G4LXR9_SCHMA Loading...

NADH-cytochrome b5 reductase

AlphaFold DB , UniProt , Accession G4LXR9, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 304 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	58.7	Low	64.9	Low	219 Å²	219	112.4 Å²	112.4	100%	1.079	63%	0.634	S	S	*	*				0	-30.5	0	-107.7	175.5	-177.7	0	0	113.7	Q3 T5	M1-Q3 PolarHBondContact O-N 3.42Å; M1-T5 PolarHBondContact O-OG1 3.42Å
2	T	65.9	Low	65	Low	119 Å²	119	110.1 Å²	110.1	73%	0.73	62%	0.624	S	S	*	*	H	α-helix	trans	-62.7	-39	-175.5	39.1	0	0	0	0	115.3	N4 T5 T6	T2-N4 PolarHBondContact O-N 3.33Å; T2-T5 PolarHBondContact O-N 3.09Å; T2-T6 PolarHBondContact O-N 3.46Å; T2-T6 PolarHBondContact O-OG1 3.49Å
3	Q	63.8	Low	64.8	Low	172 Å²	172	106 Å²	106	80%	0.804	61%	0.612	S	S	*	*	H	α-helix	trans	-66	-36.8	-172.8	-141.2	177.4	9.1	0	0	113.7	M1 A7	M1-Q3 PolarHBondContact O-N 3.42Å; Q3-A7 PolarHBondContact O-N 3.19Å
4	N	68.9	Low	65.1	Low	132 Å²	132	102.9 Å²	102.9	71%	0.706	60%	0.599	S	S	*	*	H	α-helix	trans	-69.2	-37.4	178	-104.2	12.1	0	0	0	112.2	T2 T6 A7 V8	T2-N4 PolarHBondContact O-N 3.33Å; N4-T6 VanDerWaalsContact C-N 3.33Å; N4-T6 PolarHBondContact O-N 3.37Å; N4-A7 PolarHBondContact O-N 3.46Å; N4-V8 WeakPolarHBondContact O-CG2 3.46Å; N4-V8 PolarHBondContact O-N 3.14Å; N4-V8 VanDerWaalsContact O-N 3.14Å
5	T	65.1	Low	65.6	Low	81 Å²	81	101.7 Å²	101.7	50%	0.497	59%	0.594	S	S	.	*	H	α-helix	trans	-64.6	-40.4	-179.2	-33.3	0	0	0	0	111.1	M1 T2 V8 I9	M1-T5 PolarHBondContact O-OG1 3.42Å; T2-T5 PolarHBondContact O-N 3.09Å; T5-V8 PolarHBondContact O-N 3.3Å; T5-I9 HydrophobicContact CG2-CD1 4.21Å; T5-I9 WeakPolarHBondContact O-CD1 3.38Å; T5-I9 VanDerWaalsContact O-CG1 3.24Å; T5-I9 WeakPolarHBondContact O-CG1 3.38Å; T5-I9 PolarHBondContact O-N 2.99Å; T5-I9 VanDerWaalsContact O-N 3.09Å
6	T	66	Low	65.5	Low	98 Å²	98	99.6 Å²	99.6	60%	0.601	59%	0.587	S	S	*	*	H	α-helix	trans	-64.9	-40.7	178.3	-42.9	0	0	0	0	112.2	T2 N4 I9 A10	T2-T6 PolarHBondContact O-N 3.46Å; T2-T6 PolarHBondContact O-OG1 3.49Å; N4-T6 VanDerWaalsContact C-N 3.33Å; N4-T6 PolarHBondContact O-N 3.37Å; T6-I9 PolarHBondContact O-N 3.48Å; T6-A10 PolarHBondContact O-N 3.29Å; T6-A10 VanDerWaalsContact O-N 3.08Å
7	A	65.3	Low	65.8	Low	50 Å²	50	96.6 Å²	96.6	41%	0.413	58%	0.576	S	S	.	*	H	α-helix	trans	-65.5	-43.5	178.1	0	0	0	0	0	112.3	Q3 N4 A10 I11	Q3-A7 PolarHBondContact O-N 3.19Å; N4-A7 PolarHBondContact O-N 3.46Å; A7-A10 PolarHBondContact O-N 3.48Å; A7-I11 WeakPolarHBondContact O-CG1 3.48Å; A7-I11 PolarHBondContact O-N 3.06Å
8	V	67.4	Low	66.3	Low	88 Å²	88	96.6 Å²	96.6	53%	0.533	58%	0.576	S	S	.	*	H	α-helix	trans	-63.6	-43.4	177.5	175.3	0	0	0	0	111.2	N4 T5 A10 I11 V12	N4-V8 WeakPolarHBondContact O-CG2 3.46Å; N4-V8 PolarHBondContact O-N 3.14Å; N4-V8 VanDerWaalsContact O-N 3.14Å; T5-V8 PolarHBondContact O-N 3.3Å; V8-A10 VanDerWaalsContact C-N 3.31Å; V8-A10 PolarHBondContact O-N 3.49Å; V8-I11 PolarHBondContact O-N 3.08Å; V8-V12 HydrophobicContact CG1-CG2 4.36Å; V8-V12 WeakPolarHBondContact O-CG2 3.37Å; V8-V12 PolarHBondContact O-N 3.49Å
9	I	62.5	Low	66.7	Low	111 Å²	111	96.5 Å²	96.5	57%	0.569	58%	0.576	S	S	*	*	H	α-helix	trans	-60.2	-42	176.6	-68.3	165.8	0	0	0	110.9	T5 T6 V12 A13	T5-I9 HydrophobicContact CG2-CD1 4.21Å; T5-I9 WeakPolarHBondContact O-CD1 3.38Å; T5-I9 VanDerWaalsContact O-CG1 3.24Å; T5-I9 WeakPolarHBondContact O-CG1 3.38Å; T5-I9 PolarHBondContact O-N 2.99Å; T5-I9 VanDerWaalsContact O-N 3.09Å; T6-I9 PolarHBondContact O-N 3.48Å; I9-V12 PolarHBondContact O-N 2.69Å; I9-A13 VanDerWaalsContact O-CB 3.31Å; I9-A13 WeakPolarHBondContact O-CB 3.24Å; I9-A13 PolarHBondContact O-N 3.16Å
10	A	62.4	Low	67	Low	60 Å²	60	94.6 Å²	94.6	50%	0.496	57%	0.571	S	S	.	*	H	α-helix	trans	-63.8	-42.7	178.1	0	0	0	0	0	112.5	T6 A7 V8 S14	T6-A10 PolarHBondContact O-N 3.29Å; T6-A10 VanDerWaalsContact O-N 3.08Å; A7-A10 PolarHBondContact O-N 3.48Å; V8-A10 VanDerWaalsContact C-N 3.31Å; V8-A10 PolarHBondContact O-N 3.49Å; A10-S14 WeakPolarHBondContact O-CB 3.44Å; A10-S14 PolarHBondContact O-N 3.02Å; A10-S14 PolarHBondContact O-OG 3.41Å
11	I	67.4	Low	67.3	Low	106 Å²	106	95.2 Å²	95.2	54%	0.544	57%	0.57	S	S	.	*	H	α-helix	trans	-64.3	-48.5	177.4	-65.6	167.7	0	0	0	110.4	A7 V8 A13 S14 V15	A7-I11 WeakPolarHBondContact O-CG1 3.48Å; A7-I11 PolarHBondContact O-N 3.06Å; V8-I11 PolarHBondContact O-N 3.08Å; I11-A13 VanDerWaalsContact C-N 3.34Å; I11-A13 PolarHBondContact O-N 3.01Å; I11-S14 PolarHBondContact O-N 3.41Å; I11-S14 VanDerWaalsContact O-N 3.16Å; I11-S14 PolarHBondContact O-OG 3.39Å; I11-V15 WeakPolarHBondContact O-CG2 3.35Å; I11-V15 PolarHBondContact O-N 2.95Å
12	V	66.3	Low	67.9	Low	85 Å²	85	87.7 Å²	87.7	52%	0.515	54%	0.539	S	S	.	.	H	α-helix	trans	-61.9	-41.1	179.8	174.8	0	0	0	0	111.8	V8 I9 S14 V15 S16	V8-V12 HydrophobicContact CG1-CG2 4.36Å; V8-V12 WeakPolarHBondContact O-CG2 3.37Å; V8-V12 PolarHBondContact O-N 3.49Å; I9-V12 PolarHBondContact O-N 2.69Å; V12-S14 VanDerWaalsContact C-N 3.35Å; V12-S14 PolarHBondContact O-N 3.04Å; V12-V15 PolarHBondContact O-N 3.47Å; V12-S16 WeakPolarHBondContact O-CB 3.37Å; V12-S16 PolarHBondContact O-N 2.86Å; V12-S16 PolarHBondContact O-OG 3.48Å
13	A	62.9	Low	68.3	Low	57 Å²	57	84 Å²	84	47%	0.471	53%	0.526	S	S	.	.	H	α-helix	trans	-62.5	-41.4	175.5	0	0	0	0	0	111.8	I9 I11 S16 A17	I9-A13 VanDerWaalsContact O-CB 3.31Å; I9-A13 WeakPolarHBondContact O-CB 3.24Å; I9-A13 PolarHBondContact O-N 3.16Å; I11-A13 VanDerWaalsContact C-N 3.34Å; I11-A13 PolarHBondContact O-N 3.01Å; A13-S16 PolarHBondContact O-N 3.34Å; A13-A17 WeakPolarHBondContact O-CB 3.2Å; A13-A17 PolarHBondContact O-N 3.5Å
14	S	68	Low	68.8	Low	62 Å²	62	80.2 Å²	80.2	43%	0.434	51%	0.514	S	S	.	.	H	α-helix	trans	-65.6	-43.5	178.5	73.2	0	0	0	0	112.9	A10 I11 V12 S16 A17 V18	A10-S14 WeakPolarHBondContact O-CB 3.44Å; A10-S14 PolarHBondContact O-N 3.02Å; A10-S14 PolarHBondContact O-OG 3.41Å; I11-S14 PolarHBondContact O-N 3.41Å; I11-S14 VanDerWaalsContact O-N 3.16Å; I11-S14 PolarHBondContact O-OG 3.39Å; V12-S14 VanDerWaalsContact C-N 3.35Å; V12-S14 PolarHBondContact O-N 3.04Å; S14-S16 PolarHBondContact O-N 3.34Å; S14-A17 PolarHBondContact O-N 3.5Å; S14-V18 WeakPolarHBondContact O-CG2 3.2Å; S14-V18 PolarHBondContact O-N 3.17Å
15	V	73	Confident	69.1	Low	85 Å²	85	77.2 Å²	77.2	52%	0.515	50%	0.5	S	S	.	.	H	α-helix	trans	-63.3	-43.9	176.4	175.3	0	0	0	0	110.7	I11 V12 A17 V18 V19	I11-V15 WeakPolarHBondContact O-CG2 3.35Å; I11-V15 PolarHBondContact O-N 2.95Å; V12-V15 PolarHBondContact O-N 3.47Å; V15-A17 VanDerWaalsContact C-N 3.33Å; V15-A17 PolarHBondContact O-N 3.23Å; V15-V18 PolarHBondContact O-N 3.42Å; V15-V19 HydrophobicContact CG1-CG2 4.42Å; V15-V19 WeakPolarHBondContact O-CG2 3.31Å; V15-V19 PolarHBondContact O-N 2.72Å
16	S	64.3	Low	69.2	Low	69 Å²	69	78.2 Å²	78.2	48%	0.483	50%	0.502	S	S	.	.	H	α-helix	trans	-61.6	-40.8	178.2	-55.3	0	0	0	0	112	V12 A13 S14 V19 A20	V12-S16 WeakPolarHBondContact O-CB 3.37Å; V12-S16 PolarHBondContact O-N 2.86Å; V12-S16 PolarHBondContact O-OG 3.48Å; A13-S16 PolarHBondContact O-N 3.34Å; S14-S16 PolarHBondContact O-N 3.34Å; S16-V19 PolarHBondContact O-N 2.75Å; S16-A20 WeakPolarHBondContact O-CB 3.31Å; S16-A20 PolarHBondContact O-N 3.42Å
17	A	70.3	Confident	69.4	Low	48 Å²	48	75.5 Å²	75.5	40%	0.397	49%	0.493	S	S	.	.	H	α-helix	trans	-64.8	-41.8	175.5	0	0	0	0	0	112.2	A13 S14 V15 A20 I21	A13-A17 WeakPolarHBondContact O-CB 3.2Å; A13-A17 PolarHBondContact O-N 3.5Å; S14-A17 PolarHBondContact O-N 3.5Å; V15-A17 VanDerWaalsContact C-N 3.33Å; V15-A17 PolarHBondContact O-N 3.23Å; A17-A20 PolarHBondContact O-N 3.32Å; A17-I21 WeakPolarHBondContact O-CB 3.35Å; A17-I21 VanDerWaalsContact O-CG1 3.22Å; A17-I21 WeakPolarHBondContact O-CG1 3.13Å; A17-I21 PolarHBondContact O-N 3.02Å
18	V	75.3	Confident	69.5	Low	97 Å²	97	77.9 Å²	77.9	59%	0.588	50%	0.498	S	S	*	.	H	α-helix	trans	-65.4	-41.5	177.2	173.6	0	0	0	0	111.5	S14 V15 I21 S22	S14-V18 WeakPolarHBondContact O-CG2 3.2Å; S14-V18 PolarHBondContact O-N 3.17Å; V15-V18 PolarHBondContact O-N 3.42Å; V18-I21 PolarHBondContact O-N 3.14Å; V18-S22 WeakPolarHBondContact O-CB 3.49Å; V18-S22 PolarHBondContact O-N 2.97Å; V18-S22 PolarHBondContact O-OG 3.04Å
19	V	73.8	Confident	69.6	Low	94 Å²	94	79.4 Å²	79.4	57%	0.57	50%	0.502	S	S	*	.	H	α-helix	trans	-64.6	-40.9	175.3	174.7	0	0	0	0	111.1	V15 S16 S22 G23	V15-V19 HydrophobicContact CG1-CG2 4.42Å; V15-V19 WeakPolarHBondContact O-CG2 3.31Å; V15-V19 PolarHBondContact O-N 2.72Å; S16-V19 PolarHBondContact O-N 2.75Å; V19-S22 VanDerWaalsContact CA-OG 3.31Å; V19-S22 WeakPolarHBondContact CA-OG 3.41Å; V19-S22 PolarHBondContact O-OG 3.01Å; V19-G23 PolarHBondContact O-N 3.35Å
20	A	72.7	Confident	69.9	Low	58 Å²	58	81.2 Å²	81.2	48%	0.479	51%	0.506	S	S	.	.	H	α-helix	trans	-65.4	-45.6	176	0	0	0	0	0	112	S16 A17 G23 V24	S16-A20 WeakPolarHBondContact O-CB 3.31Å; S16-A20 PolarHBondContact O-N 3.42Å; A17-A20 PolarHBondContact O-N 3.32Å; A20-G23 PolarHBondContact O-N 2.94Å; A20-V24 VanDerWaalsContact O-CG2 3.27Å; A20-V24 WeakPolarHBondContact O-CG2 3.43Å; A20-V24 PolarHBondContact O-N 2.81Å
21	I	74.3	Confident	70.2	Confident	108 Å²	108	86.7 Å²	86.7	55%	0.554	51%	0.514	S	S	*	.	H	α-helix	trans	-64.4	-46	178.1	-68.4	164.8	0	0	0	110.6	A17 V18 G23 V24 V25	A17-I21 WeakPolarHBondContact O-CB 3.35Å; A17-I21 VanDerWaalsContact O-CG1 3.22Å; A17-I21 WeakPolarHBondContact O-CG1 3.13Å; A17-I21 PolarHBondContact O-N 3.02Å; V18-I21 PolarHBondContact O-N 3.14Å; I21-G23 VanDerWaalsContact C-N 3.34Å; I21-G23 PolarHBondContact O-N 2.87Å; I21-V24 PolarHBondContact O-N 3.2Å; I21-V25 HydrophobicContact CG2-CG2 4.11Å; I21-V25 WeakPolarHBondContact O-CB 3.37Å; I21-V25 VanDerWaalsContact O-CG2 3.25Å; I21-V25 WeakPolarHBondContact O-CG2 3.27Å; I21-V25 PolarHBondContact O-N 3.46Å
22	S	71.3	Confident	70	Confident	61 Å²	61	87.2 Å²	87.2	43%	0.427	53%	0.525	S	S	.	.	H	α-helix	trans	-62.5	-41.8	176.3	50.5	0	0	0	0	111	V18 V19 V24 V25 L26	V18-S22 WeakPolarHBondContact O-CB 3.49Å; V18-S22 PolarHBondContact O-N 2.97Å; V18-S22 PolarHBondContact O-OG 3.04Å; V19-S22 VanDerWaalsContact CA-OG 3.31Å; V19-S22 WeakPolarHBondContact CA-OG 3.41Å; V19-S22 PolarHBondContact O-OG 3.01Å; S22-V24 VanDerWaalsContact C-N 3.34Å; S22-V24 PolarHBondContact O-N 2.78Å; S22-V25 PolarHBondContact O-N 3.44Å; S22-L26 WeakPolarHBondContact O-CB 3.25Å; S22-L26 PolarHBondContact O-N 2.77Å
23	G	72.7	Confident	70.3	Confident	43 Å²	43	92.5 Å²	92.5	44%	0.443	54%	0.541	S	S	.	.	H	α-helix	trans	-59.8	-39.7	172.5	0	0	0	0	0	113.5	V19 A20 I21 G27	V19-G23 PolarHBondContact O-N 3.35Å; A20-G23 PolarHBondContact O-N 2.94Å; I21-G23 VanDerWaalsContact C-N 3.34Å; I21-G23 PolarHBondContact O-N 2.87Å; G23-G27 PolarHBondContact O-N 2.69Å
24	V	75.7	Confident	71.2	Confident	91 Å²	91	99.1 Å²	99.1	55%	0.552	56%	0.559	S	S	*	*	H	α-helix	trans	-69.7	-45	175.2	170.6	0	0	0	0	111.3	A20 I21 S22 G27 L28	A20-V24 VanDerWaalsContact O-CG2 3.27Å; A20-V24 WeakPolarHBondContact O-CG2 3.43Å; A20-V24 PolarHBondContact O-N 2.81Å; I21-V24 PolarHBondContact O-N 3.2Å; S22-V24 VanDerWaalsContact C-N 3.34Å; S22-V24 PolarHBondContact O-N 2.78Å; V24-G27 CarbonylContact O-C 3.57Å; V24-G27 PolarHBondContact O-N 2.91Å; V24-L28 HydrophobicContact CG1-CD1 3.98Å; V24-L28 HydrophobicContact CG1-CG 4.37Å; V24-L28 WeakPolarHBondContact O-CB 3.22Å; V24-L28 VanDerWaalsContact O-CG 3.23Å; V24-L28 WeakPolarHBondContact O-CG 3.45Å; V24-L28 PolarHBondContact O-N 2.86Å
25	V	74.4	Confident	72	Confident	70 Å²	70	99 Å²	99	42%	0.424	56%	0.556	S	S	.	*	H	α-helix	trans	-64.3	-45.2	178	170.5	0	0	0	0	110.2	I21 S22 L28 I29	I21-V25 HydrophobicContact CG2-CG2 4.11Å; I21-V25 WeakPolarHBondContact O-CB 3.37Å; I21-V25 VanDerWaalsContact O-CG2 3.25Å; I21-V25 WeakPolarHBondContact O-CG2 3.27Å; I21-V25 PolarHBondContact O-N 3.46Å; S22-V25 PolarHBondContact O-N 3.44Å; V25-L28 PolarHBondContact O-N 2.87Å; V25-I29 HydrophobicContact CG1-CD1 3.66Å; V25-I29 HydrophobicContact CG1-CG1 4.35Å; V25-I29 WeakPolarHBondContact O-CB 3.3Å; V25-I29 WeakPolarHBondContact O-CG1 3.48Å; V25-I29 PolarHBondContact O-N 3.49Å
26	L	67.9	Low	73	Confident	102 Å²	102	100.7 Å²	100.7	53%	0.534	56%	0.557	S	S	.	*	H	α-helix	trans	-59.7	-48.2	173.1	-147.3	73.1	0	0	0	109.2	S22 L28 I29 F30	S22-L26 WeakPolarHBondContact O-CB 3.25Å; S22-L26 PolarHBondContact O-N 2.77Å; L26-L28 VanDerWaalsContact C-N 3.27Å; L26-L28 PolarHBondContact O-N 3.19Å; L26-I29 PolarHBondContact O-N 3.22Å; L26-I29 VanDerWaalsContact O-N 3.14Å; L26-F30 HydrophobicContact CB-CD2 4.46Å; L26-F30 HydrophobicContact CD1-CD2 4.19Å; L26-F30 HydrophobicContact CD1-CE2 3.66Å; L26-F30 HydrophobicContact CD2-CE2 4.4Å; L26-F30 HydrophobicContact CG-CD2 3.69Å; L26-F30 HydrophobicContact CG-CE2 3.6Å; L26-F30 WeakPolarHBondContact O-CB 3.48Å; L26-F30 WeakPolarHBondContact O-CD2 3.39Å; L26-F30 PolarHBondContact O-N 3.07Å
27	G	69	Low	74.5	Confident	40 Å²	40	103.3 Å²	103.3	41%	0.412	56%	0.559	S	S	.	*	H	α-helix	trans	-60.3	-31.9	176.1	0	0	0	0	0	114.2	G23 V24 R31	G23-G27 PolarHBondContact O-N 2.69Å; V24-G27 CarbonylContact O-C 3.57Å; V24-G27 PolarHBondContact O-N 2.91Å; G27-R31 WeakPolarHBondContact O-CB 3.39Å; G27-R31 WeakPolarHBondContact O-CG 3.45Å; G27-R31 PolarHBondContact O-N 3.29Å
28	L	67.7	Low	75.9	Confident	100 Å²	100	101.4 Å²	101.4	52%	0.524	54%	0.543	S	S	.	.	H	α-helix	trans	-77.5	-37.5	174.1	-72.2	172.3	0	0	0	112.1	V24 V25 L26 R31	V24-L28 HydrophobicContact CG1-CD1 3.98Å; V24-L28 HydrophobicContact CG1-CG 4.37Å; V24-L28 WeakPolarHBondContact O-CB 3.22Å; V24-L28 VanDerWaalsContact O-CG 3.23Å; V24-L28 WeakPolarHBondContact O-CG 3.45Å; V24-L28 PolarHBondContact O-N 2.86Å; V25-L28 PolarHBondContact O-N 2.87Å; L26-L28 VanDerWaalsContact C-N 3.27Å; L26-L28 PolarHBondContact O-N 3.19Å; L28-R31 PolarHBondContact O-N 3.4Å
29	I	70.2	Confident	76.9	Confident	120 Å²	120	97.3 Å²	97.3	62%	0.615	52%	0.518	S	S	*	.	H	α-helix	trans	-68.2	-41.6	176	-70.8	167.9	0	0	0	110.7	V25 L26 R31	V25-I29 HydrophobicContact CG1-CD1 3.66Å; V25-I29 HydrophobicContact CG1-CG1 4.35Å; V25-I29 WeakPolarHBondContact O-CB 3.3Å; V25-I29 WeakPolarHBondContact O-CG1 3.48Å; V25-I29 PolarHBondContact O-N 3.49Å; L26-I29 PolarHBondContact O-N 3.22Å; L26-I29 VanDerWaalsContact O-N 3.14Å; I29-R31 VanDerWaalsContact C-N 3.34Å
30	F	68.9	Low	77.6	Confident	150 Å²	150	98 Å²	98	66%	0.658	52%	0.522	S	S	*	.	S	Bend	trans	-89.7	3.6	178.5	-70.4	-76.8	0	0	0	113.4	L26 P32	L26-F30 HydrophobicContact CB-CD2 4.46Å; L26-F30 HydrophobicContact CD1-CD2 4.19Å; L26-F30 HydrophobicContact CD1-CE2 3.66Å; L26-F30 HydrophobicContact CD2-CE2 4.4Å; L26-F30 HydrophobicContact CG-CD2 3.69Å; L26-F30 HydrophobicContact CG-CE2 3.6Å; L26-F30 WeakPolarHBondContact O-CB 3.48Å; L26-F30 WeakPolarHBondContact O-CD2 3.39Å; L26-F30 PolarHBondContact O-N 3.07Å; F30-P32 WeakPolarHBondContact O-CD 3.23Å
31	R	67.3	Low	78.5	Confident	174 Å²	174	98.1 Å²	98.1	66%	0.657	52%	0.515	S	S	*	.	S	Bend	trans	-62.6	123	172.4	-117.3	179.3	-176.5	179.1	1	107.8	G27 L28 I29 K33	G27-R31 WeakPolarHBondContact O-CB 3.39Å; G27-R31 WeakPolarHBondContact O-CG 3.45Å; G27-R31 PolarHBondContact O-N 3.29Å; L28-R31 PolarHBondContact O-N 3.4Å; I29-R31 VanDerWaalsContact C-N 3.34Å; R31-K33 PolarHBondContact O-N 3.03Å
32	P	64.9	Low	79.2	Confident	118 Å²	118	97 Å²	97	77%	0.766	51%	0.51	S	S	*	.	P	Polyproline II helix	trans	-58.8	118	179.9	21.9	-30.9	0	0	0	108.4	F30 K34	F30-P32 WeakPolarHBondContact O-CD 3.23Å; P32-K34 PolarHBondContact O-N 2.81Å
33	K	72.4	Confident	80.3	Confident	196 Å²	196	100.2 Å²	100.2	85%	0.852	52%	0.522	S	S	*	.	P	Polyproline II helix	trans	-58.1	132.4	175.5	-71.1	-175	179.8	177.4	0	108	R31	R31-K33 PolarHBondContact O-N 3.03Å
34	K	81.3	Confident	81.4	Confident	195 Å²	195	101.2 Å²	101.2	85%	0.848	52%	0.52	S	S	*	.	P	Polyproline II helix	trans	-55.8	134.5	171.9	-71	-174	178.9	-178.6	0	108.2	P32	P32-K34 PolarHBondContact O-N 2.81Å
35	P	85.3	Confident	82.4	Confident	59 Å²	59	101.3 Å²	101.3	38%	0.383	51%	0.513	S	S	.	.	P	Polyproline II helix	trans	-62.8	147.6	-179.6	27.4	-34.2	0	0	0	110	V73	P35-V73 HydrophobicContact CB-CB 4.42Å; P35-V73 HydrophobicContact CB-CG1 3.66Å; P35-V73 HydrophobicContact CB-CG2 3.95Å; P35-V73 HydrophobicContact CG-CG1 4.03Å; P35-V73 HydrophobicContact CG-CG2 3.96Å
36	K	93.6	Very high	83.6	Confident	122 Å²	122	99.1 Å²	99.1	53%	0.53	50%	0.499	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.5	137.3	172.7	-64.1	179.8	178.7	179.2	0	108.4	H72 V73	K36-H72 VanDerWaalsContact CB-CD2 3.48Å; K36-H72 WeakPolarHBondContact CB-CD2 3.24Å; K36-H72 WeakPolarHBondContact CB-NE2 3.35Å; K36-H72 VanDerWaalsContact CD-CE1 3.49Å; K36-H72 WeakPolarHBondContact CD-CE1 3.38Å; K36-H72 CarbonylContact O-C 3.56Å; K36-H72 VanDerWaalsContact O-CA 3.24Å; K36-H72 WeakPolarHBondContact O-CA 3.44Å; K36-V73 PolarHBondContact O-N 3.29Å
37	K	96.6	Very high	85	Confident	123 Å²	123	97.7 Å²	97.7	54%	0.535	50%	0.496	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.2	136	178.7	-67.8	-172.5	174.3	-167.4	0	110.2	V73	K37-V73 HydrophobicContact CG-CG2 4.26Å
38	T	97.9	Very high	86.4	Confident	8 Å²	8	95.9 Å²	95.9	5%	0.049	48%	0.477	C	S	.	.	S	Bend	trans	-78.2	-46	177.8	-56	0	0	0	0	111	V40 V46 L48 L67 P68 V73 L74	T38-V40 PolarHBondContact O-N 3.03Å; T38-V46 HydrophobicContact CG2-CG1 4.03Å; T38-L48 HydrophobicContact CG2-CD2 3.95Å; T38-L67 HydrophobicContact CG2-CD2 4.18Å; T38-P68 HydrophobicContact CG2-CG 3.99Å; T38-P68 WeakPolarHBondContact OG1-CD 3.2Å; T38-V73 WeakPolarHBondContact CB-O 3.39Å; T38-V73 PolarHBondContact N-O 2.99Å; T38-V73 PolarHBondContact OG1-O 3.23Å; T38-L74 PolarHBondContact N-O 3.26Å
39	L	96.4	Very high	87.9	Confident	11 Å²	11	95.7 Å²	95.7	6%	0.058	47%	0.469	C	S	.	.			trans	-82.4	104.5	173.3	-57.1	175.9	0	0	0	109	L74 L76 V82 V145	L39-L74 WeakPolarHBondContact CB-O 3.47Å; L39-L74 HydrophobicContact CD1-CD1 4.03Å; L39-L74 HydrophobicContact CD1-CD2 4.4Å; L39-L74 HydrophobicContact CD1-CG 3.85Å; L39-L74 HydrophobicContact CD2-CD1 4.38Å; L39-L74 HydrophobicContact CG-CD1 3.94Å; L39-L74 HydrophobicContact CG-CG 4.18Å; L39-L74 WeakPolarHBondContact CG-O 3.24Å; L39-L74 PolarHBondContact N-O 3.18Å; L39-L76 HydrophobicContact CD1-CB 4.05Å; L39-L76 HydrophobicContact CD1-CD1 3.64Å; L39-L76 HydrophobicContact CD1-CG 4.46Å; L39-V82 HydrophobicContact CD1-CG1 3.64Å; L39-V82 HydrophobicContact CD2-CG1 4.32Å; L39-V145 HydrophobicContact CD2-CG1 4.48Å
40	V	89.4	Confident	89.3	Confident	109 Å²	109	90 Å²	90	66%	0.661	44%	0.44	S	S	*	.			trans	-92.5	-33.3	-179.8	-67.7	0	0	0	0	112.7	T38	T38-V40 PolarHBondContact O-N 3.03Å
41	D	91.3	Very high	90.7	Very high	61 Å²	61	85.4 Å²	85.4	33%	0.326	42%	0.424	S	S	.	.	S	Bend	trans	-152	167.8	174.8	70.5	80	0	0	0	109.8	D43 T44 G147	D41-D43 VanDerWaalsContact C-N 3.3Å; D41-D43 PolarHBondContact O-N 3.47Å; D41-D43 WeakPolarHBondContact OD1-CA 3.43Å; D41-D43 PolarHBondContact OD1-N 2.79Å; D41-T44 VanDerWaalsContact CG-OG1 3.28Å; D41-T44 PolarHBondContact OD1-N 3.27Å; D41-T44 PolarHBondContact OD1-OG1 3.47Å; D41-T44 VanDerWaalsContact OD2-CB 3.24Å; D41-T44 WeakPolarHBondContact OD2-CB 3.43Å; D41-T44 PolarHBondContact OD2-OG1 3Å; D41-G147 CarbonylContact C-O 3.52Å
42	N	90.2	Very high	92.2	Very high	85 Å²	85	80.4 Å²	80.4	46%	0.455	41%	0.411	S	S	.	.	S	Bend	trans	-74.3	-16.9	-169.9	-60.4	-9.1	0	0	0	114.5	G147 P148	N42-G147 WeakPolarHBondContact CA-O 3.43Å; N42-P148 VanDerWaalsContact CG-O 3.26Å; N42-P148 WeakPolarHBondContact OD1-CD 3.48Å; N42-P148 VanDerWaalsContact OD1-CG 3.27Å; N42-P148 WeakPolarHBondContact OD1-CG 3.25Å; N42-P148 PolarHBondContact OD1-O 3.49Å
43	D	93.1	Very high	93.8	Very high	128 Å²	128	78 Å²	78	68%	0.684	39%	0.386	S	S	*	.	S	Bend	trans	-109.4	-28.6	-167.7	-65	-47	0	0	0	112.4	D41 K45	D41-D43 VanDerWaalsContact C-N 3.3Å; D41-D43 PolarHBondContact O-N 3.47Å; D41-D43 WeakPolarHBondContact OD1-CA 3.43Å; D41-D43 PolarHBondContact OD1-N 2.79Å; D43-K45 PolarHBondContact O-N 2.81Å
44	T	96.8	Very high	94.9	Very high	64 Å²	64	71 Å²	71	39%	0.393	36%	0.362	S	S	.	.			trans	-62.7	122.7	176	-68.4	0	0	0	0	110.9	D41 V46	D41-T44 VanDerWaalsContact CG-OG1 3.28Å; D41-T44 PolarHBondContact OD1-N 3.27Å; D41-T44 PolarHBondContact OD1-OG1 3.47Å; D41-T44 VanDerWaalsContact OD2-CB 3.24Å; D41-T44 WeakPolarHBondContact OD2-CB 3.43Å; D41-T44 PolarHBondContact OD2-OG1 3Å; T44-V46 HydrophobicContact CG2-CG2 4.26Å
45	K	97	Very high	95.7	Very high	93 Å²	93	66.8 Å²	66.8	40%	0.404	34%	0.344	S	S	.	.			trans	-84.6	127.1	171.3	-66	-179.2	179.1	-170.5	0	109.6	D43 S85 D144 R146	D43-K45 PolarHBondContact O-N 2.81Å; K45-S85 PolarHBondContact NZ-OG 3.18Å; K45-D144 HydrophobicContact CB-CB 4.38Å; K45-D144 HydrophobicContact CD-CB 4.31Å; K45-R146 HydrophobicContact CG-CB 4.28Å
46	V	98	Very high	96.2	Very high	24 Å²	24	67.1 Å²	67.1	15%	0.145	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	118.1	175	-172.6	0	0	0	0	108	T38 T44 L48 V145	T38-V46 HydrophobicContact CG2-CG1 4.03Å; T44-V46 HydrophobicContact CG2-CG2 4.26Å; V46-L48 HydrophobicContact CB-CD2 4.49Å; V46-L48 HydrophobicContact CG1-CD2 3.74Å; V46-L48 PolarHBondContact O-N 2.78Å; V46-V145 PolarHBondContact N-O 3.27Å; V46-V145 PolarHBondContact O-N 3.04Å
47	P	98.4	Very high	96.3	Very high	72 Å²	72	62.4 Å²	62.4	47%	0.468	32%	0.323	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.4	118	174.4	29.3	-32.8	0	0	0	109	F142	P47-F142 HydrophobicContact CB-CB 4.5Å; P47-F142 HydrophobicContact CB-CD1 4.1Å
48	L	98.8	Very high	96.2	Very high	2 Å²	2	61 Å²	61	1%	0.01	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	137	176.4	-58.3	-173.2	0	0	0	110.7	T38 V46 L65 L67 V109 F142 I143 V145	T38-L48 HydrophobicContact CG2-CD2 3.95Å; V46-L48 HydrophobicContact CB-CD2 4.49Å; V46-L48 HydrophobicContact CG1-CD2 3.74Å; V46-L48 PolarHBondContact O-N 2.78Å; L48-L65 HydrophobicContact CB-CB 3.99Å; L48-L65 HydrophobicContact CB-CD1 4.11Å; L48-L65 HydrophobicContact CD1-CB 4.33Å; L48-L65 HydrophobicContact CD1-CD1 4.33Å; L48-L67 HydrophobicContact CD1-CD2 4.15Å; L48-V109 HydrophobicContact CD1-CG1 4.28Å; L48-F142 WeakPolarHBondContact O-CA 3.44Å; L48-I143 PolarHBondContact N-O 3.41Å; L48-I143 PolarHBondContact O-N 2.88Å; L48-V145 HydrophobicContact CB-CG2 4.21Å; L48-V145 HydrophobicContact CD1-CB 4.1Å; L48-V145 HydrophobicContact CD1-CG1 4.43Å; L48-V145 HydrophobicContact CD1-CG2 3.79Å; L48-V145 HydrophobicContact CG-CB 4.25Å; L48-V145 HydrophobicContact CG-CG2 3.91Å
49	R	98.7	Very high	96.1	Very high	95 Å²	95	61.7 Å²	61.7	36%	0.358	32%	0.322	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83	135.4	-175.7	-172	173	58.8	81.5	4.8	110.9	V51 L65 G66 D140 G141 F142	R49-V51 PolarHBondContact O-N 3.22Å; R49-L65 CarbonylContact O-C 3.58Å; R49-L65 VanDerWaalsContact O-CA 3.27Å; R49-L65 WeakPolarHBondContact O-CA 3.45Å; R49-G66 PolarHBondContact O-N 3.31Å; R49-D140 WeakPolarHBondContact CD-OD1 3.31Å; R49-D140 IonicContact CZ-OD1 2.93Å; R49-D140 IonicContact NE-OD1 2.64Å; R49-D140 IonicContact NH1-OD1 2.69Å; R49-D140 PolarHBondContact NH1-OD1 2.85Å; R49-G141 CarbonylContact C-O 3.18Å; R49-G141 WeakPolarHBondContact CA-O 3.39Å; R49-F142 HydrophobicContact CB-CD1 4.04Å; R49-F142 HydrophobicContact CB-CE1 3.64Å; R49-F142 HydrophobicContact CB-CZ 3.98Å; R49-F142 HydrophobicContact CG-CE1 4.18Å; R49-F142 HydrophobicContact CG-CE2 4.35Å; R49-F142 HydrophobicContact CG-CZ 4.01Å
50	V	98.8	Very high	96.2	Very high	0 Å²	0	61.1 Å²	61.1	0%	0	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.9	111.9	168.5	-179.4	0	0	0	0	108.7	R53 L63 L65 L137 D140 G141	V50-R53 HydrophobicContact CG1-CB 4.47Å; V50-L63 HydrophobicContact CG1-CD1 3.79Å; V50-L63 HydrophobicContact CG2-CD1 4.05Å; V50-L65 HydrophobicContact CB-CD2 4.45Å; V50-L65 HydrophobicContact CG2-CD2 3.87Å; V50-L137 HydrophobicContact CG2-CD2 3.53Å; V50-L137 HydrophobicContact CG2-CG 3.85Å; V50-D140 PolarHBondContact O-N 2.83Å; V50-G141 PolarHBondContact N-O 3.46Å
51	V	98.6	Very high	96.7	Very high	54 Å²	54	56 Å²	56	33%	0.327	29%	0.288	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.3	-42.3	176.6	177.2	0	0	0	0	110.4	R49 K64 G66	R49-V51 PolarHBondContact O-N 3.22Å; V51-K64 HydrophobicContact CB-CD 4.37Å; V51-K64 HydrophobicContact CB-CG 4.15Å; V51-K64 HydrophobicContact CG1-CD 4.26Å; V51-K64 PolarHBondContact N-O 2.87Å; V51-G66 VanDerWaalsContact CG2-N 3.35Å
52	D	98.5	Very high	97	Very high	69 Å²	69	56.4 Å²	56.4	37%	0.369	29%	0.285	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.8	152.4	-179	179.8	40.2	0	0	0	109.9	K64	D52-K64 HydrophobicContact CB-CB 4.04Å; D52-K64 HydrophobicContact CB-CD 4.42Å; D52-K64 PolarHBondContact N-O 2.59Å; D52-K64 PolarHBondContact O-N 3.48Å
