContact CD-OD2 3.41Å; P300-D303 WeakPolarHBondContact CG-OD2 3.12Å; P300-D303 PolarHBondContact O-N 3.18Å; I301-D303 PolarHBondContact O-N 2.84Å
304	M	90.6	Very high	92.1	Very high	62 Å²	62	51.2 Å²	51.2	31%	0.305	27%	0.274	S	S	.	.	G	3₁₀ helix	trans	-107.4	-3.2	-178.3	-62.9	-172.9	-71.6	0	0	113.8	V266 V267 L299 I301 E302	V266-M304 HydrophobicContact CB-SD 4.01Å; V266-M304 HydrophobicContact CG1-SD 4.25Å; V267-M304 WeakPolarHBondContact O-CA 3.41Å; L299-M304 HydrophobicContact CD2-CG 3.56Å; L299-M304 HydrophobicContact CD2-SD 3.76Å; L299-M304 HydrophobicContact CG-CG 4.12Å; L299-M304 HydrophobicContact CG-SD 4.42Å; I301-M304 HydrophobicContact CG1-CE 4.33Å; I301-M304 WeakPolarHBondContact O-CA 3.46Å; I301-M304 WeakPolarHBondContact O-CB 3.37Å; I301-M304 PolarHBondContact O-N 3.12Å; E302-M304 PolarHBondContact O-N 2.8Å
305	E	90	Very high	92	Very high	121 Å²	121	52 Å²	52	57%	0.565	28%	0.282	S	S	*	.	S	Bend	trans	-101.8	153.8	-174.8	-71.8	-174.2	169	0	0	112.9	R271 I301 G307	R271-E305 VanDerWaalsContact CZ-O 3.27Å; R271-E305 PolarHBondContact NH1-O 3.16Å; R271-E305 PolarHBondContact NH2-O 3.12Å; I301-E305 HydrophobicContact CG2-CG 4.37Å; I301-E305 PolarHBondContact O-N 3.1Å; E305-G307 PolarHBondContact O-N 2.56Å
306	G	91.3	Very high	91.8	Very high	53 Å²	53	51.3 Å²	51.3	55%	0.546	29%	0.287	S	S	.	.			trans	75.4	12.5	165.3	0	0	0	0	0	117.4	R271	R271-G306 PolarHBondContact NH1-O 2.93Å
307	G	95.5	Very high	91.6	Very high	6 Å²	6	55.5 Å²	55.5	6%	0.062	30%	0.303	C	S	.	.			trans	-61.9	144.7	172	0	0	0	0	0	112.2	E305 Q330	E305-G307 PolarHBondContact O-N 2.56Å; G307-Q330 VanDerWaalsContact O-CG 3.3Å; G307-Q330 WeakPolarHBondContact O-CG 3.47Å; G307-Q330 PolarHBondContact O-NE2 3.38Å
308	T	97.4	Very high	91.6	Very high	2 Å²	2	55.8 Å²	55.8	1%	0.012	32%	0.318	C	S	.	.	S	Bend	trans	-94.4	-26.1	178.8	66.8	0	0	0	0	113.4	N239 F252 D254 Q330	N239-T308 WeakPolarHBondContact OD1-CB 3.33Å; N239-T308 PolarHBondContact OD1-OG1 3.17Å; F252-T308 HydrophobicContact CD2-CG2 3.84Å; F252-T308 HydrophobicContact CE2-CG2 3.35Å; F252-T308 HydrophobicContact CZ-CG2 4.09Å; D254-T308 HydrophobicContact CB-CG2 4.14Å; D254-T308 PolarHBondContact N-OG1 3.24Å; D254-T308 VanDerWaalsContact N-OG1 3.08Å; D254-T308 PolarHBondContact O-N 2.83Å; D254-T308 PolarHBondContact O-OG1 2.85Å; T308-Q330 WeakPolarHBondContact O-CG 3.43Å
309	F	98.1	Very high	91.6	Very high	0 Å²	0	50.6 Å²	50.6	0%	0	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.4	146.8	179.4	-173.1	-99.2	0	0	0	110.6	A228 L232 V238 D254 I255 S256 I311 Q330 A332 L334 L360 F375	A228-F309 HydrophobicContact CB-CE1 4.27Å; L232-F309 HydrophobicContact CD1-CB 3.97Å; L232-F309 HydrophobicContact CD1-CD1 4.26Å; L232-F309 HydrophobicContact CD1-CD2 4.49Å; L232-F309 HydrophobicContact CD1-CG 4Å; L232-F309 HydrophobicContact CD2-CD2 3.98Å; L232-F309 HydrophobicContact CD2-CE2 4.35Å; L232-F309 HydrophobicContact CD2-CG 4.32Å; V238-F309 HydrophobicContact CG1-CD2 4.39Å; V238-F309 HydrophobicContact CG1-CE2 3.94Å; D254-F309 PolarHBondContact O-N 3.24Å; D254-F309 VanDerWaalsContact O-N 3.14Å; I255-F309 CarbonylContact C-O 3.53Å; I255-F309 WeakPolarHBondContact CA-O 3.49Å; S256-F309 WeakPolarHBondContact CB-O 3.35Å; S256-F309 PolarHBondContact N-O 2.85Å; F309-I311 HydrophobicContact CD1-CG1 4.24Å; F309-I311 HydrophobicContact CE1-CG1 4.02Å; F309-Q330 VanDerWaalsContact C-OE1 3.22Å; F309-A332 HydrophobicContact CD2-CB 4.1Å; F309-A332 HydrophobicContact CE2-CB 3.67Å; F309-L334 HydrophobicContact CE1-CB 3.69Å; F309-L334 HydrophobicContact CZ-CB 3.73Å; F309-L360 HydrophobicContact CE2-CD1 4.05Å; F309-L360 HydrophobicContact CZ-CD1 3.99Å; F309-F375 HydrophobicContact CE1-CZ 4.35Å; F309-F375 HydrophobicContact CE2-CE1 4.21Å; F309-F375 AromaticContact CE2-CZ 3.97Å; F309-F375 HydrophobicContact CE2-CZ 3.97Å; F309-F375 AromaticContact CZ-CE1 3.81Å; F309-F375 HydrophobicContact CZ-CE1 3.81Å; F309-F375 AromaticContact CZ-CZ 3.68Å; F309-F375 HydrophobicContact CZ-CZ 3.68Å
310	T	97.8	Very high	91.6	Very high	4 Å²	4	54 Å²	54	3%	0.025	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	139.1	178.8	-62.2	0	0	0	0	112.2	S256 V267 Q330 I333 L334	S256-T310 VanDerWaalsContact CB-OG1 3.24Å; S256-T310 WeakPolarHBondContact CB-OG1 3.39Å; S256-T310 CarbonylContact O-C 3.55Å; S256-T310 VanDerWaalsContact O-CA 3.31Å; S256-T310 WeakPolarHBondContact O-CA 3.31Å; V267-T310 HydrophobicContact CG1-CG2 4.49Å; T310-Q330 PolarHBondContact OG1-NE2 2.76Å; T310-Q330 PolarHBondContact OG1-OE1 3.11Å; T310-I333 HydrophobicContact CG2-CD1 3.44Å; T310-I333 VanDerWaalsContact CG2-CD1 3.44Å; T310-I333 HydrophobicContact CG2-CG1 3.86Å; T310-I333 CarbonylContact O-C 3.59Å; T310-I333 WeakPolarHBondContact O-CA 3.26Å; T310-L334 PolarHBondContact O-N 3.48Å
311	I	97.2	Very high	91.5	Very high	0 Å²	0	56.8 Å²	56.8	0%	0	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	122.8	164.5	-56.3	177.2	0	0	0	108.8	M221 V225 A228 I255 S256 A258 F309 L334 I336	M221-I311 HydrophobicContact CE-CB 4.47Å; M221-I311 HydrophobicContact CE-CG2 3.76Å; V225-I311 HydrophobicContact CB-CD1 4.47Å; V225-I311 HydrophobicContact CG2-CD1 4.05Å; A228-I311 HydrophobicContact CB-CD1 3.96Å; I255-I311 HydrophobicContact CG2-CD1 3.77Å; I255-I311 HydrophobicContact CG2-CG1 3.89Å; S256-I311 PolarHBondContact O-N 3.09Å; A258-I311 PolarHBondContact N-O 2.94Å; F309-I311 HydrophobicContact CD1-CG1 4.24Å; F309-I311 HydrophobicContact CE1-CG1 4.02Å; I311-L334 CarbonylContact C-O 3.52Å; I311-L334 WeakPolarHBondContact CA-O 3.33Å; I311-L334 HydrophobicContact CD1-CD2 4.28Å; I311-L334 HydrophobicContact CG1-CB 4.24Å; I311-L334 HydrophobicContact CG1-CD2 4.12Å; I311-L334 HydrophobicContact CG2-CD2 4.23Å; I311-I336 HydrophobicContact CG2-CD1 4.29Å
312	S	95.4	Very high	91.7	Very high	32 Å²	32	53.7 Å²	53.7	22%	0.224	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	128	175.6	-176.5	0	0	0	0	110.7	L334 G335 I336	S312-L334 PolarHBondContact N-O 2.86Å; S312-G335 WeakPolarHBondContact O-CA 3.44Å; S312-I336 PolarHBondContact O-N 3.25Å
313	N	92.5	Very high	91.9	Very high	38 Å²	38	50.9 Å²	50.9	20%	0.203	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	93	-178.6	-173.8	-10.3	0	0	0	111	M221 G315 V316 I336	M221-N313 HydrophobicContact SD-CB 4Å; M221-N313 PolarHBondContact SD-ND2 3.34Å; N313-G315 VanDerWaalsContact C-N 3.29Å; N313-G315 WeakPolarHBondContact OD1-CA 3.06Å; N313-G315 PolarHBondContact OD1-N 2.8Å; N313-V316 WeakPolarHBondContact O-CG2 3.2Å; N313-V316 PolarHBondContact OD1-N 2.83Å; N313-I336 HydrophobicContact CB-CD1 3.91Å; N313-I336 HydrophobicContact CB-CG1 3.71Å
314	G	89.6	Confident	92	Very high	19 Å²	19	49.9 Å²	49.9	20%	0.196	31%	0.305	C	S	.	.			trans	-78.8	-14.1	171.5	0	0	0	0	0	113.2	V316 F317 S319 I336	G314-V316 VanDerWaalsContact C-N 3.28Å; G314-V316 PolarHBondContact O-N 3.04Å; G314-F317 PolarHBondContact O-N 3.34Å; G314-F317 VanDerWaalsContact O-N 3.11Å; G314-S319 WeakPolarHBondContact O-CB 3.07Å; G314-S319 PolarHBondContact O-N 3.39Å; G314-I336 PolarHBondContact N-O 3.41Å
315	G	87.2	Confident	92.3	Very high	18 Å²	18	49.7 Å²	49.7	19%	0.186	31%	0.305	C	S	.	.	G	3₁₀ helix	trans	-65	-28	-177.3	0	0	0	0	0	114.3	N313 F317 G318 I336 A338	N313-G315 VanDerWaalsContact C-N 3.29Å; N313-G315 WeakPolarHBondContact OD1-CA 3.06Å; N313-G315 PolarHBondContact OD1-N 2.8Å; G315-F317 PolarHBondContact O-N 3.33Å; G315-F317 VanDerWaalsContact O-N 3.17Å; G315-G318 PolarHBondContact O-N 3.16Å; G315-I336 PolarHBondContact N-O 2.88Å; G315-A338 VanDerWaalsContact CA-N 3.26Å