53	R	97.8	Very high	97.4	Very high	67 Å²	67	52.4 Å²	52.4	25%	0.253	26%	0.263	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.3	124.8	173	-176.4	-167.8	61.1	-136.2	-9.3	110.1	V50 I61 R62 L63 L134 A135 N136 L137	V50-R53 HydrophobicContact CG1-CB 4.47Å; R53-I61 HydrophobicContact CG-CB 4.23Å; R53-I61 HydrophobicContact CG-CD1 4.1Å; R53-I61 HydrophobicContact CG-CG2 4.45Å; R53-R62 WeakPolarHBondContact CA-O 3.38Å; R53-L63 HydrophobicContact CB-CD1 4.1Å; R53-L63 HydrophobicContact CG-CD1 4.16Å; R53-L134 WeakPolarHBondContact CD-O 3.49Å; R53-L134 PolarHBondContact NH1-O 2.8Å; R53-A135 PolarHBondContact NE-O 2.74Å; R53-A135 VanDerWaalsContact NH1-C 3.31Å; R53-A135 PolarHBondContact NH1-O 3.43Å; R53-A135 VanDerWaalsContact NH1-O 3.09Å; R53-N136 VanDerWaalsContact NH1-C 3.29Å; R53-L137 VanDerWaalsContact NH1-C 3.33Å; R53-L137 PolarHBondContact NH1-O 3.01Å
54	S	97	Very high	97.7	Very high	49 Å²	49	49.1 Å²	49.1	34%	0.343	24%	0.243	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-137	149.9	176.6	53.9	0	0	0	0	111.2	I61 R62	S54-I61 CarbonylContact O-C 3.54Å; S54-I61 WeakPolarHBondContact O-CA 3.23Å; S54-R62 PolarHBondContact N-O 3.21Å; S54-R62 VanDerWaalsContact N-O 3.12Å; S54-R62 PolarHBondContact O-N 2.88Å
55	F	97.3	Very high	97.8	Very high	107 Å²	107	46.1 Å²	46.1	47%	0.469	22%	0.224	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.5	124.9	168	-82.7	-89.2	0	0	0	108.8	T57 T60 I61 V115	F55-T57 WeakPolarHBondContact CB-O 3.41Å; F55-T60 CarbonylContact C-O 3.57Å; F55-T60 WeakPolarHBondContact CA-O 3.4Å; F55-I61 HydrophobicContact CD1-CG2 3.75Å; F55-I61 HydrophobicContact CD2-CG2 3.99Å; F55-I61 HydrophobicContact CE1-CG2 3.62Å; F55-I61 HydrophobicContact CE2-CG2 3.86Å; F55-I61 HydrophobicContact CG-CG2 3.93Å; F55-I61 HydrophobicContact CZ-CG2 3.68Å; F55-V115 HydrophobicContact CE1-CG2 4.29Å
56	I	96.3	Very high	97.9	Very high	66 Å²	66	42.1 Å²	42.1	34%	0.338	21%	0.21	S	C	.	.	S	Bend	trans	-101	-18.7	175.5	61.6	167.9	0	0	0	112	T60 R62 V112 I220 L221	I56-T60 HydrophobicContact CD1-CG2 4.15Å; I56-T60 HydrophobicContact CG1-CG2 4.02Å; I56-T60 WeakPolarHBondContact CG1-O 3.48Å; I56-T60 PolarHBondContact N-O 2.81Å; I56-R62 HydrophobicContact CG2-CB 3.72Å; I56-V112 HydrophobicContact CD1-CG1 3.81Å; I56-V112 HydrophobicContact CD1-CG2 3.96Å; I56-I220 HydrophobicContact CD1-CG2 4.39Å; I56-L221 HydrophobicContact CD1-CD2 4.28Å
57	T	95.1	Very high	97.9	Very high	24 Å²	24	41.7 Å²	41.7	15%	0.147	21%	0.207	C	C	.	.	S	Bend	trans	-133.2	-177	163.6	78	0	0	0	0	108.6	F55 D59 T60 I220	F55-T57 WeakPolarHBondContact CB-O 3.41Å; T57-D59 PolarHBondContact O-N 2.91Å; T57-D59 VanDerWaalsContact O-N 3.16Å; T57-D59 PolarHBondContact OG1-N 2.96Å; T57-D59 PolarHBondContact OG1-OD1 2.81Å; T57-T60 PolarHBondContact N-O 2.86Å; T57-T60 WeakPolarHBondContact OG1-CB 3.37Å; T57-T60 PolarHBondContact OG1-N 2.79Å; T57-T60 VanDerWaalsContact OG1-N 3.08Å; T57-T60 PolarHBondContact OG1-OG1 3.32Å; T57-I220 HydrophobicContact CG2-CG1 4.39Å
58	H	95	Very high	97.9	Very high	93 Å²	93	41.7 Å²	41.7	43%	0.431	21%	0.207	S	C	.	.	S	Bend	trans	-62.6	-18.4	177.3	69.5	-80.9	0	0	0	114.8	D218	H58-D218 IonicContact CE1-OD1 3.27Å; H58-D218 PolarHBondContact CE1-OD1 3.5Å; H58-D218 VanDerWaalsContact CE1-OD1 3.24Å; H58-D218 IonicContact NE2-OD1 3.7Å
59	D	96	Very high	97.8	Very high	22 Å²	22	44.3 Å²	44.3	12%	0.118	22%	0.223	C	C	.	.	S	Bend	trans	-139.3	6.1	-177.8	70.9	5.3	0	0	0	114.2	T57 K114 V115	T57-D59 PolarHBondContact O-N 2.91Å; T57-D59 VanDerWaalsContact O-N 3.16Å; T57-D59 PolarHBondContact OG1-N 2.96Å; T57-D59 PolarHBondContact OG1-OD1 2.81Å; D59-K114 VanDerWaalsContact CG-CE 3.45Å; D59-K114 IonicContact OD1-NZ 2.97Å; D59-K114 WeakPolarHBondContact OD2-CE 3.45Å; D59-K114 IonicContact OD2-NZ 2.72Å; D59-K114 PolarHBondContact OD2-NZ 3.4Å; D59-V115 WeakPolarHBondContact O-CA 3.36Å; D59-V115 VanDerWaalsContact O-CB 3.31Å; D59-V115 WeakPolarHBondContact O-CB 3.44Å; D59-V115 PolarHBondContact O-N 3.24Å
60	T	98.5	Very high	97.6	Very high	0 Å²	0	43.5 Å²	43.5	0%	0	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	129.5	-176.8	-61.3	0	0	0	0	110.4	F55 I56 T57 V112 I113 I220	F55-T60 CarbonylContact C-O 3.57Å; F55-T60 WeakPolarHBondContact CA-O 3.4Å; I56-T60 HydrophobicContact CD1-CG2 4.15Å; I56-T60 HydrophobicContact CG1-CG2 4.02Å; I56-T60 WeakPolarHBondContact CG1-O 3.48Å; I56-T60 PolarHBondContact N-O 2.81Å; T57-T60 PolarHBondContact N-O 2.86Å; T57-T60 WeakPolarHBondContact OG1-CB 3.37Å; T57-T60 PolarHBondContact OG1-N 2.79Å; T57-T60 VanDerWaalsContact OG1-N 3.08Å; T57-T60 PolarHBondContact OG1-OG1 3.32Å; T60-V112 HydrophobicContact CG2-CG1 3.42Å; T60-V112 VanDerWaalsContact CG2-CG1 3.42Å; T60-I113 WeakPolarHBondContact CA-O 3.3Å; T60-I220 HydrophobicContact CG2-CD1 3.94Å; T60-I220 HydrophobicContact CG2-CG1 4.06Å; T60-I220 HydrophobicContact CG2-CG2 4.28Å
61	I	98.5	Very high	97.4	Very high	0 Å²	0	48.3 Å²	48.3	0%	0	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.5	147.4	176.4	64	173.7	0	0	0	111.2	R53 S54 F55 L63 V112 I113 V115 L134 A135	R53-I61 HydrophobicContact CG-CB 4.23Å; R53-I61 HydrophobicContact CG-CD1 4.1Å; R53-I61 HydrophobicContact CG-CG2 4.45Å; S54-I61 CarbonylContact O-C 3.54Å; S54-I61 WeakPolarHBondContact O-CA 3.23Å; F55-I61 HydrophobicContact CD1-CG2 3.75Å; F55-I61 HydrophobicContact CD2-CG2 3.99Å; F55-I61 HydrophobicContact CE1-CG2 3.62Å; F55-I61 HydrophobicContact CE2-CG2 3.86Å; F55-I61 HydrophobicContact CG-CG2 3.93Å; F55-I61 HydrophobicContact CZ-CG2 3.68Å; I61-L63 HydrophobicContact CD1-CB 4.43Å; I61-V112 CarbonylContact O-C 3.5Å; I61-V112 WeakPolarHBondContact O-CA 3.34Å; I61-I113 HydrophobicContact CD1-CB 4.39Å; I61-I113 HydrophobicContact CG1-CB 3.91Å; I61-I113 WeakPolarHBondContact CG1-O 3.36Å; I61-I113 PolarHBondContact N-O 3.4Å; I61-I113 PolarHBondContact O-N 3.3Å; I61-V115 HydrophobicContact CG1-CG2 4.27Å; I61-V115 HydrophobicContact CG2-CG2 3.99Å; I61-L134 HydrophobicContact CD1-CB 4.42Å; I61-A135 HydrophobicContact CD1-CB 4.31Å
62	R	98.6	Very high	97.4	Very high	71 Å²	71	46.9 Å²	46.9	27%	0.268	25%	0.252	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.2	121.7	155	-172.7	175.2	-170	147.4	3.2	107.7	R53 S54 I56 D110 F111 E224	R53-R62 WeakPolarHBondContact CA-O 3.38Å; S54-R62 PolarHBondContact N-O 3.21Å; S54-R62 VanDerWaalsContact N-O 3.12Å; S54-R62 PolarHBondContact O-N 2.88Å; I56-R62 HydrophobicContact CG2-CB 3.72Å; R62-D110 HydrophobicContact CG-CB 4.47Å; R62-D110 IonicContact CZ-OD2 3.63Å; R62-D110 VanDerWaalsContact CZ-OD2 3.27Å; R62-D110 IonicContact NE-OD2 3.4Å; R62-D110 PolarHBondContact NE-OD2 3.03Å; R62-D110 IonicContact NH2-OD2 3.63Å; R62-D110 PolarHBondContact NH2-OD2 2.88Å; R62-F111 CarbonylContact C-O 3.53Å; R62-F111 WeakPolarHBondContact CA-O 3.31Å; R62-E224 IonicContact NH1-OE1 3.63Å
63	L	98.8	Very high	97.4	Very high	0 Å²	0	43.6 Å²	43.6	0%	0	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	115.3	178.6	-178.5	70.3	0	0	0	108.8	V50 R53 I61 L65 F84 D110 F111 I113 L134	V50-L63 HydrophobicContact CG1-CD1 3.79Å; V50-L63 HydrophobicContact CG2-CD1 4.05Å; R53-L63 HydrophobicContact CB-CD1 4.1Å; R53-L63 HydrophobicContact CG-CD1 4.16Å; I61-L63 HydrophobicContact CD1-CB 4.43Å; L63-L65 HydrophobicContact CD1-CD2 4.36Å; L63-L65 HydrophobicContact CD2-CD2 4Å; L63-L65 HydrophobicContact CD2-CG 4.41Å; L63-L65 HydrophobicContact CG-CD2 3.93Å; L63-L65 HydrophobicContact CG-CG 4.36Å; L63-F84 HydrophobicContact CD2-CE2 4.09Å; L63-D110 WeakPolarHBondContact O-CA 3.3Å; L63-F111 PolarHBondContact N-O 3.01Å; L63-F111 PolarHBondContact O-N 2.92Å; L63-I113 HydrophobicContact CB-CD1 4.18Å; L63-I113 HydrophobicContact CD2-CD1 3.92Å; L63-L134 HydrophobicContact CD2-CB 4.44Å; L63-L134 HydrophobicContact CD2-CD2 4.07Å
64	K	98.8	Very high	97.4	Very high	60 Å²	60	40.8 Å²	40.8	26%	0.261	22%	0.224	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.8	119.3	176.3	-177.1	173.3	-68.9	170.5	0	109.8	V51 D52 Y108 D110	V51-K64 HydrophobicContact CB-CD 4.37Å; V51-K64 HydrophobicContact CB-CG 4.15Å; V51-K64 HydrophobicContact CG1-CD 4.26Å; V51-K64 PolarHBondContact N-O 2.87Å; D52-K64 HydrophobicContact CB-CB 4.04Å; D52-K64 HydrophobicContact CB-CD 4.42Å; D52-K64 PolarHBondContact N-O 2.59Å; D52-K64 PolarHBondContact O-N 3.48Å; K64-Y108 HydrophobicContact CD-CD2 4.03Å; K64-Y108 HydrophobicContact CD-CG 4.28Å; K64-Y108 HydrophobicContact CG-CD2 3.97Å; K64-Y108 HydrophobicContact CG-CG 4.33Å; K64-D110 WeakPolarHBondContact CA-OD1 3.36Å; K64-D110 WeakPolarHBondContact CB-OD1 3.33Å; K64-D110 WeakPolarHBondContact CE-OD1 3.5Å; K64-D110 WeakPolarHBondContact CG-OD1 3.38Å
65	L	98.9	Very high	97.4	Very high	0 Å²	0	38.8 Å²	38.8	0%	0	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105	135.1	174.9	-55.9	-178.3	0	0	0	110.4	L48 R49 V50 L63 F84 Y108 V109 F111 I143 V145	L48-L65 HydrophobicContact CB-CB 3.99Å; L48-L65 HydrophobicContact CB-CD1 4.11Å; L48-L65 HydrophobicContact CD1-CB 4.33Å; L48-L65 HydrophobicContact CD1-CD1 4.33Å; R49-L65 CarbonylContact O-C 3.58Å; R49-L65 VanDerWaalsContact O-CA 3.27Å; R49-L65 WeakPolarHBondContact O-CA 3.45Å; V50-L65 HydrophobicContact CB-CD2 4.45Å; V50-L65 HydrophobicContact CG2-CD2 3.87Å; L63-L65 HydrophobicContact CD1-CD2 4.36Å; L63-L65 HydrophobicContact CD2-CD2 4Å; L63-L65 HydrophobicContact CD2-CG 4.41Å; L63-L65 HydrophobicContact CG-CD2 3.93Å; L63-L65 HydrophobicContact CG-CG 4.36Å; L65-F84 HydrophobicContact CD1-CE1 4.13Å; L65-F84 HydrophobicContact CD1-CE2 4.22Å; L65-F84 HydrophobicContact CD1-CZ 3.56Å; L65-Y108 CarbonylContact O-C 3.53Å; L65-Y108 WeakPolarHBondContact O-CA 3.28Å; L65-Y108 WeakPolarHBondContact O-CB 3.39Å; L65-V109 HydrophobicContact CB-CG1 3.93Å; L65-V109 PolarHBondContact N-O 2.8Å; L65-V109 PolarHBondContact O-N 3.01Å; L65-F111 HydrophobicContact CD1-CD2 4.14Å; L65-F111 HydrophobicContact CD1-CE2 3.9Å; L65-F111 HydrophobicContact CG-CD2 4.4Å; L65-F111 HydrophobicContact CG-CE2 4.45Å; L65-I143 HydrophobicContact CD1-CG2 3.56Å; L65-I143 HydrophobicContact CD2-CG2 3.88Å; L65-I143 HydrophobicContact CG-CG2 4.41Å; L65-V145 HydrophobicContact CD1-CG2 4.18Å
66	G	98.7	Very high	97.5	Very high	10 Å²	10	34.3 Å²	34.3	10%	0.103	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.6	130.7	174.9	0	0	0	0	0	110.2	R49 V51	R49-G66 PolarHBondContact O-N 3.31Å; V51-G66 VanDerWaalsContact CG2-N 3.35Å
67	L	98.7	Very high	97.5	Very high	14 Å²	14	32.8 Å²	32.8	7%	0.073	19%	0.187	C	C	.	.			trans	-78.9	164.6	171.1	-58	-179.9	0	0	0	110	T38 L48 T69 H72 V73 L74 G107 V109	T38-L67 HydrophobicContact CG2-CD2 4.18Å; L48-L67 HydrophobicContact CD1-CD2 4.15Å; L67-T69 PolarHBondContact O-N 3.36Å; L67-H72 HydrophobicContact CB-CB 3.82Å; L67-H72 HydrophobicContact CD1-CB 4.26Å; L67-H72 VanDerWaalsContact CD1-O 3.32Å; L67-H72 WeakPolarHBondContact CD1-O 3.32Å; L67-V73 VanDerWaalsContact CD1-C 3.43Å; L67-L74 HydrophobicContact CD2-CD1 4.16Å; L67-G107 PolarHBondContact N-O 2.97Å; L67-V109 HydrophobicContact CD2-CB 4.33Å; L67-V109 HydrophobicContact CD2-CG1 3.8Å
68	P	97.5	Very high	97.7	Very high	73 Å²	73	32.4 Å²	32.4	47%	0.474	18%	0.184	S	C	.	.	S	Bend	trans	-54.7	-33.2	-171.2	-29.4	36.1	0	0	0	114.9	T38	T38-P68 HydrophobicContact CG2-CG 3.99Å; T38-P68 WeakPolarHBondContact OG1-CD 3.2Å
69	T	96.7	Very high	97.8	Very high	57 Å²	57	28 Å²	28	35%	0.35	17%	0.165	S	C	.	.	S	Bend	trans	-145.2	166.8	169.8	79.6	0	0	0	0	110.6	L67 D71 H72 G107	L67-T69 PolarHBondContact O-N 3.36Å; T69-D71 PolarHBondContact O-N 3.29Å; T69-D71 VanDerWaalsContact O-N 3.07Å; T69-D71 PolarHBondContact OG1-N 2.59Å; T69-H72 PolarHBondContact N-ND1 3.25Å; T69-H72 WeakPolarHBondContact O-CB 3.27Å; T69-H72 PolarHBondContact O-N 2.89Å; T69-H72 PolarHBondContact OG1-CE1 2.88Å; T69-H72 PolarHBondContact OG1-ND1 3.12Å; T69-G107 WeakPolarHBondContact O-CA 3.4Å
70	A	95.5	Very high	97.9	Very high	78 Å²	78	27.7 Å²	27.7	65%	0.645	16%	0.163	S	C	*	.	T	Hydrogen-bonded Turn	trans	-58.6	-19.1	175.7	0	0	0	0	0	114.7	K106 G107	A70-K106 VanDerWaalsContact O-CB 3.3Å; A70-K106 WeakPolarHBondContact O-CB 3.49Å; A70-G107 PolarHBondContact O-N 2.82Å
71	D	95.6	Very high	97.9	Very high	101 Å²	101	28.8 Å²	28.8	54%	0.54	17%	0.168	S	C	.	.	T	Hydrogen-bonded Turn	trans	-92.4	-7.3	178.6	-66.7	-44.6	0	0	0	113.8	T69	T69-D71 PolarHBondContact O-N 3.29Å; T69-D71 VanDerWaalsContact O-N 3.07Å; T69-D71 PolarHBondContact OG1-N 2.59Å
72	H	98.1	Very high	97.9	Very high	24 Å²	24	28.8 Å²	28.8	11%	0.111	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.7	147.3	178.8	-76.8	73.7	0	0	0	111	K36 L67 T69 K106 G107	K36-H72 VanDerWaalsContact CB-CD2 3.48Å; K36-H72 WeakPolarHBondContact CB-CD2 3.24Å; K36-H72 WeakPolarHBondContact CB-NE2 3.35Å; K36-H72 VanDerWaalsContact CD-CE1 3.49Å; K36-H72 WeakPolarHBondContact CD-CE1 3.38Å; K36-H72 CarbonylContact O-C 3.56Å; K36-H72 VanDerWaalsContact O-CA 3.24Å; K36-H72 WeakPolarHBondContact O-CA 3.44Å; L67-H72 HydrophobicContact CB-CB 3.82Å; L67-H72 HydrophobicContact CD1-CB 4.26Å; L67-H72 VanDerWaalsContact CD1-O 3.32Å; L67-H72 WeakPolarHBondContact CD1-O 3.32Å; T69-H72 PolarHBondContact N-ND1 3.25Å; T69-H72 WeakPolarHBondContact O-CB 3.27Å; T69-H72 PolarHBondContact O-N 2.89Å; T69-H72 PolarHBondContact OG1-CE1 2.88Å; T69-H72 PolarHBondContact OG1-ND1 3.12Å; H72-K106 CarbonylContact O-C 3.51Å; H72-K106 VanDerWaalsContact O-CA 3.3Å; H72-K106 WeakPolarHBondContact O-CA 3.28Å; H72-G107 PolarHBondContact O-N 2.72Å
73	V	98.1	Very high	97.9	Very high	0 Å²	0	27.8 Å²	27.8	0%	0	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	167	159.7	-60.6	0	0	0	0	108.2	P35 K36 K37 T38 L67 G75 D103 K106	P35-V73 HydrophobicContact CB-CB 4.42Å; P35-V73 HydrophobicContact CB-CG1 3.66Å; P35-V73 HydrophobicContact CB-CG2 3.95Å; P35-V73 HydrophobicContact CG-CG1 4.03Å; P35-V73 HydrophobicContact CG-CG2 3.96Å; K36-V73 PolarHBondContact O-N 3.29Å; K37-V73 HydrophobicContact CG-CG2 4.26Å; T38-V73 WeakPolarHBondContact CB-O 3.39Å; T38-V73 PolarHBondContact N-O 2.99Å; T38-V73 PolarHBondContact OG1-O 3.23Å; L67-V73 VanDerWaalsContact CD1-C 3.43Å; V73-G75 VanDerWaalsContact C-N 3.31Å; V73-G75 PolarHBondContact O-N 3.09Å; V73-D103 HydrophobicContact CB-CB 3.91Å; V73-D103 HydrophobicContact CG1-CB 4.25Å; V73-D103 WeakPolarHBondContact CG1-O 3.49Å; V73-D103 HydrophobicContact CG2-CB 4.14Å; V73-K106 HydrophobicContact CG1-CG 3.98Å
74	L	98.4	Very high	97.9	Very high	8 Å²	8	27.8 Å²	27.8	4%	0.042	16%	0.164	C	C	.	.			trans	-65.5	-41.2	178.2	-175.8	64	0	0	0	110.2	T38 L39 L67 L76 V82 P99 D103 V109	T38-L74 PolarHBondContact N-O 3.26Å; L39-L74 WeakPolarHBondContact CB-O 3.47Å; L39-L74 HydrophobicContact CD1-CD1 4.03Å; L39-L74 HydrophobicContact CD1-CD2 4.4Å; L39-L74 HydrophobicContact CD1-CG 3.85Å; L39-L74 HydrophobicContact CD2-CD1 4.38Å; L39-L74 HydrophobicContact CG-CD1 3.94Å; L39-L74 HydrophobicContact CG-CG 4.18Å; L39-L74 WeakPolarHBondContact CG-O 3.24Å; L39-L74 PolarHBondContact N-O 3.18Å; L67-L74 HydrophobicContact CD2-CD1 4.16Å; L74-L76 HydrophobicContact CD2-CB 3.64Å; L74-L76 HydrophobicContact CD2-CD2 3.93Å; L74-L76 HydrophobicContact CD2-CG 4.35Å; L74-L76 HydrophobicContact CG-CB 3.97Å; L74-V82 HydrophobicContact CD2-CG1 4.4Å; L74-P99 HydrophobicContact CD2-CB 4.44Å; L74-P99 HydrophobicContact CD2-CG 3.85Å; L74-D103 PolarHBondContact N-OD1 2.9Å; L74-D103 VanDerWaalsContact N-OD1 3.17Å; L74-V109 HydrophobicContact CD1-CG1 4.44Å; L74-V109 HydrophobicContact CD2-CG2 3.9Å
75	G	97.1	Very high	97.9	Very high	7 Å²	7	25 Å²	25	7%	0.072	15%	0.153	C	C	.	.			trans	85.5	17	-177.6	0	0	0	0	0	113.1	V73 D103	V73-G75 VanDerWaalsContact C-N 3.31Å; V73-G75 PolarHBondContact O-N 3.09Å; G75-D103 WeakPolarHBondContact CA-OD2 3.41Å; G75-D103 PolarHBondContact N-OD1 3.21Å; G75-D103 PolarHBondContact N-OD2 3.09Å
76	L	97.9	Very high	97.9	Very high	12 Å²	12	25.5 Å²	25.5	6%	0.063	16%	0.156	C	C	.	.	P	Polyproline II helix	trans	-86.6	122.8	-174.9	-170.9	74.9	0	0	0	110.5	L39 L74 N80 V82 P99 P148	L39-L76 HydrophobicContact CD1-CB 4.05Å; L39-L76 HydrophobicContact CD1-CD1 3.64Å; L39-L76 HydrophobicContact CD1-CG 4.46Å; L74-L76 HydrophobicContact CD2-CB 3.64Å; L74-L76 HydrophobicContact CD2-CD2 3.93Å; L74-L76 HydrophobicContact CD2-CG 4.35Å; L74-L76 HydrophobicContact CG-CB 3.97Å; L76-N80 HydrophobicContact CD1-CB 3.98Å; L76-N80 WeakPolarHBondContact CD2-O 3.46Å; L76-N80 HydrophobicContact CG-CB 4.2Å; L76-V82 HydrophobicContact CD1-CG1 3.88Å; L76-V82 HydrophobicContact CD2-CG1 4.41Å; L76-P99 VanDerWaalsContact CD2-CD 3.45Å; L76-P99 HydrophobicContact CD2-CG 3.49Å; L76-P99 VanDerWaalsContact CD2-CG 3.49Å; L76-P148 HydrophobicContact CD1-CB 3.68Å
77	P	97.2	Very high	97.8	Very high	34 Å²	34	32.6 Å²	32.6	22%	0.221	18%	0.184	C	C	.	.	P	Polyproline II helix	trans	-61.3	138.8	172.1	-19	31.8	0	0	0	111.1	G79 N80 P148 E153	P77-G79 PolarHBondContact O-N 3.05Å; P77-N80 VanDerWaalsContact O-CB 3.32Å; P77-N80 WeakPolarHBondContact O-CB 3.47Å; P77-N80 PolarHBondContact O-N 3.19Å; P77-P148 HydrophobicContact CG-CB 4.31Å; P77-P148 HydrophobicContact CG-CG 4.37Å; P77-E153 HydrophobicContact CB-CG 3.72Å
78	V	98.5	Very high	97.6	Very high	16 Å²	16	32.9 Å²	32.9	10%	0.097	19%	0.186	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.9	127.8	-176.1	177.1	0	0	0	0	109.9	L102 E153 Y154 L193 Y196	V78-L102 HydrophobicContact CG2-CD2 4.41Å; V78-E153 CarbonylContact O-C 3.47Å; V78-E153 VanDerWaalsContact O-CA 3.29Å; V78-E153 WeakPolarHBondContact O-CA 3.12Å; V78-Y154 PolarHBondContact O-N 2.96Å; V78-L193 HydrophobicContact CG1-CD2 3.7Å; V78-L193 HydrophobicContact CG1-CG 4.3Å; V78-Y196 HydrophobicContact CB-CD2 4.49Å; V78-Y196 HydrophobicContact CB-CG 4.33Å; V78-Y196 HydrophobicContact CG1-CD1 4.3Å; V78-Y196 HydrophobicContact CG1-CG 3.97Å; V78-Y196 HydrophobicContact CG2-CD1 4.3Å; V78-Y196 HydrophobicContact CG2-CD2 3.4Å; V78-Y196 HydrophobicContact CG2-CE2 3.78Å; V78-Y196 HydrophobicContact CG2-CG 3.66Å
79	G	98.1	Very high	97.3	Very high	2 Å²	2	36.8 Å²	36.8	2%	0.021	20%	0.203	C	C	.	.	T	Hydrogen-bonded Turn	trans	101.7	-16.3	-171.1	0	0	0	0	0	113.6	P77 L152	P77-G79 PolarHBondContact O-N 3.05Å; G79-L152 CarbonylContact C-O 3.53Å; G79-L152 WeakPolarHBondContact CA-O 3.2Å
80	N	98.1	Very high	97.2	Very high	14 Å²	14	36.9 Å²	36.9	8%	0.075	22%	0.215	C	C	.	.			trans	-88.9	166.5	173.3	-71.6	-24.2	0	0	0	112.1	L76 P77 P148 S149 G150 L152	L76-N80 HydrophobicContact CD1-CB 3.98Å; L76-N80 WeakPolarHBondContact CD2-O 3.46Å; L76-N80 HydrophobicContact CG-CB 4.2Å; P77-N80 VanDerWaalsContact O-CB 3.32Å; P77-N80 WeakPolarHBondContact O-CB 3.47Å; P77-N80 PolarHBondContact O-N 3.19Å; N80-P148 HydrophobicContact CB-CB 4.19Å; N80-S149 CarbonylContact C-O 3.57Å; N80-S149 WeakPolarHBondContact CA-O 3.21Å; N80-S149 VanDerWaalsContact CB-O 3.26Å; N80-S149 WeakPolarHBondContact CB-O 3.44Å; N80-G150 WeakPolarHBondContact OD1-CA 3.43Å; N80-L152 PolarHBondContact OD1-O 2.81Å
81	H	98.5	Very high	97.2	Very high	23 Å²	23	38.3 Å²	38.3	11%	0.106	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	171.2	174.1	58.3	-95.7	0	0	0	110.8	Y83 P96 Y97 S149	H81-Y83 AromaticContact NE2-CE2 3.95Å; H81-Y83 AromaticContact NE2-CZ 3.63Å; H81-P96 VanDerWaalsContact CD2-CB 3.44Å; H81-P96 WeakPolarHBondContact CD2-CB 3.41Å; H81-Y97 WeakPolarHBondContact CB-O 3.14Å; H81-S149 PolarHBondContact CE1-O 2.8Å; H81-S149 PolarHBondContact N-O 3Å; H81-S149 PolarHBondContact ND1-O 2.87Å; H81-S149 PolarHBondContact NE2-OG 2.93Å; H81-S149 PolarHBondContact O-N 2.87Å
82	V	98.8	Very high	97.2	Very high	0 Å²	0	38.6 Å²	38.6	0%	0	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	160.9	167.5	-62.8	0	0	0	0	110	L39 L74 L76 F84 P96 Y97 F111 V145 R146	L39-V82 HydrophobicContact CD1-CG1 3.64Å; L39-V82 HydrophobicContact CD2-CG1 4.32Å; L74-V82 HydrophobicContact CD2-CG1 4.4Å; L76-V82 HydrophobicContact CD1-CG1 3.88Å; L76-V82 HydrophobicContact CD2-CG1 4.41Å; V82-F84 HydrophobicContact CG2-CD1 3.99Å; V82-F84 HydrophobicContact CG2-CE1 3.65Å; V82-P96 CarbonylContact O-C 3.48Å; V82-P96 VanDerWaalsContact O-CA 3.27Å; V82-P96 WeakPolarHBondContact O-CA 3.34Å; V82-Y97 WeakPolarHBondContact CG2-O 3.36Å; V82-Y97 PolarHBondContact N-O 3.15Å; V82-Y97 PolarHBondContact O-N 2.86Å; V82-F111 HydrophobicContact CG2-CE1 3.66Å; V82-F111 HydrophobicContact CG2-CZ 3.65Å; V82-V145 HydrophobicContact CB-CG1 3.62Å; V82-V145 HydrophobicContact CG1-CG1 3.89Å; V82-V145 HydrophobicContact CG2-CG1 3.67Å; V82-R146 CarbonylContact C-O 3.56Å; V82-R146 VanDerWaalsContact CA-O 3.31Å; V82-R146 WeakPolarHBondContact CA-O 3.32Å; V82-R146 WeakPolarHBondContact CB-O 3.49Å
83	Y	98.7	Very high	97.3	Very high	50 Å²	50	38.3 Å²	38.3	20%	0.196	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.5	129.8	166.2	-69.6	-77.8	0	0	0	110	H81 V94 R95 P96 V145 R146 S149	H81-Y83 AromaticContact NE2-CE2 3.95Å; H81-Y83 AromaticContact NE2-CZ 3.63Å; Y83-V94 HydrophobicContact CD1-CG1 3.82Å; Y83-V94 HydrophobicContact CG-CG1 4.1Å; Y83-R95 WeakPolarHBondContact CA-O 3.15Å; Y83-P96 HydrophobicContact CD1-CB 4.09Å; Y83-P96 HydrophobicContact CE1-CB 3.87Å; Y83-P96 HydrophobicContact CE1-CG 4.38Å; Y83-V145 WeakPolarHBondContact O-CA 3.47Å; Y83-R146 HydrophobicContact CD2-CG 4.45Å; Y83-R146 PolarHBondContact N-O 2.81Å; Y83-R146 PolarHBondContact O-N 3.07Å; Y83-S149 WeakPolarHBondContact CE2-OG 3.47Å
84	F	98.8	Very high	97.3	Very high	0 Å²	0	40.6 Å²	40.6	0%	0	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.1	138.1	163.6	-71.1	5.4	0	0	0	109.3	L63 L65 V82 V94 R95 Y97 F111 I113 M130 L134 I143 D144 V145	L63-F84 HydrophobicContact CD2-CE2 4.09Å; L65-F84 HydrophobicContact CD1-CE1 4.13Å; L65-F84 HydrophobicContact CD1-CE2 4.22Å; L65-F84 HydrophobicContact CD1-CZ 3.56Å; V82-F84 HydrophobicContact CG2-CD1 3.99Å; V82-F84 HydrophobicContact CG2-CE1 3.65Å; F84-V94 CarbonylContact O-C 3.58Å; F84-V94 VanDerWaalsContact O-CA 3.26Å; F84-V94 WeakPolarHBondContact O-CA 3.39Å; F84-R95 PolarHBondContact N-O 3.34Å; F84-R95 PolarHBondContact O-N 3.35Å; F84-Y97 HydrophobicContact CB-CD2 3.72Å; F84-Y97 HydrophobicContact CB-CE2 3.79Å; F84-Y97 HydrophobicContact CD1-CD2 4.05Å; F84-Y97 AromaticContact CD2-CD2 3.41Å; F84-Y97 HydrophobicContact CD2-CD2 3.41Å; F84-Y97 VanDerWaalsContact CD2-CD2 3.41Å; F84-Y97 AromaticContact CD2-CE2 3.65Å; F84-Y97 HydrophobicContact CD2-CE2 3.65Å; F84-Y97 HydrophobicContact CD2-CG 4.18Å; F84-Y97 AromaticContact CE2-CD2 3.98Å; F84-Y97 HydrophobicContact CE2-CD2 3.98Å; F84-Y97 HydrophobicContact CE2-CE2 4.45Å; F84-Y97 HydrophobicContact CE2-CG 4.32Å; F84-Y97 AromaticContact CG-CD2 3.44Å; F84-Y97 HydrophobicContact CG-CD2 3.44Å; F84-Y97 VanDerWaalsContact CG-CD2 3.44Å; F84-Y97 AromaticContact CG-CE2 3.88Å; F84-Y97 HydrophobicContact CG-CE2 3.88Å; F84-Y97 HydrophobicContact CG-CG 4.41Å; F84-F111 HydrophobicContact CE1-CD2 4.48Å; F84-F111 HydrophobicContact CE1-CE1 4.07Å; F84-F111 AromaticContact CE1-CE2 3.97Å; F84-F111 HydrophobicContact CE1-CE2 3.97Å; F84-F111 AromaticContact CE1-CZ 3.74Å; F84-F111 HydrophobicContact CE1-CZ 3.74Å; F84-F111 HydrophobicContact CZ-CD1 4.06Å; F84-F111 AromaticContact CZ-CD2 3.66Å; F84-F111 HydrophobicContact CZ-CD2 3.66Å; F84-F111 AromaticContact CZ-CE1 3.97Å; F84-F111 HydrophobicContact CZ-CE1 3.97Å; F84-F111 AromaticContact CZ-CE2 3.56Å; F84-F111 HydrophobicContact CZ-CE2 3.56Å; F84-F111 AromaticContact CZ-CG 3.89Å; F84-F111 HydrophobicContact CZ-CG 3.89Å; F84-F111 AromaticContact CZ-CZ 3.73Å; F84-F111 HydrophobicContact CZ-CZ 3.73Å; F84-I113 HydrophobicContact CE2-CD1 4.38Å; F84-M130 HydrophobicContact CB-CE 4.46Å; F84-L134 HydrophobicContact CD2-CD1 3.7Å; F84-L134 HydrophobicContact CD2-CD2 4Å; F84-L134 HydrophobicContact CE2-CD1 4.12Å; F84-L134 HydrophobicContact CE2-CD2 4.33Å; F84-I143 HydrophobicContact CB-CD1 4.12Å; F84-I143 HydrophobicContact CB-CG1 3.84Å; F84-I143 HydrophobicContact CD1-CG1 4.48Å; F84-I143 HydrophobicContact CD2-CG1 3.8Å; F84-I143 HydrophobicContact CE2-CG1 4.48Å; F84-I143 HydrophobicContact CE2-CG2 4.44Å; F84-I143 HydrophobicContact CG-CG1 3.81Å; F84-D144 CarbonylContact C-O 3.53Å; F84-D144 VanDerWaalsContact CA-O 3.28Å; F84-D144 WeakPolarHBondContact CA-O 3.42Å; F84-V145 HydrophobicContact CD1-CB 4.37Å; F84-V145 HydrophobicContact CD1-CG1 4.2Å; F84-V145 HydrophobicContact CD1-CG2 3.69Å; F84-V145 HydrophobicContact CE1-CB 4.39Å; F84-V145 HydrophobicContact CE1-CG1 4.03Å; F84-V145 HydrophobicContact CE1-CG2 3.54Å; F84-V145 HydrophobicContact CZ-CG2 4.41Å