316	V	85.5	Confident	92.6	Very high	101 Å²	101	44 Å²	44	61%	0.612	28%	0.278	S	S	*	.	G	3₁₀ helix	trans	-62.6	-20.3	174.4	-58.8	0	0	0	0	113.1	N313 G314	N313-V316 WeakPolarHBondContact O-CG2 3.2Å; N313-V316 PolarHBondContact OD1-N 2.83Å; G314-V316 VanDerWaalsContact C-N 3.28Å; G314-V316 PolarHBondContact O-N 3.04Å
317	F	86.2	Confident	92.6	Very high	154 Å²	154	43.1 Å²	43.1	68%	0.675	26%	0.26	S	S	*	.	G	3₁₀ helix	trans	-103.7	7.8	176.9	-57.3	-68.8	0	0	0	113.1	A260 G314 G315 S319	A260-F317 HydrophobicContact CB-CZ 3.81Å; G314-F317 PolarHBondContact O-N 3.34Å; G314-F317 VanDerWaalsContact O-N 3.11Å; G315-F317 PolarHBondContact O-N 3.33Å; G315-F317 VanDerWaalsContact O-N 3.17Å; F317-S319 VanDerWaalsContact C-N 3.35Å
318	G	87.5	Confident	92.5	Very high	56 Å²	56	44.5 Å²	44.5	58%	0.577	27%	0.268	S	S	*	.	T	Hydrogen-bonded Turn	trans	76.9	16.9	-179.2	0	0	0	0	0	114.5	G315 L320	G315-G318 PolarHBondContact O-N 3.16Å; G318-L320 PolarHBondContact O-N 3.44Å
319	S	90.6	Very high	92.3	Very high	40 Å²	40	48.4 Å²	48.4	28%	0.28	29%	0.294	S	S	.	.			trans	-62.5	133.7	176	-177.6	0	0	0	0	110.9	G314 F317 F321 H337 A338	G314-S319 WeakPolarHBondContact O-CB 3.07Å; G314-S319 PolarHBondContact O-N 3.39Å; F317-S319 VanDerWaalsContact C-N 3.35Å; S319-F321 PolarHBondContact OG-O 3.1Å; S319-H337 WeakPolarHBondContact O-CB 3.5Å; S319-A338 VanDerWaalsContact O-CB 3.31Å; S319-A338 WeakPolarHBondContact O-CB 2.69Å; S319-A338 PolarHBondContact O-N 3.47Å
320	L	89.6	Confident	92.2	Very high	93 Å²	93	48.5 Å²	48.5	49%	0.487	29%	0.294	S	S	.	.			trans	-73.4	-55.9	175.8	-176.9	70.6	0	0	0	110.8	G318 H337 Y357	G318-L320 PolarHBondContact O-N 3.44Å; L320-H337 WeakPolarHBondContact O-CB 3.28Å; L320-Y357 HydrophobicContact CD1-CD2 4.07Å; L320-Y357 HydrophobicContact CD1-CE2 3.82Å; L320-Y357 HydrophobicContact CG-CD2 4.16Å; L320-Y357 HydrophobicContact CG-CE2 4.08Å; L320-Y357 WeakPolarHBondContact O-CD2 3.28Å
321	F	88.8	Confident	92.2	Very high	110 Å²	110	48.4 Å²	48.4	48%	0.482	29%	0.294	S	S	.	.			trans	-159.2	166.5	169.1	65.3	-92.9	0	0	0	109.3	F191 S319 H337 Y357	F191-F321 HydrophobicContact CD1-CD2 4.48Å; F191-F321 HydrophobicContact CE1-CB 4.35Å; F191-F321 AromaticContact CE1-CD2 3.87Å; F191-F321 HydrophobicContact CE1-CD2 3.87Å; F191-F321 HydrophobicContact CE1-CG 4.47Å; F191-F321 HydrophobicContact CZ-CD2 4.35Å; S319-F321 PolarHBondContact OG-O 3.1Å; F321-H337 WeakPolarHBondContact CA-CD2 3.08Å; F321-H337 WeakPolarHBondContact CA-NE2 3.04Å; F321-Y357 HydrophobicContact CB-CG 4.41Å; F321-Y357 HydrophobicContact CD1-CD2 4.42Å
322	G	91	Very high	92.2	Very high	25 Å²	25	48.4 Å²	48.4	26%	0.258	29%	0.294	S	S	.	.			trans	-166.9	173.6	176.3	0	0	0	0	0	111.1	P324 H337 C359	G322-P324 WeakPolarHBondContact O-CD 3.35Å; G322-H337 PolarHBondContact N-CE1 2.97Å; G322-H337 PolarHBondContact N-NE2 3.3Å; G322-C359 PolarHBondContact O-SG 3.12Å
323	T	95.5	Very high	92.4	Very high	92 Å²	92	47.3 Å²	47.3	56%	0.564	29%	0.285	S	S	*	.			trans	-112.4	91.9	-179.9	53.9	0	0	0	0	109	T189 F191	T189-T323 HydrophobicContact CG2-CG2 3.98Å; F191-T323 HydrophobicContact CZ-CG2 3.75Å
324	P	95.3	Very high	92.7	Very high	22 Å²	22	45.5 Å²	45.5	14%	0.143	28%	0.276	C	S	.	.	P	Polyproline II helix	trans	-63	146.4	-179.6	26	-33.5	0	0	0	111	G322 I333 C359 T361	G322-P324 WeakPolarHBondContact O-CD 3.35Å; P324-I333 HydrophobicContact CB-CD1 3.9Å; P324-I333 HydrophobicContact CB-CG1 4Å; P324-I333 HydrophobicContact CB-CG2 4.02Å; P324-I333 HydrophobicContact CG-CG1 4.13Å; P324-I333 HydrophobicContact CG-CG2 3.89Å; P324-C359 WeakPolarHBondContact CD-SG 3.46Å; P324-T361 VanDerWaalsContact O-CB 3.25Å; P324-T361 WeakPolarHBondContact O-CB 3.32Å; P324-T361 WeakPolarHBondContact O-CG2 3.44Å; P324-T361 PolarHBondContact O-OG1 3.3Å
325	I	95.4	Very high	93	Very high	58 Å²	58	44.7 Å²	44.7	30%	0.297	27%	0.267	S	S	.	.	P	Polyproline II helix	trans	-83.9	129.6	174.9	-63	167.5	0	0	0	108.7	L178 S181 M187 N327 I333	L178-I325 HydrophobicContact CD2-CB 4.24Å; L178-I325 HydrophobicContact CD2-CD1 4.06Å; L178-I325 HydrophobicContact CD2-CG2 4.09Å; S181-I325 WeakPolarHBondContact OG-CG2 3.48Å; M187-I325 HydrophobicContact CE-CG2 4.13Å; M187-I325 HydrophobicContact SD-CG2 4.47Å; I325-N327 PolarHBondContact O-N 3.48Å; I325-I333 WeakPolarHBondContact O-CD1 3.45Å
326	I	96.4	Very high	93.5	Very high	2 Å²	2	44 Å²	44	1%	0.01	26%	0.259	C	S	.	.	P	Polyproline II helix	trans	-54.6	135	176.2	-65.7	163.6	0	0	0	109	S181 Y185 M187 P328 Q330 I333 T361 D363	S181-I326 PolarHBondContact OG-O 2.93Å; Y185-I326 HydrophobicContact CD2-CB 4.08Å; Y185-I326 HydrophobicContact CD2-CD1 4.28Å; Y185-I326 HydrophobicContact CD2-CG2 4.13Å; Y185-I326 HydrophobicContact CE2-CB 4.14Å; Y185-I326 HydrophobicContact CE2-CG2 3.76Å; Y185-I326 HydrophobicContact CG-CD1 4.22Å; M187-I326 HydrophobicContact CE-CB 3.63Å; M187-I326 HydrophobicContact CE-CD1 3.55Å; M187-I326 HydrophobicContact CE-CG1 3.38Å; M187-I326 HydrophobicContact CG-CD1 4.35Å; I326-P328 VanDerWaalsContact O-CD 3.25Å; I326-P328 WeakPolarHBondContact O-CD 3.42Å; I326-Q330 HydrophobicContact CG2-CB 4.45Å; I326-Q330 WeakPolarHBondContact CG2-O 3.44Å; I326-I333 HydrophobicContact CB-CG2 4.44Å; I326-I333 HydrophobicContact CG1-CG2 3.91Å; I326-T361 HydrophobicContact CD1-CG2 4.34Å; I326-T361 HydrophobicContact CG1-CG2 4.16Å; I326-D363 HydrophobicContact CD1-CB 4.31Å
327	N	92.6	Very high	94	Very high	33 Å²	33	39.6 Å²	39.6	18%	0.176	23%	0.232	C	C	.	.			trans	-86.8	104.6	175.6	-177.1	21	0	0	0	109.3	R177 I325 Q330	R177-N327 PolarHBondContact NH2-OD1 2.98Å; I325-N327 PolarHBondContact O-N 3.48Å; N327-Q330 VanDerWaalsContact O-CB 3.24Å; N327-Q330 WeakPolarHBondContact O-CB 3.42Å; N327-Q330 VanDerWaalsContact O-CG 3.31Å; N327-Q330 WeakPolarHBondContact O-CG 3.43Å; N327-Q330 PolarHBondContact O-N 2.81Å
328	P	92.6	Very high	94.5	Very high	35 Å²	35	33.1 Å²	33.1	23%	0.227	21%	0.207	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.7	144.5	-179.1	-15.3	27.1	0	0	0	111.3	R177 Y185 I326	R177-P328 PolarHBondContact NH2-O 2.9Å; Y185-P328 HydrophobicContact CE2-CB 4.24Å; Y185-P328 HydrophobicContact CE2-CG 4Å; Y185-P328 WeakPolarHBondContact OH-CA 3.47Å; Y185-P328 WeakPolarHBondContact OH-CB 3.45Å; I326-P328 VanDerWaalsContact O-CD 3.25Å; I326-P328 WeakPolarHBondContact O-CD 3.42Å
329	P	93.5	Very high	94.9	Very high	84 Å²	84	33.2 Å²	33.2	55%	0.545	19%	0.194	S	C	.	.	T	Hydrogen-bonded Turn	cis	-93.5	17	8.5	37.6	-37	0	0	0	114.5	Y185 V241	Y185-P329 WeakPolarHBondContact OH-CA 3.39Å; V241-P329 WeakPolarHBondContact CG1-O 3.28Å
330	Q	96.4	Very high	95.1	Very high	3 Å²	3	34.3 Å²	34.3	1%	0.014	20%	0.198	C	C	.	.			trans	-67	166.2	-177.1	-54.8	172.4	-0.3	0	0	111.8	Y185 S256 G307 T308 F309 T310 I326 N327	Y185-Q330 PolarHBondContact OH-O 2.94Å; Y185-Q330 VanDerWaalsContact OH-O 3.09Å; S256-Q330 PolarHBondContact OG-NE2 2.86Å; G307-Q330 VanDerWaalsContact O-CG 3.3Å; G307-Q330 WeakPolarHBondContact O-CG 3.47Å; G307-Q330 PolarHBondContact O-NE2 3.38Å; T308-Q330 WeakPolarHBondContact O-CG 3.43Å; F309-Q330 VanDerWaalsContact C-OE1 3.22Å; T310-Q330 PolarHBondContact OG1-NE2 2.76Å; T310-Q330 PolarHBondContact OG1-OE1 3.11Å; I326-Q330 HydrophobicContact CG2-CB 4.45Å; I326-Q330 WeakPolarHBondContact CG2-O 3.44Å; N327-Q330 VanDerWaalsContact O-CB 3.24Å; N327-Q330 WeakPolarHBondContact O-CB 3.42Å; N327-Q330 VanDerWaalsContact O-CG 3.31Å; N327-Q330 WeakPolarHBondContact O-CG 3.43Å; N327-Q330 PolarHBondContact O-N 2.81Å