85	S	98.6	Very high	97.3	Very high	2 Å²	2	46.3 Å²	46.3	1%	0.014	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	140.1	172.9	66.2	0	0	0	0	112.7	K45 V93 I143 D144	K45-S85 PolarHBondContact NZ-OG 3.18Å; S85-V93 VanDerWaalsContact CA-O 3.28Å; S85-V93 WeakPolarHBondContact CA-O 3.46Å; S85-I143 WeakPolarHBondContact O-CD1 3.23Å; S85-D144 PolarHBondContact N-O 3.29Å; S85-D144 WeakPolarHBondContact O-CB 3.3Å; S85-D144 WeakPolarHBondContact OG-CB 3.12Å
86	A	98.2	Very high	97.3	Very high	10 Å²	10	49.3 Å²	49.3	8%	0.083	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.7	149	174.5	0	0	0	0	0	110.1	L88 V93 M130 Y133 I143	A86-L88 HydrophobicContact CB-CD1 4.4Å; A86-L88 HydrophobicContact CB-CD2 3.92Å; A86-L88 HydrophobicContact CB-CG 4.01Å; A86-V93 PolarHBondContact N-O 3.17Å; A86-V93 PolarHBondContact O-N 2.87Å; A86-M130 HydrophobicContact CB-CE 4.13Å; A86-Y133 HydrophobicContact CB-CD1 4.12Å; A86-Y133 HydrophobicContact CB-CE1 3.63Å; A86-I143 HydrophobicContact CB-CD1 3.99Å
87	K	97.4	Very high	97.4	Very high	159 Å²	159	50.4 Å²	50.4	69%	0.691	27%	0.268	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-88.5	107.6	170.9	-170.2	175.3	-178.4	178.6	0	108.9	G90 N91 M92	K87-G90 WeakPolarHBondContact CE-O 3.44Å; K87-N91 CarbonylContact C-O 3.53Å; K87-N91 WeakPolarHBondContact CA-O 3.47Å; K87-M92 HydrophobicContact CB-CE 4.21Å
88	L	94.6	Very high	97.4	Very high	21 Å²	21	49.5 Å²	49.5	11%	0.11	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	124.7	-175.3	-53.1	178.4	0	0	0	108.8	A86 G90 N91 V93 V129 Y133	A86-L88 HydrophobicContact CB-CD1 4.4Å; A86-L88 HydrophobicContact CB-CD2 3.92Å; A86-L88 HydrophobicContact CB-CG 4.01Å; L88-G90 PolarHBondContact O-N 2.95Å; L88-N91 PolarHBondContact N-O 3.05Å; L88-N91 PolarHBondContact O-N 2.91Å; L88-V93 HydrophobicContact CB-CG2 4.07Å; L88-V93 HydrophobicContact CD1-CB 4.14Å; L88-V93 HydrophobicContact CD1-CG2 4.03Å; L88-V93 HydrophobicContact CG-CG2 4.25Å; L88-V129 HydrophobicContact CB-CG1 4.34Å; L88-V129 HydrophobicContact CD1-CG1 3.77Å; L88-Y133 HydrophobicContact CD1-CD1 4.23Å; L88-Y133 HydrophobicContact CD1-CD2 4.49Å; L88-Y133 HydrophobicContact CD1-CG 3.91Å; L88-Y133 HydrophobicContact CD2-CD1 3.99Å; L88-Y133 HydrophobicContact CD2-CD2 3.35Å; L88-Y133 HydrophobicContact CD2-CE1 4.19Å; L88-Y133 HydrophobicContact CD2-CE2 3.58Å; L88-Y133 HydrophobicContact CD2-CG 3.55Å; L88-Y133 HydrophobicContact CG-CG 4.4Å
89	D	91.1	Very high	97.4	Very high	154 Å²	154	48.8 Å²	48.8	82%	0.824	26%	0.257	S	S	*	.	T	Hydrogen-bonded Turn	trans	48.3	45.2	-176.1	-55.6	-29.7	0	0	0	113	N91	D89-N91 PolarHBondContact O-N 3.36Å; D89-N91 VanDerWaalsContact O-N 3.15Å; D89-N91 PolarHBondContact O-ND2 2.92Å; D89-N91 VanDerWaalsContact O-ND2 3.09Å
90	G	93.1	Very high	97.4	Very high	59 Å²	59	49.1 Å²	49.1	61%	0.608	26%	0.259	S	S	*	.	T	Hydrogen-bonded Turn	trans	77.8	-13.6	-178	0	0	0	0	0	115.5	K87 L88	K87-G90 WeakPolarHBondContact CE-O 3.44Å; L88-G90 PolarHBondContact O-N 2.95Å
91	N	95.5	Very high	97.5	Very high	109 Å²	109	49.1 Å²	49.1	58%	0.583	26%	0.259	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-99.4	138.9	-175.5	-63.8	-67.6	0	0	0	112	K87 L88 D89 V93	K87-N91 CarbonylContact C-O 3.53Å; K87-N91 WeakPolarHBondContact CA-O 3.47Å; L88-N91 PolarHBondContact N-O 3.05Å; L88-N91 PolarHBondContact O-N 2.91Å; D89-N91 PolarHBondContact O-N 3.36Å; D89-N91 VanDerWaalsContact O-N 3.15Å; D89-N91 PolarHBondContact O-ND2 2.92Å; D89-N91 VanDerWaalsContact O-ND2 3.09Å; N91-V93 PolarHBondContact O-N 2.84Å
92	M	97.4	Very high	97.4	Very high	107 Å²	107	49 Å²	49	53%	0.527	26%	0.259	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.8	115.1	170.1	-174.3	58.1	54.4	0	0	109.4	K87 V94	K87-M92 HydrophobicContact CB-CE 4.21Å; M92-V94 HydrophobicContact CG-CG2 4.03Å
93	V	98.2	Very high	97.3	Very high	18 Å²	18	51.8 Å²	51.8	11%	0.109	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	126.2	176.7	-174.4	0	0	0	0	108.4	S85 A86 L88 N91 V129 M130	S85-V93 VanDerWaalsContact CA-O 3.28Å; S85-V93 WeakPolarHBondContact CA-O 3.46Å; A86-V93 PolarHBondContact N-O 3.17Å; A86-V93 PolarHBondContact O-N 2.87Å; L88-V93 HydrophobicContact CB-CG2 4.07Å; L88-V93 HydrophobicContact CD1-CB 4.14Å; L88-V93 HydrophobicContact CD1-CG2 4.03Å; L88-V93 HydrophobicContact CG-CG2 4.25Å; N91-V93 PolarHBondContact O-N 2.84Å; V93-V129 HydrophobicContact CG2-CG1 4.28Å; V93-M130 HydrophobicContact CB-CE 4.1Å; V93-M130 HydrophobicContact CG1-CB 4.05Å; V93-M130 HydrophobicContact CG1-CE 4Å; V93-M130 WeakPolarHBondContact O-CE 3.38Å
94	V	98.4	Very high	97.1	Very high	48 Å²	48	53.2 Å²	53.2	29%	0.291	29%	0.291	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	129.3	-180	-172.2	0	0	0	0	109.7	Y83 F84 M92	Y83-V94 HydrophobicContact CD1-CG1 3.82Å; Y83-V94 HydrophobicContact CG-CG1 4.1Å; F84-V94 CarbonylContact O-C 3.58Å; F84-V94 VanDerWaalsContact O-CA 3.26Å; F84-V94 WeakPolarHBondContact O-CA 3.39Å; M92-V94 HydrophobicContact CG-CG2 4.03Å
95	R	98.4	Very high	96.9	Very high	128 Å²	128	55.6 Å²	55.6	48%	0.483	30%	0.303	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.5	141.9	178.7	-68.3	-63.6	-179.3	-87.6	3	111.9	Y83 F84 Y97 M130	Y83-R95 WeakPolarHBondContact CA-O 3.15Å; F84-R95 PolarHBondContact N-O 3.34Å; F84-R95 PolarHBondContact O-N 3.35Å; R95-Y97 HydrophobicContact CB-CD2 4.43Å; R95-Y97 HydrophobicContact CB-CE2 3.64Å; R95-Y97 WeakPolarHBondContact O-CD2 3.38Å; R95-M130 HydrophobicContact CB-CB 4.43Å; R95-M130 HydrophobicContact CB-CG 4.2Å; R95-M130 HydrophobicContact CG-CB 3.82Å; R95-M130 HydrophobicContact CG-CG 4.14Å
96	P	98.3	Very high	96.9	Very high	69 Å²	69	60.9 Å²	60.9	45%	0.448	33%	0.325	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.4	143.4	175	32.2	-33.8	0	0	0	111	H81 V82 Y83	H81-P96 VanDerWaalsContact CD2-CB 3.44Å; H81-P96 WeakPolarHBondContact CD2-CB 3.41Å; V82-P96 CarbonylContact O-C 3.48Å; V82-P96 VanDerWaalsContact O-CA 3.27Å; V82-P96 WeakPolarHBondContact O-CA 3.34Å; Y83-P96 HydrophobicContact CD1-CB 4.09Å; Y83-P96 HydrophobicContact CE1-CB 3.87Å; Y83-P96 HydrophobicContact CE1-CG 4.38Å
97	Y	98.7	Very high	96.9	Very high	35 Å²	35	61.2 Å²	61.2	14%	0.137	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142	131.2	174	-67.2	-77.4	0	0	0	110	H81 V82 F84 R95 I113 M130 L134	H81-Y97 WeakPolarHBondContact CB-O 3.14Å; V82-Y97 WeakPolarHBondContact CG2-O 3.36Å; V82-Y97 PolarHBondContact N-O 3.15Å; V82-Y97 PolarHBondContact O-N 2.86Å; F84-Y97 HydrophobicContact CB-CD2 3.72Å; F84-Y97 HydrophobicContact CB-CE2 3.79Å; F84-Y97 HydrophobicContact CD1-CD2 4.05Å; F84-Y97 AromaticContact CD2-CD2 3.41Å; F84-Y97 HydrophobicContact CD2-CD2 3.41Å; F84-Y97 VanDerWaalsContact CD2-CD2 3.41Å; F84-Y97 AromaticContact CD2-CE2 3.65Å; F84-Y97 HydrophobicContact CD2-CE2 3.65Å; F84-Y97 HydrophobicContact CD2-CG 4.18Å; F84-Y97 AromaticContact CE2-CD2 3.98Å; F84-Y97 HydrophobicContact CE2-CD2 3.98Å; F84-Y97 HydrophobicContact CE2-CE2 4.45Å; F84-Y97 HydrophobicContact CE2-CG 4.32Å; F84-Y97 AromaticContact CG-CD2 3.44Å; F84-Y97 HydrophobicContact CG-CD2 3.44Å; F84-Y97 VanDerWaalsContact CG-CD2 3.44Å; F84-Y97 AromaticContact CG-CE2 3.88Å; F84-Y97 HydrophobicContact CG-CE2 3.88Å; F84-Y97 HydrophobicContact CG-CG 4.41Å; R95-Y97 HydrophobicContact CB-CD2 4.43Å; R95-Y97 HydrophobicContact CB-CE2 3.64Å; R95-Y97 WeakPolarHBondContact O-CD2 3.38Å; Y97-I113 HydrophobicContact CD1-CD1 4.17Å; Y97-I113 HydrophobicContact CD1-CG1 3.81Å; Y97-I113 HydrophobicContact CE1-CB 4.43Å; Y97-I113 HydrophobicContact CE1-CD1 4.1Å; Y97-I113 HydrophobicContact CE1-CG1 3.79Å; Y97-I113 HydrophobicContact CE1-CG2 3.87Å; Y97-M130 HydrophobicContact CE2-CG 3.94Å; Y97-M130 WeakPolarHBondContact OH-CG 3.35Å; Y97-L134 HydrophobicContact CE1-CD1 4.47Å; Y97-L134 HydrophobicContact CE2-CD1 3.97Å
98	T	98.7	Very high	96.9	Very high	15 Å²	15	57.3 Å²	57.3	9%	0.092	31%	0.311	C	S	.	.			trans	-97.5	126.1	174.2	-49.9	0	0	0	0	109.2	P189 Q192	T98-P189 HydrophobicContact CG2-CB 4.22Å; T98-Q192 HydrophobicContact CG2-CB 4.11Å; T98-Q192 HydrophobicContact CG2-CG 4.45Å
99	P	98.7	Very high	97.1	Very high	1 Å²	1	56.4 Å²	56.4	1%	0.006	31%	0.306	C	S	.	.	B	Isolated β-bridge	trans	-72.3	151.6	177.9	30.7	-34.6	0	0	0	111	L74 L76 V109 D110 F111	L74-P99 HydrophobicContact CD2-CB 4.44Å; L74-P99 HydrophobicContact CD2-CG 3.85Å; L76-P99 VanDerWaalsContact CD2-CD 3.45Å; L76-P99 HydrophobicContact CD2-CG 3.49Å; L76-P99 VanDerWaalsContact CD2-CG 3.49Å; P99-V109 HydrophobicContact CB-CG2 3.36Å; P99-V109 HydrophobicContact CG-CG2 4.24Å; P99-D110 CarbonylContact C-O 3.56Å; P99-D110 VanDerWaalsContact CA-O 3.31Å; P99-D110 WeakPolarHBondContact CA-O 3.19Å; P99-D110 WeakPolarHBondContact CB-O 3.37Å; P99-F111 HydrophobicContact CB-CD1 4.1Å; P99-F111 HydrophobicContact CB-CE1 3.7Å; P99-F111 HydrophobicContact CB-CE2 4.48Å; P99-F111 HydrophobicContact CB-CZ 3.91Å; P99-F111 HydrophobicContact CG-CE1 4.25Å
100	I	98.4	Very high	97.5	Very high	9 Å²	9	49.1 Å²	49.1	5%	0.046	27%	0.267	C	S	.	.	S	Bend	trans	-96.1	-5.6	175.9	59.2	149.7	0	0	0	112.7	D110 V112 T188 F191 L221	I100-D110 HydrophobicContact CD1-CB 4.08Å; I100-D110 HydrophobicContact CG1-CB 3.78Å; I100-D110 WeakPolarHBondContact CG1-O 3.49Å; I100-D110 PolarHBondContact N-O 2.8Å; I100-V112 HydrophobicContact CD1-CG2 3.5Å; I100-V112 VanDerWaalsContact CD1-CG2 3.5Å; I100-V112 HydrophobicContact CG1-CG2 4.05Å; I100-V112 HydrophobicContact CG2-CB 4.21Å; I100-V112 HydrophobicContact CG2-CG2 4.09Å; I100-T188 HydrophobicContact CG2-CG2 4.29Å; I100-F191 HydrophobicContact CB-CD1 3.77Å; I100-F191 HydrophobicContact CB-CE1 4.11Å; I100-F191 HydrophobicContact CG2-CD1 4.07Å; I100-L221 HydrophobicContact CD1-CD2 4.25Å; I100-L221 HydrophobicContact CG2-CD1 4Å
101	T	98.2	Very high	97.8	Very high	15 Å²	15	46.3 Å²	46.3	9%	0.092	24%	0.238	C	C	.	.	S	Bend	trans	-98.1	156.4	170.2	49.1	0	0	0	0	111.1	Q105 Y108 V109 D110	T101-Q105 HydrophobicContact CG2-CG 4.24Å; T101-Y108 HydrophobicContact CG2-CE2 3.93Å; T101-V109 WeakPolarHBondContact OG1-CA 3.5Å; T101-V109 WeakPolarHBondContact OG1-CG2 3.41Å; T101-D110 HydrophobicContact CG2-CB 3.75Å; T101-D110 PolarHBondContact OG1-N 2.88Å
102	L	97.8	Very high	97.9	Very high	20 Å²	20	41.5 Å²	41.5	11%	0.105	21%	0.213	C	C	.	.			trans	-108	171.6	177.5	-58	172.7	0	0	0	110.3	V78 S104 Q105 Q192 Y196	V78-L102 HydrophobicContact CG2-CD2 4.41Å; L102-S104 PolarHBondContact O-N 3.35Å; L102-Q105 PolarHBondContact O-N 2.8Å; L102-Q105 PolarHBondContact O-OE1 2.88Å; L102-Q192 HydrophobicContact CD2-CG 3.95Å; L102-Y196 HydrophobicContact CD1-CD2 4.22Å; L102-Y196 HydrophobicContact CD2-CD2 4.33Å
103	D	96.1	Very high	98	Very high	58 Å²	58	36.6 Å²	36.6	31%	0.31	19%	0.189	S	C	.	.	T	Hydrogen-bonded Turn	trans	-68.3	0.1	173.7	-81.3	-1.7	0	0	0	113.5	V73 L74 G75 Q105	V73-D103 HydrophobicContact CB-CB 3.91Å; V73-D103 HydrophobicContact CG1-CB 4.25Å; V73-D103 WeakPolarHBondContact CG1-O 3.49Å; V73-D103 HydrophobicContact CG2-CB 4.14Å; L74-D103 PolarHBondContact N-OD1 2.9Å; L74-D103 VanDerWaalsContact N-OD1 3.17Å; G75-D103 WeakPolarHBondContact CA-OD2 3.41Å; G75-D103 PolarHBondContact N-OD1 3.21Å; G75-D103 PolarHBondContact N-OD2 3.09Å; D103-Q105 VanDerWaalsContact C-N 3.27Å
104	S	94.2	Very high	98	Very high	80 Å²	80	37.5 Å²	37.5	56%	0.559	19%	0.191	S	C	*	.	T	Hydrogen-bonded Turn	trans	-72.3	-23.1	165.1	56.4	0	0	0	0	112.1	L102	L102-S104 PolarHBondContact O-N 3.35Å
105	Q	96.1	Very high	98	Very high	51 Å²	51	35.6 Å²	35.6	24%	0.238	18%	0.179	C	C	.	.	S	Bend	trans	-86.1	132.7	169.3	-70.7	72.6	47.1	0	0	110.1	T101 L102 D103 Y108	T101-Q105 HydrophobicContact CG2-CG 4.24Å; L102-Q105 PolarHBondContact O-N 2.8Å; L102-Q105 PolarHBondContact O-OE1 2.88Å; D103-Q105 VanDerWaalsContact C-N 3.27Å; Q105-Y108 HydrophobicContact CB-CE1 4.24Å; Q105-Y108 HydrophobicContact CG-CE1 4.45Å; Q105-Y108 WeakPolarHBondContact CG-OH 3.49Å
106	K	97.3	Very high	97.8	Very high	113 Å²	113	34.7 Å²	34.7	49%	0.491	18%	0.177	S	C	.	.			trans	-112.6	149.6	178.5	-59.6	-177.2	178.8	178.8	0	111.1	A70 H72 V73 Y108	A70-K106 VanDerWaalsContact O-CB 3.3Å; A70-K106 WeakPolarHBondContact O-CB 3.49Å; H72-K106 CarbonylContact O-C 3.51Å; H72-K106 VanDerWaalsContact O-CA 3.3Å; H72-K106 WeakPolarHBondContact O-CA 3.28Å; V73-K106 HydrophobicContact CG1-CG 3.98Å; K106-Y108 WeakPolarHBondContact O-CD1 3.44Å; K106-Y108 PolarHBondContact O-N 2.8Å
107	G	98.1	Very high	97.7	Very high	16 Å²	16	37 Å²	37	17%	0.165	18%	0.18	C	C	.	.	S	Bend	trans	79.8	-14.1	174.6	0	0	0	0	0	115.4	L67 T69 A70 H72	L67-G107 PolarHBondContact N-O 2.97Å; T69-G107 WeakPolarHBondContact O-CA 3.4Å; A70-G107 PolarHBondContact O-N 2.82Å; H72-G107 PolarHBondContact O-N 2.72Å
108	Y	98.7	Very high	97.4	Very high	78 Å²	78	36.4 Å²	36.4	31%	0.306	19%	0.185	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.6	165	177.8	72.9	-83.2	0	0	0	112.4	K64 L65 T101 Q105 K106	K64-Y108 HydrophobicContact CD-CD2 4.03Å; K64-Y108 HydrophobicContact CD-CG 4.28Å; K64-Y108 HydrophobicContact CG-CD2 3.97Å; K64-Y108 HydrophobicContact CG-CG 4.33Å; L65-Y108 CarbonylContact O-C 3.53Å; L65-Y108 WeakPolarHBondContact O-CA 3.28Å; L65-Y108 WeakPolarHBondContact O-CB 3.39Å; T101-Y108 HydrophobicContact CG2-CE2 3.93Å; Q105-Y108 HydrophobicContact CB-CE1 4.24Å; Q105-Y108 HydrophobicContact CG-CE1 4.45Å; Q105-Y108 WeakPolarHBondContact CG-OH 3.49Å; K106-Y108 WeakPolarHBondContact O-CD1 3.44Å; K106-Y108 PolarHBondContact O-N 2.8Å
109	V	98.8	Very high	97.1	Very high	1 Å²	1	42.7 Å²	42.7	1%	0.006	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.2	135.2	170	53.9	0	0	0	0	108.8	L48 L65 L67 L74 P99 T101 F111	L48-V109 HydrophobicContact CD1-CG1 4.28Å; L65-V109 HydrophobicContact CB-CG1 3.93Å; L65-V109 PolarHBondContact N-O 2.8Å; L65-V109 PolarHBondContact O-N 3.01Å; L67-V109 HydrophobicContact CD2-CB 4.33Å; L67-V109 HydrophobicContact CD2-CG1 3.8Å; L74-V109 HydrophobicContact CD1-CG1 4.44Å; L74-V109 HydrophobicContact CD2-CG2 3.9Å; P99-V109 HydrophobicContact CB-CG2 3.36Å; P99-V109 HydrophobicContact CG-CG2 4.24Å; T101-V109 WeakPolarHBondContact OG1-CA 3.5Å; T101-V109 WeakPolarHBondContact OG1-CG2 3.41Å; V109-F111 HydrophobicContact CB-CE2 4.22Å; V109-F111 HydrophobicContact CG1-CE2 3.69Å; V109-F111 HydrophobicContact CG1-CZ 4.43Å; V109-F111 HydrophobicContact CG2-CD2 4.2Å; V109-F111 HydrophobicContact CG2-CE2 3.51Å; V109-F111 HydrophobicContact CG2-CZ 3.79Å
110	D	98.8	Very high	96.7	Very high	1 Å²	1	47.9 Å²	47.9	1%	0.005	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	139.9	175.3	-67.4	-25.2	0	0	0	111.7	R62 L63 K64 P99 I100 T101	R62-D110 HydrophobicContact CG-CB 4.47Å; R62-D110 IonicContact CZ-OD2 3.63Å; R62-D110 VanDerWaalsContact CZ-OD2 3.27Å; R62-D110 IonicContact NE-OD2 3.4Å; R62-D110 PolarHBondContact NE-OD2 3.03Å; R62-D110 IonicContact NH2-OD2 3.63Å; R62-D110 PolarHBondContact NH2-OD2 2.88Å; L63-D110 WeakPolarHBondContact O-CA 3.3Å; K64-D110 WeakPolarHBondContact CA-OD1 3.36Å; K64-D110 WeakPolarHBondContact CB-OD1 3.33Å; K64-D110 WeakPolarHBondContact CE-OD1 3.5Å; K64-D110 WeakPolarHBondContact CG-OD1 3.38Å; P99-D110 CarbonylContact C-O 3.56Å; P99-D110 VanDerWaalsContact CA-O 3.31Å; P99-D110 WeakPolarHBondContact CA-O 3.19Å; P99-D110 WeakPolarHBondContact CB-O 3.37Å; I100-D110 HydrophobicContact CD1-CB 4.08Å; I100-D110 HydrophobicContact CG1-CB 3.78Å; I100-D110 WeakPolarHBondContact CG1-O 3.49Å; I100-D110 PolarHBondContact N-O 2.8Å; T101-D110 HydrophobicContact CG2-CB 3.75Å; T101-D110 PolarHBondContact OG1-N 2.88Å
111	F	98.9	Very high	96.2	Very high	1 Å²	1	51.1 Å²	51.1	0%	0.004	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	144.6	171.4	-64.7	-91.4	0	0	0	109.8	R62 L63 L65 V82 F84 P99 V109 I113	R62-F111 CarbonylContact C-O 3.53Å; R62-F111 WeakPolarHBondContact CA-O 3.31Å; L63-F111 PolarHBondContact N-O 3.01Å; L63-F111 PolarHBondContact O-N 2.92Å; L65-F111 HydrophobicContact CD1-CD2 4.14Å; L65-F111 HydrophobicContact CD1-CE2 3.9Å; L65-F111 HydrophobicContact CG-CD2 4.4Å; L65-F111 HydrophobicContact CG-CE2 4.45Å; V82-F111 HydrophobicContact CG2-CE1 3.66Å; V82-F111 HydrophobicContact CG2-CZ 3.65Å; F84-F111 HydrophobicContact CE1-CD2 4.48Å; F84-F111 HydrophobicContact CE1-CE1 4.07Å; F84-F111 AromaticContact CE1-CE2 3.97Å; F84-F111 HydrophobicContact CE1-CE2 3.97Å; F84-F111 AromaticContact CE1-CZ 3.74Å; F84-F111 HydrophobicContact CE1-CZ 3.74Å; F84-F111 HydrophobicContact CZ-CD1 4.06Å; F84-F111 AromaticContact CZ-CD2 3.66Å; F84-F111 HydrophobicContact CZ-CD2 3.66Å; F84-F111 AromaticContact CZ-CE1 3.97Å; F84-F111 HydrophobicContact CZ-CE1 3.97Å; F84-F111 AromaticContact CZ-CE2 3.56Å; F84-F111 HydrophobicContact CZ-CE2 3.56Å; F84-F111 AromaticContact CZ-CG 3.89Å; F84-F111 HydrophobicContact CZ-CG 3.89Å; F84-F111 AromaticContact CZ-CZ 3.73Å; F84-F111 HydrophobicContact CZ-CZ 3.73Å; P99-F111 HydrophobicContact CB-CD1 4.1Å; P99-F111 HydrophobicContact CB-CE1 3.7Å; P99-F111 HydrophobicContact CB-CE2 4.48Å; P99-F111 HydrophobicContact CB-CZ 3.91Å; P99-F111 HydrophobicContact CG-CE1 4.25Å; V109-F111 HydrophobicContact CB-CE2 4.22Å; V109-F111 HydrophobicContact CG1-CE2 3.69Å; V109-F111 HydrophobicContact CG1-CZ 4.43Å; V109-F111 HydrophobicContact CG2-CD2 4.2Å; V109-F111 HydrophobicContact CG2-CE2 3.51Å; V109-F111 HydrophobicContact CG2-CZ 3.79Å; F111-I113 HydrophobicContact CB-CD1 4.05Å; F111-I113 HydrophobicContact CB-CG1 4.18Å
112	V	98.7	Very high	95.8	Very high	7 Å²	7	56.4 Å²	56.4	4%	0.042	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	121.3	171.8	170.8	0	0	0	0	108.8	I56 T60 I61 I100 T188 I220 L221	I56-V112 HydrophobicContact CD1-CG1 3.81Å; I56-V112 HydrophobicContact CD1-CG2 3.96Å; T60-V112 HydrophobicContact CG2-CG1 3.42Å; T60-V112 VanDerWaalsContact CG2-CG1 3.42Å; I61-V112 CarbonylContact O-C 3.5Å; I61-V112 WeakPolarHBondContact O-CA 3.34Å; I100-V112 HydrophobicContact CD1-CG2 3.5Å; I100-V112 VanDerWaalsContact CD1-CG2 3.5Å; I100-V112 HydrophobicContact CG1-CG2 4.05Å; I100-V112 HydrophobicContact CG2-CB 4.21Å; I100-V112 HydrophobicContact CG2-CG2 4.09Å; V112-T188 HydrophobicContact CB-CG2 4.14Å; V112-T188 WeakPolarHBondContact O-CG2 3.41Å; V112-I220 HydrophobicContact CG1-CG2 3.4Å; V112-L221 HydrophobicContact CG2-CD1 4.27Å; V112-L221 HydrophobicContact CG2-CD2 4.15Å; V112-L221 HydrophobicContact CG2-CG 4.4Å
113	I	98.7	Very high	95.3	Very high	4 Å²	4	64 Å²	64	2%	0.021	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.4	115.8	-166.8	-60.2	163.4	0	0	0	109	T60 I61 L63 F84 Y97 F111 L134	T60-I113 WeakPolarHBondContact CA-O 3.3Å; I61-I113 HydrophobicContact CD1-CB 4.39Å; I61-I113 HydrophobicContact CG1-CB 3.91Å; I61-I113 WeakPolarHBondContact CG1-O 3.36Å; I61-I113 PolarHBondContact N-O 3.4Å; I61-I113 PolarHBondContact O-N 3.3Å; L63-I113 HydrophobicContact CB-CD1 4.18Å; L63-I113 HydrophobicContact CD2-CD1 3.92Å; F84-I113 HydrophobicContact CE2-CD1 4.38Å; Y97-I113 HydrophobicContact CD1-CD1 4.17Å; Y97-I113 HydrophobicContact CD1-CG1 3.81Å; Y97-I113 HydrophobicContact CE1-CB 4.43Å; Y97-I113 HydrophobicContact CE1-CD1 4.1Å; Y97-I113 HydrophobicContact CE1-CG1 3.79Å; Y97-I113 HydrophobicContact CE1-CG2 3.87Å; F111-I113 HydrophobicContact CB-CD1 4.05Å; F111-I113 HydrophobicContact CB-CG1 4.18Å; I113-L134 HydrophobicContact CD1-CD1 3.74Å
114	K	97.8	Very high	95.1	Very high	37 Å²	37	67.3 Å²	67.3	16%	0.161	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.1	127.8	169.7	-172.3	165.1	-169.6	156.4	0	110	D59 Y116 S131 D218	D59-K114 VanDerWaalsContact CG-CE 3.45Å; D59-K114 IonicContact OD1-NZ 2.97Å; D59-K114 WeakPolarHBondContact OD2-CE 3.45Å; D59-K114 IonicContact OD2-NZ 2.72Å; D59-K114 PolarHBondContact OD2-NZ 3.4Å; K114-Y116 HydrophobicContact CB-CE2 4.22Å; K114-Y116 HydrophobicContact CD-CE1 4.23Å; K114-Y116 HydrophobicContact CG-CE1 4.4Å; K114-Y116 HydrophobicContact CG-CE2 4.36Å; K114-Y116 WeakPolarHBondContact O-CD2 3.32Å; K114-S131 VanDerWaalsContact O-CB 3.32Å; K114-S131 WeakPolarHBondContact O-CB 3.31Å; K114-D218 IonicContact NZ-OD1 2.74Å
115	V	98	Very high	95	Very high	8 Å²	8	67 Å²	67	5%	0.048	34%	0.341	C	S	.	.			trans	-95.1	100.6	-177.6	-172.9	0	0	0	0	109.6	F55 D59 I61 K117 Q132 A135	F55-V115 HydrophobicContact CE1-CG2 4.29Å; D59-V115 WeakPolarHBondContact O-CA 3.36Å; D59-V115 VanDerWaalsContact O-CB 3.31Å; D59-V115 WeakPolarHBondContact O-CB 3.44Å; D59-V115 PolarHBondContact O-N 3.24Å; I61-V115 HydrophobicContact CG1-CG2 4.27Å; I61-V115 HydrophobicContact CG2-CG2 3.99Å; V115-K117 PolarHBondContact O-N 3.45Å; V115-Q132 HydrophobicContact CG1-CG 4.05Å; V115-A135 HydrophobicContact CG1-CB 3.9Å; V115-A135 HydrophobicContact CG2-CB 3.74Å
116	Y	95.6	Very high	94.9	Very high	110 Å²	110	72.4 Å²	72.4	43%	0.431	36%	0.364	S	S	.	.			trans	-79.1	100.3	175.2	-58.9	-85.5	0	0	0	109.8	K114 G127 G128 S131 Q132 S185	K114-Y116 HydrophobicContact CB-CE2 4.22Å; K114-Y116 HydrophobicContact CD-CE1 4.23Å; K114-Y116 HydrophobicContact CG-CE1 4.4Å; K114-Y116 HydrophobicContact CG-CE2 4.36Å; K114-Y116 WeakPolarHBondContact O-CD2 3.32Å; Y116-G127 CarbonylContact O-C 3.5Å; Y116-G127 WeakPolarHBondContact O-CA 3.14Å; Y116-G128 PolarHBondContact O-N 3.16Å; Y116-S131 PolarHBondContact N-OG 3.18Å; Y116-Q132 WeakPolarHBondContact O-CG 3.26Å; Y116-Q132 PolarHBondContact O-NE2 3.18Å; Y116-S185 PolarHBondContact OH-OG 2.97Å
117	K	95.2	Very high	94.8	Very high	117 Å²	117	68 Å²	68	51%	0.509	35%	0.351	S	S	.	.			trans	-69.3	144.8	179.4	-65.2	179.4	-177.6	174.4	0	111.7	V115 V120	V115-K117 PolarHBondContact O-N 3.45Å; K117-V120 HydrophobicContact CB-CG2 3.86Å
118	G	93.1	Very high	94.7	Very high	23 Å²	23	68 Å²	68	24%	0.237	35%	0.351	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.7	155.2	170.1	0	0	0	0	0	112.7	V120 P125 Q132	G118-V120 PolarHBondContact O-N 3.01Å; G118-V120 VanDerWaalsContact O-N 3.08Å; G118-P125 CarbonylContact C-O 3.5Å; G118-P125 VanDerWaalsContact CA-O 3.25Å; G118-P125 WeakPolarHBondContact CA-O 3.13Å; G118-Q132 VanDerWaalsContact N-OE1 3.11Å
119	N	92.2	Very high	94.6	Very high	147 Å²	147	67.1 Å²	67.1	79%	0.786	35%	0.353	S	S	*	.	T	Hydrogen-bonded Turn	trans	58.5	15.8	177.1	-55.8	-39.9	0	0	0	116.1	P125	N119-P125 PolarHBondContact N-O 2.96Å; N119-P125 PolarHBondContact OD1-O 3.25Å
120	V	90.3	Very high	94.5	Very high	110 Å²	110	67.2 Å²	67.2	67%	0.667	35%	0.354	S	S	*	.	S	Bend	trans	-91.5	-48.3	173.4	176.8	0	0	0	0	111.3	K117 G118	K117-V120 HydrophobicContact CB-CG2 3.86Å; G118-V120 PolarHBondContact O-N 3.01Å; G118-V120 VanDerWaalsContact O-N 3.08Å
121	N	87.5	Confident	94.5	Very high	76 Å²	76	67.4 Å²	67.4	41%	0.406	36%	0.355	S	S	.	.	S	Bend	trans	-102.5	118.7	177	-172.5	-37	0	0	0	109.3	K123 F124	N121-K123 PolarHBondContact O-N 2.97Å; N121-K123 VanDerWaalsContact O-N 3.12Å; N121-K123 WeakPolarHBondContact OD1-CB 3.43Å; N121-K123 PolarHBondContact OD1-N 2.77Å; N121-F124 HydrophobicContact CB-CB 4.47Å; N121-F124 HydrophobicContact CB-CD2 4.24Å; N121-F124 CarbonylContact O-C 3.58Å; N121-F124 WeakPolarHBondContact O-CA 3.4Å; N121-F124 PolarHBondContact O-N 2.95Å
122	P	89.1	Confident	94.5	Very high	126 Å²	126	69.9 Å²	69.9	82%	0.818	37%	0.367	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.2	-28.3	-179.6	-26.2	34.4	0	0	0	114.3	F124	P122-F124 VanDerWaalsContact C-N 3.25Å; P122-F124 PolarHBondContact O-N 2.99Å
123	K	89	Confident	94.5	Very high	179 Å²	179	72.9 Å²	72.9	78%	0.778	38%	0.378	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.5	-19.7	175.7	-62.7	-174.7	177.9	-178.7	0	112.8	N121	N121-K123 PolarHBondContact O-N 2.97Å; N121-K123 VanDerWaalsContact O-N 3.12Å; N121-K123 WeakPolarHBondContact OD1-CB 3.43Å; N121-K123 PolarHBondContact OD1-N 2.77Å
124	F	90.7	Very high	94.5	Very high	128 Å²	128	72.7 Å²	72.7	56%	0.561	38%	0.377	S	S	*	.			trans	-133.1	68.4	-176.7	-55.1	-71.3	0	0	0	110.5	N121 P122 K126 G127	N121-F124 HydrophobicContact CB-CB 4.47Å; N121-F124 HydrophobicContact CB-CD2 4.24Å; N121-F124 CarbonylContact O-C 3.58Å; N121-F124 WeakPolarHBondContact O-CA 3.4Å; N121-F124 PolarHBondContact O-N 2.95Å; P122-F124 VanDerWaalsContact C-N 3.25Å; P122-F124 PolarHBondContact O-N 2.99Å; F124-K126 PolarHBondContact O-N 2.86Å; F124-G127 PolarHBondContact O-N 3.31Å
125	P	92.9	Very high	94.5	Very high	73 Å²	73	71.4 Å²	71.4	47%	0.474	37%	0.373	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.7	-31.7	-174.5	23.4	-34	0	0	0	112.9	G118 N119 G127	G118-P125 CarbonylContact C-O 3.5Å; G118-P125 VanDerWaalsContact CA-O 3.25Å; G118-P125 WeakPolarHBondContact CA-O 3.13Å; N119-P125 PolarHBondContact N-O 2.96Å; N119-P125 PolarHBondContact OD1-O 3.25Å; P125-G127 VanDerWaalsContact C-N 3.3Å; P125-G127 PolarHBondContact O-N 2.85Å
126	K	93.3	Very high	94.4	Very high	165 Å²	165	76.9 Å²	76.9	72%	0.717	40%	0.402	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.6	-9.6	175.1	-65.3	-169.5	176.9	-172.5	0	114.2	F124 Q132	F124-K126 PolarHBondContact O-N 2.86Å; K126-Q132 PolarHBondContact O-NE2 3.01Å
127	G	95	Very high	94.5	Very high	21 Å²	21	72.2 Å²	72.2	22%	0.216	39%	0.385	C	S	.	.			trans	59.2	-153.4	-169.9	0	0	0	0	0	112.4	Y116 F124 P125 V129	Y116-G127 CarbonylContact O-C 3.5Å; Y116-G127 WeakPolarHBondContact O-CA 3.14Å; F124-G127 PolarHBondContact O-N 3.31Å; P125-G127 VanDerWaalsContact C-N 3.3Å; P125-G127 PolarHBondContact O-N 2.85Å; G127-V129 PolarHBondContact O-N 3.3Å
128	G	95.8	Very high	94.6	Very high	17 Å²	17	70.7 Å²	70.7	18%	0.175	39%	0.387	C	S	.	.			trans	-88.2	104.6	175.5	0	0	0	0	0	110.5	Y116 S131 Q132	Y116-G128 PolarHBondContact O-N 3.16Å; G128-S131 WeakPolarHBondContact CA-OG 3.27Å; G128-S131 PolarHBondContact O-N 2.93Å; G128-S131 PolarHBondContact O-OG 2.72Å; G128-Q132 WeakPolarHBondContact O-CB 3.39Å; G128-Q132 WeakPolarHBondContact O-CG 3.14Å; G128-Q132 PolarHBondContact O-N 3.08Å; G128-Q132 PolarHBondContact O-NE2 3.27Å; G128-Q132 VanDerWaalsContact O-NE2 3.1Å
129	V	96.8	Very high	94.9	Very high	58 Å²	58	73.1 Å²	73.1	35%	0.352	40%	0.397	S	S	.	.	H	α-helix	trans	-57.8	-52	-178.4	179.6	0	0	0	0	111.3	L88 V93 G127 Y133	L88-V129 HydrophobicContact CB-CG1 4.34Å; L88-V129 HydrophobicContact CD1-CG1 3.77Å; V93-V129 HydrophobicContact CG2-CG1 4.28Å; G127-V129 PolarHBondContact O-N 3.3Å; V129-Y133 WeakPolarHBondContact O-CB 3.27Å; V129-Y133 PolarHBondContact O-N 3.24Å
130	M	98.1	Very high	95.1	Very high	3 Å²	3	70.7 Å²	70.7	2%	0.015	38%	0.384	C	S	.	.	H	α-helix	trans	-65.9	-43	179.5	-177.6	61.7	80.9	0	0	112.3	F84 A86 V93 R95 Y97 Q132 Y133 L134 I143	F84-M130 HydrophobicContact CB-CE 4.46Å; A86-M130 HydrophobicContact CB-CE 4.13Å; V93-M130 HydrophobicContact CB-CE 4.1Å; V93-M130 HydrophobicContact CG1-CB 4.05Å; V93-M130 HydrophobicContact CG1-CE 4Å; V93-M130 WeakPolarHBondContact O-CE 3.38Å; R95-M130 HydrophobicContact CB-CB 4.43Å; R95-M130 HydrophobicContact CB-CG 4.2Å; R95-M130 HydrophobicContact CG-CB 3.82Å; R95-M130 HydrophobicContact CG-CG 4.14Å; Y97-M130 HydrophobicContact CE2-CG 3.94Å; Y97-M130 WeakPolarHBondContact OH-CG 3.35Å; M130-Q132 PolarHBondContact O-N 3.19Å; M130-Y133 WeakPolarHBondContact O-CB 3.41Å; M130-Y133 PolarHBondContact O-N 2.97Å; M130-Y133 HydrophobicContact SD-CD1 4.01Å; M130-L134 HydrophobicContact CG-CD1 3.84Å; M130-L134 HydrophobicContact CG-CG 4.32Å; M130-L134 VanDerWaalsContact O-CG 3.3Å; M130-L134 WeakPolarHBondContact O-CG 3.25Å; M130-L134 PolarHBondContact O-N 3.36Å; M130-L134 HydrophobicContact SD-CD1 4.11Å; M130-L134 HydrophobicContact SD-CD2 4.44Å; M130-L134 HydrophobicContact SD-CG 4.09Å; M130-I143 HydrophobicContact SD-CD1 4.33Å
131	S	98.3	Very high	95.5	Very high	6 Å²	6	66 Å²	66	4%	0.042	36%	0.358	C	S	.	.	H	α-helix	trans	-66.4	-37.7	-178.5	58.4	0	0	0	0	112.3	K114 Y116 G128 A135	K114-S131 VanDerWaalsContact O-CB 3.32Å; K114-S131 WeakPolarHBondContact O-CB 3.31Å; Y116-S131 PolarHBondContact N-OG 3.18Å; G128-S131 WeakPolarHBondContact CA-OG 3.27Å; G128-S131 PolarHBondContact O-N 2.93Å; G128-S131 PolarHBondContact O-OG 2.72Å; S131-A135 WeakPolarHBondContact O-CB 3.4Å; S131-A135 PolarHBondContact O-N 3.19Å
132	Q	98.1	Very high	96	Very high	52 Å²	52	67.7 Å²	67.7	24%	0.243	36%	0.362	C	S	.	.	H	α-helix	trans	-68.8	-38.4	174	-72.9	174	104.4	0	0	111.5	V115 Y116 G118 K126 G128 M130 A135 N136	V115-Q132 HydrophobicContact CG1-CG 4.05Å; Y116-Q132 WeakPolarHBondContact O-CG 3.26Å; Y116-Q132 PolarHBondContact O-NE2 3.18Å; G118-Q132 VanDerWaalsContact N-OE1 3.11Å; K126-Q132 PolarHBondContact O-NE2 3.01Å; G128-Q132 WeakPolarHBondContact O-CB 3.39Å; G128-Q132 WeakPolarHBondContact O-CG 3.14Å; G128-Q132 PolarHBondContact O-N 3.08Å; G128-Q132 PolarHBondContact O-NE2 3.27Å; G128-Q132 VanDerWaalsContact O-NE2 3.1Å; M130-Q132 PolarHBondContact O-N 3.19Å; Q132-A135 PolarHBondContact O-N 3.06Å; Q132-N136 PolarHBondContact O-N 3.5Å; Q132-N136 PolarHBondContact O-ND2 3.44Å
133	Y	98.3	Very high	96.5	Very high	70 Å²	70	61.8 Å²	61.8	28%	0.275	32%	0.324	S	S	.	.	H	α-helix	trans	-59.4	-50.6	173	171	-108.6	0	0	0	111.7	A86 L88 V129 M130 A135 N136 L137 I143	A86-Y133 HydrophobicContact CB-CD1 4.12Å; A86-Y133 HydrophobicContact CB-CE1 3.63Å; L88-Y133 HydrophobicContact CD1-CD1 4.23Å; L88-Y133 HydrophobicContact CD1-CD2 4.49Å; L88-Y133 HydrophobicContact CD1-CG 3.91Å; L88-Y133 HydrophobicContact CD2-CD1 3.99Å; L88-Y133 HydrophobicContact CD2-CD2 3.35Å; L88-Y133 HydrophobicContact CD2-CE1 4.19Å; L88-Y133 HydrophobicContact CD2-CE2 3.58Å; L88-Y133 HydrophobicContact CD2-CG 3.55Å; L88-Y133 HydrophobicContact CG-CG 4.4Å; V129-Y133 WeakPolarHBondContact O-CB 3.27Å; V129-Y133 PolarHBondContact O-N 3.24Å; M130-Y133 WeakPolarHBondContact O-CB 3.41Å; M130-Y133 PolarHBondContact O-N 2.97Å; M130-Y133 HydrophobicContact SD-CD1 4.01Å; Y133-A135 VanDerWaalsContact C-N 3.29Å; Y133-A135 PolarHBondContact O-N 2.66Å; Y133-N136 CarbonylContact O-C 3.15Å; Y133-N136 PolarHBondContact O-N 3.19Å; Y133-L137 HydrophobicContact CE1-CD1 4.44Å; Y133-L137 HydrophobicContact CE1-CD2 4.29Å; Y133-L137 HydrophobicContact CE2-CD1 4.31Å; Y133-L137 PolarHBondContact O-N 3.32Å; Y133-L137 WeakPolarHBondContact OH-CD1 3.49Å; Y133-I143 HydrophobicContact CE1-CD1 4.07Å
134	L	98.6	Very high	97	Very high	0 Å²	0	56 Å²	56	0%	0	30%	0.301	C	S	.	.	H	α-helix	trans	-63.3	-35.1	179.2	-64.8	168.4	0	0	0	112.5	R53 I61 L63 F84 Y97 I113 M130 N136 L137 I143	R53-L134 WeakPolarHBondContact CD-O 3.49Å; R53-L134 PolarHBondContact NH1-O 2.8Å; I61-L134 HydrophobicContact CD1-CB 4.42Å; L63-L134 HydrophobicContact CD2-CB 4.44Å; L63-L134 HydrophobicContact CD2-CD2 4.07Å; F84-L134 HydrophobicContact CD2-CD1 3.7Å; F84-L134 HydrophobicContact CD2-CD2 4Å; F84-L134 HydrophobicContact CE2-CD1 4.12Å; F84-L134 HydrophobicContact CE2-CD2 4.33Å; Y97-L134 HydrophobicContact CE1-CD1 4.47Å; Y97-L134 HydrophobicContact CE2-CD1 3.97Å; I113-L134 HydrophobicContact CD1-CD1 3.74Å; M130-L134 HydrophobicContact CG-CD1 3.84Å; M130-L134 HydrophobicContact CG-CG 4.32Å; M130-L134 VanDerWaalsContact O-CG 3.3Å; M130-L134 WeakPolarHBondContact O-CG 3.25Å; M130-L134 PolarHBondContact O-N 3.36Å; M130-L134 HydrophobicContact SD-CD1 4.11Å; M130-L134 HydrophobicContact SD-CD2 4.44Å; M130-L134 HydrophobicContact SD-CG 4.09Å; L134-N136 PolarHBondContact O-N 3.45Å; L134-L137 HydrophobicContact CD2-CD2 4.31Å; L134-I143 HydrophobicContact CD2-CB 4.34Å; L134-I143 HydrophobicContact CD2-CD1 4.08Å; L134-I143 HydrophobicContact CD2-CG1 4.02Å
135	A	98	Very high	97.3	Very high	10 Å²	10	49.9 Å²	49.9	8%	0.083	27%	0.274	C	S	.	.	H	α-helix	trans	-65.5	-20.1	173.9	0	0	0	0	0	113.9	R53 I61 V115 S131 Q132 Y133	R53-A135 PolarHBondContact NE-O 2.74Å; R53-A135 VanDerWaalsContact NH1-C 3.31Å; R53-A135 PolarHBondContact NH1-O 3.43Å; R53-A135 VanDerWaalsContact NH1-O 3.09Å; I61-A135 HydrophobicContact CD1-CB 4.31Å; V115-A135 HydrophobicContact CG1-CB 3.9Å; V115-A135 HydrophobicContact CG2-CB 3.74Å; S131-A135 WeakPolarHBondContact O-CB 3.4Å; S131-A135 PolarHBondContact O-N 3.19Å; Q132-A135 PolarHBondContact O-N 3.06Å; Y133-A135 VanDerWaalsContact C-N 3.29Å; Y133-A135 PolarHBondContact O-N 2.66Å
136	N	97.2	Very high	97.6	Very high	124 Å²	124	49.4 Å²	49.4	66%	0.663	26%	0.263	S	S	*	.	H	α-helix	trans	-111.8	-13.9	179.9	-69.1	-65.2	0	0	0	113.9	R53 Q132 Y133 L134 P138	R53-N136 VanDerWaalsContact NH1-C 3.29Å; Q132-N136 PolarHBondContact O-N 3.5Å; Q132-N136 PolarHBondContact O-ND2 3.44Å; Y133-N136 CarbonylContact O-C 3.15Å; Y133-N136 PolarHBondContact O-N 3.19Å; L134-N136 PolarHBondContact O-N 3.45Å; N136-P138 WeakPolarHBondContact O-CD 3.24Å; N136-P138 VanDerWaalsContact O-N 3.12Å
137	L	97.5	Very high	97.7	Very high	12 Å²	12	41.6 Å²	41.6	6%	0.063	23%	0.229	C	C	.	.			trans	-58.4	109.9	178.8	-178.7	61.6	0	0	0	110.8	V50 R53 Y133 L134 I143	V50-L137 HydrophobicContact CG2-CD2 3.53Å; V50-L137 HydrophobicContact CG2-CG 3.85Å; R53-L137 VanDerWaalsContact NH1-C 3.33Å; R53-L137 PolarHBondContact NH1-O 3.01Å; Y133-L137 HydrophobicContact CE1-CD1 4.44Å; Y133-L137 HydrophobicContact CE1-CD2 4.29Å; Y133-L137 HydrophobicContact CE2-CD1 4.31Å; Y133-L137 PolarHBondContact O-N 3.32Å; Y133-L137 WeakPolarHBondContact OH-CD1 3.49Å; L134-L137 HydrophobicContact CD2-CD2 4.31Å; L137-I143 HydrophobicContact CD2-CB 4.18Å
138	P	97.3	Very high	97.8	Very high	84 Å²	84	41.8 Å²	41.8	55%	0.545	23%	0.226	S	C	.	.			trans	-58.1	157.5	-172.2	23.4	-35.8	0	0	0	112.5	N136 D140 G141	N136-P138 WeakPolarHBondContact O-CD 3.24Å; N136-P138 VanDerWaalsContact O-N 3.12Å; P138-D140 PolarHBondContact O-N 2.78Å; P138-G141 WeakPolarHBondContact O-CA 3.25Å; P138-G141 PolarHBondContact O-N 3.1Å
139	V	98.1	Very high	97.9	Very high	75 Å²	75	41.8 Å²	41.8	46%	0.455	22%	0.224	S	C	.	.	T	Hydrogen-bonded Turn	trans	-52.6	141.8	162.9	175.5	0	0	0	0	108.2	G141	V139-G141 PolarHBondContact O-N 3.28Å
140	D	98	Very high	97.9	Very high	95 Å²	95	39.6 Å²	39.6	51%	0.508	21%	0.213	S	C	.	.	T	Hydrogen-bonded Turn	trans	68.7	-1.8	-169.3	-56.6	-47.1	0	0	0	116.1	R49 V50 P138 F142	R49-D140 WeakPolarHBondContact CD-OD1 3.31Å; R49-D140 IonicContact CZ-OD1 2.93Å; R49-D140 IonicContact NE-OD1 2.64Å; R49-D140 IonicContact NH1-OD1 2.69Å; R49-D140 PolarHBondContact NH1-OD1 2.85Å; V50-D140 PolarHBondContact O-N 2.83Å; P138-D140 PolarHBondContact O-N 2.78Å; D140-F142 WeakPolarHBondContact O-CD2 3.47Å; D140-F142 VanDerWaalsContact O-CE2 3.23Å; D140-F142 WeakPolarHBondContact O-CE2 3.45Å
141	G	98.4	Very high	97.8	Very high	13 Å²	13	43.3 Å²	43.3	13%	0.134	23%	0.227	C	C	.	.			trans	-67	163.1	163.1	0	0	0	0	0	112.1	R49 V50 P138 V139	R49-G141 CarbonylContact C-O 3.18Å; R49-G141 WeakPolarHBondContact CA-O 3.39Å; V50-G141 PolarHBondContact N-O 3.46Å; P138-G141 WeakPolarHBondContact O-CA 3.25Å; P138-G141 PolarHBondContact O-N 3.1Å; V139-G141 PolarHBondContact O-N 3.28Å
142	F	98.6	Very high	97.8	Very high	111 Å²	111	43.1 Å²	43.1	49%	0.487	23%	0.225	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	147.1	-177.4	-68.9	-98.6	0	0	0	112	P47 L48 R49 D140	P47-F142 HydrophobicContact CB-CB 4.5Å; P47-F142 HydrophobicContact CB-CD1 4.1Å; L48-F142 WeakPolarHBondContact O-CA 3.44Å; R49-F142 HydrophobicContact CB-CD1 4.04Å; R49-F142 HydrophobicContact CB-CE1 3.64Å; R49-F142 HydrophobicContact CB-CZ 3.98Å; R49-F142 HydrophobicContact CG-CE1 4.18Å; R49-F142 HydrophobicContact CG-CE2 4.35Å; R49-F142 HydrophobicContact CG-CZ 4.01Å; D140-F142 WeakPolarHBondContact O-CD2 3.47Å; D140-F142 VanDerWaalsContact O-CE2 3.23Å; D140-F142 WeakPolarHBondContact O-CE2 3.45Å
143	I	98.8	Very high	97.8	Very high	2 Å²	2	43.1 Å²	43.1	1%	0.01	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127	134.4	169	-177.6	66.4	0	0	0	109.4	L48 L65 F84 S85 A86 M130 Y133 L134 L137 V145	L48-I143 PolarHBondContact N-O 3.41Å; L48-I143 PolarHBondContact O-N 2.88Å; L65-I143 HydrophobicContact CD1-CG2 3.56Å; L65-I143 HydrophobicContact CD2-CG2 3.88Å; L65-I143 HydrophobicContact CG-CG2 4.41Å; F84-I143 HydrophobicContact CB-CD1 4.12Å; F84-I143 HydrophobicContact CB-CG1 3.84Å; F84-I143 HydrophobicContact CD1-CG1 4.48Å; F84-I143 HydrophobicContact CD2-CG1 3.8Å; F84-I143 HydrophobicContact CE2-CG1 4.48Å; F84-I143 HydrophobicContact CE2-CG2 4.44Å; F84-I143 HydrophobicContact CG-CG1 3.81Å; S85-I143 WeakPolarHBondContact O-CD1 3.23Å; A86-I143 HydrophobicContact CB-CD1 3.99Å; M130-I143 HydrophobicContact SD-CD1 4.33Å; Y133-I143 HydrophobicContact CE1-CD1 4.07Å; L134-I143 HydrophobicContact CD2-CB 4.34Å; L134-I143 HydrophobicContact CD2-CD1 4.08Å; L134-I143 HydrophobicContact CD2-CG1 4.02Å; L137-I143 HydrophobicContact CD2-CB 4.18Å; I143-V145 HydrophobicContact CG2-CG2 4.22Å; I143-V145 PolarHBondContact O-N 2.82Å
144	D	98.6	Very high	97.9	Very high	57 Å²	57	40 Å²	40	31%	0.305	21%	0.213	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.2	127	174.6	-73.8	-23.5	0	0	0	109.9	K45 F84 S85	K45-D144 HydrophobicContact CB-CB 4.38Å; K45-D144 HydrophobicContact CD-CB 4.31Å; F84-D144 CarbonylContact C-O 3.53Å; F84-D144 VanDerWaalsContact CA-O 3.28Å; F84-D144 WeakPolarHBondContact CA-O 3.42Å; S85-D144 PolarHBondContact N-O 3.29Å; S85-D144 WeakPolarHBondContact O-CB 3.3Å; S85-D144 WeakPolarHBondContact OG-CB 3.12Å
145	V	98.8	Very high	97.8	Very high	0 Å²	0	44.7 Å²	44.7	0%	0	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	131.5	179.2	-175	0	0	0	0	109.7	L39 V46 L48 L65 V82 Y83 F84 I143	L39-V145 HydrophobicContact CD2-CG1 4.48Å; V46-V145 PolarHBondContact N-O 3.27Å; V46-V145 PolarHBondContact O-N 3.04Å; L48-V145 HydrophobicContact CB-CG2 4.21Å; L48-V145 HydrophobicContact CD1-CB 4.1Å; L48-V145 HydrophobicContact CD1-CG1 4.43Å; L48-V145 HydrophobicContact CD1-CG2 3.79Å; L48-V145 HydrophobicContact CG-CB 4.25Å; L48-V145 HydrophobicContact CG-CG2 3.91Å; L65-V145 HydrophobicContact CD1-CG2 4.18Å; V82-V145 HydrophobicContact CB-CG1 3.62Å; V82-V145 HydrophobicContact CG1-CG1 3.89Å; V82-V145 HydrophobicContact CG2-CG1 3.67Å; Y83-V145 WeakPolarHBondContact O-CA 3.47Å; F84-V145 HydrophobicContact CD1-CB 4.37Å; F84-V145 HydrophobicContact CD1-CG1 4.2Å; F84-V145 HydrophobicContact CD1-CG2 3.69Å; F84-V145 HydrophobicContact CE1-CB 4.39Å; F84-V145 HydrophobicContact CE1-CG1 4.03Å; F84-V145 HydrophobicContact CE1-CG2 3.54Å; F84-V145 HydrophobicContact CZ-CG2 4.41Å; I143-V145 HydrophobicContact CG2-CG2 4.22Å; I143-V145 PolarHBondContact O-N 2.82Å
146	R	97.9	Very high	97.8	Very high	63 Å²	63	44.9 Å²	44.9	24%	0.238	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.5	154.5	172.4	69.6	176.4	-173.9	90.8	3.4	111.8	K45 V82 Y83	K45-R146 HydrophobicContact CG-CB 4.28Å; V82-R146 CarbonylContact C-O 3.56Å; V82-R146 VanDerWaalsContact CA-O 3.31Å; V82-R146 WeakPolarHBondContact CA-O 3.32Å; V82-R146 WeakPolarHBondContact CB-O 3.49Å; Y83-R146 HydrophobicContact CD2-CG 4.45Å; Y83-R146 PolarHBondContact N-O 2.81Å; Y83-R146 PolarHBondContact O-N 3.07Å
147	G	96.2	Very high	97.8	Very high	0 Å²	0	41.6 Å²	41.6	0%	0	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	152.7	-173.3	-179.4	0	0	0	0	0	110.3	D41 N42	D41-G147 CarbonylContact C-O 3.52Å; N42-G147 WeakPolarHBondContact CA-O 3.43Å
148	P	96.7	Very high	97.8	Very high	25 Å²	25	41 Å²	41	16%	0.162	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	cis	-69	153.5	6.3	25.1	-34.9	0	0	0	115.2	N42 L76 P77 N80	N42-P148 VanDerWaalsContact CG-O 3.26Å; N42-P148 WeakPolarHBondContact OD1-CD 3.48Å; N42-P148 VanDerWaalsContact OD1-CG 3.27Å; N42-P148 WeakPolarHBondContact OD1-CG 3.25Å; N42-P148 PolarHBondContact OD1-O 3.49Å; L76-P148 HydrophobicContact CD1-CB 3.68Å; P77-P148 HydrophobicContact CG-CB 4.31Å; P77-P148 HydrophobicContact CG-CG 4.37Å; N80-P148 HydrophobicContact CB-CB 4.19Å
149	S	97	Very high	97.9	Very high	18 Å²	18	39.4 Å²	39.4	13%	0.126	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.3	142.4	168.1	177.8	0	0	0	0	110.7	N80 H81 Y83	N80-S149 CarbonylContact C-O 3.57Å; N80-S149 WeakPolarHBondContact CA-O 3.21Å; N80-S149 VanDerWaalsContact CB-O 3.26Å; N80-S149 WeakPolarHBondContact CB-O 3.44Å; H81-S149 PolarHBondContact CE1-O 2.8Å; H81-S149 PolarHBondContact N-O 3Å; H81-S149 PolarHBondContact ND1-O 2.87Å; H81-S149 PolarHBondContact NE2-OG 2.93Å; H81-S149 PolarHBondContact O-N 2.87Å; Y83-S149 WeakPolarHBondContact CE2-OG 3.47Å
150	G	97	Very high	97.9	Very high	11 Å²	11	35.8 Å²	35.8	11%	0.113	18%	0.184	C	C	.	.			trans	154.3	159.2	178.9	0	0	0	0	0	112.2	N80	N80-G150 WeakPolarHBondContact OD1-CA 3.43Å
151	R	97.4	Very high	97.9	Very high	82 Å²	82	33.9 Å²	33.9	31%	0.309	17%	0.172	S	C	.	.	S	Bend	trans	-97.9	-14.9	178.1	-70.1	-173.4	-55.4	120.4	3.1	112.5	I162 K163 L166 H302 V303	R151-I162 CarbonylContact O-C 3.55Å; R151-I162 VanDerWaalsContact O-CA 3.31Å; R151-I162 WeakPolarHBondContact O-CA 3.29Å; R151-K163 HydrophobicContact CB-CB 4.41Å; R151-K163 PolarHBondContact O-N 3.39Å; R151-L166 HydrophobicContact CG-CD2 3.86Å; R151-L166 HydrophobicContact CG-CG 4.45Å; R151-H302 PolarHBondContact NH2-CE1 2.91Å; R151-V303 PolarHBondContact NH2-O 2.74Å
152	L	98.2	Very high	97.9	Very high	1 Å²	1	34.4 Å²	34.4	1%	0.005	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	128.4	-176.8	179.8	153.7	0	0	0	109.4	G79 N80 F160 H161 I162 L193 L275 H302 F304	G79-L152 CarbonylContact C-O 3.53Å; G79-L152 WeakPolarHBondContact CA-O 3.2Å; N80-L152 PolarHBondContact OD1-O 2.81Å; L152-F160 HydrophobicContact CD1-CD1 3.81Å; L152-F160 HydrophobicContact CD1-CE1 4.15Å; L152-F160 HydrophobicContact CD2-CD1 3.72Å; L152-F160 HydrophobicContact CD2-CE1 3.95Å; L152-F160 HydrophobicContact CG-CD1 3.8Å; L152-F160 HydrophobicContact CG-CE1 4.37Å; L152-H161 WeakPolarHBondContact CA-O 3.14Å; L152-I162 HydrophobicContact CD1-CD1 4.42Å; L152-I162 HydrophobicContact CD1-CG1 4.47Å; L152-I162 HydrophobicContact CG-CG1 4.44Å; L152-L193 HydrophobicContact CD2-CD1 4.17Å; L152-L193 HydrophobicContact CD2-CD2 4.32Å; L152-L275 HydrophobicContact CD1-CD2 3.68Å; L152-H302 HydrophobicContact CD1-CB 4.14Å; L152-F304 HydrophobicContact CD1-CZ 4.39Å; L152-F304 HydrophobicContact CD2-CE1 4.45Å; L152-F304 HydrophobicContact CD2-CZ 4.29Å
153	E	98.2	Very high	97.8	Very high	53 Å²	53	32.3 Å²	32.3	25%	0.248	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	127.3	169.9	-178.5	-176.4	155.6	0	0	109.3	P77 V78 K155 F160 H161	P77-E153 HydrophobicContact CB-CG 3.72Å; V78-E153 CarbonylContact O-C 3.47Å; V78-E153 VanDerWaalsContact O-CA 3.29Å; V78-E153 WeakPolarHBondContact O-CA 3.12Å; E153-K155 HydrophobicContact CG-CD 3.89Å; E153-K155 VanDerWaalsContact OE1-CD 3.22Å; E153-K155 WeakPolarHBondContact OE1-CD 3.26Å; E153-K155 IonicContact OE1-NZ 3.89Å; E153-K155 PolarHBondContact OE1-NZ 3.33Å; E153-F160 CarbonylContact O-C 3.55Å; E153-F160 WeakPolarHBondContact O-CA 3.34Å; E153-H161 HydrophobicContact CB-CB 4.31Å; E153-H161 PolarHBondContact N-O 3.45Å; E153-H161 PolarHBondContact O-N 2.97Å
154	Y	98.6	Very high	97.6	Very high	5 Å²	5	36 Å²	36	2%	0.02	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.3	123.2	172.8	-171.5	-109.3	0	0	0	110.6	V78 G156 S157 G158 L159 F160 L193 Y196 I197 D203 T205	V78-Y154 PolarHBondContact O-N 2.96Å; Y154-G156 VanDerWaalsContact CE1-CA 3.4Å; Y154-S157 PolarHBondContact OH-N 2.64Å; Y154-G158 WeakPolarHBondContact OH-CA 3.32Å; Y154-G158 PolarHBondContact OH-N 3.03Å; Y154-L159 WeakPolarHBondContact CD2-O 3.2Å; Y154-F160 AromaticContact CD2-CD1 3.75Å; Y154-F160 HydrophobicContact CD2-CD1 3.75Å; Y154-F160 AromaticContact CD2-CD2 3.88Å; Y154-F160 HydrophobicContact CD2-CD2 3.88Å; Y154-F160 AromaticContact CD2-CE1 3.47Å; Y154-F160 HydrophobicContact CD2-CE1 3.47Å; Y154-F160 VanDerWaalsContact CD2-CE1 3.47Å; Y154-F160 AromaticContact CD2-CE2 3.58Å; Y154-F160 HydrophobicContact CD2-CE2 3.58Å; Y154-F160 AromaticContact CD2-CG 3.96Å; Y154-F160 HydrophobicContact CD2-CG 3.96Å; Y154-F160 AromaticContact CD2-CZ 3.38Å; Y154-F160 HydrophobicContact CD2-CZ 3.38Å; Y154-F160 HydrophobicContact CE2-CD2 4.05Å; Y154-F160 HydrophobicContact CE2-CE1 4.19Å; Y154-F160 AromaticContact CE2-CE2 3.51Å; Y154-F160 HydrophobicContact CE2-CE2 3.51Å; Y154-F160 AromaticContact CE2-CZ 3.61Å; Y154-F160 HydrophobicContact CE2-CZ 3.61Å; Y154-F160 HydrophobicContact CG-CE1 4.27Å; Y154-F160 HydrophobicContact CG-CZ 4.45Å; Y154-L193 VanDerWaalsContact CB-CD2 3.5Å; Y154-L193 HydrophobicContact CG-CD2 4.07Å; Y154-Y196 AromaticContact CD1-CD1 3.61Å; Y154-Y196 HydrophobicContact CD1-CD1 3.61Å; Y154-Y196 AromaticContact CD1-CE1 3.8Å; Y154-Y196 HydrophobicContact CD1-CE1 3.8Å; Y154-Y196 AromaticContact CE1-CD1 3.91Å; Y154-Y196 HydrophobicContact CE1-CD1 3.91Å; Y154-Y196 HydrophobicContact CE1-CE1 4.06Å; Y154-I197 HydrophobicContact CD1-CG1 4.03Å; Y154-I197 HydrophobicContact CE1-CD1 4.12Å; Y154-I197 HydrophobicContact CE1-CG1 3.4Å; Y154-I197 HydrophobicContact CE2-CD1 4.21Å; Y154-I197 HydrophobicContact CE2-CG1 4.35Å; Y154-D203 WeakPolarHBondContact CE1-OD2 3.5Å; Y154-D203 PolarHBondContact OH-OD1 2.89Å; Y154-D203 PolarHBondContact OH-OD2 3.43Å; Y154-T205 PolarHBondContact OH-OG1 2.82Å
155	K	97.7	Very high	97.4	Very high	98 Å²	98	36.5 Å²	36.5	43%	0.426	19%	0.189	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.6	-6.4	-176.3	-57.1	-56.1	-64.8	169	0	113.3	E153 L159 H161	E153-K155 HydrophobicContact CG-CD 3.89Å; E153-K155 VanDerWaalsContact OE1-CD 3.22Å; E153-K155 WeakPolarHBondContact OE1-CD 3.26Å; E153-K155 IonicContact OE1-NZ 3.89Å; E153-K155 PolarHBondContact OE1-NZ 3.33Å; K155-L159 HydrophobicContact CB-CB 4.19Å; K155-L159 HydrophobicContact CB-CD2 3.96Å; K155-L159 HydrophobicContact CB-CG 4.02Å; K155-L159 HydrophobicContact CG-CD2 4.38Å; K155-L159 HydrophobicContact CG-CG 4.35Å; K155-L159 PolarHBondContact N-O 3.44Å; K155-H161 HydrophobicContact CG-CB 4.37Å
156	G	97.6	Very high	97.1	Very high	13 Å²	13	41.2 Å²	41.2	13%	0.134	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	103.4	154.6	-176.1	0	0	0	0	0	113.3	Y154 G158 L159	Y154-G156 VanDerWaalsContact CE1-CA 3.4Å; G156-G158 PolarHBondContact O-N 3.39Å; G156-L159 WeakPolarHBondContact O-CB 3.36Å; G156-L159 PolarHBondContact O-N 3.19Å
157	S	97.3	Very high	96.8	Very high	55 Å²	55	49.7 Å²	49.7	39%	0.385	25%	0.246	S	C	.	.	T	Hydrogen-bonded Turn	trans	53	39.3	173.6	-49.2	0	0	0	0	113.3	Y154 L159 K174 D203	Y154-S157 PolarHBondContact OH-N 2.64Å; S157-L159 PolarHBondContact O-N 2.78Å; S157-K174 VanDerWaalsContact O-CE 3.28Å; S157-K174 WeakPolarHBondContact O-CE 3.2Å; S157-K174 PolarHBondContact O-NZ 3.46Å; S157-D203 WeakPolarHBondContact CA-OD1 3.49Å; S157-D203 WeakPolarHBondContact CA-OD2 3.29Å; S157-D203 PolarHBondContact N-OD2 3.17Å
158	G	98	Very high	96.7	Very high	0 Å²	0	51.9 Å²	51.9	0%	0	26%	0.261	C	S	.	.	T	Hydrogen-bonded Turn	trans	81.9	7	177.5	0	0	0	0	0	114.8	Y154 G156 K174 V175 T205	Y154-G158 WeakPolarHBondContact OH-CA 3.32Å; Y154-G158 PolarHBondContact OH-N 3.03Å; G156-G158 PolarHBondContact O-N 3.39Å; G158-K174 WeakPolarHBondContact O-CA 3.44Å; G158-V175 WeakPolarHBondContact CA-O 3.09Å; G158-V175 WeakPolarHBondContact O-CG2 3.22Å; G158-V175 PolarHBondContact O-N 3.38Å; G158-T205 VanDerWaalsContact CA-OG1 3.26Å; G158-T205 WeakPolarHBondContact CA-OG1 3.46Å; G158-T205 PolarHBondContact N-OG1 3.44Å
159	L	98.5	Very high	96.7	Very high	50 Å²	50	55.5 Å²	55.5	26%	0.262	29%	0.287	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92	118.7	176.7	-179.4	62.9	0	0	0	110.9	Y154 K155 G156 S157 P172 K174	Y154-L159 WeakPolarHBondContact CD2-O 3.2Å; K155-L159 HydrophobicContact CB-CB 4.19Å; K155-L159 HydrophobicContact CB-CD2 3.96Å; K155-L159 HydrophobicContact CB-CG 4.02Å; K155-L159 HydrophobicContact CG-CD2 4.38Å; K155-L159 HydrophobicContact CG-CG 4.35Å; K155-L159 PolarHBondContact N-O 3.44Å; G156-L159 WeakPolarHBondContact O-CB 3.36Å; G156-L159 PolarHBondContact O-N 3.19Å; S157-L159 PolarHBondContact O-N 2.78Å; L159-P172 HydrophobicContact CD1-CB 4.03Å; L159-K174 HydrophobicContact CB-CD 4.12Å; L159-K174 HydrophobicContact CD1-CD 4.44Å
160	F	98.7	Very high	96.7	Very high	0 Å²	0	57.1 Å²	57.1	0%	0	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.5	143.3	170.5	-67.7	-96.7	0	0	0	110.3	L152 E153 Y154 I162 P172 V173 V175 V178 L193 I273 L275	L152-F160 HydrophobicContact CD1-CD1 3.81Å; L152-F160 HydrophobicContact CD1-CE1 4.15Å; L152-F160 HydrophobicContact CD2-CD1 3.72Å; L152-F160 HydrophobicContact CD2-CE1 3.95Å; L152-F160 HydrophobicContact CG-CD1 3.8Å; L152-F160 HydrophobicContact CG-CE1 4.37Å; E153-F160 CarbonylContact O-C 3.55Å; E153-F160 WeakPolarHBondContact O-CA 3.34Å; Y154-F160 AromaticContact CD2-CD1 3.75Å; Y154-F160 HydrophobicContact CD2-CD1 3.75Å; Y154-F160 AromaticContact CD2-CD2 3.88Å; Y154-F160 HydrophobicContact CD2-CD2 3.88Å; Y154-F160 AromaticContact CD2-CE1 3.47Å; Y154-F160 HydrophobicContact CD2-CE1 3.47Å; Y154-F160 VanDerWaalsContact CD2-CE1 3.47Å; Y154-F160 AromaticContact CD2-CE2 3.58Å; Y154-F160 HydrophobicContact CD2-CE2 3.58Å; Y154-F160 AromaticContact CD2-CG 3.96Å; Y154-F160 HydrophobicContact CD2-CG 3.96Å; Y154-F160 AromaticContact CD2-CZ 3.38Å; Y154-F160 HydrophobicContact CD2-CZ 3.38Å; Y154-F160 HydrophobicContact CE2-CD2 4.05Å; Y154-F160 HydrophobicContact CE2-CE1 4.19Å; Y154-F160 AromaticContact CE2-CE2 3.51Å; Y154-F160 HydrophobicContact CE2-CE2 3.51Å; Y154-F160 AromaticContact CE2-CZ 3.61Å; Y154-F160 HydrophobicContact CE2-CZ 3.61Å; Y154-F160 HydrophobicContact CG-CE1 4.27Å; Y154-F160 HydrophobicContact CG-CZ 4.45Å; F160-I162 HydrophobicContact CB-CD1 4.2Å; F160-I162 HydrophobicContact CB-CG1 3.99Å; F160-P172 CarbonylContact O-C 3.6Å; F160-P172 WeakPolarHBondContact O-CA 3.37Å; F160-V173 HydrophobicContact CB-CB 4.42Å; F160-V173 PolarHBondContact N-O 3.4Å; F160-V173 PolarHBondContact O-N 3.38Å; F160-V175 HydrophobicContact CD2-CG2 3.78Å; F160-V175 HydrophobicContact CE2-CG2 3.5Å; F160-V175 VanDerWaalsContact CE2-CG2 3.5Å; F160-V178 HydrophobicContact CE2-CG2 3.81Å; F160-V178 HydrophobicContact CZ-CG1 4.47Å; F160-V178 HydrophobicContact CZ-CG2 3.78Å; F160-L193 HydrophobicContact CE1-CD2 4.19Å; F160-I273 HydrophobicContact CD2-CG2 4.38Å; F160-I273 HydrophobicContact CE2-CG2 3.89Å; F160-I273 HydrophobicContact CG-CD1 4.39Å; F160-I273 HydrophobicContact CZ-CG2 4.18Å; F160-L275 HydrophobicContact CE1-CD1 4.45Å