331	S	97.5	Very high	95.5	Very high	2 Å²	2	35.3 Å²	35.3	1%	0.014	20%	0.204	C	C	.	.	S	Bend	trans	-105.8	-10.1	179.8	-57	0	0	0	0	114.1	A240 V241 Y362 D363 L366	A240-S331 VanDerWaalsContact O-CB 3.22Å; A240-S331 WeakPolarHBondContact O-CB 3.08Å; A240-S331 PolarHBondContact O-OG 3.29Å; V241-S331 WeakPolarHBondContact CA-OG 3.35Å; S331-Y362 CarbonylContact O-C 3.58Å; S331-Y362 VanDerWaalsContact O-CA 3.3Å; S331-Y362 WeakPolarHBondContact O-CA 3.18Å; S331-D363 PolarHBondContact O-N 3.02Å; S331-L366 VanDerWaalsContact OG-CD2 3.24Å; S331-L366 WeakPolarHBondContact OG-CD2 3.36Å
332	A	98.2	Very high	95.8	Very high	0 Å²	0	32 Å²	32	0%	0	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-154.5	155.1	-176.5	0	0	0	0	0	113.1	V238 F309 L360 T361 I367	V238-A332 HydrophobicContact CG1-CB 3.89Å; F309-A332 HydrophobicContact CD2-CB 4.1Å; F309-A332 HydrophobicContact CE2-CB 3.67Å; A332-L360 HydrophobicContact CB-CD1 4.04Å; A332-T361 CarbonylContact C-O 3.51Å; A332-T361 VanDerWaalsContact CA-O 3.25Å; A332-T361 WeakPolarHBondContact CA-O 3.48Å; A332-I367 HydrophobicContact CB-CD1 4.04Å
333	I	98.2	Very high	96.1	Very high	8 Å²	8	35.3 Å²	35.3	4%	0.041	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.1	128.6	176.6	-179.8	160.7	0	0	0	110.3	T310 P324 I325 I326 T361	T310-I333 HydrophobicContact CG2-CD1 3.44Å; T310-I333 VanDerWaalsContact CG2-CD1 3.44Å; T310-I333 HydrophobicContact CG2-CG1 3.86Å; T310-I333 CarbonylContact O-C 3.59Å; T310-I333 WeakPolarHBondContact O-CA 3.26Å; P324-I333 HydrophobicContact CB-CD1 3.9Å; P324-I333 HydrophobicContact CB-CG1 4Å; P324-I333 HydrophobicContact CB-CG2 4.02Å; P324-I333 HydrophobicContact CG-CG1 4.13Å; P324-I333 HydrophobicContact CG-CG2 3.89Å; I325-I333 WeakPolarHBondContact O-CD1 3.45Å; I326-I333 HydrophobicContact CB-CG2 4.44Å; I326-I333 HydrophobicContact CG1-CG2 3.91Å; I333-T361 PolarHBondContact N-O 2.89Å; I333-T361 PolarHBondContact O-N 2.86Å
334	L	98.4	Very high	96	Very high	0 Å²	0	32 Å²	32	0%	0	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.2	122.7	173.2	-178.1	73.4	0	0	0	109.6	F309 T310 I311 S312 I336 C359 L376 I379	F309-L334 HydrophobicContact CE1-CB 3.69Å; F309-L334 HydrophobicContact CZ-CB 3.73Å; T310-L334 PolarHBondContact O-N 3.48Å; I311-L334 CarbonylContact C-O 3.52Å; I311-L334 WeakPolarHBondContact CA-O 3.33Å; I311-L334 HydrophobicContact CD1-CD2 4.28Å; I311-L334 HydrophobicContact CG1-CB 4.24Å; I311-L334 HydrophobicContact CG1-CD2 4.12Å; I311-L334 HydrophobicContact CG2-CD2 4.23Å; S312-L334 PolarHBondContact N-O 2.86Å; L334-I336 HydrophobicContact CD2-CG2 4.03Å; L334-I336 HydrophobicContact CG-CG2 4.09Å; L334-C359 CarbonylContact C-O 3.6Å; L334-C359 WeakPolarHBondContact CA-O 3.04Å; L334-C359 WeakPolarHBondContact CD1-O 3.15Å; L334-L376 HydrophobicContact CD1-CD1 3.78Å; L334-I379 HydrophobicContact CD1-CD1 3.92Å; L334-I379 HydrophobicContact CD2-CD1 4.03Å
335	G	97.6	Very high	96	Very high	2 Å²	2	35.4 Å²	35.4	2%	0.021	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.4	125	168.4	0	0	0	0	0	111.2	S312 I358 C359	S312-G335 WeakPolarHBondContact O-CA 3.44Å; G335-I358 CarbonylContact O-C 3.56Å; G335-I358 WeakPolarHBondContact O-CA 3.32Å; G335-C359 VanDerWaalsContact CA-SG 3.55Å; G335-C359 PolarHBondContact N-O 3.45Å; G335-C359 PolarHBondContact O-N 2.96Å
336	I	97.1	Very high	95.8	Very high	3 Å²	3	33.9 Å²	33.9	2%	0.015	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	142.5	172.1	67.5	176.1	0	0	0	110.5	M221 F224 I311 S312 N313 G314 G315 L334 M356 I358	M221-I336 HydrophobicContact CE-CD1 4.04Å; M221-I336 HydrophobicContact SD-CD1 3.53Å; M221-I336 VanDerWaalsContact SD-CD1 3.53Å; F224-I336 HydrophobicContact CD1-CG2 3.83Å; F224-I336 HydrophobicContact CD2-CD1 4Å; F224-I336 HydrophobicContact CE1-CG2 4.02Å; F224-I336 HydrophobicContact CE2-CD1 4.44Å; F224-I336 HydrophobicContact CG-CD1 4.24Å; F224-I336 HydrophobicContact CG-CG2 4.18Å; I311-I336 HydrophobicContact CG2-CD1 4.29Å; S312-I336 PolarHBondContact O-N 3.25Å; N313-I336 HydrophobicContact CB-CD1 3.91Å; N313-I336 HydrophobicContact CB-CG1 3.71Å; G314-I336 PolarHBondContact N-O 3.41Å; G315-I336 PolarHBondContact N-O 2.88Å; L334-I336 HydrophobicContact CD2-CG2 4.03Å; L334-I336 HydrophobicContact CG-CG2 4.09Å; I336-M356 HydrophobicContact CB-SD 3.97Å; I336-I358 HydrophobicContact CG2-CG2 4.08Å
337	H	96.5	Very high	95.6	Very high	10 Å²	10	41.5 Å²	41.5	5%	0.046	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	-171.2	-166.9	-60.4	97.7	0	0	0	112.6	S319 L320 F321 G322 M356 Y357	S319-H337 WeakPolarHBondContact O-CB 3.5Å; L320-H337 WeakPolarHBondContact O-CB 3.28Å; F321-H337 WeakPolarHBondContact CA-CD2 3.08Å; F321-H337 WeakPolarHBondContact CA-NE2 3.04Å; G322-H337 PolarHBondContact N-CE1 2.97Å; G322-H337 PolarHBondContact N-NE2 3.3Å; H337-M356 VanDerWaalsContact O-CE 3.31Å; H337-M356 WeakPolarHBondContact O-CE 3.46Å; H337-Y357 WeakPolarHBondContact CB-O 2.84Å; H337-Y357 PolarHBondContact N-O 3.36Å; H337-Y357 PolarHBondContact ND1-O 2.74Å
338	A	96.1	Very high	95.6	Very high	17 Å²	17	43.9 Å²	43.9	14%	0.14	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.3	142.8	-175.4	0	0	0	0	0	111.4	G315 S319 V340	G315-A338 VanDerWaalsContact CA-N 3.26Å; S319-A338 VanDerWaalsContact O-CB 3.31Å; S319-A338 WeakPolarHBondContact O-CB 2.69Å; S319-A338 PolarHBondContact O-N 3.47Å; A338-V340 HydrophobicContact CB-CG2 4.14Å
339	I	96.1	Very high	95.8	Very high	59 Å²	59	49 Å²	49	30%	0.303	30%	0.304	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.2	120.6	167.3	-55.5	177.1	0	0	0	107.1	M196 V200 F220 P354 M355 M356	M196-I339 HydrophobicContact CB-CG2 4.36Å; M196-I339 HydrophobicContact CE-CD1 4.18Å; M196-I339 HydrophobicContact CG-CD1 4.35Å; M196-I339 HydrophobicContact CG-CG1 4.27Å; M196-I339 HydrophobicContact CG-CG2 4.44Å; V200-I339 HydrophobicContact CG2-CD1 4.48Å; F220-I339 HydrophobicContact CD1-CD1 4.45Å; F220-I339 HydrophobicContact CD2-CD1 4.37Å; F220-I339 HydrophobicContact CE1-CD1 4.34Å; F220-I339 HydrophobicContact CE2-CD1 4.24Å; F220-I339 HydrophobicContact CG-CD1 4.46Å; F220-I339 HydrophobicContact CZ-CD1 4.22Å; I339-P354 HydrophobicContact CG2-CB 3.58Å; I339-M355 WeakPolarHBondContact CA-O 3.25Å; I339-M356 HydrophobicContact CD1-CE 3.88Å; I339-M356 HydrophobicContact CG1-CE 3.34Å
340	V	95.2	Very high	95.9	Very high	63 Å²	63	51.9 Å²	51.9	38%	0.382	31%	0.313	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	133.3	-178.6	-176.2	0	0	0	0	109.1	A338 K342 M355	A338-V340 HydrophobicContact CB-CG2 4.14Å; V340-K342 HydrophobicContact CG1-CG 4.41Å; V340-K342 PolarHBondContact O-N 3.24Å; V340-M355 PolarHBondContact N-O 3.24Å; V340-M355 PolarHBondContact O-N 3.04Å
341	D	96.8	Very high	95.9	Very high	114 Å²	114	55.3 Å²	55.3	61%	0.61	33%	0.329	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-66.4	122.6	172.8	-73.1	-18.2	0	0	0	109.8	I352 R353	D341-I352 HydrophobicContact CB-CG2 3.76Å; D341-R353 WeakPolarHBondContact CA-O 3.48Å
342	K	95.7	Very high	95.9	Very high	39 Å²	39	60.5 Å²	60.5	17%	0.17	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.3	150.9	179.3	-62.2	-174.9	-166.2	166.9	0	111.5	E193 V340 A344 I352 R353 M355 Y357	E193-K342 IonicContact OE1-NZ 3.03Å; E193-K342 PolarHBondContact OE1-NZ 3.02Å; V340-K342 HydrophobicContact CG1-CG 4.41Å; V340-K342 PolarHBondContact O-N 3.24Å; K342-A344 PolarHBondContact O-N 3.42Å; K342-I352 WeakPolarHBondContact O-CA 3.24Å; K342-R353 PolarHBondContact N-O 2.98Å; K342-R353 PolarHBondContact O-N 3.07Å; K342-M355 HydrophobicContact CB-CB 4.45Å; K342-M355 HydrophobicContact CB-CG 3.93Å; K342-M355 HydrophobicContact CD-CB 4.09Å; K342-M355 HydrophobicContact CD-CG 4.32Å; K342-M355 HydrophobicContact CG-CB 4.37Å; K342-M355 HydrophobicContact CG-CG 4.39Å; K342-Y357 PolarHBondContact NZ-OH 3.15Å