161	H	98.4	Very high	96.7	Very high	55 Å²	55	61 Å²	61	26%	0.255	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	114	163.8	-83.8	-171.5	0	0	0	107.5	L152 E153 K155 P170	L152-H161 WeakPolarHBondContact CA-O 3.14Å; E153-H161 HydrophobicContact CB-CB 4.31Å; E153-H161 PolarHBondContact N-O 3.45Å; E153-H161 PolarHBondContact O-N 2.97Å; K155-H161 HydrophobicContact CG-CB 4.37Å; H161-P170 HydrophobicContact CB-CB 3.76Å; H161-P170 HydrophobicContact CB-CG 4.41Å
162	I	98.2	Very high	96.7	Very high	24 Å²	24	61.5 Å²	61.5	12%	0.123	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	124	-175.5	-54.2	-179.2	0	0	0	110	R151 L152 F160 N171 V173 I273	R151-I162 CarbonylContact O-C 3.55Å; R151-I162 VanDerWaalsContact O-CA 3.31Å; R151-I162 WeakPolarHBondContact O-CA 3.29Å; L152-I162 HydrophobicContact CD1-CD1 4.42Å; L152-I162 HydrophobicContact CD1-CG1 4.47Å; L152-I162 HydrophobicContact CG-CG1 4.44Å; F160-I162 HydrophobicContact CB-CD1 4.2Å; F160-I162 HydrophobicContact CB-CG1 3.99Å; I162-N171 PolarHBondContact N-O 2.91Å; I162-N171 PolarHBondContact O-N 2.99Å; I162-V173 HydrophobicContact CD1-CB 4.31Å; I162-V173 HydrophobicContact CD1-CG2 4.02Å; I162-V173 HydrophobicContact CG1-CG2 4.36Å; I162-I273 HydrophobicContact CD1-CD1 3.5Å; I162-I273 VanDerWaalsContact CD1-CD1 3.5Å
163	K	97.1	Very high	96.6	Very high	66 Å²	66	62.9 Å²	62.9	29%	0.287	34%	0.337	S	S	.	.			trans	-94.9	134.4	176	-52.9	177.3	176.2	178.7	0	110.4	R151 D165 S168 P170	R151-K163 HydrophobicContact CB-CB 4.41Å; R151-K163 PolarHBondContact O-N 3.39Å; K163-D165 VanDerWaalsContact C-N 3.29Å; K163-D165 WeakPolarHBondContact CB-O 3.43Å; K163-D165 PolarHBondContact O-N 3.34Å; K163-S168 WeakPolarHBondContact CD-O 3.37Å; K163-P170 HydrophobicContact CG-CB 3.93Å
164	P	94.2	Very high	96.6	Very high	79 Å²	79	66.4 Å²	66.4	51%	0.513	35%	0.352	S	S	.	.	S	Bend	trans	-56.3	-45.2	170.2	-25.5	34.1	0	0	0	112.1
165	D	94	Very high	96.6	Very high	68 Å²	68	66.4 Å²	66.4	36%	0.364	35%	0.352	S	S	.	.	S	Bend	trans	-138.9	172.1	175.1	68.6	79.5	0	0	0	110.4	K163 R167 S168	K163-D165 VanDerWaalsContact C-N 3.29Å; K163-D165 WeakPolarHBondContact CB-O 3.43Å; K163-D165 PolarHBondContact O-N 3.34Å; D165-R167 PolarHBondContact O-N 3.2Å; D165-R167 VanDerWaalsContact O-N 3.17Å; D165-R167 WeakPolarHBondContact OD1-CA 3.26Å; D165-R167 WeakPolarHBondContact OD1-CB 3.47Å; D165-R167 PolarHBondContact OD1-N 2.96Å; D165-S168 PolarHBondContact O-N 3.02Å; D165-S168 PolarHBondContact OD1-N 2.87Å; D165-S168 WeakPolarHBondContact OD2-CB 3.23Å; D165-S168 PolarHBondContact OD2-OG 3.13Å
166	L	91.6	Very high	96.7	Very high	100 Å²	100	68 Å²	68	52%	0.524	36%	0.36	S	S	.	.	S	Bend	trans	-65.7	-18.7	-173.8	-67.8	174.7	0	0	0	114.9	R151	R151-L166 HydrophobicContact CG-CD2 3.86Å; R151-L166 HydrophobicContact CG-CG 4.45Å
167	R	92.2	Very high	96.7	Very high	241 Å²	241	69.3 Å²	69.3	91%	0.909	36%	0.362	S	S	*	.	S	Bend	trans	-99.3	-26.2	-176.9	-56.4	176.8	-172.9	151.4	1.7	112.5	D165	D165-R167 PolarHBondContact O-N 3.2Å; D165-R167 VanDerWaalsContact O-N 3.17Å; D165-R167 WeakPolarHBondContact OD1-CA 3.26Å; D165-R167 WeakPolarHBondContact OD1-CB 3.47Å; D165-R167 PolarHBondContact OD1-N 2.96Å
168	S	94.9	Very high	96.8	Very high	45 Å²	45	66.7 Å²	66.7	32%	0.315	34%	0.343	S	S	.	.	S	Bend	trans	-64.8	152.7	178.1	-77.6	0	0	0	0	113	K163 D165	K163-S168 WeakPolarHBondContact CD-O 3.37Å; D165-S168 PolarHBondContact O-N 3.02Å; D165-S168 PolarHBondContact OD1-N 2.87Å; D165-S168 WeakPolarHBondContact OD2-CB 3.23Å; D165-S168 PolarHBondContact OD2-OG 3.13Å
169	S	95.6	Very high	96.9	Very high	101 Å²	101	66.7 Å²	66.7	71%	0.706	34%	0.343	S	S	*	.	P	Polyproline II helix	trans	-65.7	146.2	169.1	-69.5	0	0	0	0	110.5
170	P	96.8	Very high	96.9	Very high	53 Å²	53	64.3 Å²	64.3	34%	0.344	33%	0.331	S	S	.	.	P	Polyproline II helix	trans	-73.4	141.3	179.3	29.4	-33.2	0	0	0	111.7	H161 K163	H161-P170 HydrophobicContact CB-CB 3.76Å; H161-P170 HydrophobicContact CB-CG 4.41Å; K163-P170 HydrophobicContact CG-CB 3.93Å
171	N	96.7	Very high	96.9	Very high	93 Å²	93	64.3 Å²	64.3	50%	0.497	33%	0.331	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.6	129	167.7	-65.2	-35.2	0	0	0	109.4	I162	I162-N171 PolarHBondContact N-O 2.91Å; I162-N171 PolarHBondContact O-N 2.99Å
172	P	97.9	Very high	96.9	Very high	92 Å²	92	61.7 Å²	61.7	60%	0.597	32%	0.319	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-73.1	129.9	174	29.6	-32.6	0	0	0	110.6	L159 F160	L159-P172 HydrophobicContact CD1-CB 4.03Å; F160-P172 CarbonylContact O-C 3.6Å; F160-P172 WeakPolarHBondContact O-CA 3.37Å
173	V	97.5	Very high	96.9	Very high	29 Å²	29	60.7 Å²	60.7	18%	0.176	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	114.4	176.1	-177.2	0	0	0	0	107.7	F160 I162 V175 M300	F160-V173 HydrophobicContact CB-CB 4.42Å; F160-V173 PolarHBondContact N-O 3.4Å; F160-V173 PolarHBondContact O-N 3.38Å; I162-V173 HydrophobicContact CD1-CB 4.31Å; I162-V173 HydrophobicContact CD1-CG2 4.02Å; I162-V173 HydrophobicContact CG1-CG2 4.36Å; V173-V175 HydrophobicContact CG1-CG1 4.1Å; V173-M300 HydrophobicContact CG1-CE 3.98Å; V173-M300 HydrophobicContact CG1-SD 3.95Å
174	K	98.3	Very high	96.9	Very high	127 Å²	127	58.3 Å²	58.3	55%	0.552	31%	0.309	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-100.3	124.7	179.6	-173.9	70	170.1	-168.7	0	109.3	S157 G158 L159	S157-K174 VanDerWaalsContact O-CE 3.28Å; S157-K174 WeakPolarHBondContact O-CE 3.2Å; S157-K174 PolarHBondContact O-NZ 3.46Å; G158-K174 WeakPolarHBondContact O-CA 3.44Å; L159-K174 HydrophobicContact CB-CD 4.12Å; L159-K174 HydrophobicContact CD1-CD 4.44Å
175	V	98.7	Very high	97	Very high	5 Å²	5	56 Å²	56	3%	0.03	30%	0.295	C	S	.	.			trans	-129.9	162.7	-179.6	-62.8	0	0	0	0	111.5	G158 F160 V173 V178 D271 I273 M300	G158-V175 WeakPolarHBondContact CA-O 3.09Å; G158-V175 WeakPolarHBondContact O-CG2 3.22Å; G158-V175 PolarHBondContact O-N 3.38Å; F160-V175 HydrophobicContact CD2-CG2 3.78Å; F160-V175 HydrophobicContact CE2-CG2 3.5Å; F160-V175 VanDerWaalsContact CE2-CG2 3.5Å; V173-V175 HydrophobicContact CG1-CG1 4.1Å; V175-V178 HydrophobicContact CG2-CG2 4.06Å; V175-D271 WeakPolarHBondContact CA-O 3.3Å; V175-D271 VanDerWaalsContact CB-O 3.29Å; V175-D271 WeakPolarHBondContact CB-O 3.45Å; V175-I273 HydrophobicContact CB-CG2 4.42Å; V175-I273 HydrophobicContact CG1-CB 3.93Å; V175-I273 HydrophobicContact CG1-CG2 4.12Å; V175-I273 HydrophobicContact CG2-CG2 3.86Å; V175-M300 HydrophobicContact CG1-CE 3.63Å
176	K	98.6	Very high	97.2	Very high	133 Å²	133	52.9 Å²	52.9	58%	0.578	28%	0.279	S	S	*	.	S	Bend	trans	-107	-28.1	167.2	-61.6	-175.1	-163.1	151.1	0	111.6	Q206 D271	K176-Q206 PolarHBondContact O-N 2.59Å; K176-D271 HydrophobicContact CB-CB 4.42Å; K176-D271 VanDerWaalsContact CD-OD2 3.27Å; K176-D271 WeakPolarHBondContact CD-OD2 3.39Å; K176-D271 HydrophobicContact CG-CB 4.27Å; K176-D271 PolarHBondContact N-O 3.02Å; K176-D271 IonicContact NZ-OD2 2.8Å; K176-D271 PolarHBondContact NZ-OD2 3.02Å
177	H	98.9	Very high	97.5	Very high	39 Å²	39	48.1 Å²	48.1	18%	0.181	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	138.2	-176.5	-53.6	97.3	0	0	0	110.9	Q206 Y266 D271 T272 I273	H177-Q206 CarbonylContact C-O 3.5Å; H177-Q206 WeakPolarHBondContact CA-O 2.97Å; H177-Y266 HydrophobicContact CB-CD1 4.49Å; H177-Y266 HydrophobicContact CB-CD2 3.78Å; H177-Y266 HydrophobicContact CB-CE2 4.41Å; H177-Y266 HydrophobicContact CB-CG 3.83Å; H177-Y266 AromaticContact CD2-CD1 3.48Å; H177-Y266 VanDerWaalsContact CD2-CD1 3.48Å; H177-Y266 WeakPolarHBondContact CD2-CD1 3.37Å; H177-Y266 AromaticContact CD2-CD2 3.98Å; H177-Y266 AromaticContact CD2-CE1 3.56Å; H177-Y266 AromaticContact CD2-CG 3.7Å; H177-Y266 AromaticContact CD2-CZ 3.88Å; H177-Y266 AromaticContact CG-CG 3.93Å; H177-D271 PolarHBondContact N-O 3.31Å; H177-D271 IonicContact ND1-OD1 3.92Å; H177-T272 HydrophobicContact CB-CG2 4.06Å; H177-T272 WeakPolarHBondContact O-CA 3.47Å; H177-I273 PolarHBondContact O-N 3.08Å
178	V	98.9	Very high	97.8	Very high	0 Å²	0	37.5 Å²	37.5	0%	0	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	115.9	175.4	179.6	0	0	0	0	108.1	F160 V175 M180 T205 Q206 I207 A208 I273 L275	F160-V178 HydrophobicContact CE2-CG2 3.81Å; F160-V178 HydrophobicContact CZ-CG1 4.47Å; F160-V178 HydrophobicContact CZ-CG2 3.78Å; V175-V178 HydrophobicContact CG2-CG2 4.06Å; V178-M180 HydrophobicContact CG1-CE 3.91Å; V178-M180 HydrophobicContact CG1-CG 4.14Å; V178-T205 HydrophobicContact CB-CG2 4.4Å; V178-T205 HydrophobicContact CG2-CG2 3.5Å; V178-T205 VanDerWaalsContact CG2-CG2 3.5Å; V178-Q206 PolarHBondContact N-O 2.8Å; V178-I207 HydrophobicContact CB-CG1 4.29Å; V178-I207 VanDerWaalsContact O-CA 3.3Å; V178-I207 WeakPolarHBondContact O-CA 3.35Å; V178-A208 PolarHBondContact O-N 2.93Å; V178-I273 CarbonylContact C-O 3.49Å; V178-I273 WeakPolarHBondContact CA-O 3.38Å; V178-I273 HydrophobicContact CB-CG2 4.24Å; V178-I273 HydrophobicContact CG1-CG2 4.17Å; V178-I273 HydrophobicContact CG2-CG2 3.81Å; V178-L275 HydrophobicContact CG1-CD1 3.69Å; V178-L275 HydrophobicContact CG1-CG 4.06Å
179	N	98.9	Very high	98	Very high	0 Å²	0	35.5 Å²	35.5	0%	0	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.1	135.8	168.9	-61.7	-34.8	0	0	0	109.2	A208 I265 Y266 T272 I273 T274 L275	N179-A208 CarbonylContact C-O 3.57Å; N179-A208 WeakPolarHBondContact CA-O 3.48Å; N179-I265 HydrophobicContact CB-CB 4.14Å; N179-I265 HydrophobicContact CB-CD1 4.22Å; N179-I265 HydrophobicContact CB-CG2 4.34Å; N179-Y266 PolarHBondContact ND2-O 3.25Å; N179-Y266 WeakPolarHBondContact OD1-CB 3.12Å; N179-Y266 WeakPolarHBondContact OD1-CD2 3.4Å; N179-Y266 PolarHBondContact OD1-N 3.25Å; N179-T272 VanDerWaalsContact ND2-CG2 3.28Å; N179-T272 WeakPolarHBondContact ND2-CG2 3.39Å; N179-I273 PolarHBondContact N-O 3.22Å; N179-T274 HydrophobicContact CB-CG2 4.06Å; N179-T274 PolarHBondContact ND2-OG1 2.8Å; N179-L275 PolarHBondContact O-N 3.23Å
180	M	98.9	Very high	98.2	Very high	0 Å²	0	30.7 Å²	30.7	0%	0	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	110.9	175.8	-64.4	-177.1	179.2	0	0	109	V178 M190 L193 L194 I207 A208 M209 V210 L275	V178-M180 HydrophobicContact CG1-CE 3.91Å; V178-M180 HydrophobicContact CG1-CG 4.14Å; M180-M190 HydrophobicContact CB-CB 4.45Å; M180-M190 HydrophobicContact CB-CG 4.18Å; M180-M190 HydrophobicContact CB-SD 3.89Å; M180-M190 HydrophobicContact CG-CB 4.48Å; M180-M190 HydrophobicContact CG-CG 4.44Å; M180-M190 HydrophobicContact CG-SD 3.77Å; M180-M190 HydrophobicContact SD-CB 3.78Å; M180-M190 HydrophobicContact SD-CG 4.36Å; M180-M190 HydrophobicContact SD-SD 4.13Å; M180-L193 HydrophobicContact CE-CB 3.82Å; M180-L194 HydrophobicContact CE-CB 4.39Å; M180-L194 HydrophobicContact SD-CB 4.39Å; M180-I207 HydrophobicContact CE-CD1 4.25Å; M180-I207 HydrophobicContact CE-CG2 4.02Å; M180-I207 HydrophobicContact CG-CG2 4.19Å; M180-I207 HydrophobicContact SD-CG2 3.88Å; M180-A208 PolarHBondContact N-O 2.64Å; M180-M209 HydrophobicContact CB-CB 4.19Å; M180-M209 HydrophobicContact CB-CE 4.07Å; M180-M209 HydrophobicContact CB-CG 4.17Å; M180-M209 HydrophobicContact CG-CE 4.48Å; M180-M209 CarbonylContact O-C 3.58Å; M180-M209 VanDerWaalsContact O-CA 3.25Å; M180-M209 WeakPolarHBondContact O-CA 3.34Å; M180-M209 HydrophobicContact SD-CE 3.56Å; M180-M209 VanDerWaalsContact SD-CE 3.56Å; M180-V210 PolarHBondContact O-N 3.38Å; M180-L275 HydrophobicContact CE-CD1 4.43Å
181	I	98.9	Very high	98.3	Very high	0 Å²	0	28.8 Å²	28.8	0%	0	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	108.5	176.3	-52.9	167.6	0	0	0	107.2	V210 V256 L261 I265 T274 L275 I276 C277 F282 C287 L291	I181-V210 WeakPolarHBondContact CA-O 3.21Å; I181-V256 HydrophobicContact CG2-CG1 4.4Å; I181-L261 HydrophobicContact CD1-CD1 4.13Å; I181-L261 HydrophobicContact CD1-CD2 3.64Å; I181-L261 HydrophobicContact CG1-CD2 3.98Å; I181-L261 HydrophobicContact CG2-CD2 4.46Å; I181-I265 HydrophobicContact CD1-CD1 4.17Å; I181-T274 HydrophobicContact CD1-CG2 3.74Å; I181-T274 HydrophobicContact CG1-CG2 4.35Å; I181-L275 PolarHBondContact N-O 2.78Å; I181-I276 VanDerWaalsContact O-CA 3.31Å; I181-I276 WeakPolarHBondContact O-CA 3.37Å; I181-C277 PolarHBondContact O-N 3.11Å; I181-C277 VanDerWaalsContact O-N 3.13Å; I181-F282 HydrophobicContact CG2-CE1 4.33Å; I181-F282 HydrophobicContact CG2-CZ 3.75Å; I181-C287 HydrophobicContact CG2-CB 4.46Å; I181-C287 WeakPolarHBondContact CG2-SG 3.41Å; I181-L291 HydrophobicContact CD1-CD1 3.93Å; I181-L291 HydrophobicContact CD1-CD2 4.03Å; I181-L291 HydrophobicContact CD1-CG 4.23Å
182	C	98.5	Very high	98.4	Very high	0 Å²	0	24.6 Å²	24.6	0%	0	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	148.3	-174.3	54	0	0	0	0	112.9	M190 V210 F211 A212 C277 F282	C182-M190 HydrophobicContact CB-CG 3.92Å; C182-V210 PolarHBondContact N-O 2.86Å; C182-F211 HydrophobicContact CB-CD2 4.29Å; C182-F211 WeakPolarHBondContact O-CD2 3.39Å; C182-F211 WeakPolarHBondContact SG-CD2 3.31Å; C182-A212 PolarHBondContact O-N 3.05Å; C182-C277 CarbonylContact C-O 3.51Å; C182-C277 VanDerWaalsContact CA-O 3.22Å; C182-C277 WeakPolarHBondContact CA-O 2.82Å; C182-F282 VanDerWaalsContact C-CZ 3.42Å; C182-F282 WeakPolarHBondContact O-CZ 3.39Å
183	G	98.4	Very high	98.4	Very high	4 Å²	4	20.2 Å²	20.2	4%	0.041	10%	0.103	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	121.3	179.4	0	0	0	0	0	111.3	S185 G186 A212 C277	G183-S185 PolarHBondContact O-N 3.07Å; G183-G186 PolarHBondContact O-N 3.34Å; G183-A212 VanDerWaalsContact CA-O 3.32Å; G183-A212 WeakPolarHBondContact CA-O 3.48Å; G183-C277 PolarHBondContact N-O 3.24Å
184	G	96.4	Very high	98.5	Very high	16 Å²	16	18.8 Å²	18.8	17%	0.165	10%	0.095	C	C	.	.	G	3₁₀ helix	trans	53.6	-122.3	179.5	0	0	0	0	0	113.7	G186 I187 F211 A212	G184-G186 PolarHBondContact O-N 2.9Å; G184-G186 VanDerWaalsContact O-N 3.14Å; G184-I187 WeakPolarHBondContact O-CG2 3.48Å; G184-I187 PolarHBondContact O-N 2.86Å; G184-F211 VanDerWaalsContact O-CE2 3.23Å; G184-F211 WeakPolarHBondContact O-CE2 3.44Å; G184-F211 WeakPolarHBondContact O-CZ 3.35Å; G184-A212 PolarHBondContact N-O 2.88Å
185	S	96.6	Very high	98.5	Very high	31 Å²	31	13 Å²	13	22%	0.217	7%	0.07	C	C	.	.	G	3₁₀ helix	trans	-66.8	-10.2	179.3	51.3	0	0	0	0	114.5	Y116 G183 I187 T188	Y116-S185 PolarHBondContact OH-OG 2.97Å; G183-S185 PolarHBondContact O-N 3.07Å; S185-I187 PolarHBondContact O-N 3.44Å; S185-T188 PolarHBondContact O-N 3.29Å; S185-T188 PolarHBondContact O-OG1 3.36Å; S185-T188 VanDerWaalsContact O-OG1 3.06Å
186	G	97.9	Very high	98.5	Very high	2 Å²	2	16.4 Å²	16.4	2%	0.021	8%	0.083	C	C	.	.	G	3₁₀ helix	trans	-61.8	-8	172.1	0	0	0	0	0	114.3	G183 G184 T188 P189 C277	G183-G186 PolarHBondContact O-N 3.34Å; G184-G186 PolarHBondContact O-N 2.9Å; G184-G186 VanDerWaalsContact O-N 3.14Å; G186-T188 PolarHBondContact O-N 2.74Å; G186-P189 WeakPolarHBondContact O-CD 3.13Å; G186-C277 VanDerWaalsContact CA-SG 3.59Å; G186-C277 WeakPolarHBondContact O-CB 3.37Å
187	I	98.6	Very high	98.5	Very high	0 Å²	0	10.2 Å²	10.2	0%	0	6%	0.056	C	C	.	.	H	α-helix	trans	-62.7	-26.2	171.5	-169.2	58.8	0	0	0	113.2	G184 S185 M190 F191 M209 F211 I220 L225	G184-I187 WeakPolarHBondContact O-CG2 3.48Å; G184-I187 PolarHBondContact O-N 2.86Å; S185-I187 PolarHBondContact O-N 3.44Å; I187-M190 HydrophobicContact CD1-CB 4.34Å; I187-M190 CarbonylContact O-C 3.57Å; I187-M190 WeakPolarHBondContact O-CB 3.44Å; I187-M190 PolarHBondContact O-N 2.79Å; I187-M190 VanDerWaalsContact O-N 3.13Å; I187-F191 HydrophobicContact CG1-CB 4.48Å; I187-F191 WeakPolarHBondContact O-CB 3.43Å; I187-F191 PolarHBondContact O-N 3.05Å; I187-M209 HydrophobicContact CD1-CE 3.92Å; I187-M209 HydrophobicContact CD1-SD 3.62Å; I187-F211 HydrophobicContact CB-CE1 4.1Å; I187-F211 HydrophobicContact CB-CE2 3.87Å; I187-F211 HydrophobicContact CB-CZ 3.58Å; I187-F211 HydrophobicContact CD1-CD1 4.09Å; I187-F211 HydrophobicContact CD1-CE1 4.09Å; I187-F211 HydrophobicContact CD1-CG 4.36Å; I187-F211 HydrophobicContact CD1-CZ 4.33Å; I187-F211 HydrophobicContact CG1-CD1 4.45Å; I187-F211 HydrophobicContact CG1-CE1 3.93Å; I187-F211 HydrophobicContact CG1-CE2 4.48Å; I187-F211 HydrophobicContact CG1-CZ 3.96Å; I187-F211 HydrophobicContact CG2-CZ 3.94Å; I187-I220 HydrophobicContact CG2-CB 4.04Å; I187-I220 HydrophobicContact CG2-CG2 3.82Å; I187-L225 HydrophobicContact CD1-CD1 3.91Å; I187-L225 HydrophobicContact CD1-CD2 4.22Å; I187-L225 HydrophobicContact CG1-CD1 4.21Å
188	T	98.7	Very high	98.4	Very high	18 Å²	18	9 Å²	9	11%	0.11	5%	0.051	C	C	.	.	H	α-helix	trans	-60.8	-50.4	-170.4	49.1	0	0	0	0	115.2	I100 V112 S185 G186 M190 F191 Q192	I100-T188 HydrophobicContact CG2-CG2 4.29Å; V112-T188 HydrophobicContact CB-CG2 4.14Å; V112-T188 WeakPolarHBondContact O-CG2 3.41Å; S185-T188 PolarHBondContact O-N 3.29Å; S185-T188 PolarHBondContact O-OG1 3.36Å; S185-T188 VanDerWaalsContact O-OG1 3.06Å; G186-T188 PolarHBondContact O-N 2.74Å; T188-M190 VanDerWaalsContact C-N 3.29Å; T188-M190 PolarHBondContact O-N 3.13Å; T188-F191 PolarHBondContact O-N 3.06Å; T188-Q192 PolarHBondContact O-N 3.34Å
189	P	98.7	Very high	98.3	Very high	3 Å²	3	13.5 Å²	13.5	2%	0.019	7%	0.072	C	C	.	.	H	α-helix	trans	-65.3	-32.8	172.9	26.1	-35.3	0	0	0	113.1	T98 G186 Q192 L193 C277 F304	T98-P189 HydrophobicContact CG2-CB 4.22Å; G186-P189 WeakPolarHBondContact O-CD 3.13Å; P189-Q192 PolarHBondContact O-N 3.14Å; P189-L193 PolarHBondContact O-N 3.24Å; P189-C277 HydrophobicContact CG-CB 3.92Å; P189-F304 HydrophobicContact CB-CD1 3.91Å; P189-F304 HydrophobicContact CB-CD2 4.17Å; P189-F304 HydrophobicContact CB-CE1 3.95Å; P189-F304 HydrophobicContact CB-CE2 4.17Å; P189-F304 HydrophobicContact CB-CG 4.04Å; P189-F304 HydrophobicContact CB-CZ 4.08Å; P189-F304 HydrophobicContact CG-CB 4.42Å; P189-F304 HydrophobicContact CG-CD1 4.42Å; P189-F304 HydrophobicContact CG-CD2 4.13Å; P189-F304 HydrophobicContact CG-CG 4.07Å
190	M	98.7	Very high	98.2	Very high	0 Å²	0	15 Å²	15	0%	0	8%	0.083	C	C	.	.	H	α-helix	trans	-66.9	-44.4	177.7	-57.7	-51.1	175.5	0	0	111.3	M180 C182 I187 T188 Q192 L193 L194 M209 L275 C277 F304	M180-M190 HydrophobicContact CB-CB 4.45Å; M180-M190 HydrophobicContact CB-CG 4.18Å; M180-M190 HydrophobicContact CB-SD 3.89Å; M180-M190 HydrophobicContact CG-CB 4.48Å; M180-M190 HydrophobicContact CG-CG 4.44Å; M180-M190 HydrophobicContact CG-SD 3.77Å; M180-M190 HydrophobicContact SD-CB 3.78Å; M180-M190 HydrophobicContact SD-CG 4.36Å; M180-M190 HydrophobicContact SD-SD 4.13Å; C182-M190 HydrophobicContact CB-CG 3.92Å; I187-M190 HydrophobicContact CD1-CB 4.34Å; I187-M190 CarbonylContact O-C 3.57Å; I187-M190 WeakPolarHBondContact O-CB 3.44Å; I187-M190 PolarHBondContact O-N 2.79Å; I187-M190 VanDerWaalsContact O-N 3.13Å; T188-M190 VanDerWaalsContact C-N 3.29Å; T188-M190 PolarHBondContact O-N 3.13Å; M190-Q192 VanDerWaalsContact C-N 3.32Å; M190-Q192 PolarHBondContact O-N 3.02Å; M190-L193 PolarHBondContact O-N 3.22Å; M190-L194 WeakPolarHBondContact O-CB 3.18Å; M190-L194 PolarHBondContact O-N 3.27Å; M190-M209 HydrophobicContact CB-CE 3.87Å; M190-L275 VanDerWaalsContact CE-C 3.43Å; M190-L275 HydrophobicContact CE-CB 3.68Å; M190-L275 WeakPolarHBondContact CE-O 3.43Å; M190-L275 HydrophobicContact SD-CB 3.83Å; M190-L275 HydrophobicContact SD-CD1 4.38Å; M190-C277 HydrophobicContact CE-CB 3.79Å; M190-F304 HydrophobicContact CE-CD2 3.82Å; M190-F304 HydrophobicContact CE-CE2 3.8Å; M190-F304 HydrophobicContact SD-CE2 3.97Å
191	F	98.9	Very high	97.7	Very high	13 Å²	13	24 Å²	24	6%	0.057	12%	0.122	C	C	.	.	H	α-helix	trans	-63.4	-38.2	178.9	-170.6	-88.6	0	0	0	111.7	I100 I187 T188 S195 L221 E224 L225 F228	I100-F191 HydrophobicContact CB-CD1 3.77Å; I100-F191 HydrophobicContact CB-CE1 4.11Å; I100-F191 HydrophobicContact CG2-CD1 4.07Å; I187-F191 HydrophobicContact CG1-CB 4.48Å; I187-F191 WeakPolarHBondContact O-CB 3.43Å; I187-F191 PolarHBondContact O-N 3.05Å; T188-F191 PolarHBondContact O-N 3.06Å; F191-S195 WeakPolarHBondContact CD1-OG 3.45Å; F191-S195 VanDerWaalsContact CE1-OG 3.24Å; F191-S195 WeakPolarHBondContact CE1-OG 3.41Å; F191-S195 WeakPolarHBondContact O-CB 3.49Å; F191-S195 PolarHBondContact O-N 3.19Å; F191-S195 PolarHBondContact O-OG 2.78Å; F191-L221 HydrophobicContact CB-CD1 4.3Å; F191-L221 HydrophobicContact CD1-CD1 4.17Å; F191-L221 HydrophobicContact CD2-CB 4.37Å; F191-L221 HydrophobicContact CD2-CD1 3.78Å; F191-L221 HydrophobicContact CE1-CD1 4.48Å; F191-L221 HydrophobicContact CE2-CB 4.31Å; F191-L221 HydrophobicContact CE2-CD1 4.12Å; F191-L221 HydrophobicContact CG-CD1 3.81Å; F191-L221 HydrophobicContact CZ-CD1 4.46Å; F191-E224 HydrophobicContact CE2-CB 3.66Å; F191-E224 HydrophobicContact CZ-CB 3.83Å; F191-E224 HydrophobicContact CZ-CG 4.34Å; F191-L225 HydrophobicContact CD2-CD2 3.96Å; F191-L225 HydrophobicContact CD2-CG 4.42Å; F191-L225 HydrophobicContact CE2-CD2 4.38Å; F191-F228 HydrophobicContact CE1-CE2 4.5Å; F191-F228 HydrophobicContact CE2-CD2 4.23Å; F191-F228 AromaticContact CE2-CE2 3.77Å; F191-F228 HydrophobicContact CE2-CE2 3.77Å; F191-F228 AromaticContact CZ-CE2 3.76Å; F191-F228 HydrophobicContact CZ-CE2 3.76Å; F191-F228 HydrophobicContact CZ-CZ 4.43Å
192	Q	98.7	Very high	97.4	Very high	4 Å²	4	31 Å²	31	2%	0.019	16%	0.159	C	C	.	.	H	α-helix	trans	-61.4	-50.6	174.7	-171.4	-167	68.7	0	0	111.4	T98 L102 T188 P189 M190 Y196	T98-Q192 HydrophobicContact CG2-CB 4.11Å; T98-Q192 HydrophobicContact CG2-CG 4.45Å; L102-Q192 HydrophobicContact CD2-CG 3.95Å; T188-Q192 PolarHBondContact O-N 3.34Å; P189-Q192 PolarHBondContact O-N 3.14Å; M190-Q192 VanDerWaalsContact C-N 3.32Å; M190-Q192 PolarHBondContact O-N 3.02Å; Q192-Y196 PolarHBondContact O-N 2.81Å
193	L	98.8	Very high	97.3	Very high	0 Å²	0	31.6 Å²	31.6	0%	0	16%	0.162	C	C	.	.	H	α-helix	trans	-62.6	-49.3	178	-82.7	166.2	0	0	0	111.9	V78 L152 Y154 F160 M180 P189 M190 S195 Y196 I197 L275 F304	V78-L193 HydrophobicContact CG1-CD2 3.7Å; V78-L193 HydrophobicContact CG1-CG 4.3Å; L152-L193 HydrophobicContact CD2-CD1 4.17Å; L152-L193 HydrophobicContact CD2-CD2 4.32Å; Y154-L193 VanDerWaalsContact CB-CD2 3.5Å; Y154-L193 HydrophobicContact CG-CD2 4.07Å; F160-L193 HydrophobicContact CE1-CD2 4.19Å; M180-L193 HydrophobicContact CE-CB 3.82Å; P189-L193 PolarHBondContact O-N 3.24Å; M190-L193 PolarHBondContact O-N 3.22Å; L193-S195 VanDerWaalsContact C-N 3.35Å; L193-S195 PolarHBondContact O-N 3.33Å; L193-Y196 PolarHBondContact O-N 3.19Å; L193-I197 VanDerWaalsContact O-CG1 3.26Å; L193-I197 WeakPolarHBondContact O-CG1 3.44Å; L193-I197 PolarHBondContact O-N 3.43Å; L193-L275 HydrophobicContact CD1-CD1 3.6Å; L193-F304 HydrophobicContact CD1-CE2 4.33Å; L193-F304 HydrophobicContact CD1-CZ 3.64Å
194	L	98.8	Very high	97.3	Very high	0 Å²	0	36.4 Å²	36.4	0%	0	19%	0.191	C	C	.	.	H	α-helix	trans	-54.8	-51.2	177.6	178.5	69.4	0	0	0	110.9	M180 M190 Y196 I197 L198 I207 M209 L225 F228 F236	M180-L194 HydrophobicContact CE-CB 4.39Å; M180-L194 HydrophobicContact SD-CB 4.39Å; M190-L194 WeakPolarHBondContact O-CB 3.18Å; M190-L194 PolarHBondContact O-N 3.27Å; L194-Y196 VanDerWaalsContact C-N 3.29Å; L194-Y196 PolarHBondContact O-N 2.59Å; L194-I197 PolarHBondContact O-N 2.87Å; L194-L198 HydrophobicContact CD1-CD1 3.49Å; L194-L198 VanDerWaalsContact CD1-CD1 3.49Å; L194-L198 HydrophobicContact CD1-CG 3.95Å; L194-L198 HydrophobicContact CG-CD1 3.91Å; L194-L198 HydrophobicContact CG-CG 4.47Å; L194-L198 WeakPolarHBondContact O-CB 3.47Å; L194-L198 WeakPolarHBondContact O-CG 3.46Å; L194-L198 PolarHBondContact O-N 2.81Å; L194-I207 HydrophobicContact CD1-CB 4.39Å; L194-I207 HydrophobicContact CD1-CD1 3.59Å; L194-I207 HydrophobicContact CD1-CG2 4.07Å; L194-M209 HydrophobicContact CD2-CE 4.04Å; L194-L225 HydrophobicContact CD2-CD2 3.57Å; L194-F228 HydrophobicContact CD2-CD2 3.85Å; L194-F228 HydrophobicContact CD2-CE2 4.48Å; L194-F228 HydrophobicContact CG-CD2 4.2Å; L194-F236 HydrophobicContact CD1-CD1 4.19Å; L194-F236 HydrophobicContact CD1-CD2 3.57Å; L194-F236 HydrophobicContact CD1-CE1 4.25Å; L194-F236 HydrophobicContact CD1-CE2 3.62Å; L194-F236 HydrophobicContact CD1-CG 3.88Å; L194-F236 HydrophobicContact CD1-CZ 3.97Å; L194-F236 HydrophobicContact CD2-CD1 4.5Å; L194-F236 HydrophobicContact CD2-CE1 3.85Å; L194-F236 HydrophobicContact CD2-CE2 4.03Å; L194-F236 HydrophobicContact CD2-CZ 3.57Å; L194-F236 HydrophobicContact CG-CZ 4.44Å
195	S	98.5	Very high	97.4	Very high	4 Å²	4	35.8 Å²	35.8	3%	0.028	18%	0.184	C	C	.	.	H	α-helix	trans	-57.8	-44	179	-67.7	0	0	0	0	111.4	F191 L193 Q199 F228	F191-S195 WeakPolarHBondContact CD1-OG 3.45Å; F191-S195 VanDerWaalsContact CE1-OG 3.24Å; F191-S195 WeakPolarHBondContact CE1-OG 3.41Å; F191-S195 WeakPolarHBondContact O-CB 3.49Å; F191-S195 PolarHBondContact O-N 3.19Å; F191-S195 PolarHBondContact O-OG 2.78Å; L193-S195 VanDerWaalsContact C-N 3.35Å; L193-S195 PolarHBondContact O-N 3.33Å; S195-Q199 VanDerWaalsContact O-CB 3.23Å; S195-Q199 WeakPolarHBondContact O-CB 3.45Å; S195-Q199 VanDerWaalsContact O-CG 3.25Å; S195-Q199 WeakPolarHBondContact O-CG 3.31Å; S195-Q199 PolarHBondContact O-N 3.18Å; S195-Q199 PolarHBondContact O-NE2 3.18Å; S195-F228 WeakPolarHBondContact OG-CE2 3.36Å
196	Y	98.6	Very high	97.5	Very high	78 Å²	78	36.2 Å²	36.2	31%	0.306	18%	0.183	S	C	.	.	H	α-helix	trans	-67.6	-46.9	-179.6	-175	-91	0	0	0	111.8	V78 L102 Y154 Q192 L193 L194 S200	V78-Y196 HydrophobicContact CB-CD2 4.49Å; V78-Y196 HydrophobicContact CB-CG 4.33Å; V78-Y196 HydrophobicContact CG1-CD1 4.3Å; V78-Y196 HydrophobicContact CG1-CG 3.97Å; V78-Y196 HydrophobicContact CG2-CD1 4.3Å; V78-Y196 HydrophobicContact CG2-CD2 3.4Å; V78-Y196 HydrophobicContact CG2-CE2 3.78Å; V78-Y196 HydrophobicContact CG2-CG 3.66Å; L102-Y196 HydrophobicContact CD1-CD2 4.22Å; L102-Y196 HydrophobicContact CD2-CD2 4.33Å; Y154-Y196 AromaticContact CD1-CD1 3.61Å; Y154-Y196 HydrophobicContact CD1-CD1 3.61Å; Y154-Y196 AromaticContact CD1-CE1 3.8Å; Y154-Y196 HydrophobicContact CD1-CE1 3.8Å; Y154-Y196 AromaticContact CE1-CD1 3.91Å; Y154-Y196 HydrophobicContact CE1-CD1 3.91Å; Y154-Y196 HydrophobicContact CE1-CE1 4.06Å; Q192-Y196 PolarHBondContact O-N 2.81Å; L193-Y196 PolarHBondContact O-N 3.19Å; L194-Y196 VanDerWaalsContact C-N 3.29Å; L194-Y196 PolarHBondContact O-N 2.59Å; Y196-S200 WeakPolarHBondContact CE1-OG 3.13Å; Y196-S200 VanDerWaalsContact O-CB 3.3Å; Y196-S200 WeakPolarHBondContact O-CB 3.26Å; Y196-S200 PolarHBondContact O-N 2.79Å; Y196-S200 PolarHBondContact O-OG 3.05Å
197	I	98.6	Very high	97.5	Very high	2 Å²	2	36.1 Å²	36.1	1%	0.01	18%	0.182	C	C	.	.	H	α-helix	trans	-61.9	-53.8	-178.2	-67.9	166.5	0	0	0	110.3	Y154 L193 L194 Q199 S200 T205 I207	Y154-I197 HydrophobicContact CD1-CG1 4.03Å; Y154-I197 HydrophobicContact CE1-CD1 4.12Å; Y154-I197 HydrophobicContact CE1-CG1 3.4Å; Y154-I197 HydrophobicContact CE2-CD1 4.21Å; Y154-I197 HydrophobicContact CE2-CG1 4.35Å; L193-I197 VanDerWaalsContact O-CG1 3.26Å; L193-I197 WeakPolarHBondContact O-CG1 3.44Å; L193-I197 PolarHBondContact O-N 3.43Å; L194-I197 PolarHBondContact O-N 2.87Å; I197-Q199 VanDerWaalsContact C-N 3.26Å; I197-Q199 PolarHBondContact O-N 3.04Å; I197-S200 PolarHBondContact O-N 3.32Å; I197-T205 HydrophobicContact CG2-CG2 4.45Å; I197-I207 HydrophobicContact CB-CD1 3.87Å; I197-I207 HydrophobicContact CD1-CD1 3.79Å; I197-I207 HydrophobicContact CD1-CG1 4.45Å; I197-I207 HydrophobicContact CG1-CD1 4.41Å; I197-I207 HydrophobicContact CG2-CD1 3.72Å; I197-I207 HydrophobicContact CG2-CG1 4.44Å
198	L	98.2	Very high	97.6	Very high	14 Å²	14	36.2 Å²	36.2	7%	0.073	18%	0.182	C	C	.	.	H	α-helix	trans	-69.2	-23.2	-174.6	-62.9	-177.5	0	0	0	113.8	L194 I207 F228 Y232 H235 F236	L194-L198 HydrophobicContact CD1-CD1 3.49Å; L194-L198 VanDerWaalsContact CD1-CD1 3.49Å; L194-L198 HydrophobicContact CD1-CG 3.95Å; L194-L198 HydrophobicContact CG-CD1 3.91Å; L194-L198 HydrophobicContact CG-CG 4.47Å; L194-L198 WeakPolarHBondContact O-CB 3.47Å; L194-L198 WeakPolarHBondContact O-CG 3.46Å; L194-L198 PolarHBondContact O-N 2.81Å; L198-I207 HydrophobicContact CD2-CD1 4.43Å; L198-F228 HydrophobicContact CD1-CB 3.93Å; L198-F228 HydrophobicContact CD1-CD1 4.42Å; L198-F228 HydrophobicContact CD1-CG 4.1Å; L198-Y232 HydrophobicContact CB-CD1 4.42Å; L198-Y232 HydrophobicContact CB-CD2 3.87Å; L198-Y232 HydrophobicContact CB-CE1 4.43Å; L198-Y232 HydrophobicContact CB-CE2 3.89Å; L198-Y232 HydrophobicContact CB-CG 4.14Å; L198-Y232 HydrophobicContact CD1-CD2 3.78Å; L198-Y232 HydrophobicContact CD1-CE2 4.45Å; L198-Y232 HydrophobicContact CD1-CG 4.19Å; L198-Y232 HydrophobicContact CD2-CG 4.18Å; L198-Y232 HydrophobicContact CG-CD2 4.29Å; L198-Y232 HydrophobicContact CG-CG 4.4Å; L198-Y232 WeakPolarHBondContact O-CE1 3.32Å; L198-Y232 PolarHBondContact O-OH 2.86Å; L198-H235 HydrophobicContact CD2-CB 3.89Å; L198-F236 HydrophobicContact CD1-CB 3.92Å; L198-F236 HydrophobicContact CD1-CD1 4.12Å; L198-F236 HydrophobicContact CD1-CG 4.1Å; L198-F236 HydrophobicContact CD2-CB 4.17Å
199	Q	96.6	Very high	97.6	Very high	94 Å²	94	35.4 Å²	35.4	44%	0.439	18%	0.177	S	C	.	.	H	α-helix	trans	-96.5	-6.4	177.7	-63.7	174.4	75	0	0	113.1	S195 I197	S195-Q199 VanDerWaalsContact O-CB 3.23Å; S195-Q199 WeakPolarHBondContact O-CB 3.45Å; S195-Q199 VanDerWaalsContact O-CG 3.25Å; S195-Q199 WeakPolarHBondContact O-CG 3.31Å; S195-Q199 PolarHBondContact O-N 3.18Å; S195-Q199 PolarHBondContact O-NE2 3.18Å; I197-Q199 VanDerWaalsContact C-N 3.26Å; I197-Q199 PolarHBondContact O-N 3.04Å
200	S	95.9	Very high	97.6	Very high	33 Å²	33	35.2 Å²	35.2	23%	0.231	18%	0.176	C	C	.	.	S	Bend	trans	-77.1	132.3	175.2	-71.2	0	0	0	0	110.3	Y196 I197	Y196-S200 WeakPolarHBondContact CE1-OG 3.13Å; Y196-S200 VanDerWaalsContact O-CB 3.3Å; Y196-S200 WeakPolarHBondContact O-CB 3.26Å; Y196-S200 PolarHBondContact O-N 2.79Å; Y196-S200 PolarHBondContact O-OG 3.05Å; I197-S200 PolarHBondContact O-N 3.32Å
201	K	89.7	Confident	97.6	Very high	188 Å²	188	35.2 Å²	35.2	82%	0.817	18%	0.176	S	C	*	.	T	Hydrogen-bonded Turn	trans	-66	141.7	171.3	-65.1	-174.4	179	-174.8	0	109.2	D203	K201-D203 PolarHBondContact O-N 2.78Å
202	D	91.8	Very high	97.6	Very high	147 Å²	147	35.2 Å²	35.2	79%	0.786	18%	0.178	S	C	*	.	T	Hydrogen-bonded Turn	trans	63.2	9.6	174.8	-43.8	-46.8	0	0	0	115.1	T204	D202-T204 PolarHBondContact O-N 2.9Å
203	D	97.4	Very high	97.6	Very high	13 Å²	13	35.6 Å²	35.6	7%	0.07	18%	0.181	C	C	.	.			trans	-82.1	106.6	173.3	-157	-36.8	0	0	0	110.4	Y154 S157 K201 T205	Y154-D203 WeakPolarHBondContact CE1-OD2 3.5Å; Y154-D203 PolarHBondContact OH-OD1 2.89Å; Y154-D203 PolarHBondContact OH-OD2 3.43Å; S157-D203 WeakPolarHBondContact CA-OD1 3.49Å; S157-D203 WeakPolarHBondContact CA-OD2 3.29Å; S157-D203 PolarHBondContact N-OD2 3.17Å; K201-D203 PolarHBondContact O-N 2.78Å; D203-T205 VanDerWaalsContact C-N 3.3Å; D203-T205 WeakPolarHBondContact OD1-CB 3.35Å; D203-T205 PolarHBondContact OD1-N 2.76Å; D203-T205 PolarHBondContact OD1-OG1 2.81Å
204	T	97	Very high	97.5	Very high	105 Å²	105	38.9 Å²	38.9	64%	0.644	20%	0.2	S	C	*	.			trans	-90.4	5.5	-178.4	63.3	0	0	0	0	113.2	D202 Q206	D202-T204 PolarHBondContact O-N 2.9Å; T204-Q206 PolarHBondContact O-N 3.01Å
205	T	98.6	Very high	97.4	Very high	2 Å²	2	39.6 Å²	39.6	1%	0.012	21%	0.205	C	C	.	.			trans	-58	134.8	-177.7	-53.8	0	0	0	0	110.4	Y154 G158 V178 I197 D203	Y154-T205 PolarHBondContact OH-OG1 2.82Å; G158-T205 VanDerWaalsContact CA-OG1 3.26Å; G158-T205 WeakPolarHBondContact CA-OG1 3.46Å; G158-T205 PolarHBondContact N-OG1 3.44Å; V178-T205 HydrophobicContact CB-CG2 4.4Å; V178-T205 HydrophobicContact CG2-CG2 3.5Å; V178-T205 VanDerWaalsContact CG2-CG2 3.5Å; I197-T205 HydrophobicContact CG2-CG2 4.45Å; D203-T205 VanDerWaalsContact C-N 3.3Å; D203-T205 WeakPolarHBondContact OD1-CB 3.35Å; D203-T205 PolarHBondContact OD1-N 2.76Å; D203-T205 PolarHBondContact OD1-OG1 2.81Å
206	Q	98.7	Very high	97.3	Very high	41 Å²	41	42.5 Å²	42.5	19%	0.192	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	129.7	-178.3	-66.6	-67.5	-50	0	0	109.5	K176 H177 V178 T204 N234 H235 Y266	K176-Q206 PolarHBondContact O-N 2.59Å; H177-Q206 CarbonylContact C-O 3.5Å; H177-Q206 WeakPolarHBondContact CA-O 2.97Å; V178-Q206 PolarHBondContact N-O 2.8Å; T204-Q206 PolarHBondContact O-N 3.01Å; Q206-N234 PolarHBondContact NE2-O 2.81Å; Q206-N234 VanDerWaalsContact NE2-O 3.08Å; Q206-N234 PolarHBondContact OE1-O 2.89Å; Q206-H235 PolarHBondContact NE2-ND1 2.97Å; Q206-H235 VanDerWaalsContact NE2-ND1 3.16Å; Q206-Y266 HydrophobicContact CB-CE2 4.07Å; Q206-Y266 PolarHBondContact OE1-OH 3.07Å
207	I	98.9	Very high	97.1	Very high	0 Å²	0	45.4 Å²	45.4	0%	0	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	130.9	-174.7	-56.8	169.7	0	0	0	110.3	V178 M180 L194 I197 L198 H235 F236 R237	V178-I207 HydrophobicContact CB-CG1 4.29Å; V178-I207 VanDerWaalsContact O-CA 3.3Å; V178-I207 WeakPolarHBondContact O-CA 3.35Å; M180-I207 HydrophobicContact CE-CD1 4.25Å; M180-I207 HydrophobicContact CE-CG2 4.02Å; M180-I207 HydrophobicContact CG-CG2 4.19Å; M180-I207 HydrophobicContact SD-CG2 3.88Å; L194-I207 HydrophobicContact CD1-CB 4.39Å; L194-I207 HydrophobicContact CD1-CD1 3.59Å; L194-I207 HydrophobicContact CD1-CG2 4.07Å; I197-I207 HydrophobicContact CB-CD1 3.87Å; I197-I207 HydrophobicContact CD1-CD1 3.79Å; I197-I207 HydrophobicContact CD1-CG1 4.45Å; I197-I207 HydrophobicContact CG1-CD1 4.41Å; I197-I207 HydrophobicContact CG2-CD1 3.72Å; I197-I207 HydrophobicContact CG2-CG1 4.44Å; L198-I207 HydrophobicContact CD2-CD1 4.43Å; I207-H235 PolarHBondContact N-O 2.95Å; I207-F236 HydrophobicContact CB-CD2 4.1Å; I207-F236 HydrophobicContact CG2-CD2 3.95Å; I207-F236 HydrophobicContact CG2-CE2 4.2Å; I207-F236 WeakPolarHBondContact O-CA 3.37Å; I207-R237 PolarHBondContact O-N 2.82Å
208	A	98.9	Very high	97	Very high	1 Å²	1	46 Å²	46	1%	0.008	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	125.7	167.4	0	0	0	0	0	109.3	V178 N179 M180 R237 I265 Y266	V178-A208 PolarHBondContact O-N 2.93Å; N179-A208 CarbonylContact C-O 3.57Å; N179-A208 WeakPolarHBondContact CA-O 3.48Å; M180-A208 PolarHBondContact N-O 2.64Å; A208-R237 CarbonylContact C-O 3.58Å; A208-R237 WeakPolarHBondContact CA-O 3.3Å; A208-R237 HydrophobicContact CB-CB 4.39Å; A208-I265 HydrophobicContact CB-CB 4.47Å; A208-I265 HydrophobicContact CB-CG2 4.42Å; A208-Y266 HydrophobicContact CB-CD2 3.64Å; A208-Y266 HydrophobicContact CB-CE2 3.56Å
209	M	98.9	Very high	97	Very high	1 Å²	1	45.7 Å²	45.7	1%	0.005	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	127.5	-179.3	-179.9	178.1	-67.9	0	0	111.1	M180 I187 M190 L194 F211 L225 F236 R237 L238 W239	M180-M209 HydrophobicContact CB-CB 4.19Å; M180-M209 HydrophobicContact CB-CE 4.07Å; M180-M209 HydrophobicContact CB-CG 4.17Å; M180-M209 HydrophobicContact CG-CE 4.48Å; M180-M209 CarbonylContact O-C 3.58Å; M180-M209 VanDerWaalsContact O-CA 3.25Å; M180-M209 WeakPolarHBondContact O-CA 3.34Å; M180-M209 HydrophobicContact SD-CE 3.56Å; M180-M209 VanDerWaalsContact SD-CE 3.56Å; I187-M209 HydrophobicContact CD1-CE 3.92Å; I187-M209 HydrophobicContact CD1-SD 3.62Å; M190-M209 HydrophobicContact CB-CE 3.87Å; L194-M209 HydrophobicContact CD2-CE 4.04Å; M209-F211 HydrophobicContact CG-CB 4.36Å; M209-F211 HydrophobicContact SD-CB 4.44Å; M209-L225 HydrophobicContact CE-CD2 4.36Å; M209-L225 HydrophobicContact SD-CD2 4.06Å; M209-F236 HydrophobicContact CB-CE2 3.69Å; M209-F236 HydrophobicContact CB-CZ 4.24Å; M209-F236 HydrophobicContact CE-CE2 4.37Å; M209-F236 HydrophobicContact CE-CZ 4.41Å; M209-F236 HydrophobicContact SD-CZ 4.27Å; M209-R237 PolarHBondContact N-O 3.49Å; M209-L238 HydrophobicContact CB-CD1 4.02Å; M209-L238 HydrophobicContact CG-CD1 3.92Å; M209-L238 HydrophobicContact SD-CD1 3.78Å; M209-W239 PolarHBondContact O-N 3Å
210	V	98.9	Very high	97.1	Very high	0 Å²	0	41.3 Å²	41.3	0%	0	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	116.4	162.7	172.7	0	0	0	0	107.7	M180 I181 C182 W239 V256 I260 L261 H264 I265	M180-V210 PolarHBondContact O-N 3.38Å; I181-V210 WeakPolarHBondContact CA-O 3.21Å; C182-V210 PolarHBondContact N-O 2.86Å; V210-W239 CarbonylContact C-O 3.5Å; V210-W239 VanDerWaalsContact CA-O 3.32Å; V210-W239 WeakPolarHBondContact CA-O 3.25Å; V210-W239 HydrophobicContact CG2-CB 4.42Å; V210-V256 HydrophobicContact CG1-CG2 3.91Å; V210-I260 HydrophobicContact CG1-CG2 3.99Å; V210-I260 HydrophobicContact CG2-CG2 4.36Å; V210-L261 HydrophobicContact CG2-CD2 4.42Å; V210-H264 HydrophobicContact CG2-CB 3.93Å; V210-I265 HydrophobicContact CG2-CG2 3.67Å
211	F	98.8	Very high	97.2	Very high	0 Å²	0	40 Å²	40	0%	0	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	114	-178.7	-171.4	-163.4	0	0	0	111.3	C182 G184 I187 M209 N213 I219 I220 L225 W239 Y240 T241	C182-F211 HydrophobicContact CB-CD2 4.29Å; C182-F211 WeakPolarHBondContact O-CD2 3.39Å; C182-F211 WeakPolarHBondContact SG-CD2 3.31Å; G184-F211 VanDerWaalsContact O-CE2 3.23Å; G184-F211 WeakPolarHBondContact O-CE2 3.44Å; G184-F211 WeakPolarHBondContact O-CZ 3.35Å; I187-F211 HydrophobicContact CB-CE1 4.1Å; I187-F211 HydrophobicContact CB-CE2 3.87Å; I187-F211 HydrophobicContact CB-CZ 3.58Å; I187-F211 HydrophobicContact CD1-CD1 4.09Å; I187-F211 HydrophobicContact CD1-CE1 4.09Å; I187-F211 HydrophobicContact CD1-CG 4.36Å; I187-F211 HydrophobicContact CD1-CZ 4.33Å; I187-F211 HydrophobicContact CG1-CD1 4.45Å; I187-F211 HydrophobicContact CG1-CE1 3.93Å; I187-F211 HydrophobicContact CG1-CE2 4.48Å; I187-F211 HydrophobicContact CG1-CZ 3.96Å; I187-F211 HydrophobicContact CG2-CZ 3.94Å; M209-F211 HydrophobicContact CG-CB 4.36Å; M209-F211 HydrophobicContact SD-CB 4.44Å; F211-N213 WeakPolarHBondContact CD2-OD1 3.4Å; F211-N213 WeakPolarHBondContact CE2-OD1 3.39Å; F211-I219 HydrophobicContact CD1-CG2 4.01Å; F211-I219 HydrophobicContact CE1-CG2 3.77Å; F211-I220 WeakPolarHBondContact CE1-O 3.46Å; F211-I220 HydrophobicContact CZ-CB 4.45Å; F211-L225 HydrophobicContact CD1-CD1 3.83Å; F211-L225 HydrophobicContact CE1-CD1 4.01Å; F211-W239 PolarHBondContact N-O 2.8Å; F211-Y240 HydrophobicContact CB-CD1 4.03Å; F211-Y240 HydrophobicContact CB-CE1 4.38Å; F211-Y240 HydrophobicContact CD1-CD1 4.15Å; F211-Y240 AromaticContact CD1-CE1 3.92Å; F211-Y240 HydrophobicContact CD1-CE1 3.92Å; F211-Y240 HydrophobicContact CG-CD1 4.46Å; F211-Y240 WeakPolarHBondContact O-CA 3.4Å; F211-T241 PolarHBondContact O-N 2.87Å
212	A	98.8	Very high	97.6	Very high	13 Å²	13	34.4 Å²	34.4	11%	0.107	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	130.4	-175.6	0	0	0	0	0	112.7	C182 G183 G184 T241 V256 F282	C182-A212 PolarHBondContact O-N 3.05Å; G183-A212 VanDerWaalsContact CA-O 3.32Å; G183-A212 WeakPolarHBondContact CA-O 3.48Å; G184-A212 PolarHBondContact N-O 2.88Å; A212-T241 VanDerWaalsContact CA-O 3.29Å; A212-T241 WeakPolarHBondContact CA-O 3.37Å; A212-T241 HydrophobicContact CB-CG2 3.6Å; A212-V256 HydrophobicContact CB-CG2 4Å; A212-F282 HydrophobicContact CB-CD2 4.33Å; A212-F282 HydrophobicContact CB-CE2 3.54Å; A212-F282 HydrophobicContact CB-CZ 4.13Å
213	N	98.4	Very high	97.9	Very high	12 Å²	12	33.6 Å²	33.6	6%	0.064	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.3	170.1	178.5	-62.7	85.8	0	0	0	111	F211 D218 I219 T241 V242 N243	F211-N213 WeakPolarHBondContact CD2-OD1 3.4Å; F211-N213 WeakPolarHBondContact CE2-OD1 3.39Å; N213-D218 HydrophobicContact CB-CB 3.94Å; N213-D218 PolarHBondContact ND2-O 2.97Å; N213-I219 HydrophobicContact CB-CG1 4.15Å; N213-T241 PolarHBondContact N-O 3Å; N213-V242 HydrophobicContact CB-CG1 4.35Å; N213-V242 VanDerWaalsContact O-CA 3.31Å; N213-V242 WeakPolarHBondContact O-CA 3.4Å; N213-N243 PolarHBondContact O-N 2.77Å
214	V	96.4	Very high	97.9	Very high	68 Å²	68	36 Å²	36	41%	0.412	18%	0.184	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.8	-54.2	176.3	-177.4	0	0	0	0	109.5	N243 E244	V214-N243 PolarHBondContact O-N 3.16Å; V214-E244 PolarHBondContact O-N 3.2Å
215	T	97.1	Very high	98	Very high	16 Å²	16	31 Å²	31	10%	0.098	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	169.3	177.3	65.2	0	0	0	0	111.2	K217 D218 E244	T215-K217 VanDerWaalsContact C-N 3.31Å; T215-K217 PolarHBondContact O-N 2.6Å; T215-K217 WeakPolarHBondContact OG1-CE 3.5Å; T215-K217 WeakPolarHBondContact OG1-CG 3.23Å; T215-D218 WeakPolarHBondContact CB-OD2 3.44Å; T215-D218 PolarHBondContact N-OD2 3.12Å; T215-D218 WeakPolarHBondContact O-CB 3.4Å; T215-D218 PolarHBondContact O-N 2.95Å; T215-D218 VanDerWaalsContact O-N 3.1Å; T215-D218 PolarHBondContact OG1-OD2 2.85Å; T215-E244 HydrophobicContact CG2-CB 3.94Å
216	E	96.3	Very high	98	Very high	65 Å²	65	32.4 Å²	32.4	30%	0.304	16%	0.16	S	C	.	.	G	3₁₀ helix	trans	-59.8	-37.4	174.3	-174.9	178.2	-157.2	0	0	113	D218 I219 R222 P246 W249	E216-D218 PolarHBondContact O-N 3.1Å; E216-I219 HydrophobicContact CG-CD1 4.3Å; E216-I219 WeakPolarHBondContact O-CB 3.22Å; E216-I219 VanDerWaalsContact O-CG1 3.31Å; E216-I219 WeakPolarHBondContact O-CG1 3.37Å; E216-I219 PolarHBondContact O-N 2.87Å; E216-I219 VanDerWaalsContact O-N 3.16Å; E216-R222 IonicContact OE1-CZ 3.83Å; E216-R222 VanDerWaalsContact OE1-CZ 3.23Å; E216-R222 IonicContact OE1-NH1 3.07Å; E216-R222 PolarHBondContact OE1-NH1 2.88Å; E216-R222 IonicContact OE1-NH2 3.24Å; E216-R222 PolarHBondContact OE1-NH2 2.8Å; E216-P246 WeakPolarHBondContact OE2-CG 3.42Å; E216-W249 HydrophobicContact CB-CZ3 4.41Å; E216-W249 HydrophobicContact CG-CZ3 3.93Å
217	K	95.8	Very high	98	Very high	138 Å²	138	35.1 Å²	35.1	60%	0.6	18%	0.176	S	C	*	.	G	3₁₀ helix	trans	-69.4	-10.2	176.7	62.6	170.7	-176.5	-169.2	0	114	T215	T215-K217 VanDerWaalsContact C-N 3.31Å; T215-K217 PolarHBondContact O-N 2.6Å; T215-K217 WeakPolarHBondContact OG1-CE 3.5Å; T215-K217 WeakPolarHBondContact OG1-CG 3.23Å
218	D	96.6	Very high	98	Very high	14 Å²	14	36 Å²	36	8%	0.075	18%	0.179	C	C	.	.	G	3₁₀ helix	trans	-88.1	-6	174.9	-71.5	-66.2	0	0	0	112.6	H58 K114 N213 T215 E216 I220	H58-D218 IonicContact CE1-OD1 3.27Å; H58-D218 PolarHBondContact CE1-OD1 3.5Å; H58-D218 VanDerWaalsContact CE1-OD1 3.24Å; H58-D218 IonicContact NE2-OD1 3.7Å; K114-D218 IonicContact NZ-OD1 2.74Å; N213-D218 HydrophobicContact CB-CB 3.94Å; N213-D218 PolarHBondContact ND2-O 2.97Å; T215-D218 WeakPolarHBondContact CB-OD2 3.44Å; T215-D218 PolarHBondContact N-OD2 3.12Å; T215-D218 WeakPolarHBondContact O-CB 3.4Å; T215-D218 PolarHBondContact O-N 2.95Å; T215-D218 VanDerWaalsContact O-N 3.1Å; T215-D218 PolarHBondContact OG1-OD2 2.85Å; E216-D218 PolarHBondContact O-N 3.1Å; D218-I220 PolarHBondContact O-N 3.16Å
219	I	97.9	Very high	97.9	Very high	9 Å²	9	38.5 Å²	38.5	5%	0.046	19%	0.19	C	C	.	.			trans	-72.4	100.5	-179.2	-58.2	171.7	0	0	0	108.9	F211 N213 E216 R222 Y240 V242 W249	F211-I219 HydrophobicContact CD1-CG2 4.01Å; F211-I219 HydrophobicContact CE1-CG2 3.77Å; N213-I219 HydrophobicContact CB-CG1 4.15Å; E216-I219 HydrophobicContact CG-CD1 4.3Å; E216-I219 WeakPolarHBondContact O-CB 3.22Å; E216-I219 VanDerWaalsContact O-CG1 3.31Å; E216-I219 WeakPolarHBondContact O-CG1 3.37Å; E216-I219 PolarHBondContact O-N 2.87Å; E216-I219 VanDerWaalsContact O-N 3.16Å; I219-R222 HydrophobicContact CB-CB 4.26Å; I219-R222 HydrophobicContact CG2-CB 3.67Å; I219-R222 HydrophobicContact CG2-CG 3.97Å; I219-Y240 HydrophobicContact CD1-CD1 3.95Å; I219-Y240 HydrophobicContact CD1-CE1 4.3Å; I219-Y240 HydrophobicContact CD1-CG 4.27Å; I219-Y240 HydrophobicContact CG1-CD1 4.48Å; I219-Y240 HydrophobicContact CG2-CD1 4.06Å; I219-Y240 HydrophobicContact CG2-CE1 3.55Å; I219-V242 HydrophobicContact CD1-CG1 4.43Å; I219-W249 HydrophobicContact CD1-CH2 3.79Å
220	I	98.1	Very high	97.9	Very high	2 Å²	2	43.7 Å²	43.7	1%	0.01	22%	0.218	C	C	.	.	T	Hydrogen-bonded Turn	trans	-72.8	134.3	178.5	-66.5	169	0	0	0	109.5	I56 T57 T60 V112 I187 F211 D218 R222	I56-I220 HydrophobicContact CD1-CG2 4.39Å; T57-I220 HydrophobicContact CG2-CG1 4.39Å; T60-I220 HydrophobicContact CG2-CD1 3.94Å; T60-I220 HydrophobicContact CG2-CG1 4.06Å; T60-I220 HydrophobicContact CG2-CG2 4.28Å; V112-I220 HydrophobicContact CG1-CG2 3.4Å; I187-I220 HydrophobicContact CG2-CB 4.04Å; I187-I220 HydrophobicContact CG2-CG2 3.82Å; F211-I220 WeakPolarHBondContact CE1-O 3.46Å; F211-I220 HydrophobicContact CZ-CB 4.45Å; D218-I220 PolarHBondContact O-N 3.16Å; I220-R222 VanDerWaalsContact C-N 3.27Å; I220-R222 PolarHBondContact O-N 3.42Å
221	L	97.9	Very high	97.9	Very high	6 Å²	6	50 Å²	50	3%	0.031	25%	0.245	C	C	.	.	T	Hydrogen-bonded Turn	trans	59.5	32.2	179.6	-59.6	167.9	0	0	0	114.1	I56 I100 V112 F191 D223 E224 L225	I56-L221 HydrophobicContact CD1-CD2 4.28Å; I100-L221 HydrophobicContact CD1-CD2 4.25Å; I100-L221 HydrophobicContact CG2-CD1 4Å; V112-L221 HydrophobicContact CG2-CD1 4.27Å; V112-L221 HydrophobicContact CG2-CD2 4.15Å; V112-L221 HydrophobicContact CG2-CG 4.4Å; F191-L221 HydrophobicContact CB-CD1 4.3Å; F191-L221 HydrophobicContact CD1-CD1 4.17Å; F191-L221 HydrophobicContact CD2-CB 4.37Å; F191-L221 HydrophobicContact CD2-CD1 3.78Å; F191-L221 HydrophobicContact CE1-CD1 4.48Å; F191-L221 HydrophobicContact CE2-CB 4.31Å; F191-L221 HydrophobicContact CE2-CD1 4.12Å; F191-L221 HydrophobicContact CG-CD1 3.81Å; F191-L221 HydrophobicContact CZ-CD1 4.46Å; L221-D223 PolarHBondContact O-N 2.97Å; L221-E224 VanDerWaalsContact CA-OE2 3.25Å; L221-E224 WeakPolarHBondContact CA-OE2 3.48Å; L221-E224 HydrophobicContact CB-CB 4.44Å; L221-E224 HydrophobicContact CD2-CG 4.39Å; L221-E224 WeakPolarHBondContact CD2-OE1 3.38Å; L221-E224 PolarHBondContact O-N 2.94Å; L221-L225 WeakPolarHBondContact O-CB 3.21Å; L221-L225 VanDerWaalsContact O-CG 3.23Å; L221-L225 WeakPolarHBondContact O-CG 3.26Å; L221-L225 PolarHBondContact O-N 2.85Å
222	R	97.6	Very high	97.8	Very high	70 Å²	70	52.1 Å²	52.1	26%	0.264	25%	0.253	S	S	.	.	H	α-helix	trans	-56.1	-51.6	-178.3	-174	-179.9	-179	175.8	2.4	112.1	E216 I219 I220 E224 L225 E226	E216-R222 IonicContact OE1-CZ 3.83Å; E216-R222 VanDerWaalsContact OE1-CZ 3.23Å; E216-R222 IonicContact OE1-NH1 3.07Å; E216-R222 PolarHBondContact OE1-NH1 2.88Å; E216-R222 IonicContact OE1-NH2 3.24Å; E216-R222 PolarHBondContact OE1-NH2 2.8Å; I219-R222 HydrophobicContact CB-CB 4.26Å; I219-R222 HydrophobicContact CG2-CB 3.67Å; I219-R222 HydrophobicContact CG2-CG 3.97Å; I220-R222 VanDerWaalsContact C-N 3.27Å; I220-R222 PolarHBondContact O-N 3.42Å; R222-E224 VanDerWaalsContact C-N 3.29Å; R222-E224 PolarHBondContact O-N 3.12Å; R222-L225 PolarHBondContact O-N 3.44Å; R222-L225 VanDerWaalsContact O-N 3.13Å; R222-E226 HydrophobicContact CG-CG 4.3Å; R222-E226 PolarHBondContact O-N 3.01Å
223	D	97.8	Very high	97.7	Very high	130 Å²	130	55.4 Å²	55.4	70%	0.695	27%	0.274	S	S	*	.	H	α-helix	trans	-62.4	-40.1	-175.4	-63.1	-14.1	0	0	0	111	L221 N227	L221-D223 PolarHBondContact O-N 2.97Å; D223-N227 VanDerWaalsContact O-CB 3.26Å; D223-N227 WeakPolarHBondContact O-CB 3.41Å; D223-N227 PolarHBondContact O-N 3.11Å
224	E	98.3	Very high	97.6	Very high	63 Å²	63	61 Å²	61	29%	0.294	30%	0.304	S	S	.	.	H	α-helix	trans	-65.3	-40.4	175.1	-65.1	93.2	154	0	0	112.6	R62 F191 L221 R222 F228	R62-E224 IonicContact NH1-OE1 3.63Å; F191-E224 HydrophobicContact CE2-CB 3.66Å; F191-E224 HydrophobicContact CZ-CB 3.83Å; F191-E224 HydrophobicContact CZ-CG 4.34Å; L221-E224 VanDerWaalsContact CA-OE2 3.25Å; L221-E224 WeakPolarHBondContact CA-OE2 3.48Å; L221-E224 HydrophobicContact CB-CB 4.44Å; L221-E224 HydrophobicContact CD2-CG 4.39Å; L221-E224 WeakPolarHBondContact CD2-OE1 3.38Å; L221-E224 PolarHBondContact O-N 2.94Å; R222-E224 VanDerWaalsContact C-N 3.29Å; R222-E224 PolarHBondContact O-N 3.12Å; E224-F228 PolarHBondContact O-N 2.63Å
225	L	98.8	Very high	97.7	Very high	0 Å²	0	60.7 Å²	60.7	0%	0	30%	0.298	C	S	.	.	H	α-helix	trans	-67.9	-43.7	177.7	-70	169.3	0	0	0	112	I187 F191 L194 M209 F211 L221 R222 F228 K229 F236 L238	I187-L225 HydrophobicContact CD1-CD1 3.91Å; I187-L225 HydrophobicContact CD1-CD2 4.22Å; I187-L225 HydrophobicContact CG1-CD1 4.21Å; F191-L225 HydrophobicContact CD2-CD2 3.96Å; F191-L225 HydrophobicContact CD2-CG 4.42Å; F191-L225 HydrophobicContact CE2-CD2 4.38Å; L194-L225 HydrophobicContact CD2-CD2 3.57Å; M209-L225 HydrophobicContact CE-CD2 4.36Å; M209-L225 HydrophobicContact SD-CD2 4.06Å; F211-L225 HydrophobicContact CD1-CD1 3.83Å; F211-L225 HydrophobicContact CE1-CD1 4.01Å; L221-L225 WeakPolarHBondContact O-CB 3.21Å; L221-L225 VanDerWaalsContact O-CG 3.23Å; L221-L225 WeakPolarHBondContact O-CG 3.26Å; L221-L225 PolarHBondContact O-N 2.85Å; R222-L225 PolarHBondContact O-N 3.44Å; R222-L225 VanDerWaalsContact O-N 3.13Å; L225-F228 PolarHBondContact O-N 2.85Å; L225-K229 PolarHBondContact O-N 2.78Å; L225-F236 HydrophobicContact CD2-CZ 4.3Å; L225-L238 HydrophobicContact CB-CD2 3.7Å