343	P	97	Very high	95.9	Very high	95 Å²	95	63.3 Å²	63.3	62%	0.617	37%	0.366	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-62.1	122.7	164.7	-16.1	29.6	0	0	0	110.3	I350 E351 I352	P343-I350 HydrophobicContact CB-CG2 3.75Å; P343-E351 CarbonylContact C-O 3.58Å; P343-E351 WeakPolarHBondContact CA-O 3.45Å; P343-I352 HydrophobicContact CB-CD1 4.17Å; P343-I352 HydrophobicContact CG-CD1 3.86Å
344	A	94.3	Very high	95.8	Very high	22 Å²	22	63.9 Å²	63.9	18%	0.182	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	144.1	176	0	0	0	0	0	109.9	K342 V346 E351 R353 M355	K342-A344 PolarHBondContact O-N 3.42Å; A344-V346 PolarHBondContact O-N 3.44Å; A344-E351 PolarHBondContact N-O 3.43Å; A344-E351 PolarHBondContact O-N 2.93Å; A344-R353 HydrophobicContact CB-CB 4.14Å; A344-R353 HydrophobicContact CB-CG 3.88Å; A344-M355 HydrophobicContact CB-SD 4.19Å
345	A	94.4	Very high	95.8	Very high	94 Å²	94	64.7 Å²	64.7	78%	0.777	37%	0.374	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-79.1	114.7	173.8	0	0	0	0	0	109.5	K349	A345-K349 CarbonylContact C-O 3.26Å; A345-K349 WeakPolarHBondContact CA-O 3.44Å
346	V	91.2	Very high	95.8	Very high	27 Å²	27	65 Å²	65	16%	0.164	38%	0.375	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	119.1	177.2	-175.9	0	0	0	0	107.4	A344 G348 K349 E351 R353	A344-V346 PolarHBondContact O-N 3.44Å; V346-G348 PolarHBondContact O-N 3.47Å; V346-G348 VanDerWaalsContact O-N 3.11Å; V346-K349 PolarHBondContact N-O 3.3Å; V346-K349 PolarHBondContact O-N 3Å; V346-E351 HydrophobicContact CB-CG 4.47Å; V346-E351 HydrophobicContact CG2-CB 4.41Å; V346-R353 HydrophobicContact CG2-CG 4.04Å
347	D	91.7	Very high	95.8	Very high	161 Å²	161	67.9 Å²	67.9	86%	0.861	39%	0.387	S	S	*	.	T	Hydrogen-bonded Turn	trans	48.6	41.7	179.6	-56.9	-37.1	0	0	0	114	K349	D347-K349 VanDerWaalsContact C-N 3.28Å; D347-K349 PolarHBondContact O-N 3.36Å
348	G	93.9	Very high	95.9	Very high	84 Å²	84	67.4 Å²	67.4	87%	0.866	39%	0.385	S	S	*	.	T	Hydrogen-bonded Turn	trans	77.2	3.6	179.7	0	0	0	0	0	115.4	V346	V346-G348 PolarHBondContact O-N 3.47Å; V346-G348 VanDerWaalsContact O-N 3.11Å
349	K	95.6	Very high	96	Very high	142 Å²	142	66.6 Å²	66.6	62%	0.617	38%	0.378	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-110.3	152.1	175.7	-61.9	176.6	-173.7	171	0	110.7	A345 V346 D347	A345-K349 CarbonylContact C-O 3.26Å; A345-K349 WeakPolarHBondContact CA-O 3.44Å; V346-K349 PolarHBondContact N-O 3.3Å; V346-K349 PolarHBondContact O-N 3Å; D347-K349 VanDerWaalsContact C-N 3.28Å; D347-K349 PolarHBondContact O-N 3.36Å
350	I	96.7	Very high	96.1	Very high	144 Å²	144	63.8 Å²	63.8	74%	0.738	36%	0.363	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-87.2	115.3	169.3	-59.8	176	0	0	0	107.6	P343	P343-I350 HydrophobicContact CB-CG2 3.75Å
351	E	96.4	Very high	96.2	Very high	76 Å²	76	61 Å²	61	36%	0.355	35%	0.346	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	148.9	173.1	-65.8	-171	-178.9	0	0	110.1	P343 A344 V346 R353	P343-E351 CarbonylContact C-O 3.58Å; P343-E351 WeakPolarHBondContact CA-O 3.45Å; A344-E351 PolarHBondContact N-O 3.43Å; A344-E351 PolarHBondContact O-N 2.93Å; V346-E351 HydrophobicContact CB-CG 4.47Å; V346-E351 HydrophobicContact CG2-CB 4.41Å; E351-R353 HydrophobicContact CB-CG 4.25Å; E351-R353 IonicContact OE2-NH1 2.68Å; E351-R353 PolarHBondContact OE2-NH1 3.36Å; E351-R353 VanDerWaalsContact OE2-NH1 3.16Å
352	I	97.4	Very high	96.3	Very high	110 Å²	110	55.8 Å²	55.8	56%	0.564	32%	0.318	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-81.3	119.9	169.3	-57.8	-57.9	0	0	0	108.3	D341 K342 P343	D341-I352 HydrophobicContact CB-CG2 3.76Å; K342-I352 WeakPolarHBondContact O-CA 3.24Å; P343-I352 HydrophobicContact CB-CD1 4.17Å; P343-I352 HydrophobicContact CG-CD1 3.86Å
353	R	97.4	Very high	96.4	Very high	60 Å²	60	54 Å²	54	23%	0.226	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	144.6	-176.8	-55.7	-69.9	-86.1	-157.1	-3.4	110.4	D195 S197 D341 K342 A344 V346 E351 M355	D195-R353 IonicContact OD1-NE 2.66Å; D195-R353 IonicContact OD2-CZ 2.75Å; D195-R353 VanDerWaalsContact OD2-CZ 3.31Å; D195-R353 IonicContact OD2-NE 3.17Å; D195-R353 PolarHBondContact OD2-NE 3.48Å; D195-R353 IonicContact OD2-NH2 3.36Å; D195-R353 PolarHBondContact OD2-NH2 2.87Å; S197-R353 PolarHBondContact OG-NE 3.27Å; S197-R353 VanDerWaalsContact OG-NE 3.12Å; D341-R353 WeakPolarHBondContact CA-O 3.48Å; K342-R353 PolarHBondContact N-O 2.98Å; K342-R353 PolarHBondContact O-N 3.07Å; A344-R353 HydrophobicContact CB-CB 4.14Å; A344-R353 HydrophobicContact CB-CG 3.88Å; V346-R353 HydrophobicContact CG2-CG 4.04Å; E351-R353 HydrophobicContact CB-CG 4.25Å; E351-R353 IonicContact OE2-NH1 2.68Å; E351-R353 PolarHBondContact OE2-NH1 3.36Å; E351-R353 VanDerWaalsContact OE2-NH1 3.16Å; R353-M355 HydrophobicContact CB-CG 4.43Å; R353-M355 HydrophobicContact CB-SD 3.69Å; R353-M355 PolarHBondContact O-N 2.89Å
354	P	97.4	Very high	96.4	Very high	20 Å²	20	53 Å²	53	13%	0.13	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.9	106.9	170.1	29.5	-34.1	0	0	0	109.2	M196 S197 V200 I339	M196-P354 HydrophobicContact CB-CB 4.29Å; M196-P354 HydrophobicContact CB-CG 4.33Å; M196-P354 VanDerWaalsContact CB-O 3.28Å; M196-P354 WeakPolarHBondContact CB-O 3.26Å; M196-P354 PolarHBondContact N-O 2.73Å; S197-P354 WeakPolarHBondContact OG-CD 3.35Å; V200-P354 HydrophobicContact CB-CG 4.48Å; V200-P354 HydrophobicContact CG2-CB 4.34Å; V200-P354 HydrophobicContact CG2-CG 4.23Å; I339-P354 HydrophobicContact CG2-CB 3.58Å
355	M	97.4	Very high	96.6	Very high	16 Å²	16	57.7 Å²	57.7	8%	0.079	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	146.9	-178	-55.7	-53.9	-66.7	0	0	111	E193 V194 D195 I339 V340 K342 A344 R353	E193-M355 HydrophobicContact CG-CB 4.25Å; E193-M355 HydrophobicContact CG-CE 3.7Å; V194-M355 WeakPolarHBondContact O-CA 2.93Å; D195-M355 HydrophobicContact CB-CE 4.17Å; D195-M355 HydrophobicContact CB-SD 4.13Å; I339-M355 WeakPolarHBondContact CA-O 3.25Å; V340-M355 PolarHBondContact N-O 3.24Å; V340-M355 PolarHBondContact O-N 3.04Å; K342-M355 HydrophobicContact CB-CB 4.45Å; K342-M355 HydrophobicContact CB-CG 3.93Å; K342-M355 HydrophobicContact CD-CB 4.09Å; K342-M355 HydrophobicContact CD-CG 4.32Å; K342-M355 HydrophobicContact CG-CB 4.37Å; K342-M355 HydrophobicContact CG-CG 4.39Å; A344-M355 HydrophobicContact CB-SD 4.19Å; R353-M355 HydrophobicContact CB-CG 4.43Å; R353-M355 HydrophobicContact CB-SD 3.69Å; R353-M355 PolarHBondContact O-N 2.89Å
356	M	97.4	Very high	96.7	Very high	8 Å²	8	53.9 Å²	53.9	4%	0.039	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	140.3	173.2	179.9	-174.7	-65.4	0	0	110.4	E193 V194 M196 F224 I336 H337 I339 I358	E193-M356 CarbonylContact C-O 3.27Å; E193-M356 WeakPolarHBondContact CA-O 3.39Å; V194-M356 PolarHBondContact N-O 2.93Å; V194-M356 PolarHBondContact O-N 3.36Å; M196-M356 HydrophobicContact CE-CE 4.11Å; M196-M356 HydrophobicContact CG-CB 3.71Å; M196-M356 HydrophobicContact CG-CE 4.45Å; M196-M356 HydrophobicContact SD-CB 4.09Å; M196-M356 HydrophobicContact SD-CE 4.18Å; M196-M356 HydrophobicContact SD-SD 4.39Å; F224-M356 HydrophobicContact CE1-SD 4.14Å; F224-M356 HydrophobicContact CE2-CE 3.91Å; F224-M356 HydrophobicContact CE2-SD 4Å; F224-M356 HydrophobicContact CZ-CE 3.86Å; F224-M356 HydrophobicContact CZ-SD 3.41Å; F224-M356 WeakPolarHBondContact CZ-SD 3.22Å; I336-M356 HydrophobicContact CB-SD 3.97Å; H337-M356 VanDerWaalsContact O-CE 3.31Å; H337-M356 WeakPolarHBondContact O-CE 3.46Å; I339-M356 HydrophobicContact CD1-CE 3.88Å; I339-M356 HydrophobicContact CG1-CE 3.34Å; M356-I358 HydrophobicContact CG-CG2 4.3Å; M356-I358 HydrophobicContact SD-CG2 3.98Å