226	E	98.5	Very high	97.8	Very high	32 Å²	32	60 Å²	60	15%	0.15	29%	0.293	C	S	.	.	H	α-helix	trans	-64.1	-42.4	176.2	-72.6	-69.8	-176.7	0	0	111.2	R222 F228 K229 D230 Y240 Y251	R222-E226 HydrophobicContact CG-CG 4.3Å; R222-E226 PolarHBondContact O-N 3.01Å; E226-F228 VanDerWaalsContact C-N 3.28Å; E226-F228 PolarHBondContact O-N 3.47Å; E226-K229 WeakPolarHBondContact O-CB 3.37Å; E226-K229 PolarHBondContact O-N 3.42Å; E226-K229 IonicContact OE2-NZ 2.64Å; E226-K229 PolarHBondContact OE2-NZ 3.3Å; E226-D230 WeakPolarHBondContact O-CB 3.31Å; E226-D230 VanDerWaalsContact O-CG 3.31Å; E226-D230 PolarHBondContact O-N 2.87Å; E226-Y240 VanDerWaalsContact OE1-CE2 3.29Å; E226-Y240 WeakPolarHBondContact OE1-CE2 3.28Å; E226-Y251 PolarHBondContact OE1-OH 3.13Å; E226-Y251 VanDerWaalsContact OE1-OH 3.07Å
227	N	98.6	Very high	97.9	Very high	98 Å²	98	63.8 Å²	63.8	52%	0.524	31%	0.305	S	S	.	.	H	α-helix	trans	-60.7	-37.4	173.8	175	73.5	0	0	0	112.1	D223 K231	D223-N227 VanDerWaalsContact O-CB 3.26Å; D223-N227 WeakPolarHBondContact O-CB 3.41Å; D223-N227 PolarHBondContact O-N 3.11Å; N227-K231 WeakPolarHBondContact O-CB 3.44Å; N227-K231 PolarHBondContact O-N 3.01Å
228	F	98.6	Very high	98	Very high	18 Å²	18	57.8 Å²	57.8	8%	0.079	28%	0.279	C	S	.	.	H	α-helix	trans	-66.4	-41.2	171.3	-76.6	-32.4	0	0	0	112.6	F191 L194 S195 L198 E224 L225 E226 D230 K231 Y232 F236	F191-F228 HydrophobicContact CE1-CE2 4.5Å; F191-F228 HydrophobicContact CE2-CD2 4.23Å; F191-F228 AromaticContact CE2-CE2 3.77Å; F191-F228 HydrophobicContact CE2-CE2 3.77Å; F191-F228 AromaticContact CZ-CE2 3.76Å; F191-F228 HydrophobicContact CZ-CE2 3.76Å; F191-F228 HydrophobicContact CZ-CZ 4.43Å; L194-F228 HydrophobicContact CD2-CD2 3.85Å; L194-F228 HydrophobicContact CD2-CE2 4.48Å; L194-F228 HydrophobicContact CG-CD2 4.2Å; S195-F228 WeakPolarHBondContact OG-CE2 3.36Å; L198-F228 HydrophobicContact CD1-CB 3.93Å; L198-F228 HydrophobicContact CD1-CD1 4.42Å; L198-F228 HydrophobicContact CD1-CG 4.1Å; E224-F228 PolarHBondContact O-N 2.63Å; L225-F228 PolarHBondContact O-N 2.85Å; E226-F228 VanDerWaalsContact C-N 3.28Å; E226-F228 PolarHBondContact O-N 3.47Å; F228-D230 VanDerWaalsContact C-N 3.31Å; F228-D230 PolarHBondContact O-N 2.94Å; F228-K231 PolarHBondContact O-N 2.84Å; F228-Y232 HydrophobicContact CD1-CD2 4.17Å; F228-Y232 AromaticContact CD1-CE2 3.89Å; F228-Y232 HydrophobicContact CD1-CE2 3.89Å; F228-Y232 HydrophobicContact CE1-CE2 4.42Å; F228-Y232 WeakPolarHBondContact O-CB 3.48Å; F228-Y232 WeakPolarHBondContact O-CD2 3.37Å; F228-Y232 PolarHBondContact O-N 2.82Å; F228-F236 HydrophobicContact CB-CD1 3.87Å; F228-F236 HydrophobicContact CB-CE1 3.97Å
229	K	98.4	Very high	98.1	Very high	54 Å²	54	60.1 Å²	60.1	24%	0.235	29%	0.287	C	S	.	.	H	α-helix	trans	-58.8	-46.4	177	-175.4	-176.5	112.9	-74	0	110.7	L225 E226 Y232 P233 F236 L238	L225-K229 PolarHBondContact O-N 2.78Å; E226-K229 WeakPolarHBondContact O-CB 3.37Å; E226-K229 PolarHBondContact O-N 3.42Å; E226-K229 IonicContact OE2-NZ 2.64Å; E226-K229 PolarHBondContact OE2-NZ 3.3Å; K229-Y232 CarbonylContact O-C 3.53Å; K229-P233 WeakPolarHBondContact O-CA 3.29Å; K229-F236 HydrophobicContact CB-CD1 4.14Å; K229-F236 HydrophobicContact CB-CE1 4.29Å; K229-L238 HydrophobicContact CB-CB 4.41Å; K229-L238 HydrophobicContact CB-CD2 4.46Å; K229-L238 HydrophobicContact CD-CB 3.89Å; K229-L238 HydrophobicContact CG-CB 4.31Å
230	D	98.5	Very high	98.2	Very high	109 Å²	109	59.7 Å²	59.7	58%	0.583	29%	0.285	S	S	*	.	H	α-helix	trans	-73.5	-33.9	-176.3	-65.7	-9.2	0	0	0	112.3	E226 F228 P233	E226-D230 WeakPolarHBondContact O-CB 3.31Å; E226-D230 VanDerWaalsContact O-CG 3.31Å; E226-D230 PolarHBondContact O-N 2.87Å; F228-D230 VanDerWaalsContact C-N 3.31Å; F228-D230 PolarHBondContact O-N 2.94Å; D230-P233 WeakPolarHBondContact O-CD 3.32Å
231	K	98.2	Very high	98.2	Very high	133 Å²	133	59.6 Å²	59.6	58%	0.578	28%	0.284	S	S	*	.	H	α-helix	trans	-77	-28.8	177	-172.5	173.9	177.5	-172.6	0	113.2	N227 F228 P233	N227-K231 WeakPolarHBondContact O-CB 3.44Å; N227-K231 PolarHBondContact O-N 3.01Å; F228-K231 PolarHBondContact O-N 2.84Å; K231-P233 VanDerWaalsContact C-CD 3.41Å
232	Y	97.8	Very high	98.2	Very high	44 Å²	44	59.3 Å²	59.3	17%	0.173	28%	0.283	C	S	.	.			trans	-129	51.5	-174.8	-55.1	-80	0	0	0	113.3	L198 F228 K229 N234 H235 F236	L198-Y232 HydrophobicContact CB-CD1 4.42Å; L198-Y232 HydrophobicContact CB-CD2 3.87Å; L198-Y232 HydrophobicContact CB-CE1 4.43Å; L198-Y232 HydrophobicContact CB-CE2 3.89Å; L198-Y232 HydrophobicContact CB-CG 4.14Å; L198-Y232 HydrophobicContact CD1-CD2 3.78Å; L198-Y232 HydrophobicContact CD1-CE2 4.45Å; L198-Y232 HydrophobicContact CD1-CG 4.19Å; L198-Y232 HydrophobicContact CD2-CG 4.18Å; L198-Y232 HydrophobicContact CG-CD2 4.29Å; L198-Y232 HydrophobicContact CG-CG 4.4Å; L198-Y232 WeakPolarHBondContact O-CE1 3.32Å; L198-Y232 PolarHBondContact O-OH 2.86Å; F228-Y232 HydrophobicContact CD1-CD2 4.17Å; F228-Y232 AromaticContact CD1-CE2 3.89Å; F228-Y232 HydrophobicContact CD1-CE2 3.89Å; F228-Y232 HydrophobicContact CE1-CE2 4.42Å; F228-Y232 WeakPolarHBondContact O-CB 3.48Å; F228-Y232 WeakPolarHBondContact O-CD2 3.37Å; F228-Y232 PolarHBondContact O-N 2.82Å; K229-Y232 CarbonylContact O-C 3.53Å; Y232-N234 PolarHBondContact O-N 2.83Å; Y232-N234 VanDerWaalsContact O-N 3.12Å; Y232-H235 PolarHBondContact O-N 2.97Å; Y232-F236 PolarHBondContact O-N 3.08Å
233	P	97.1	Very high	98.2	Very high	82 Å²	82	58.5 Å²	58.5	53%	0.532	28%	0.284	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.6	-25.8	-170	26.8	-36.3	0	0	0	113.7	K229 D230 K231 H235	K229-P233 WeakPolarHBondContact O-CA 3.29Å; D230-P233 WeakPolarHBondContact O-CD 3.32Å; K231-P233 VanDerWaalsContact C-CD 3.41Å; P233-H235 VanDerWaalsContact C-N 3.34Å
234	N	96.2	Very high	98.1	Very high	131 Å²	131	58.3 Å²	58.3	70%	0.701	28%	0.279	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.2	-2.5	178.1	-64.9	-31.1	0	0	0	113.8	Q206 Y232	Q206-N234 PolarHBondContact NE2-O 2.81Å; Q206-N234 VanDerWaalsContact NE2-O 3.08Å; Q206-N234 PolarHBondContact OE1-O 2.89Å; Y232-N234 PolarHBondContact O-N 2.83Å; Y232-N234 VanDerWaalsContact O-N 3.12Å
235	H	97.5	Very high	98	Very high	60 Å²	60	57.2 Å²	57.2	28%	0.278	28%	0.28	S	S	.	.	T	Hydrogen-bonded Turn	trans	-128.5	-20.2	-177.2	-70.6	-96.3	0	0	0	112.9	L198 Q206 I207 Y232 P233	L198-H235 HydrophobicContact CD2-CB 3.89Å; Q206-H235 PolarHBondContact NE2-ND1 2.97Å; Q206-H235 VanDerWaalsContact NE2-ND1 3.16Å; I207-H235 PolarHBondContact N-O 2.95Å; Y232-H235 PolarHBondContact O-N 2.97Å; P233-H235 VanDerWaalsContact C-N 3.34Å
236	F	98.8	Very high	97.8	Very high	2 Å²	2	59.4 Å²	59.4	1%	0.009	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.7	117.1	-176.8	-178.9	-139.5	0	0	0	111.9	L194 L198 I207 M209 L225 F228 K229 Y232 L238	L194-F236 HydrophobicContact CD1-CD1 4.19Å; L194-F236 HydrophobicContact CD1-CD2 3.57Å; L194-F236 HydrophobicContact CD1-CE1 4.25Å; L194-F236 HydrophobicContact CD1-CE2 3.62Å; L194-F236 HydrophobicContact CD1-CG 3.88Å; L194-F236 HydrophobicContact CD1-CZ 3.97Å; L194-F236 HydrophobicContact CD2-CD1 4.5Å; L194-F236 HydrophobicContact CD2-CE1 3.85Å; L194-F236 HydrophobicContact CD2-CE2 4.03Å; L194-F236 HydrophobicContact CD2-CZ 3.57Å; L194-F236 HydrophobicContact CG-CZ 4.44Å; L198-F236 HydrophobicContact CD1-CB 3.92Å; L198-F236 HydrophobicContact CD1-CD1 4.12Å; L198-F236 HydrophobicContact CD1-CG 4.1Å; L198-F236 HydrophobicContact CD2-CB 4.17Å; I207-F236 HydrophobicContact CB-CD2 4.1Å; I207-F236 HydrophobicContact CG2-CD2 3.95Å; I207-F236 HydrophobicContact CG2-CE2 4.2Å; I207-F236 WeakPolarHBondContact O-CA 3.37Å; M209-F236 HydrophobicContact CB-CE2 3.69Å; M209-F236 HydrophobicContact CB-CZ 4.24Å; M209-F236 HydrophobicContact CE-CE2 4.37Å; M209-F236 HydrophobicContact CE-CZ 4.41Å; M209-F236 HydrophobicContact SD-CZ 4.27Å; L225-F236 HydrophobicContact CD2-CZ 4.3Å; F228-F236 HydrophobicContact CB-CD1 3.87Å; F228-F236 HydrophobicContact CB-CE1 3.97Å; K229-F236 HydrophobicContact CB-CD1 4.14Å; K229-F236 HydrophobicContact CB-CE1 4.29Å; Y232-F236 PolarHBondContact O-N 3.08Å; F236-L238 HydrophobicContact CE1-CB 4.08Å; F236-L238 HydrophobicContact CE1-CD2 4.2Å; F236-L238 HydrophobicContact CE2-CB 4.31Å; F236-L238 HydrophobicContact CZ-CB 3.83Å; F236-L238 HydrophobicContact CZ-CD1 4.01Å; F236-L238 HydrophobicContact CZ-CD2 4.21Å; F236-L238 HydrophobicContact CZ-CG 4.25Å
237	R	98.6	Very high	97.5	Very high	144 Å²	144	67.2 Å²	67.2	54%	0.543	33%	0.331	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	132.5	170.3	-58.4	178.3	-172	175.3	1.5	108.7	I207 A208 M209	I207-R237 PolarHBondContact O-N 2.82Å; A208-R237 CarbonylContact C-O 3.58Å; A208-R237 WeakPolarHBondContact CA-O 3.3Å; A208-R237 HydrophobicContact CB-CB 4.39Å; M209-R237 PolarHBondContact N-O 3.49Å
238	L	98.9	Very high	97.2	Very high	12 Å²	12	73.6 Å²	73.6	6%	0.063	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	127.7	-178	177.2	59.7	0	0	0	109.3	M209 L225 K229 F236 Y240	M209-L238 HydrophobicContact CB-CD1 4.02Å; M209-L238 HydrophobicContact CG-CD1 3.92Å; M209-L238 HydrophobicContact SD-CD1 3.78Å; L225-L238 HydrophobicContact CB-CD2 3.7Å; K229-L238 HydrophobicContact CB-CB 4.41Å; K229-L238 HydrophobicContact CB-CD2 4.46Å; K229-L238 HydrophobicContact CD-CB 3.89Å; K229-L238 HydrophobicContact CG-CB 4.31Å; F236-L238 HydrophobicContact CE1-CB 4.08Å; F236-L238 HydrophobicContact CE1-CD2 4.2Å; F236-L238 HydrophobicContact CE2-CB 4.31Å; F236-L238 HydrophobicContact CZ-CB 3.83Å; F236-L238 HydrophobicContact CZ-CD1 4.01Å; F236-L238 HydrophobicContact CZ-CD2 4.21Å; F236-L238 HydrophobicContact CZ-CG 4.25Å; L238-Y240 HydrophobicContact CD1-CE1 4.17Å; L238-Y240 HydrophobicContact CD2-CE1 4.35Å; L238-Y240 HydrophobicContact CD2-CE2 3.94Å; L238-Y240 WeakPolarHBondContact CD2-OH 3.35Å; L238-Y240 HydrophobicContact CG-CE1 4.36Å; L238-Y240 HydrophobicContact CG-CE2 3.97Å
239	W	98.8	Very high	97.1	Very high	63 Å²	63	74.5 Å²	74.5	24%	0.239	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133	135	176.2	-164.9	-99.7	0	0	0	110.1	M209 V210 F211 Y251 S252 H264	M209-W239 PolarHBondContact O-N 3Å; V210-W239 CarbonylContact C-O 3.5Å; V210-W239 VanDerWaalsContact CA-O 3.32Å; V210-W239 WeakPolarHBondContact CA-O 3.25Å; V210-W239 HydrophobicContact CG2-CB 4.42Å; F211-W239 PolarHBondContact N-O 2.8Å; W239-Y251 AromaticContact CD2-CD1 3.82Å; W239-Y251 HydrophobicContact CD2-CD1 3.82Å; W239-Y251 AromaticContact CE3-CD1 3.7Å; W239-Y251 HydrophobicContact CE3-CD1 3.7Å; W239-Y251 HydrophobicContact CE3-CE1 4.28Å; W239-Y251 HydrophobicContact CG-CD1 4.4Å; W239-Y251 HydrophobicContact CH2-CD1 4.33Å; W239-Y251 HydrophobicContact CZ2-CD1 4.45Å; W239-Y251 AromaticContact CZ3-CD1 3.96Å; W239-Y251 HydrophobicContact CZ3-CD1 3.96Å; W239-S252 PolarHBondContact NE1-OG 3.01Å; W239-H264 HydrophobicContact CB-CB 3.9Å; W239-H264 AromaticContact CD1-CD2 3.38Å; W239-H264 AromaticContact CD1-CG 3.66Å; W239-H264 AromaticContact CD1-NE2 3.75Å; W239-H264 AromaticContact CD2-CD2 3.78Å; W239-H264 AromaticContact CD2-CE1 3.28Å; W239-H264 AromaticContact CD2-CG 3.68Å; W239-H264 AromaticContact CD2-ND1 3.37Å; W239-H264 AromaticContact CD2-NE2 3.53Å; W239-H264 AromaticContact CE2-CD2 3.61Å; W239-H264 AromaticContact CE2-CE1 3.23Å; W239-H264 AromaticContact CE2-ND1 3.8Å; W239-H264 AromaticContact CE2-NE2 3.07Å; W239-H264 AromaticContact CE3-CE1 3.49Å; W239-H264 VanDerWaalsContact CE3-CE1 3.49Å; W239-H264 AromaticContact CE3-ND1 3.55Å; W239-H264 HydrophobicContact CG-CB 3.98Å; W239-H264 AromaticContact CG-CD2 3.65Å; W239-H264 AromaticContact CG-CE1 3.94Å; W239-H264 AromaticContact CG-CG 3.47Å; W239-H264 VanDerWaalsContact CG-CG 3.47Å; W239-H264 AromaticContact CG-ND1 3.67Å; W239-H264 AromaticContact CG-NE2 3.94Å; W239-H264 AromaticContact CH2-CE1 3.6Å; W239-H264 AromaticContact CZ2-CE1 3.4Å; W239-H264 WeakPolarHBondContact CZ2-CE1 3.35Å; W239-H264 AromaticContact CZ2-NE2 3.37Å; W239-H264 WeakPolarHBondContact CZ2-NE2 3.47Å; W239-H264 AromaticContact CZ3-CE1 3.64Å; W239-H264 AromaticContact NE1-CD2 3.32Å; W239-H264 PolarHBondContact NE1-CD2 2.8Å; W239-H264 VanDerWaalsContact NE1-CD2 3.32Å; W239-H264 AromaticContact NE1-CE1 3.8Å; W239-H264 AromaticContact NE1-CG 3.95Å; W239-H264 AromaticContact NE1-NE2 3.21Å; W239-H264 PolarHBondContact NE1-NE2 2.97Å
240	Y	98.8	Very high	97	Very high	0 Å²	0	75.7 Å²	75.7	0%	0	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	152.1	177.8	-59.3	-78.9	0	0	0	110.9	F211 I219 E226 L238 W249 Y251 S252	F211-Y240 HydrophobicContact CB-CD1 4.03Å; F211-Y240 HydrophobicContact CB-CE1 4.38Å; F211-Y240 HydrophobicContact CD1-CD1 4.15Å; F211-Y240 AromaticContact CD1-CE1 3.92Å; F211-Y240 HydrophobicContact CD1-CE1 3.92Å; F211-Y240 HydrophobicContact CG-CD1 4.46Å; F211-Y240 WeakPolarHBondContact O-CA 3.4Å; I219-Y240 HydrophobicContact CD1-CD1 3.95Å; I219-Y240 HydrophobicContact CD1-CE1 4.3Å; I219-Y240 HydrophobicContact CD1-CG 4.27Å; I219-Y240 HydrophobicContact CG1-CD1 4.48Å; I219-Y240 HydrophobicContact CG2-CD1 4.06Å; I219-Y240 HydrophobicContact CG2-CE1 3.55Å; E226-Y240 VanDerWaalsContact OE1-CE2 3.29Å; E226-Y240 WeakPolarHBondContact OE1-CE2 3.28Å; L238-Y240 HydrophobicContact CD1-CE1 4.17Å; L238-Y240 HydrophobicContact CD2-CE1 4.35Å; L238-Y240 HydrophobicContact CD2-CE2 3.94Å; L238-Y240 WeakPolarHBondContact CD2-OH 3.35Å; L238-Y240 HydrophobicContact CG-CE1 4.36Å; L238-Y240 HydrophobicContact CG-CE2 3.97Å; Y240-W249 VanDerWaalsContact CB-CZ2 3.49Å; Y240-W249 HydrophobicContact CD2-CH2 4.45Å; Y240-W249 HydrophobicContact CG-CH2 4.26Å; Y240-W249 HydrophobicContact CG-CZ2 4.44Å; Y240-Y251 AromaticContact CD2-CD1 3.95Å; Y240-Y251 HydrophobicContact CD2-CD1 3.95Å; Y240-Y251 AromaticContact CD2-CD2 3.88Å; Y240-Y251 HydrophobicContact CD2-CD2 3.88Å; Y240-Y251 AromaticContact CD2-CE1 3.68Å; Y240-Y251 HydrophobicContact CD2-CE1 3.68Å; Y240-Y251 AromaticContact CD2-CE2 3.64Å; Y240-Y251 HydrophobicContact CD2-CE2 3.64Å; Y240-Y251 HydrophobicContact CD2-CG 4.04Å; Y240-Y251 AromaticContact CD2-CZ 3.53Å; Y240-Y251 HydrophobicContact CE2-CE1 4.26Å; Y240-Y251 HydrophobicContact CE2-CE2 4.24Å; Y240-Y251 AromaticContact CE2-CZ 3.91Å; Y240-Y251 WeakPolarHBondContact O-CB 3.42Å; Y240-S252 PolarHBondContact O-N 3.1Å
241	T	98.7	Very high	97	Very high	0 Å²	0	72.8 Å²	72.8	0%	0	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.8	135.2	161.8	-166.8	0	0	0	0	110.2	F211 A212 N213 S252 G254 V256	F211-T241 PolarHBondContact O-N 2.87Å; A212-T241 VanDerWaalsContact CA-O 3.29Å; A212-T241 WeakPolarHBondContact CA-O 3.37Å; A212-T241 HydrophobicContact CB-CG2 3.6Å; N213-T241 PolarHBondContact N-O 3Å; T241-S252 VanDerWaalsContact CA-O 3.3Å; T241-S252 WeakPolarHBondContact CA-O 3.38Å; T241-S252 PolarHBondContact OG1-O 3.18Å; T241-G254 PolarHBondContact OG1-O 3.02Å; T241-V256 HydrophobicContact CG2-CG2 3.9Å
242	V	98.4	Very high	97	Very high	0 Å²	0	67.5 Å²	67.5	0%	0	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	142.9	179.4	-62.4	0	0	0	0	110.8	N213 I219 A245 W249 S252 T253 G254	N213-V242 HydrophobicContact CB-CG1 4.35Å; N213-V242 VanDerWaalsContact O-CA 3.31Å; N213-V242 WeakPolarHBondContact O-CA 3.4Å; I219-V242 HydrophobicContact CD1-CG1 4.43Å; V242-A245 HydrophobicContact CG2-CB 3.79Å; V242-W249 HydrophobicContact CB-CZ2 4.47Å; V242-W249 HydrophobicContact CG1-CH2 4.21Å; V242-W249 HydrophobicContact CG1-CZ2 3.81Å; V242-W249 HydrophobicContact CG2-CD2 4.17Å; V242-W249 HydrophobicContact CG2-CG 4.46Å; V242-W249 HydrophobicContact CG2-CZ2 3.93Å; V242-S252 PolarHBondContact N-O 2.81Å; V242-T253 CarbonylContact O-C 3.5Å; V242-T253 VanDerWaalsContact O-CA 3.28Å; V242-T253 WeakPolarHBondContact O-CA 3.31Å; V242-T253 WeakPolarHBondContact O-CG2 3.39Å; V242-G254 PolarHBondContact O-N 3.26Å
243	N	96.7	Very high	97	Very high	53 Å²	53	69.4 Å²	69.4	28%	0.283	35%	0.348	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.5	-39.7	176.9	-70.1	2.7	0	0	0	111.8	N213 V214 Y255	N213-N243 PolarHBondContact O-N 2.77Å; V214-N243 PolarHBondContact O-N 3.16Å; N243-Y255 WeakPolarHBondContact ND2-CE1 3.49Å; N243-Y255 VanDerWaalsContact ND2-CZ 3.31Å; N243-Y255 PolarHBondContact ND2-OH 2.83Å
244	E	96.6	Very high	97	Very high	127 Å²	127	66.5 Å²	66.5	59%	0.593	33%	0.333	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-114.8	85.9	-177.7	-68.5	172.9	-147.3	0	0	108.6	V214 T215	V214-E244 PolarHBondContact O-N 3.2Å; T215-E244 HydrophobicContact CG2-CB 3.94Å
245	A	95.7	Very high	96.9	Very high	39 Å²	39	68.1 Å²	68.1	32%	0.322	33%	0.33	S	S	.	.			trans	-76.7	139.9	-178.3	0	0	0	0	0	112.2	V242 W249 T253	V242-A245 HydrophobicContact CG2-CB 3.79Å; A245-W249 HydrophobicContact CB-CB 3.88Å; A245-W249 HydrophobicContact CB-CG 3.88Å; A245-T253 HydrophobicContact CB-CG2 3.76Å; A245-T253 VanDerWaalsContact CB-OG1 3.24Å; A245-T253 WeakPolarHBondContact CB-OG1 3.27Å
246	P	95.3	Very high	97	Very high	47 Å²	47	65.5 Å²	65.5	31%	0.305	32%	0.319	S	S	.	.			trans	-67	164.4	167.6	33.1	-38.5	0	0	0	110.8	E216 R248 W249	E216-P246 WeakPolarHBondContact OE2-CG 3.42Å; P246-R248 PolarHBondContact O-N 2.84Å; P246-R248 VanDerWaalsContact O-N 3.12Å; P246-W249 HydrophobicContact CG-CB 4.06Å; P246-W249 HydrophobicContact CG-CD2 4.44Å; P246-W249 HydrophobicContact CG-CE3 3.93Å; P246-W249 PolarHBondContact O-N 2.85Å
247	E	91	Very high	96.9	Very high	196 Å²	196	68.1 Å²	68.1	92%	0.916	33%	0.333	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.4	-33.3	-178.2	-169.1	-176.5	174.5	0	0	113.3
248	R	93.1	Very high	96.9	Very high	232 Å²	232	63.8 Å²	63.8	88%	0.875	32%	0.319	S	S	*	.	T	Hydrogen-bonded Turn	trans	-113.1	65.8	178.9	-62.6	-175.3	-175	-177	1.5	111.4	P246	P246-R248 PolarHBondContact O-N 2.84Å; P246-R248 VanDerWaalsContact O-N 3.12Å
249	W	96.5	Very high	96.9	Very high	36 Å²	36	68.8 Å²	68.8	14%	0.136	34%	0.342	C	S	.	.			trans	-96.8	121.9	178.2	-171	-123.5	0	0	0	111.8	E216 I219 Y240 V242 A245 P246 Y251 S252	E216-W249 HydrophobicContact CB-CZ3 4.41Å; E216-W249 HydrophobicContact CG-CZ3 3.93Å; I219-W249 HydrophobicContact CD1-CH2 3.79Å; Y240-W249 VanDerWaalsContact CB-CZ2 3.49Å; Y240-W249 HydrophobicContact CD2-CH2 4.45Å; Y240-W249 HydrophobicContact CG-CH2 4.26Å; Y240-W249 HydrophobicContact CG-CZ2 4.44Å; V242-W249 HydrophobicContact CB-CZ2 4.47Å; V242-W249 HydrophobicContact CG1-CH2 4.21Å; V242-W249 HydrophobicContact CG1-CZ2 3.81Å; V242-W249 HydrophobicContact CG2-CD2 4.17Å; V242-W249 HydrophobicContact CG2-CG 4.46Å; V242-W249 HydrophobicContact CG2-CZ2 3.93Å; A245-W249 HydrophobicContact CB-CB 3.88Å; A245-W249 HydrophobicContact CB-CG 3.88Å; P246-W249 HydrophobicContact CG-CB 4.06Å; P246-W249 HydrophobicContact CG-CD2 4.44Å; P246-W249 HydrophobicContact CG-CE3 3.93Å; P246-W249 PolarHBondContact O-N 2.85Å; W249-Y251 VanDerWaalsContact C-N 3.34Å; W249-Y251 HydrophobicContact CD2-CD2 4.16Å; W249-Y251 AromaticContact CE2-CD2 3.85Å; W249-Y251 HydrophobicContact CE3-CD2 4.19Å; W249-Y251 AromaticContact CH2-CD2 3.62Å; W249-Y251 HydrophobicContact CH2-CD2 3.62Å; W249-Y251 HydrophobicContact CH2-CE2 4.23Å; W249-Y251 HydrophobicContact CH2-CG 4.47Å; W249-Y251 AromaticContact CZ2-CD2 3.61Å; W249-Y251 HydrophobicContact CZ2-CD2 3.61Å; W249-Y251 HydrophobicContact CZ2-CG 4.08Å; W249-Y251 AromaticContact CZ3-CD2 3.92Å; W249-Y251 HydrophobicContact CZ3-CD2 3.92Å; W249-Y251 HydrophobicContact CZ3-CE2 4.35Å; W249-Y251 VanDerWaalsContact NE1-C 3.34Å; W249-Y251 PolarHBondContact NE1-O 3.22Å; W249-S252 PolarHBondContact NE1-O 3.43Å
250	A	95.8	Very high	96.9	Very high	80 Å²	80	66.1 Å²	66.1	66%	0.661	33%	0.332	S	S	*	.			trans	-85.5	-6.1	-176.3	0	0	0	0	0	114
251	Y	98.3	Very high	96.9	Very high	48 Å²	48	66.1 Å²	66.1	19%	0.188	33%	0.332	C	S	.	.	S	Bend	trans	-120.3	-169.6	-173.3	-47.5	-93.7	0	0	0	111.3	E226 W239 Y240 W249	E226-Y251 PolarHBondContact OE1-OH 3.13Å; E226-Y251 VanDerWaalsContact OE1-OH 3.07Å; W239-Y251 AromaticContact CD2-CD1 3.82Å; W239-Y251 HydrophobicContact CD2-CD1 3.82Å; W239-Y251 AromaticContact CE3-CD1 3.7Å; W239-Y251 HydrophobicContact CE3-CD1 3.7Å; W239-Y251 HydrophobicContact CE3-CE1 4.28Å; W239-Y251 HydrophobicContact CG-CD1 4.4Å; W239-Y251 HydrophobicContact CH2-CD1 4.33Å; W239-Y251 HydrophobicContact CZ2-CD1 4.45Å; W239-Y251 AromaticContact CZ3-CD1 3.96Å; W239-Y251 HydrophobicContact CZ3-CD1 3.96Å; Y240-Y251 AromaticContact CD2-CD1 3.95Å; Y240-Y251 HydrophobicContact CD2-CD1 3.95Å; Y240-Y251 AromaticContact CD2-CD2 3.88Å; Y240-Y251 HydrophobicContact CD2-CD2 3.88Å; Y240-Y251 AromaticContact CD2-CE1 3.68Å; Y240-Y251 HydrophobicContact CD2-CE1 3.68Å; Y240-Y251 AromaticContact CD2-CE2 3.64Å; Y240-Y251 HydrophobicContact CD2-CE2 3.64Å; Y240-Y251 HydrophobicContact CD2-CG 4.04Å; Y240-Y251 AromaticContact CD2-CZ 3.53Å; Y240-Y251 HydrophobicContact CE2-CE1 4.26Å; Y240-Y251 HydrophobicContact CE2-CE2 4.24Å; Y240-Y251 AromaticContact CE2-CZ 3.91Å; Y240-Y251 WeakPolarHBondContact O-CB 3.42Å; W249-Y251 VanDerWaalsContact C-N 3.34Å; W249-Y251 HydrophobicContact CD2-CD2 4.16Å; W249-Y251 AromaticContact CE2-CD2 3.85Å; W249-Y251 HydrophobicContact CE3-CD2 4.19Å; W249-Y251 AromaticContact CH2-CD2 3.62Å; W249-Y251 HydrophobicContact CH2-CD2 3.62Å; W249-Y251 HydrophobicContact CH2-CE2 4.23Å; W249-Y251 HydrophobicContact CH2-CG 4.47Å; W249-Y251 AromaticContact CZ2-CD2 3.61Å; W249-Y251 HydrophobicContact CZ2-CD2 3.61Å; W249-Y251 HydrophobicContact CZ2-CG 4.08Å; W249-Y251 AromaticContact CZ3-CD2 3.92Å; W249-Y251 HydrophobicContact CZ3-CD2 3.92Å; W249-Y251 HydrophobicContact CZ3-CE2 4.35Å; W249-Y251 VanDerWaalsContact NE1-C 3.34Å; W249-Y251 PolarHBondContact NE1-O 3.22Å
252	S	98.4	Very high	96.8	Very high	21 Å²	21	72.9 Å²	72.9	15%	0.147	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.7	153.3	-179.1	-59.1	0	0	0	0	112.8	W239 Y240 T241 V242 W249	W239-S252 PolarHBondContact NE1-OG 3.01Å; Y240-S252 PolarHBondContact O-N 3.1Å; T241-S252 VanDerWaalsContact CA-O 3.3Å; T241-S252 WeakPolarHBondContact CA-O 3.38Å; T241-S252 PolarHBondContact OG1-O 3.18Å; V242-S252 PolarHBondContact N-O 2.81Å; W249-S252 PolarHBondContact NE1-O 3.43Å
253	T	98	Very high	96.9	Very high	84 Å²	84	78.3 Å²	78.3	52%	0.515	39%	0.389	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	135.2	172.9	-55.8	0	0	0	0	109.5	V242 A245	V242-T253 CarbonylContact O-C 3.5Å; V242-T253 VanDerWaalsContact O-CA 3.28Å; V242-T253 WeakPolarHBondContact O-CA 3.31Å; V242-T253 WeakPolarHBondContact O-CG2 3.39Å; A245-T253 HydrophobicContact CB-CG2 3.76Å; A245-T253 VanDerWaalsContact CB-OG1 3.24Å; A245-T253 WeakPolarHBondContact CB-OG1 3.27Å
254	G	96.1	Very high	96.9	Very high	21 Å²	21	77.6 Å²	77.6	22%	0.216	38%	0.384	C	S	.	.	S	Bend	trans	107.3	-170.8	178.9	0	0	0	0	0	114.2	T241 V242	T241-G254 PolarHBondContact OG1-O 3.02Å; V242-G254 PolarHBondContact O-N 3.26Å
255	Y	95.7	Very high	97	Very high	165 Å²	165	72 Å²	72	65%	0.647	36%	0.358	S	S	*	.	S	Bend	trans	-72	151.4	178	-64	-79	0	0	0	111.4	N243 N257	N243-Y255 WeakPolarHBondContact ND2-CE1 3.49Å; N243-Y255 VanDerWaalsContact ND2-CZ 3.31Å; N243-Y255 PolarHBondContact ND2-OH 2.83Å; Y255-N257 PolarHBondContact O-N 2.94Å
256	V	98.3	Very high	97.2	Very high	5 Å²	5	71 Å²	71	3%	0.03	35%	0.346	C	S	.	.			trans	-53.5	131.6	168.6	171.2	0	0	0	0	109.6	I181 V210 A212 T241 L261 F282 A286	I181-V256 HydrophobicContact CG2-CG1 4.4Å; V210-V256 HydrophobicContact CG1-CG2 3.91Å; A212-V256 HydrophobicContact CB-CG2 4Å; T241-V256 HydrophobicContact CG2-CG2 3.9Å; V256-L261 HydrophobicContact CG1-CD1 3.95Å; V256-L261 HydrophobicContact CG1-CD2 3.67Å; V256-L261 HydrophobicContact CG1-CG 3.75Å; V256-F282 HydrophobicContact CB-CE2 4.28Å; V256-F282 HydrophobicContact CG2-CE2 3.75Å; V256-F282 HydrophobicContact CG2-CZ 4.34Å; V256-A286 HydrophobicContact CB-CB 4.33Å; V256-A286 WeakPolarHBondContact O-CB 3.3Å
257	N	97.8	Very high	97.3	Very high	57 Å²	57	72.2 Å²	72.2	31%	0.305	35%	0.354	S	S	.	.			trans	-143.7	-179.9	179.2	64.1	29.8	0	0	0	110.2	Y255 Q259 I260 L261 S290	Y255-N257 PolarHBondContact O-N 2.94Å; N257-Q259 VanDerWaalsContact C-N 3.3Å; N257-Q259 PolarHBondContact O-N 2.81Å; N257-Q259 PolarHBondContact OD1-N 2.84Å; N257-Q259 VanDerWaalsContact OD1-N 3.14Å; N257-I260 PolarHBondContact O-N 3.41Å; N257-I260 WeakPolarHBondContact OD1-CG1 3.37Å; N257-I260 PolarHBondContact OD1-N 3.41Å; N257-L261 WeakPolarHBondContact O-CG 3.4Å; N257-L261 PolarHBondContact O-N 3.12Å; N257-L261 VanDerWaalsContact O-N 3.17Å; N257-S290 WeakPolarHBondContact CA-OG 3.49Å