357	Y	97.4	Very high	97	Very high	65 Å²	65	52.6 Å²	52.6	26%	0.255	27%	0.269	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.7	131.1	163.3	-66.9	-69.3	0	0	0	110.9	N192 E193 L320 F321 H337 K342	N192-Y357 WeakPolarHBondContact O-CA 3.24Å; E193-Y357 HydrophobicContact CB-CD1 4Å; E193-Y357 HydrophobicContact CB-CE1 3.88Å; E193-Y357 HydrophobicContact CG-CD1 4.21Å; E193-Y357 HydrophobicContact CG-CE1 3.97Å; L320-Y357 HydrophobicContact CD1-CD2 4.07Å; L320-Y357 HydrophobicContact CD1-CE2 3.82Å; L320-Y357 HydrophobicContact CG-CD2 4.16Å; L320-Y357 HydrophobicContact CG-CE2 4.08Å; L320-Y357 WeakPolarHBondContact O-CD2 3.28Å; F321-Y357 HydrophobicContact CB-CG 4.41Å; F321-Y357 HydrophobicContact CD1-CD2 4.42Å; H337-Y357 WeakPolarHBondContact CB-O 2.84Å; H337-Y357 PolarHBondContact N-O 3.36Å; H337-Y357 PolarHBondContact ND1-O 2.74Å; K342-Y357 PolarHBondContact NZ-OH 3.15Å
358	I	98	Very high	97.3	Very high	0 Å²	0	49.5 Å²	49.5	0%	0	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	151.2	167.8	65.2	171.9	0	0	0	109.4	F191 N192 V194 F224 G335 I336 M356 L376 I379	F191-I358 WeakPolarHBondContact CA-O 3.31Å; N192-I358 HydrophobicContact CB-CD1 4.5Å; N192-I358 HydrophobicContact CB-CG1 4.05Å; N192-I358 PolarHBondContact N-O 2.79Å; N192-I358 PolarHBondContact O-N 2.93Å; V194-I358 HydrophobicContact CG2-CB 4.42Å; V194-I358 HydrophobicContact CG2-CD1 3.56Å; V194-I358 HydrophobicContact CG2-CG1 3.63Å; V194-I358 HydrophobicContact CG2-CG2 4Å; F224-I358 HydrophobicContact CE1-CG2 4Å; G335-I358 CarbonylContact O-C 3.56Å; G335-I358 WeakPolarHBondContact O-CA 3.32Å; I336-I358 HydrophobicContact CG2-CG2 4.08Å; M356-I358 HydrophobicContact CG-CG2 4.3Å; M356-I358 HydrophobicContact SD-CG2 3.98Å; I358-L376 HydrophobicContact CB-CD1 4.35Å; I358-L376 HydrophobicContact CD1-CD1 3.48Å; I358-L376 VanDerWaalsContact CD1-CD1 3.48Å; I358-L376 HydrophobicContact CD1-CG 3.97Å; I358-L376 HydrophobicContact CG1-CD1 3.72Å; I358-L376 HydrophobicContact CG1-CD2 4.48Å; I358-L376 HydrophobicContact CG1-CG 4.15Å; I358-I379 HydrophobicContact CD1-CB 4.43Å; I358-I379 HydrophobicContact CD1-CG2 3.96Å
359	C	98	Very high	97.4	Very high	0 Å²	0	46.9 Å²	46.9	0%	0	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.9	151.7	177.4	71.6	0	0	0	0	111.1	T189 T190 F191 G322 P324 L334 G335	T189-C359 HydrophobicContact CG2-CB 3.78Å; T190-C359 CarbonylContact O-C 3.6Å; T190-C359 WeakPolarHBondContact O-CA 3.49Å; T190-C359 WeakPolarHBondContact O-CB 3.42Å; F191-C359 HydrophobicContact CD1-CB 3.39Å; F191-C359 HydrophobicContact CE1-CB 3.5Å; F191-C359 VanDerWaalsContact CE1-CB 3.5Å; F191-C359 HydrophobicContact CG-CB 4.16Å; F191-C359 HydrophobicContact CZ-CB 4.35Å; G322-C359 PolarHBondContact O-SG 3.12Å; P324-C359 WeakPolarHBondContact CD-SG 3.46Å; L334-C359 CarbonylContact C-O 3.6Å; L334-C359 WeakPolarHBondContact CA-O 3.04Å; L334-C359 WeakPolarHBondContact CD1-O 3.15Å; G335-C359 VanDerWaalsContact CA-SG 3.55Å; G335-C359 PolarHBondContact N-O 3.45Å; G335-C359 PolarHBondContact O-N 2.96Å
360	L	98.5	Very high	97.4	Very high	0 Å²	0	48.4 Å²	48.4	0%	0	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	116.1	169.8	-177.4	73.3	0	0	0	107.7	T189 T190 F309 A332 Y362 A372 F375 L376	T189-L360 VanDerWaalsContact CA-O 3.27Å; T189-L360 WeakPolarHBondContact CA-O 3.28Å; T190-L360 HydrophobicContact CG2-CB 4.13Å; T190-L360 PolarHBondContact N-O 3.37Å; T190-L360 PolarHBondContact O-N 2.92Å; F309-L360 HydrophobicContact CE2-CD1 4.05Å; F309-L360 HydrophobicContact CZ-CD1 3.99Å; A332-L360 HydrophobicContact CB-CD1 4.04Å; L360-Y362 HydrophobicContact CD2-CD1 4.08Å; L360-Y362 HydrophobicContact CG-CD1 4.14Å; L360-A372 HydrophobicContact CD2-CB 3.97Å; L360-F375 HydrophobicContact CD1-CD1 3.95Å; L360-F375 HydrophobicContact CD1-CE1 3.74Å; L360-F375 HydrophobicContact CD2-CD1 3.74Å; L360-F375 HydrophobicContact CD2-CE1 4.4Å; L360-F375 HydrophobicContact CD2-CG 4.45Å; L360-F375 HydrophobicContact CG-CD1 4.4Å; L360-L376 HydrophobicContact CB-CD1 4.2Å
361	T	98.4	Very high	97.5	Very high	3 Å²	3	42.9 Å²	42.9	2%	0.018	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.7	132.1	162.6	-53.8	0	0	0	0	108.3	M187 L188 T189 P324 I326 A332 I333	M187-T361 HydrophobicContact CB-CG2 4.12Å; M187-T361 HydrophobicContact CE-CG2 3.59Å; L188-T361 VanDerWaalsContact O-CA 3.31Å; L188-T361 WeakPolarHBondContact O-CA 3.42Å; T189-T361 PolarHBondContact OG1-OG1 3.42Å; P324-T361 VanDerWaalsContact O-CB 3.25Å; P324-T361 WeakPolarHBondContact O-CB 3.32Å; P324-T361 WeakPolarHBondContact O-CG2 3.44Å; P324-T361 PolarHBondContact O-OG1 3.3Å; I326-T361 HydrophobicContact CD1-CG2 4.34Å; I326-T361 HydrophobicContact CG1-CG2 4.16Å; A332-T361 CarbonylContact C-O 3.51Å; A332-T361 VanDerWaalsContact CA-O 3.25Å; A332-T361 WeakPolarHBondContact CA-O 3.48Å; I333-T361 PolarHBondContact N-O 2.89Å; I333-T361 PolarHBondContact O-N 2.86Å
362	Y	98.3	Very high	97.6	Very high	6 Å²	6	39.3 Å²	39.3	2%	0.024	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.3	155.6	-174.9	57	-84.9	0	0	0	112	M187 L188 T190 S331 L360 H364 I367 A372	M187-Y362 WeakPolarHBondContact CA-O 3.39Å; L188-Y362 HydrophobicContact CB-CE1 4.27Å; L188-Y362 HydrophobicContact CB-CE2 4.13Å; L188-Y362 WeakPolarHBondContact CD2-OH 3.43Å; L188-Y362 PolarHBondContact N-O 2.8Å; L188-Y362 VanDerWaalsContact N-O 3.09Å; L188-Y362 VanDerWaalsContact O-CD1 3.23Å; L188-Y362 WeakPolarHBondContact O-CD1 3.46Å; L188-Y362 WeakPolarHBondContact O-CE1 3.41Å; L188-Y362 PolarHBondContact O-N 2.96Å; T190-Y362 HydrophobicContact CG2-CE1 4.09Å; S331-Y362 CarbonylContact O-C 3.58Å; S331-Y362 VanDerWaalsContact O-CA 3.3Å; S331-Y362 WeakPolarHBondContact O-CA 3.18Å; L360-Y362 HydrophobicContact CD2-CD1 4.08Å; L360-Y362 HydrophobicContact CG-CD1 4.14Å; Y362-H364 HydrophobicContact CD2-CB 4.48Å; Y362-H364 HydrophobicContact CE2-CB 4.27Å; Y362-H364 AromaticContact CE2-CD2 3.62Å; Y362-H364 PolarHBondContact O-N 3.3Å; Y362-I367 HydrophobicContact CD2-CB 3.81Å; Y362-I367 HydrophobicContact CD2-CG2 3.86Å; Y362-I367 VanDerWaalsContact CD2-O 3.28Å; Y362-I367 WeakPolarHBondContact CD2-O 3.27Å; Y362-I367 HydrophobicContact CE2-CG2 4.41Å; Y362-I367 WeakPolarHBondContact CE2-O 3.27Å; Y362-I367 HydrophobicContact CG-CB 4.34Å; Y362-I367 HydrophobicContact CG-CG2 4.19Å; Y362-A372 HydrophobicContact CD1-CB 3.68Å; Y362-A372 HydrophobicContact CD2-CB 4.22Å; Y362-A372 HydrophobicContact CE1-CB 3.34Å; Y362-A372 HydrophobicContact CE2-CB 3.89Å; Y362-A372 HydrophobicContact CG-CB 4.1Å; Y362-A372 VanDerWaalsContact CZ-CB 3.42Å
363	D	98	Very high	97.6	Very high	1 Å²	1	37.3 Å²	37.3	1%	0.005	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.7	104.9	171.8	-177.7	15.1	0	0	0	110	Y185 A186 I326 S331 R365 L366 I367	Y185-D363 HydrophobicContact CD1-CB 3.78Å; Y185-D363 WeakPolarHBondContact CD1-OD2 3.36Å; Y185-D363 HydrophobicContact CG-CB 4.35Å; A186-D363 PolarHBondContact N-OD1 2.9Å; A186-D363 VanDerWaalsContact N-OD1 3.1Å; I326-D363 HydrophobicContact CD1-CB 4.31Å; S331-D363 PolarHBondContact O-N 3.02Å; D363-R365 PolarHBondContact O-N 3.38Å; D363-R365 VanDerWaalsContact O-N 3.11Å; D363-R365 WeakPolarHBondContact OD1-CB 3.39Å; D363-R365 WeakPolarHBondContact OD1-CG 3.37Å; D363-R365 IonicContact OD1-CZ 3.87Å; D363-R365 PolarHBondContact OD1-N 3.5Å; D363-R365 IonicContact OD1-NE 2.95Å; D363-R365 PolarHBondContact OD1-NE 3.25Å; D363-R365 IonicContact OD1-NH2 3.94Å; D363-R365 IonicContact OD2-CZ 3.24Å; D363-R365 VanDerWaalsContact OD2-CZ 3.24Å; D363-R365 IonicContact OD2-NE 2.96Å; D363-R365 PolarHBondContact OD2-NE 3.43Å; D363-R365 IonicContact OD2-NH2 2.7Å; D363-R365 PolarHBondContact OD2-NH2 3.19Å; D363-L366 PolarHBondContact O-N 3.46Å; D363-I367 PolarHBondContact O-N 3.06Å
364	H	97.6	Very high	97.6	Very high	73 Å²	73	36.7 Å²	36.7	34%	0.338	18%	0.177	S	C	.	.	T	Hydrogen-bonded Turn	trans	-70.4	-3.5	-177.8	-154.8	-52.1	0	0	0	113.2	A186 Y362 L366 I367 D368	A186-H364 HydrophobicContact CB-CB 4.22Å; A186-H364 WeakPolarHBondContact O-CB 3.41Å; A186-H364 PolarHBondContact O-N 3.45Å; Y362-H364 HydrophobicContact CD2-CB 4.48Å; Y362-H364 HydrophobicContact CE2-CB 4.27Å; Y362-H364 AromaticContact CE2-CD2 3.62Å; Y362-H364 PolarHBondContact O-N 3.3Å; H364-L366 VanDerWaalsContact C-N 3.26Å; H364-I367 WeakPolarHBondContact CA-O 3.37Å; H364-D368 IonicContact CE1-OD1 3.71Å
365	R	97	Very high	97.6	Very high	121 Å²	121	35.8 Å²	35.8	46%	0.457	17%	0.171	S	C	.	.	T	Hydrogen-bonded Turn	trans	-71.6	-25.8	166.8	-58.5	175.4	-58.3	162.5	11.7	112	T184 A186 I242 D363	T184-R365 PolarHBondContact O-NE 2.85Å; T184-R365 PolarHBondContact O-NH1 2.79Å; A186-R365 HydrophobicContact CB-CG 3.81Å; I242-R365 HydrophobicContact CD1-CB 3.56Å; D363-R365 PolarHBondContact O-N 3.38Å; D363-R365 VanDerWaalsContact O-N 3.11Å; D363-R365 WeakPolarHBondContact OD1-CB 3.39Å; D363-R365 WeakPolarHBondContact OD1-CG 3.37Å; D363-R365 IonicContact OD1-CZ 3.87Å; D363-R365 PolarHBondContact OD1-N 3.5Å; D363-R365 IonicContact OD1-NE 2.95Å; D363-R365 PolarHBondContact OD1-NE 3.25Å; D363-R365 IonicContact OD1-NH2 3.94Å; D363-R365 IonicContact OD2-CZ 3.24Å; D363-R365 VanDerWaalsContact OD2-CZ 3.24Å; D363-R365 IonicContact OD2-NE 2.96Å; D363-R365 PolarHBondContact OD2-NE 3.43Å; D363-R365 IonicContact OD2-NH2 2.7Å; D363-R365 PolarHBondContact OD2-NH2 3.19Å
366	L	97.4	Very high	97.6	Very high	15 Å²	15	35 Å²	35	8%	0.079	17%	0.167	C	C	.	.	T	Hydrogen-bonded Turn	trans	-112.8	-43.3	-176	-179.3	65.2	0	0	0	112.7	I237 A240 I242 I247 S331 D363 H364	I237-L366 HydrophobicContact CD1-CD1 3.61Å; I237-L366 HydrophobicContact CD1-CG 3.98Å; I237-L366 HydrophobicContact CG1-CD1 4.5Å; I237-L366 HydrophobicContact CG1-CG 4.36Å; A240-L366 VanDerWaalsContact C-CD2 3.49Å; A240-L366 HydrophobicContact CB-CD2 4.01Å; A240-L366 VanDerWaalsContact O-CD2 3.24Å; A240-L366 WeakPolarHBondContact O-CD2 3.39Å; I242-L366 HydrophobicContact CD1-CB 4.02Å; I242-L366 HydrophobicContact CG1-CB 4.09Å; I242-L366 HydrophobicContact CG1-CD1 4.22Å; I247-L366 HydrophobicContact CB-CD1 4.28Å; I247-L366 HydrophobicContact CD1-CD1 3.77Å; I247-L366 HydrophobicContact CG1-CD1 3.8Å; I247-L366 HydrophobicContact CG2-CD1 3.53Å; S331-L366 VanDerWaalsContact OG-CD2 3.24Å; S331-L366 WeakPolarHBondContact OG-CD2 3.36Å; D363-L366 PolarHBondContact O-N 3.46Å; H364-L366 VanDerWaalsContact C-N 3.26Å
367	I	98.1	Very high	97.6	Very high	0 Å²	0	42.5 Å²	42.5	0%	0	20%	0.195	C	C	.	.			trans	-108.9	114	-171.8	-59.8	159.8	0	0	0	108.2	V238 A332 Y362 D363 H364 E371 A372	V238-I367 HydrophobicContact CB-CD1 4.41Å; V238-I367 HydrophobicContact CG1-CD1 4.33Å; V238-I367 HydrophobicContact CG2-CD1 4.46Å; V238-I367 HydrophobicContact CG2-CG2 4.37Å; A332-I367 HydrophobicContact CB-CD1 4.04Å; Y362-I367 HydrophobicContact CD2-CB 3.81Å; Y362-I367 HydrophobicContact CD2-CG2 3.86Å; Y362-I367 VanDerWaalsContact CD2-O 3.28Å; Y362-I367 WeakPolarHBondContact CD2-O 3.27Å; Y362-I367 HydrophobicContact CE2-CG2 4.41Å; Y362-I367 WeakPolarHBondContact CE2-O 3.27Å; Y362-I367 HydrophobicContact CG-CB 4.34Å; Y362-I367 HydrophobicContact CG-CG2 4.19Å; D363-I367 PolarHBondContact O-N 3.06Å; H364-I367 WeakPolarHBondContact CA-O 3.37Å; I367-E371 HydrophobicContact CG2-CB 4.04Å; I367-A372 HydrophobicContact CG2-CB 3.97Å
368	D	97.3	Very high	97.6	Very high	96 Å²	96	40 Å²	40	51%	0.513	19%	0.187	S	C	.	.			trans	-77.5	162.6	174.4	-79.2	-35.3	0	0	0	111.8	H364 R370 E371 A372	H364-D368 IonicContact CE1-OD1 3.71Å; D368-R370 PolarHBondContact O-N 3.1Å; D368-E371 WeakPolarHBondContact CB-OE2 3.16Å; D368-E371 PolarHBondContact O-N 3.07Å; D368-A372 PolarHBondContact O-N 3.35Å
369	G	95.2	Very high	97.6	Very high	28 Å²	28	40 Å²	40	29%	0.289	19%	0.187	S	C	.	.	H	α-helix	trans	-60.7	-28.9	-174.3	0	0	0	0	0	114.4	V373	G369-V373 WeakPolarHBondContact O-CB 3.41Å; G369-V373 WeakPolarHBondContact O-CG2 3.32Å; G369-V373 PolarHBondContact O-N 3.48Å
370	R	96.9	Very high	97.6	Very high	175 Å²	175	42.7 Å²	42.7	66%	0.66	20%	0.198	S	C	*	.	H	α-helix	trans	-68.1	-46.7	178.5	-178.7	-169.9	74.1	113.7	-2.9	110.9	D368 T374	D368-R370 PolarHBondContact O-N 3.1Å; R370-T374 WeakPolarHBondContact O-CB 3.35Å; R370-T374 PolarHBondContact O-N 3.27Å; R370-T374 PolarHBondContact O-OG1 3.32Å
371	E	97.6	Very high	97.5	Very high	28 Å²	28	47.6 Å²	47.6	13%	0.131	22%	0.217	C	C	.	.	H	α-helix	trans	-64.1	-47.4	179.8	-68.4	63.3	-151.2	0	0	109.1	I237 I367 D368 V373 T374 F375	I237-E371 HydrophobicContact CG2-CB 3.99Å; I237-E371 HydrophobicContact CG2-CG 3.78Å; I367-E371 HydrophobicContact CG2-CB 4.04Å; D368-E371 WeakPolarHBondContact CB-OE2 3.16Å; D368-E371 PolarHBondContact O-N 3.07Å; E371-V373 PolarHBondContact O-N 3.49Å; E371-T374 PolarHBondContact O-N 3.2Å; E371-F375 VanDerWaalsContact O-CB 3.28Å; E371-F375 WeakPolarHBondContact O-CB 3.39Å; E371-F375 PolarHBondContact O-N 2.98Å
372	A	98.1	Very high	97.4	Very high	0 Å²	0	47.5 Å²	47.5	0%	0	22%	0.216	C	C	.	.	H	α-helix	trans	-60.1	-47	177.2	0	0	0	0	0	113	T190 L360 Y362 I367 D368 L376	T190-A372 HydrophobicContact CG2-CB 4.29Å; L360-A372 HydrophobicContact CD2-CB 3.97Å; Y362-A372 HydrophobicContact CD1-CB 3.68Å; Y362-A372 HydrophobicContact CD2-CB 4.22Å; Y362-A372 HydrophobicContact CE1-CB 3.34Å; Y362-A372 HydrophobicContact CE2-CB 3.89Å; Y362-A372 HydrophobicContact CG-CB 4.1Å; Y362-A372 VanDerWaalsContact CZ-CB 3.42Å; I367-A372 HydrophobicContact CG2-CB 3.97Å; D368-A372 PolarHBondContact O-N 3.35Å; A372-L376 WeakPolarHBondContact O-CB 3.49Å; A372-L376 PolarHBondContact O-N 3.21Å
373	V	97.3	Very high	97.3	Very high	68 Å²	68	47.2 Å²	47.2	41%	0.412	22%	0.215	S	C	.	.	H	α-helix	trans	-68.1	-39.4	178.1	170.3	0	0	0	0	111.2	G369 E371 R377	G369-V373 WeakPolarHBondContact O-CB 3.41Å; G369-V373 WeakPolarHBondContact O-CG2 3.32Å; G369-V373 PolarHBondContact O-N 3.48Å; E371-V373 PolarHBondContact O-N 3.49Å; V373-R377 WeakPolarHBondContact O-CB 3.34Å; V373-R377 PolarHBondContact O-N 3.48Å
374	T	97.6	Very high	97.3	Very high	48 Å²	48	50.1 Å²	50.1	29%	0.294	23%	0.229	S	C	.	.	H	α-helix	trans	-64.2	-48	178.3	-58.4	0	0	0	0	110.4	Q235 R370 E371 L376 R377 T378	Q235-T374 HydrophobicContact CG-CG2 4.44Å; R370-T374 WeakPolarHBondContact O-CB 3.35Å; R370-T374 PolarHBondContact O-N 3.27Å; R370-T374 PolarHBondContact O-OG1 3.32Å; E371-T374 PolarHBondContact O-N 3.2Å; T374-L376 PolarHBondContact O-N 3.49Å; T374-R377 PolarHBondContact O-N 2.93Å; T374-T378 PolarHBondContact O-N 2.95Å; T374-T378 PolarHBondContact O-OG1 3.39Å
375	F	98.3	Very high	97.2	Very high	0 Å²	0	50.6 Å²	50.6	0%	0	23%	0.234	C	C	.	.	H	α-helix	trans	-54.8	-52.7	174.5	178.2	-93.3	0	0	0	112.5	A231 L232 Q235 V238 F309 L360 E371 R377 T378 I379	A231-F375 HydrophobicContact CB-CD2 3.61Å; A231-F375 HydrophobicContact CB-CE2 3.52Å; A231-F375 HydrophobicContact CB-CG 4.32Å; A231-F375 HydrophobicContact CB-CZ 4.19Å; L232-F375 HydrophobicContact CB-CE2 4.38Å; L232-F375 HydrophobicContact CD2-CE2 3.59Å; L232-F375 HydrophobicContact CD2-CZ 3.99Å; L232-F375 HydrophobicContact CG-CE2 3.68Å; L232-F375 HydrophobicContact CG-CZ 4.09Å; Q235-F375 HydrophobicContact CB-CB 4.45Å; Q235-F375 HydrophobicContact CB-CD2 4.22Å; Q235-F375 HydrophobicContact CG-CB 4.25Å; V238-F375 HydrophobicContact CB-CD2 4.07Å; V238-F375 HydrophobicContact CB-CE2 4.29Å; V238-F375 HydrophobicContact CB-CG 4.49Å; V238-F375 HydrophobicContact CG1-CD1 4.34Å; V238-F375 HydrophobicContact CG1-CD2 3.97Å; V238-F375 HydrophobicContact CG1-CE1 4.28Å; V238-F375 HydrophobicContact CG1-CE2 3.92Å; V238-F375 HydrophobicContact CG1-CG 4.17Å; V238-F375 HydrophobicContact CG1-CZ 4.06Å; V238-F375 HydrophobicContact CG2-CB 4.04Å; V238-F375 HydrophobicContact CG2-CD2 3.95Å; V238-F375 HydrophobicContact CG2-CG 4.04Å; F309-F375 HydrophobicContact CE1-CZ 4.35Å; F309-F375 HydrophobicContact CE2-CE1 4.21Å; F309-F375 AromaticContact CE2-CZ 3.97Å; F309-F375 HydrophobicContact CE2-CZ 3.97Å; F309-F375 AromaticContact CZ-CE1 3.81Å; F309-F375 HydrophobicContact CZ-CE1 3.81Å; F309-F375 AromaticContact CZ-CZ 3.68Å; F309-F375 HydrophobicContact CZ-CZ 3.68Å; L360-F375 HydrophobicContact CD1-CD1 3.95Å; L360-F375 HydrophobicContact CD1-CE1 3.74Å; L360-F375 HydrophobicContact CD2-CD1 3.74Å; L360-F375 HydrophobicContact CD2-CE1 4.4Å; L360-F375 HydrophobicContact CD2-CG 4.45Å; L360-F375 HydrophobicContact CG-CD1 4.4Å; E371-F375 VanDerWaalsContact O-CB 3.28Å; E371-F375 WeakPolarHBondContact O-CB 3.39Å; E371-F375 PolarHBondContact O-N 2.98Å; F375-R377 VanDerWaalsContact C-N 3.3Å; F375-R377 PolarHBondContact O-N 2.97Å; F375-T378 PolarHBondContact O-N 3.46Å; F375-I379 HydrophobicContact CD1-CD1 3.98Å; F375-I379 HydrophobicContact CE1-CD1 3.32Å; F375-I379 HydrophobicContact CE1-CG1 4.33Å; F375-I379 HydrophobicContact CE2-CD1 4.48Å; F375-I379 HydrophobicContact CZ-CD1 3.64Å; F375-I379 HydrophobicContact CZ-CG1 4.5Å; F375-I379 PolarHBondContact O-N 2.91Å
376	L	98.2	Very high	96.9	Very high	0 Å²	0	46.5 Å²	46.5	0%	0	22%	0.223	C	C	.	.	H	α-helix	trans	-65.2	-36.6	-177.6	-166.4	64.1	0	0	0	111.7	T190 N192 L334 I358 L360 A372 T374 I379 K380	T190-L376 HydrophobicContact CG2-CD2 3.94Å; N192-L376 HydrophobicContact CB-CD2 4.03Å; N192-L376 HydrophobicContact CB-CG 4.22Å; L334-L376 HydrophobicContact CD1-CD1 3.78Å; I358-L376 HydrophobicContact CB-CD1 4.35Å; I358-L376 HydrophobicContact CD1-CD1 3.48Å; I358-L376 VanDerWaalsContact CD1-CD1 3.48Å; I358-L376 HydrophobicContact CD1-CG 3.97Å; I358-L376 HydrophobicContact CG1-CD1 3.72Å; I358-L376 HydrophobicContact CG1-CD2 4.48Å; I358-L376 HydrophobicContact CG1-CG 4.15Å; L360-L376 HydrophobicContact CB-CD1 4.2Å; A372-L376 WeakPolarHBondContact O-CB 3.49Å; A372-L376 PolarHBondContact O-N 3.21Å; T374-L376 PolarHBondContact O-N 3.49Å; L376-I379 PolarHBondContact O-N 2.91Å; L376-K380 PolarHBondContact O-N 3.4Å
377	R	97.5	Very high	96.5	Very high	166 Å²	166	47.9 Å²	47.9	63%	0.626	24%	0.236	S	C	*	.	H	α-helix	trans	-67	-37.3	174.6	-171.9	179.5	-175.3	-177.4	1.6	112.2	V373 T374 F375 K380 R381	V373-R377 WeakPolarHBondContact O-CB 3.34Å; V373-R377 PolarHBondContact O-N 3.48Å; T374-R377 PolarHBondContact O-N 2.93Å; F375-R377 VanDerWaalsContact C-N 3.3Å; F375-R377 PolarHBondContact O-N 2.97Å; R377-K380 WeakPolarHBondContact O-CB 3.44Å; R377-K380 PolarHBondContact O-N 3.32Å; R377-R381 WeakPolarHBondContact O-CG 3.38Å; R377-R381 PolarHBondContact O-N 3.06Å
378	T	97.3	Very high	96.2	Very high	13 Å²	13	48.5 Å²	48.5	8%	0.08	24%	0.239	C	C	.	.	H	α-helix	trans	-63.1	-43.3	174.6	-63.4	0	0	0	0	110.7	Y230 A231 T374 F375 R381 A382	Y230-T378 HydrophobicContact CD1-CG2 3.79Å; Y230-T378 HydrophobicContact CE1-CG2 3.68Å; A231-T378 HydrophobicContact CB-CG2 3.83Å; T374-T378 PolarHBondContact O-N 2.95Å; T374-T378 PolarHBondContact O-OG1 3.39Å; F375-T378 PolarHBondContact O-N 3.46Å; T378-R381 PolarHBondContact O-N 3.34Å; T378-A382 WeakPolarHBondContact O-CB 3.33Å; T378-A382 PolarHBondContact O-N 3.39Å
379	I	97.6	Very high	95.7	Very high	0 Å²	0	46.2 Å²	46.2	0%	0	23%	0.226	C	C	.	.	H	α-helix	trans	-60	-49.3	172	-65.5	178.9	0	0	0	110.9	F224 A227 A228 A231 L334 I358 F375 L376 R381 A382 I383	F224-I379 HydrophobicContact CD1-CG2 4.49Å; A227-I379 HydrophobicContact CB-CG2 4.08Å; A228-I379 HydrophobicContact CB-CD1 4.23Å; A231-I379 HydrophobicContact CB-CD1 4.36Å; A231-I379 HydrophobicContact CB-CG1 3.65Å; L334-I379 HydrophobicContact CD1-CD1 3.92Å; L334-I379 HydrophobicContact CD2-CD1 4.03Å; I358-I379 HydrophobicContact CD1-CB 4.43Å; I358-I379 HydrophobicContact CD1-CG2 3.96Å; F375-I379 HydrophobicContact CD1-CD1 3.98Å; F375-I379 HydrophobicContact CE1-CD1 3.32Å; F375-I379 HydrophobicContact CE1-CG1 4.33Å; F375-I379 HydrophobicContact CE2-CD1 4.48Å; F375-I379 HydrophobicContact CZ-CD1 3.64Å; F375-I379 HydrophobicContact CZ-CG1 4.5Å; F375-I379 PolarHBondContact O-N 2.91Å; L376-I379 PolarHBondContact O-N 2.91Å; I379-R381 PolarHBondContact O-N 2.88Å; I379-A382 PolarHBondContact O-N 3.19Å; I379-I383 HydrophobicContact CG2-CG1 4.22Å; I379-I383 VanDerWaalsContact O-CG1 3.32Å; I379-I383 WeakPolarHBondContact O-CG1 3.37Å; I379-I383 PolarHBondContact O-N 2.96Å
380	K	97.8	Very high	95.3	Very high	55 Å²	55	52 Å²	52	24%	0.239	25%	0.25	C	S	.	.	H	α-helix	trans	-53.2	-51.3	177.1	169.8	179.6	166.6	70.5	0	111.3	N192 E193 V194 L376 R377 A382 I383 E384	N192-K380 HydrophobicContact CB-CD 4.3Å; E193-K380 PolarHBondContact O-NZ 3.36Å; V194-K380 HydrophobicContact CG2-CB 4.15Å; V194-K380 HydrophobicContact CG2-CG 4.15Å; L376-K380 PolarHBondContact O-N 3.4Å; R377-K380 WeakPolarHBondContact O-CB 3.44Å; R377-K380 PolarHBondContact O-N 3.32Å; K380-A382 PolarHBondContact O-N 2.85Å; K380-I383 PolarHBondContact O-N 3.5Å; K380-E384 HydrophobicContact CG-CG 4.43Å; K380-E384 VanDerWaalsContact NZ-CD 3.34Å; K380-E384 IonicContact NZ-OE1 3.82Å; K380-E384 PolarHBondContact NZ-OE1 3.26Å; K380-E384 IonicContact NZ-OE2 2.63Å; K380-E384 PolarHBondContact NZ-OE2 2.92Å; K380-E384 WeakPolarHBondContact O-CB 3.06Å; K380-E384 WeakPolarHBondContact O-CG 3.19Å; K380-E384 PolarHBondContact O-N 2.94Å
381	R	97	Very high	94.9	Very high	104 Å²	104	49.2 Å²	49.2	39%	0.392	25%	0.248	S	C	.	.	H	α-helix	trans	-57.6	-48	178.1	-75.8	176.8	64.4	-158.5	-6.9	111.6	R377 T378 I379 I383 E384 N385 I388 L393	R377-R381 WeakPolarHBondContact O-CG 3.38Å; R377-R381 PolarHBondContact O-N 3.06Å; T378-R381 PolarHBondContact O-N 3.34Å; I379-R381 PolarHBondContact O-N 2.88Å; R381-I383 VanDerWaalsContact C-N 3.3Å; R381-I383 PolarHBondContact O-N 3.44Å; R381-E384 PolarHBondContact O-N 3.49Å; R381-N385 PolarHBondContact O-N 3.45Å; R381-I388 HydrophobicContact CB-CD1 3.92Å; R381-L393 PolarHBondContact NH2-O 2.82Å; R381-L393 PolarHBondContact NH2-OXT 3.46Å; R381-L393 VanDerWaalsContact NH2-OXT 3.16Å
382	A	95.7	Very high	94.1	Very high	0 Å²	0	50.4 Å²	50.4	0%	0	27%	0.267	C	S	.	.	H	α-helix	trans	-62.8	-33.9	-179.8	0	0	0	0	0	113	A227 Y230 T378 I379 K380 N385 P386 M389	A227-A382 HydrophobicContact CB-CB 3.81Å; Y230-A382 HydrophobicContact CD1-CB 4.41Å; T378-A382 WeakPolarHBondContact O-CB 3.33Å; T378-A382 PolarHBondContact O-N 3.39Å; I379-A382 PolarHBondContact O-N 3.19Å; K380-A382 PolarHBondContact O-N 2.85Å; A382-N385 CarbonylContact O-C 3.56Å; A382-N385 VanDerWaalsContact O-C 3.26Å; A382-P386 WeakPolarHBondContact O-CA 3.4Å; A382-M389 HydrophobicContact CB-CG 3.73Å; A382-M389 HydrophobicContact CB-SD 4.1Å
383	I	96.8	Very high	93.4	Very high	0 Å²	0	56.4 Å²	56.4	0%	0	30%	0.298	C	S	.	.	H	α-helix	trans	-78	-42	177	-64.9	-64.3	0	0	0	111.8	V194 M196 V199 P223 F224 A227 I379 K380 R381 N385	V194-I383 HydrophobicContact CG1-CB 3.93Å; V194-I383 HydrophobicContact CG1-CG2 3.56Å; M196-I383 HydrophobicContact CE-CG2 4.03Å; M196-I383 HydrophobicContact SD-CG2 3.51Å; M196-I383 VanDerWaalsContact SD-CG2 3.51Å; V199-I383 HydrophobicContact CG2-CG2 4.04Å; V199-I383 WeakPolarHBondContact CG2-O 3.31Å; P223-I383 HydrophobicContact CB-CD1 3.84Å; F224-I383 HydrophobicContact CD1-CD1 3.82Å; F224-I383 HydrophobicContact CD1-CG1 3.98Å; F224-I383 HydrophobicContact CD2-CD1 4.49Å; F224-I383 HydrophobicContact CE1-CD1 3.93Å; F224-I383 HydrophobicContact CE1-CG1 3.77Å; F224-I383 HydrophobicContact CE1-CG2 4.39Å; F224-I383 HydrophobicContact CG-CD1 4.12Å; F224-I383 HydrophobicContact CZ-CD1 4.3Å; F224-I383 HydrophobicContact CZ-CG1 4.36Å; F224-I383 HydrophobicContact CZ-CG2 4.26Å; A227-I383 HydrophobicContact CB-CD1 3.82Å; A227-I383 HydrophobicContact CB-CG1 4Å; I379-I383 HydrophobicContact CG2-CG1 4.22Å; I379-I383 VanDerWaalsContact O-CG1 3.32Å; I379-I383 WeakPolarHBondContact O-CG1 3.37Å; I379-I383 PolarHBondContact O-N 2.96Å; K380-I383 PolarHBondContact O-N 3.5Å; R381-I383 VanDerWaalsContact C-N 3.3Å; R381-I383 PolarHBondContact O-N 3.44Å; I383-N385 VanDerWaalsContact C-N 3.27Å; I383-N385 PolarHBondContact O-N 2.76Å
384	E	96.9	Very high	93.2	Very high	63 Å²	63	55.8 Å²	55.8	29%	0.294	29%	0.293	S	S	.	.	H	α-helix	trans	-67.4	-30.5	177.7	-71.3	180	162.7	0	0	112.1	V194 D195 A198 K380 R381	V194-E384 HydrophobicContact CG1-CG 3.91Å; D195-E384 HydrophobicContact CB-CG 4.14Å; D195-E384 PolarHBondContact N-OE1 2.96Å; D195-E384 WeakPolarHBondContact O-CG 3.39Å; A198-E384 VanDerWaalsContact CB-O 3.28Å; A198-E384 WeakPolarHBondContact CB-O 3.28Å; K380-E384 HydrophobicContact CG-CG 4.43Å; K380-E384 VanDerWaalsContact NZ-CD 3.34Å; K380-E384 IonicContact NZ-OE1 3.82Å; K380-E384 PolarHBondContact NZ-OE1 3.26Å; K380-E384 IonicContact NZ-OE2 2.63Å; K380-E384 PolarHBondContact NZ-OE2 2.92Å; K380-E384 WeakPolarHBondContact O-CB 3.06Å; K380-E384 WeakPolarHBondContact O-CG 3.19Å; K380-E384 PolarHBondContact O-N 2.94Å; R381-E384 PolarHBondContact O-N 3.49Å
385	N	95.2	Very high	93	Very high	82 Å²	82	56.2 Å²	56.2	44%	0.439	29%	0.292	S	S	.	.			trans	-138.1	88	174.2	-175.2	2.3	0	0	0	111.4	R381 A382 I383 A387 I388	R381-N385 PolarHBondContact O-N 3.45Å; A382-N385 CarbonylContact O-C 3.56Å; A382-N385 VanDerWaalsContact O-C 3.26Å; I383-N385 VanDerWaalsContact C-N 3.27Å; I383-N385 PolarHBondContact O-N 2.76Å; N385-A387 PolarHBondContact O-N 3.28Å; N385-A387 WeakPolarHBondContact OD1-CB 3.26Å; N385-A387 PolarHBondContact OD1-N 3.14Å; N385-I388 HydrophobicContact CB-CD1 3.99Å; N385-I388 HydrophobicContact CB-CG1 4.2Å; N385-I388 VanDerWaalsContact O-CB 3.3Å; N385-I388 WeakPolarHBondContact O-CB 3.45Å; N385-I388 WeakPolarHBondContact O-CG1 3.49Å; N385-I388 PolarHBondContact O-N 2.91Å
386	P	90.6	Very high	92.7	Very high	36 Å²	36	59.3 Å²	59.3	23%	0.234	31%	0.309	C	S	.	.	T	Hydrogen-bonded Turn	trans	-58.1	-18.8	-179.1	-28	36.8	0	0	0	115.5	A198 V199 A382 I388 M389	A198-P386 HydrophobicContact CB-CG 4.49Å; V199-P386 HydrophobicContact CG2-CG 3.97Å; A382-P386 WeakPolarHBondContact O-CA 3.4Å; P386-I388 PolarHBondContact O-N 3Å; P386-M389 HydrophobicContact CB-CE 4.06Å; P386-M389 PolarHBondContact O-N 3.24Å
387	A	90.7	Very high	92.4	Very high	43 Å²	43	62.8 Å²	62.8	36%	0.355	33%	0.327	S	S	.	.	H	α-helix	trans	-63.4	-24.1	174.5	0	0	0	0	0	112.5	N385 M389 L390 L391	N385-A387 PolarHBondContact O-N 3.28Å; N385-A387 WeakPolarHBondContact OD1-CB 3.26Å; N385-A387 PolarHBondContact OD1-N 3.14Å; A387-M389 VanDerWaalsContact C-N 3.3Å; A387-M389 PolarHBondContact O-N 3.44Å; A387-L390 WeakPolarHBondContact O-CB 3.43Å; A387-L390 PolarHBondContact O-N 3.08Å; A387-L390 VanDerWaalsContact O-N 3.12Å; A387-L391 HydrophobicContact CB-CD1 4.49Å; A387-L391 WeakPolarHBondContact O-CB 3.28Å; A387-L391 WeakPolarHBondContact O-CG 3.33Å; A387-L391 PolarHBondContact O-N 3.39Å
388	I	90.4	Very high	92	Very high	13 Å²	13	56.4 Å²	56.4	7%	0.067	31%	0.308	C	S	.	.	H	α-helix	trans	-57	-44.1	175.6	-72.7	176.8	0	0	0	111.2	Y230 R381 N385 P386 L390 L391 G392 L393	Y230-I388 HydrophobicContact CE1-CG2 3.88Å; R381-I388 HydrophobicContact CB-CD1 3.92Å; N385-I388 HydrophobicContact CB-CD1 3.99Å; N385-I388 HydrophobicContact CB-CG1 4.2Å; N385-I388 VanDerWaalsContact O-CB 3.3Å; N385-I388 WeakPolarHBondContact O-CB 3.45Å; N385-I388 WeakPolarHBondContact O-CG1 3.49Å; N385-I388 PolarHBondContact O-N 2.91Å; P386-I388 PolarHBondContact O-N 3Å; I388-L390 VanDerWaalsContact C-N 3.29Å; I388-L390 PolarHBondContact O-N 3.28Å; I388-L391 PolarHBondContact O-N 3.3Å; I388-G392 WeakPolarHBondContact O-CA 3.38Å; I388-G392 PolarHBondContact O-N 2.88Å; I388-L393 HydrophobicContact CG1-CB 4.45Å; I388-L393 HydrophobicContact CG2-CB 4.43Å; I388-L393 WeakPolarHBondContact CG2-O 3.25Å; I388-L393 PolarHBondContact O-N 3.49Å
389	M	88.2	Confident	91.7	Very high	48 Å²	48	59.3 Å²	59.3	24%	0.236	32%	0.323	C	S	.	.	H	α-helix	trans	-67.4	-32.1	178.9	-64.5	-179.1	-75.5	0	0	112.3	K226 A227 Y230 A382 P386 A387	K226-M389 VanDerWaalsContact C-SD 3.6Å; K226-M389 HydrophobicContact CB-SD 3.82Å; A227-M389 VanDerWaalsContact CA-SD 3.58Å; A227-M389 HydrophobicContact CB-SD 4Å; A227-M389 PolarHBondContact N-SD 3.37Å; A227-M389 VanDerWaalsContact N-SD 3.4Å; Y230-M389 HydrophobicContact CD1-CG 4.37Å; Y230-M389 HydrophobicContact CG-CG 4.26Å; A382-M389 HydrophobicContact CB-CG 3.73Å; A382-M389 HydrophobicContact CB-SD 4.1Å; P386-M389 HydrophobicContact CB-CE 4.06Å; P386-M389 PolarHBondContact O-N 3.24Å; A387-M389 VanDerWaalsContact C-N 3.3Å; A387-M389 PolarHBondContact O-N 3.44Å
390	L	85.4	Confident	91.3	Very high	151 Å²	151	63.5 Å²	63.5	79%	0.791	35%	0.346	S	S	*	.	H	α-helix	trans	-73.6	-36.7	178.3	-179.5	65.2	0	0	0	111.9	A387 I388	A387-L390 WeakPolarHBondContact O-CB 3.43Å; A387-L390 PolarHBondContact O-N 3.08Å; A387-L390 VanDerWaalsContact O-N 3.12Å; I388-L390 VanDerWaalsContact C-N 3.29Å; I388-L390 PolarHBondContact O-N 3.28Å
391	L	88.2	Confident	90.8	Very high	116 Å²	116	64.2 Å²	64.2	61%	0.607	36%	0.355	S	S	*	.	H	α-helix	trans	-96.6	-13	-173.7	-63.2	175.6	0	0	0	113.4	A387 I388 L393	A387-L391 HydrophobicContact CB-CD1 4.49Å; A387-L391 WeakPolarHBondContact O-CB 3.28Å; A387-L391 WeakPolarHBondContact O-CG 3.33Å; A387-L391 PolarHBondContact O-N 3.39Å; I388-L391 PolarHBondContact O-N 3.3Å; L391-L393 HydrophobicContact CB-CD1 3.69Å; L391-L393 HydrophobicContact CB-CD2 4.43Å; L391-L393 HydrophobicContact CB-CG 3.61Å; L391-L393 HydrophobicContact CD1-CD1 3.69Å; L391-L393 HydrophobicContact CG-CD1 4.35Å
392	G	82.2	Confident	90.2	Very high	52 Å²	52	60.8 Å²	60.8	54%	0.536	35%	0.352	S	S	.	.	T	Hydrogen-bonded Turn	trans	68	45.3	-177.8	0	0	0	0	0	113.9	I388	I388-G392 WeakPolarHBondContact O-CA 3.38Å; I388-G392 PolarHBondContact O-N 2.88Å
393	L	82.6	Confident	89.7	Confident	126 Å²	126	66.4 Å²	66.4	66%	0.66	38%	0.384	S	S	*	.			trans	-104.1	0	-168.9	-65	176.5	0	0	0	117.7	Y230 R381 I388 L391	Y230-L393 PolarHBondContact OH-N 2.92Å; Y230-L393 PolarHBondContact OH-O 3.49Å; R381-L393 PolarHBondContact NH2-O 2.82Å; R381-L393 PolarHBondContact NH2-OXT 3.46Å; R381-L393 VanDerWaalsContact NH2-OXT 3.16Å; I388-L393 HydrophobicContact CG1-CB 4.45Å; I388-L393 HydrophobicContact CG2-CB 4.43Å; I388-L393 WeakPolarHBondContact CG2-O 3.25Å; I388-L393 PolarHBondContact O-N 3.49Å; L391-L393 HydrophobicContact CB-CD1 3.69Å; L391-L393 HydrophobicContact CB-CD2 4.43Å; L391-L393 HydrophobicContact CB-CG 3.61Å; L391-L393 HydrophobicContact CD1-CD1 3.69Å; L391-L393 HydrophobicContact CG-CD1 4.35Å

Retrieved 393 of 393 residues in 121.7 ms (Link to these results)

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