258	E	98.1	Very high	97.6	Very high	53 Å²	53	64.6 Å²	64.6	25%	0.248	33%	0.325	C	S	.	.	H	α-helix	trans	-59.7	-40.9	-176.9	-61.9	76.2	-165.3	0	0	112.3	L261 Q262 S290 K293 L294	E258-L261 PolarHBondContact O-N 2.82Å; E258-Q262 VanDerWaalsContact O-CB 3.28Å; E258-Q262 WeakPolarHBondContact O-CB 3.47Å; E258-Q262 PolarHBondContact O-N 3.27Å; E258-S290 VanDerWaalsContact CD-OG 3.27Å; E258-S290 PolarHBondContact N-OG 2.84Å; E258-S290 WeakPolarHBondContact OE1-CA 3.49Å; E258-S290 PolarHBondContact OE1-OG 2.87Å; E258-K293 HydrophobicContact CG-CB 4.11Å; E258-K293 HydrophobicContact CG-CD 4.12Å; E258-K293 VanDerWaalsContact OE1-CD 3.31Å; E258-K293 WeakPolarHBondContact OE1-CD 3.47Å; E258-K293 WeakPolarHBondContact OE1-CE 3.48Å; E258-K293 IonicContact OE1-NZ 3.23Å; E258-K293 PolarHBondContact OE1-NZ 3.36Å; E258-L294 HydrophobicContact CB-CD1 4.38Å; E258-L294 HydrophobicContact CB-CD2 4.3Å; E258-L294 HydrophobicContact CB-CG 4.3Å; E258-L294 HydrophobicContact CG-CG 4.45Å
259	Q	98.4	Very high	97.7	Very high	118 Å²	118	59 Å²	59	55%	0.551	31%	0.307	S	S	*	.	H	α-helix	trans	-62.7	-52.3	-178.6	-177.2	-177.2	-4.8	0	0	111.2	N257 L261 Q262 E263	N257-Q259 VanDerWaalsContact C-N 3.3Å; N257-Q259 PolarHBondContact O-N 2.81Å; N257-Q259 PolarHBondContact OD1-N 2.84Å; N257-Q259 VanDerWaalsContact OD1-N 3.14Å; Q259-L261 VanDerWaalsContact C-N 3.27Å; Q259-L261 PolarHBondContact O-N 3.48Å; Q259-Q262 PolarHBondContact O-N 3.23Å; Q259-E263 WeakPolarHBondContact CG-OE1 3.32Å; Q259-E263 PolarHBondContact NE2-OE1 3.32Å; Q259-E263 WeakPolarHBondContact O-CB 3.29Å; Q259-E263 WeakPolarHBondContact O-CG 3.35Å; Q259-E263 PolarHBondContact O-N 2.87Å
260	I	98.6	Very high	97.5	Very high	7 Å²	7	64.6 Å²	64.6	4%	0.036	34%	0.339	C	S	.	.	H	α-helix	trans	-57.9	-43.4	179.8	-66.2	172.1	0	0	0	110.4	V210 N257 H264	V210-I260 HydrophobicContact CG1-CG2 3.99Å; V210-I260 HydrophobicContact CG2-CG2 4.36Å; N257-I260 PolarHBondContact O-N 3.41Å; N257-I260 WeakPolarHBondContact OD1-CG1 3.37Å; N257-I260 PolarHBondContact OD1-N 3.41Å; I260-H264 WeakPolarHBondContact O-CB 3.37Å; I260-H264 PolarHBondContact O-CD2 3.32Å; I260-H264 VanDerWaalsContact O-CD2 3.25Å; I260-H264 PolarHBondContact O-N 2.78Å
261	L	98.8	Very high	97.6	Very high	0 Å²	0	62.5 Å²	62.5	0%	0	32%	0.317	C	S	.	.	H	α-helix	trans	-67	-46.4	179.4	-65.2	-176	0	0	0	111.5	I181 V210 V256 N257 E258 Q259 E263 H264 I265 L291 L294	I181-L261 HydrophobicContact CD1-CD1 4.13Å; I181-L261 HydrophobicContact CD1-CD2 3.64Å; I181-L261 HydrophobicContact CG1-CD2 3.98Å; I181-L261 HydrophobicContact CG2-CD2 4.46Å; V210-L261 HydrophobicContact CG2-CD2 4.42Å; V256-L261 HydrophobicContact CG1-CD1 3.95Å; V256-L261 HydrophobicContact CG1-CD2 3.67Å; V256-L261 HydrophobicContact CG1-CG 3.75Å; N257-L261 WeakPolarHBondContact O-CG 3.4Å; N257-L261 PolarHBondContact O-N 3.12Å; N257-L261 VanDerWaalsContact O-N 3.17Å; E258-L261 PolarHBondContact O-N 2.82Å; Q259-L261 VanDerWaalsContact C-N 3.27Å; Q259-L261 PolarHBondContact O-N 3.48Å; L261-E263 PolarHBondContact O-N 3.21Å; L261-H264 PolarHBondContact O-N 3.34Å; L261-I265 HydrophobicContact CB-CD1 4.1Å; L261-I265 HydrophobicContact CB-CG1 4.03Å; L261-I265 HydrophobicContact CD2-CD1 4.1Å; L261-I265 HydrophobicContact CD2-CG1 4.31Å; L261-I265 HydrophobicContact CD2-CG2 4.49Å; L261-I265 WeakPolarHBondContact O-CG1 3.48Å; L261-I265 PolarHBondContact O-N 2.79Å; L261-L291 HydrophobicContact CD1-CD2 3.97Å; L261-L291 HydrophobicContact CD1-CG 4.03Å; L261-L294 HydrophobicContact CB-CD1 3.8Å
262	Q	98.3	Very high	97.6	Very high	141 Å²	141	60.4 Å²	60.4	66%	0.659	31%	0.309	S	S	*	.	H	α-helix	trans	-60.4	-35.7	179.8	-172.9	175	16	0	0	112.6	E258 Q259 L294	E258-Q262 VanDerWaalsContact O-CB 3.28Å; E258-Q262 WeakPolarHBondContact O-CB 3.47Å; E258-Q262 PolarHBondContact O-N 3.27Å; Q259-Q262 PolarHBondContact O-N 3.23Å; Q262-L294 HydrophobicContact CB-CD1 4.49Å; Q262-L294 HydrophobicContact CB-CD2 4.3Å
263	E	98.5	Very high	97.6	Very high	114 Å²	114	59.5 Å²	59.5	53%	0.533	30%	0.303	S	S	.	.	H	α-helix	trans	-78.7	-35.7	-179.2	-71.2	175	-168.4	0	0	113	Q259 L261	Q259-E263 WeakPolarHBondContact CG-OE1 3.32Å; Q259-E263 PolarHBondContact NE2-OE1 3.32Å; Q259-E263 WeakPolarHBondContact O-CB 3.29Å; Q259-E263 WeakPolarHBondContact O-CG 3.35Å; Q259-E263 PolarHBondContact O-N 2.87Å; L261-E263 PolarHBondContact O-N 3.21Å
264	H	98.6	Very high	97.7	Very high	38 Å²	38	55.5 Å²	55.5	18%	0.176	28%	0.278	C	S	.	.	H	α-helix	trans	-117.1	-10.7	-164.3	-59.9	-61.6	0	0	0	116.3	V210 W239 I260 L261	V210-H264 HydrophobicContact CG2-CB 3.93Å; W239-H264 HydrophobicContact CB-CB 3.9Å; W239-H264 AromaticContact CD1-CD2 3.38Å; W239-H264 AromaticContact CD1-CG 3.66Å; W239-H264 AromaticContact CD1-NE2 3.75Å; W239-H264 AromaticContact CD2-CD2 3.78Å; W239-H264 AromaticContact CD2-CE1 3.28Å; W239-H264 AromaticContact CD2-CG 3.68Å; W239-H264 AromaticContact CD2-ND1 3.37Å; W239-H264 AromaticContact CD2-NE2 3.53Å; W239-H264 AromaticContact CE2-CD2 3.61Å; W239-H264 AromaticContact CE2-CE1 3.23Å; W239-H264 AromaticContact CE2-ND1 3.8Å; W239-H264 AromaticContact CE2-NE2 3.07Å; W239-H264 AromaticContact CE3-CE1 3.49Å; W239-H264 VanDerWaalsContact CE3-CE1 3.49Å; W239-H264 AromaticContact CE3-ND1 3.55Å; W239-H264 HydrophobicContact CG-CB 3.98Å; W239-H264 AromaticContact CG-CD2 3.65Å; W239-H264 AromaticContact CG-CE1 3.94Å; W239-H264 AromaticContact CG-CG 3.47Å; W239-H264 VanDerWaalsContact CG-CG 3.47Å; W239-H264 AromaticContact CG-ND1 3.67Å; W239-H264 AromaticContact CG-NE2 3.94Å; W239-H264 AromaticContact CH2-CE1 3.6Å; W239-H264 AromaticContact CZ2-CE1 3.4Å; W239-H264 WeakPolarHBondContact CZ2-CE1 3.35Å; W239-H264 AromaticContact CZ2-NE2 3.37Å; W239-H264 WeakPolarHBondContact CZ2-NE2 3.47Å; W239-H264 AromaticContact CZ3-CE1 3.64Å; W239-H264 AromaticContact NE1-CD2 3.32Å; W239-H264 PolarHBondContact NE1-CD2 2.8Å; W239-H264 VanDerWaalsContact NE1-CD2 3.32Å; W239-H264 AromaticContact NE1-CE1 3.8Å; W239-H264 AromaticContact NE1-CG 3.95Å; W239-H264 AromaticContact NE1-NE2 3.21Å; W239-H264 PolarHBondContact NE1-NE2 2.97Å; I260-H264 WeakPolarHBondContact O-CB 3.37Å; I260-H264 PolarHBondContact O-CD2 3.32Å; I260-H264 VanDerWaalsContact O-CD2 3.25Å; I260-H264 PolarHBondContact O-N 2.78Å; L261-H264 PolarHBondContact O-N 3.34Å
265	I	98.7	Very high	97.8	Very high	11 Å²	11	54.5 Å²	54.5	6%	0.056	27%	0.268	C	S	.	.	S	Bend	trans	-112.7	161.4	173	63.8	157.2	0	0	0	112.3	N179 I181 A208 V210 L261 L291 Y296	N179-I265 HydrophobicContact CB-CB 4.14Å; N179-I265 HydrophobicContact CB-CD1 4.22Å; N179-I265 HydrophobicContact CB-CG2 4.34Å; I181-I265 HydrophobicContact CD1-CD1 4.17Å; A208-I265 HydrophobicContact CB-CB 4.47Å; A208-I265 HydrophobicContact CB-CG2 4.42Å; V210-I265 HydrophobicContact CG2-CG2 3.67Å; L261-I265 HydrophobicContact CB-CD1 4.1Å; L261-I265 HydrophobicContact CB-CG1 4.03Å; L261-I265 HydrophobicContact CD2-CD1 4.1Å; L261-I265 HydrophobicContact CD2-CG1 4.31Å; L261-I265 HydrophobicContact CD2-CG2 4.49Å; L261-I265 WeakPolarHBondContact O-CG1 3.48Å; L261-I265 PolarHBondContact O-N 2.79Å; I265-L291 HydrophobicContact CD1-CD2 4.08Å; I265-Y296 HydrophobicContact CD1-CE1 4.11Å; I265-Y296 HydrophobicContact CD1-CE2 4.44Å; I265-Y296 WeakPolarHBondContact CD1-OH 3.24Å
266	Y	98.7	Very high	97.9	Very high	17 Å²	17	46.7 Å²	46.7	7%	0.067	24%	0.237	C	C	.	.			trans	-70	138.1	177.4	-64.7	-74.5	0	0	0	110.7	H177 N179 Q206 A208 Y296	H177-Y266 HydrophobicContact CB-CD1 4.49Å; H177-Y266 HydrophobicContact CB-CD2 3.78Å; H177-Y266 HydrophobicContact CB-CE2 4.41Å; H177-Y266 HydrophobicContact CB-CG 3.83Å; H177-Y266 AromaticContact CD2-CD1 3.48Å; H177-Y266 VanDerWaalsContact CD2-CD1 3.48Å; H177-Y266 WeakPolarHBondContact CD2-CD1 3.37Å; H177-Y266 AromaticContact CD2-CD2 3.98Å; H177-Y266 AromaticContact CD2-CE1 3.56Å; H177-Y266 AromaticContact CD2-CG 3.7Å; H177-Y266 AromaticContact CD2-CZ 3.88Å; H177-Y266 AromaticContact CG-CG 3.93Å; N179-Y266 PolarHBondContact ND2-O 3.25Å; N179-Y266 WeakPolarHBondContact OD1-CB 3.12Å; N179-Y266 WeakPolarHBondContact OD1-CD2 3.4Å; N179-Y266 PolarHBondContact OD1-N 3.25Å; Q206-Y266 HydrophobicContact CB-CE2 4.07Å; Q206-Y266 PolarHBondContact OE1-OH 3.07Å; A208-Y266 HydrophobicContact CB-CD2 3.64Å; A208-Y266 HydrophobicContact CB-CE2 3.56Å; Y266-Y296 WeakPolarHBondContact O-CE1 3.44Å; Y266-Y296 PolarHBondContact O-OH 2.73Å
267	P	98.1	Very high	98	Very high	72 Å²	72	47.5 Å²	47.5	47%	0.468	24%	0.243	S	C	.	.			trans	-62.6	158.3	-176.9	27.9	-36.8	0	0	0	112.4	K269 T272 Y296	P267-K269 PolarHBondContact O-N 3.32Å; P267-K269 VanDerWaalsContact O-N 3.11Å; P267-T272 PolarHBondContact O-OG1 3.11Å; P267-Y296 WeakPolarHBondContact CA-OH 3.28Å
268	A	96.4	Very high	98	Very high	37 Å²	37	45.7 Å²	45.7	31%	0.306	24%	0.238	S	C	.	.	S	Bend	trans	-56.5	114	172.8	0	0	0	0	0	110.7	Y296	A268-Y296 HydrophobicContact CB-CD1 3.86Å; A268-Y296 HydrophobicContact CB-CD2 4.09Å; A268-Y296 HydrophobicContact CB-CE1 4.1Å; A268-Y296 HydrophobicContact CB-CE2 4.33Å; A268-Y296 HydrophobicContact CB-CG 3.87Å
269	K	94.9	Very high	97.8	Very high	114 Å²	114	45.8 Å²	45.8	50%	0.496	24%	0.243	S	C	.	.			trans	-146.8	161.1	175.5	-65.6	-174.2	177.4	178.1	0	108.9	P267 D271 T272	P267-K269 PolarHBondContact O-N 3.32Å; P267-K269 VanDerWaalsContact O-N 3.11Å; K269-D271 PolarHBondContact O-N 2.83Å; K269-D271 VanDerWaalsContact O-N 3.14Å; K269-T272 PolarHBondContact O-N 3.19Å
270	D	93.1	Very high	97.7	Very high	154 Å²	154	43.9 Å²	43.9	82%	0.824	24%	0.241	S	C	*	.	T	Hydrogen-bonded Turn	trans	-62.5	-21.3	179	-61.4	-20	0	0	0	113.2	M300	D270-M300 WeakPolarHBondContact O-CE 3.38Å
271	D	97.5	Very high	97.5	Very high	36 Å²	36	47.2 Å²	47.2	19%	0.193	26%	0.263	C	S	.	.	T	Hydrogen-bonded Turn	trans	-103.9	19.9	176.7	70.7	-4.1	0	0	0	113.9	V175 K176 H177 K269	V175-D271 WeakPolarHBondContact CA-O 3.3Å; V175-D271 VanDerWaalsContact CB-O 3.29Å; V175-D271 WeakPolarHBondContact CB-O 3.45Å; K176-D271 HydrophobicContact CB-CB 4.42Å; K176-D271 VanDerWaalsContact CD-OD2 3.27Å; K176-D271 WeakPolarHBondContact CD-OD2 3.39Å; K176-D271 HydrophobicContact CG-CB 4.27Å; K176-D271 PolarHBondContact N-O 3.02Å; K176-D271 IonicContact NZ-OD2 2.8Å; K176-D271 PolarHBondContact NZ-OD2 3.02Å; H177-D271 PolarHBondContact N-O 3.31Å; H177-D271 IonicContact ND1-OD1 3.92Å; K269-D271 PolarHBondContact O-N 2.83Å; K269-D271 VanDerWaalsContact O-N 3.14Å
272	T	98.6	Very high	97.4	Very high	4 Å²	4	48.4 Å²	48.4	3%	0.025	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	120	176.1	-57.9	0	0	0	0	110.8	H177 N179 P267 K269 M300	H177-T272 HydrophobicContact CB-CG2 4.06Å; H177-T272 WeakPolarHBondContact O-CA 3.47Å; N179-T272 VanDerWaalsContact ND2-CG2 3.28Å; N179-T272 WeakPolarHBondContact ND2-CG2 3.39Å; P267-T272 PolarHBondContact O-OG1 3.11Å; K269-T272 PolarHBondContact O-N 3.19Å; T272-M300 WeakPolarHBondContact O-CE 3.38Å
273	I	98.7	Very high	97.4	Very high	1 Å²	1	42.7 Å²	42.7	1%	0.005	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.8	140.7	168.5	-168.6	173.5	0	0	0	110.2	F160 I162 V175 H177 V178 N179 L275 M300	F160-I273 HydrophobicContact CD2-CG2 4.38Å; F160-I273 HydrophobicContact CE2-CG2 3.89Å; F160-I273 HydrophobicContact CG-CD1 4.39Å; F160-I273 HydrophobicContact CZ-CG2 4.18Å; I162-I273 HydrophobicContact CD1-CD1 3.5Å; I162-I273 VanDerWaalsContact CD1-CD1 3.5Å; V175-I273 HydrophobicContact CB-CG2 4.42Å; V175-I273 HydrophobicContact CG1-CB 3.93Å; V175-I273 HydrophobicContact CG1-CG2 4.12Å; V175-I273 HydrophobicContact CG2-CG2 3.86Å; H177-I273 PolarHBondContact O-N 3.08Å; V178-I273 CarbonylContact C-O 3.49Å; V178-I273 WeakPolarHBondContact CA-O 3.38Å; V178-I273 HydrophobicContact CB-CG2 4.24Å; V178-I273 HydrophobicContact CG1-CG2 4.17Å; V178-I273 HydrophobicContact CG2-CG2 3.81Å; N179-I273 PolarHBondContact N-O 3.22Å; I273-L275 HydrophobicContact CD1-CD2 3.8Å; I273-L275 HydrophobicContact CG1-CD2 3.93Å; I273-M300 HydrophobicContact CB-CE 4.34Å; I273-M300 WeakPolarHBondContact CG1-O 3.18Å
274	T	98.9	Very high	97.4	Very high	1 Å²	1	42.6 Å²	42.6	1%	0.006	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	120.4	174.9	-61.7	0	0	0	0	110.5	N179 I181 I276 L291 Y296 M300 I301 H302	N179-T274 HydrophobicContact CB-CG2 4.06Å; N179-T274 PolarHBondContact ND2-OG1 2.8Å; I181-T274 HydrophobicContact CD1-CG2 3.74Å; I181-T274 HydrophobicContact CG1-CG2 4.35Å; T274-I276 HydrophobicContact CG2-CG1 4.24Å; T274-L291 HydrophobicContact CG2-CD1 3.84Å; T274-L291 HydrophobicContact CG2-CD2 4.13Å; T274-Y296 WeakPolarHBondContact OG1-CD1 3.48Å; T274-M300 PolarHBondContact N-O 3.03Å; T274-I301 CarbonylContact O-C 3.55Å; T274-I301 VanDerWaalsContact O-CA 3.32Å; T274-I301 WeakPolarHBondContact O-CA 3.31Å; T274-H302 PolarHBondContact O-N 3.32Å
275	L	98.9	Very high	97.4	Very high	0 Å²	0	48.1 Å²	48.1	0%	0	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	132.4	-179.7	-51.8	-177.4	0	0	0	109.5	L152 F160 V178 N179 M180 I181 M190 L193 I273 H302 F304	L152-L275 HydrophobicContact CD1-CD2 3.68Å; F160-L275 HydrophobicContact CE1-CD1 4.45Å; V178-L275 HydrophobicContact CG1-CD1 3.69Å; V178-L275 HydrophobicContact CG1-CG 4.06Å; N179-L275 PolarHBondContact O-N 3.23Å; M180-L275 HydrophobicContact CE-CD1 4.43Å; I181-L275 PolarHBondContact N-O 2.78Å; M190-L275 VanDerWaalsContact CE-C 3.43Å; M190-L275 HydrophobicContact CE-CB 3.68Å; M190-L275 WeakPolarHBondContact CE-O 3.43Å; M190-L275 HydrophobicContact SD-CB 3.83Å; M190-L275 HydrophobicContact SD-CD1 4.38Å; L193-L275 HydrophobicContact CD1-CD1 3.6Å; I273-L275 HydrophobicContact CD1-CD2 3.8Å; I273-L275 HydrophobicContact CG1-CD2 3.93Å; L275-H302 CarbonylContact C-O 3.57Å; L275-H302 WeakPolarHBondContact CA-O 2.94Å; L275-H302 HydrophobicContact CD2-CB 3.74Å; L275-F304 HydrophobicContact CB-CE2 4.06Å; L275-F304 HydrophobicContact CD1-CE2 4.31Å
276	I	98.8	Very high	97.3	Very high	0 Å²	0	48.1 Å²	48.1	0%	0	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	133.4	-177.7	-46	173.2	0	0	0	109.9	I181 T274 F282 I283 C287 L288 L291 I301 H302 V303 F304	I181-I276 VanDerWaalsContact O-CA 3.31Å; I181-I276 WeakPolarHBondContact O-CA 3.37Å; T274-I276 HydrophobicContact CG2-CG1 4.24Å; I276-F282 HydrophobicContact CG2-CE1 4.45Å; I276-I283 HydrophobicContact CG2-CG1 4.05Å; I276-I283 HydrophobicContact CG2-CG2 4.42Å; I276-C287 HydrophobicContact CD1-CB 4.08Å; I276-C287 HydrophobicContact CG2-CB 3.91Å; I276-L288 HydrophobicContact CD1-CD2 3.71Å; I276-L288 HydrophobicContact CD1-CG 4.49Å; I276-L291 HydrophobicContact CD1-CD1 3.45Å; I276-L291 VanDerWaalsContact CD1-CD1 3.45Å; I276-L291 HydrophobicContact CG1-CD1 4.29Å; I276-I301 HydrophobicContact CD1-CG2 3.63Å; I276-I301 HydrophobicContact CG1-CG2 4.28Å; I276-H302 PolarHBondContact N-O 3.4Å; I276-V303 HydrophobicContact CB-CG2 4.36Å; I276-V303 HydrophobicContact CD1-CG2 4.38Å; I276-V303 WeakPolarHBondContact O-CA 3.43Å; I276-F304 PolarHBondContact O-N 2.96Å; I276-F304 VanDerWaalsContact O-N 3.11Å
277	C	98.7	Very high	97.3	Very high	22 Å²	22	47.3 Å²	47.3	15%	0.149	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.1	134.2	170.4	-168.9	0	0	0	0	111.6	I181 C182 G183 G186 P189 M190 F304	I181-C277 PolarHBondContact O-N 3.11Å; I181-C277 VanDerWaalsContact O-N 3.13Å; C182-C277 CarbonylContact C-O 3.51Å; C182-C277 VanDerWaalsContact CA-O 3.22Å; C182-C277 WeakPolarHBondContact CA-O 2.82Å; G183-C277 PolarHBondContact N-O 3.24Å; G186-C277 VanDerWaalsContact CA-SG 3.59Å; G186-C277 WeakPolarHBondContact O-CB 3.37Å; P189-C277 HydrophobicContact CG-CB 3.92Å; M190-C277 HydrophobicContact CE-CB 3.79Å; C277-F304 HydrophobicContact CB-CB 4.1Å; C277-F304 HydrophobicContact CB-CD2 4.14Å
278	G	97.9	Very high	97.3	Very high	19 Å²	19	47 Å²	47	20%	0.196	26%	0.257	C	S	.	.	S	Bend	trans	166.6	-171.4	178.1	0	0	0	0	0	111.9	I283	G278-I283 WeakPolarHBondContact O-CD1 3.38Å
279	P	95.2	Very high	97.4	Very high	56 Å²	56	47.3 Å²	47.3	36%	0.364	26%	0.257	S	S	.	.			trans	-59.1	148	176	-24.3	34.8	0	0	0	112.2	P281 F282 I283	P279-P281 VanDerWaalsContact C-N 3.35Å; P279-F282 WeakPolarHBondContact O-CA 3.48Å; P279-F282 VanDerWaalsContact O-CB 3.3Å; P279-F282 WeakPolarHBondContact O-CB 3.32Å; P279-F282 PolarHBondContact O-N 3.06Å; P279-I283 PolarHBondContact O-N 2.94Å
280	P	95.6	Very high	97.6	Very high	78 Å²	78	42.1 Å²	42.1	51%	0.506	24%	0.235	S	C	.	.	H	α-helix	trans	-52.3	-43.1	-178.5	-25	31.9	0	0	0	114.5	F282 I283 E284	P280-F282 VanDerWaalsContact C-N 3.28Å; P280-F282 PolarHBondContact O-N 3.4Å; P280-I283 PolarHBondContact O-N 3.13Å; P280-I283 VanDerWaalsContact O-N 3.1Å; P280-E284 WeakPolarHBondContact O-CB 3.28Å; P280-E284 WeakPolarHBondContact O-CG 3.38Å; P280-E284 PolarHBondContact O-N 3.3Å
281	P	94.9	Very high	97.8	Very high	77 Å²	77	34.8 Å²	34.8	50%	0.5	20%	0.196	S	C	.	.	H	α-helix	trans	-61	-34.3	176.7	-25.4	36.2	0	0	0	114.1	P279 F285	P279-P281 VanDerWaalsContact C-N 3.35Å; P281-F285 HydrophobicContact CB-CD2 3.92Å; P281-F285 HydrophobicContact CB-CE2 4.28Å; P281-F285 WeakPolarHBondContact O-CB 3.5Å; P281-F285 PolarHBondContact O-N 3.41Å
282	F	97.1	Very high	97.9	Very high	25 Å²	25	36.6 Å²	36.6	11%	0.11	21%	0.211	C	C	.	.	I	π-helix	trans	-66.9	-40.4	176.1	167.1	-102.5	0	0	0	111.3	I181 C182 A212 V256 I276 P279 P280 A286 C287	I181-F282 HydrophobicContact CG2-CE1 4.33Å; I181-F282 HydrophobicContact CG2-CZ 3.75Å; C182-F282 VanDerWaalsContact C-CZ 3.42Å; C182-F282 WeakPolarHBondContact O-CZ 3.39Å; A212-F282 HydrophobicContact CB-CD2 4.33Å; A212-F282 HydrophobicContact CB-CE2 3.54Å; A212-F282 HydrophobicContact CB-CZ 4.13Å; V256-F282 HydrophobicContact CB-CE2 4.28Å; V256-F282 HydrophobicContact CG2-CE2 3.75Å; V256-F282 HydrophobicContact CG2-CZ 4.34Å; I276-F282 HydrophobicContact CG2-CE1 4.45Å; P279-F282 WeakPolarHBondContact O-CA 3.48Å; P279-F282 VanDerWaalsContact O-CB 3.3Å; P279-F282 WeakPolarHBondContact O-CB 3.32Å; P279-F282 PolarHBondContact O-N 3.06Å; P280-F282 VanDerWaalsContact C-N 3.28Å; P280-F282 PolarHBondContact O-N 3.4Å; F282-A286 WeakPolarHBondContact O-CB 3.14Å; F282-A286 PolarHBondContact O-N 3.14Å; F282-C287 WeakPolarHBondContact CE1-SG 3.25Å; F282-C287 WeakPolarHBondContact CZ-SG 3.37Å; F282-C287 PolarHBondContact O-N 3.04Å; F282-C287 PolarHBondContact O-SG 3.22Å
283	I	98.4	Very high	97.8	Very high	21 Å²	21	43.2 Å²	43.2	11%	0.108	24%	0.239	C	C	.	.	I	π-helix	trans	-71.5	-51.9	179	-60.5	170.5	0	0	0	110.4	I276 G278 P279 P280 L288 V303	I276-I283 HydrophobicContact CG2-CG1 4.05Å; I276-I283 HydrophobicContact CG2-CG2 4.42Å; G278-I283 WeakPolarHBondContact O-CD1 3.38Å; P279-I283 PolarHBondContact O-N 2.94Å; P280-I283 PolarHBondContact O-N 3.13Å; P280-I283 VanDerWaalsContact O-N 3.1Å; I283-L288 HydrophobicContact CG2-CD1 3.81Å; I283-L288 HydrophobicContact CG2-CG 3.97Å; I283-L288 WeakPolarHBondContact O-CB 3.24Å; I283-L288 WeakPolarHBondContact O-CG 3.15Å; I283-L288 PolarHBondContact O-N 3.31Å; I283-V303 HydrophobicContact CD1-CG1 3.86Å; I283-V303 HydrophobicContact CG2-CG1 4.07Å; I283-V303 HydrophobicContact CG2-CG2 4.3Å
284	E	98.1	Very high	97.8	Very high	112 Å²	112	44.9 Å²	44.9	52%	0.523	25%	0.248	S	C	.	.	I	π-helix	trans	-78.6	-33.4	-167.5	-67.8	171.7	-171.2	0	0	113.7	P280 P289	P280-E284 WeakPolarHBondContact O-CB 3.28Å; P280-E284 WeakPolarHBondContact O-CG 3.38Å; P280-E284 PolarHBondContact O-N 3.3Å; E284-P289 VanDerWaalsContact O-CD 3.24Å; E284-P289 WeakPolarHBondContact O-CD 3.38Å; E284-P289 WeakPolarHBondContact O-CG 3.36Å
285	F	97.3	Very high	97.7	Very high	154 Å²	154	51.3 Å²	51.3	68%	0.675	28%	0.283	S	S	*	.	I	π-helix	trans	-106.5	-23.2	-175	-56.6	-58.3	0	0	0	114.3	P281	P281-F285 HydrophobicContact CB-CD2 3.92Å; P281-F285 HydrophobicContact CB-CE2 4.28Å; P281-F285 WeakPolarHBondContact O-CB 3.5Å; P281-F285 PolarHBondContact O-N 3.41Å
286	A	97.7	Very high	97.7	Very high	10 Å²	10	52 Å²	52	8%	0.083	29%	0.286	C	S	.	.	I	π-helix	trans	-106.9	-62.5	178.6	0	0	0	0	0	111.6	V256 F282 S290	V256-A286 HydrophobicContact CB-CB 4.33Å; V256-A286 WeakPolarHBondContact O-CB 3.3Å; F282-A286 WeakPolarHBondContact O-CB 3.14Å; F282-A286 PolarHBondContact O-N 3.14Å; A286-S290 WeakPolarHBondContact O-CB 3.38Å; A286-S290 PolarHBondContact O-N 3.36Å; A286-S290 PolarHBondContact O-OG 3.06Å; A286-S290 VanDerWaalsContact O-OG 3.11Å
287	C	98.6	Very high	97.6	Very high	0 Å²	0	54.1 Å²	54.1	0%	0	30%	0.299	C	S	.	.	I	π-helix	trans	-69.4	-57.9	-169	-57.4	0	0	0	0	113.4	I181 I276 F282 S290 L291	I181-C287 HydrophobicContact CG2-CB 4.46Å; I181-C287 WeakPolarHBondContact CG2-SG 3.41Å; I276-C287 HydrophobicContact CD1-CB 4.08Å; I276-C287 HydrophobicContact CG2-CB 3.91Å; F282-C287 WeakPolarHBondContact CE1-SG 3.25Å; F282-C287 WeakPolarHBondContact CZ-SG 3.37Å; F282-C287 PolarHBondContact O-N 3.04Å; F282-C287 PolarHBondContact O-SG 3.22Å; C287-S290 PolarHBondContact O-N 2.97Å; C287-L291 WeakPolarHBondContact O-CB 3.47Å; C287-L291 VanDerWaalsContact O-CG 3.25Å; C287-L291 WeakPolarHBondContact O-CG 3.44Å; C287-L291 PolarHBondContact O-N 3.45Å
288	L	98.5	Very high	97.4	Very high	65 Å²	65	61.7 Å²	61.7	34%	0.34	33%	0.329	S	S	.	.	H	α-helix	trans	-64.4	-42.1	-174.2	-66	177.1	0	0	0	113.1	I276 I283 S292 I301 V303	I276-L288 HydrophobicContact CD1-CD2 3.71Å; I276-L288 HydrophobicContact CD1-CG 4.49Å; I283-L288 HydrophobicContact CG2-CD1 3.81Å; I283-L288 HydrophobicContact CG2-CG 3.97Å; I283-L288 WeakPolarHBondContact O-CB 3.24Å; I283-L288 WeakPolarHBondContact O-CG 3.15Å; I283-L288 PolarHBondContact O-N 3.31Å; L288-S292 WeakPolarHBondContact O-CB 3.28Å; L288-S292 PolarHBondContact O-N 3.17Å; L288-I301 HydrophobicContact CD2-CG2 4.12Å; L288-V303 HydrophobicContact CD2-CG2 4.33Å
289	P	98.5	Very high	97.2	Very high	45 Å²	45	67 Å²	67	29%	0.292	35%	0.354	S	S	.	.	H	α-helix	trans	-62.4	-45.3	175.5	-25.9	37.7	0	0	0	112.6	E284 S292 K293	E284-P289 VanDerWaalsContact O-CD 3.24Å; E284-P289 WeakPolarHBondContact O-CD 3.38Å; E284-P289 WeakPolarHBondContact O-CG 3.36Å; P289-S292 PolarHBondContact O-N 3.14Å; P289-K293 WeakPolarHBondContact O-CG 3.43Å; P289-K293 PolarHBondContact O-N 3.36Å
290	S	98.6	Very high	97.3	Very high	5 Å²	5	65.3 Å²	65.3	4%	0.035	34%	0.341	C	S	.	.	H	α-helix	trans	-66.6	-41.6	-179.8	-63.8	0	0	0	0	112.3	N257 E258 A286 C287 S292 K293 L294	N257-S290 WeakPolarHBondContact CA-OG 3.49Å; E258-S290 VanDerWaalsContact CD-OG 3.27Å; E258-S290 PolarHBondContact N-OG 2.84Å; E258-S290 WeakPolarHBondContact OE1-CA 3.49Å; E258-S290 PolarHBondContact OE1-OG 2.87Å; A286-S290 WeakPolarHBondContact O-CB 3.38Å; A286-S290 PolarHBondContact O-N 3.36Å; A286-S290 PolarHBondContact O-OG 3.06Å; A286-S290 VanDerWaalsContact O-OG 3.11Å; C287-S290 PolarHBondContact O-N 2.97Å; S290-S292 VanDerWaalsContact C-N 3.3Å; S290-S292 PolarHBondContact O-N 3Å; S290-K293 PolarHBondContact O-N 3.35Å; S290-L294 VanDerWaalsContact O-CG 3.3Å; S290-L294 WeakPolarHBondContact O-CG 3.49Å; S290-L294 PolarHBondContact O-N 3.28Å
291	L	98.6	Very high	97.4	Very high	0 Å²	0	63.1 Å²	63.1	0%	0	33%	0.325	C	S	.	.	H	α-helix	trans	-62.4	-37.1	173.4	-71.9	171.3	0	0	0	112.5	I181 L261 I265 T274 I276 C287 L294 D295 Y296 I301	I181-L291 HydrophobicContact CD1-CD1 3.93Å; I181-L291 HydrophobicContact CD1-CD2 4.03Å; I181-L291 HydrophobicContact CD1-CG 4.23Å; L261-L291 HydrophobicContact CD1-CD2 3.97Å; L261-L291 HydrophobicContact CD1-CG 4.03Å; I265-L291 HydrophobicContact CD1-CD2 4.08Å; T274-L291 HydrophobicContact CG2-CD1 3.84Å; T274-L291 HydrophobicContact CG2-CD2 4.13Å; I276-L291 HydrophobicContact CD1-CD1 3.45Å; I276-L291 VanDerWaalsContact CD1-CD1 3.45Å; I276-L291 HydrophobicContact CG1-CD1 4.29Å; C287-L291 WeakPolarHBondContact O-CB 3.47Å; C287-L291 VanDerWaalsContact O-CG 3.25Å; C287-L291 WeakPolarHBondContact O-CG 3.44Å; C287-L291 PolarHBondContact O-N 3.45Å; L291-L294 CarbonylContact O-C 3.49Å; L291-L294 PolarHBondContact O-N 3.41Å; L291-D295 PolarHBondContact O-N 3.06Å; L291-Y296 HydrophobicContact CB-CD2 4.39Å; L291-Y296 HydrophobicContact CB-CG 4.45Å; L291-Y296 HydrophobicContact CD2-CD1 4.02Å; L291-Y296 HydrophobicContact CD2-CD2 3.58Å; L291-Y296 HydrophobicContact CD2-CE1 4.27Å; L291-Y296 HydrophobicContact CD2-CE2 3.86Å; L291-Y296 HydrophobicContact CD2-CG 3.65Å; L291-Y296 PolarHBondContact O-N 3.41Å; L291-I301 HydrophobicContact CB-CD1 4.16Å; L291-I301 HydrophobicContact CD1-CD1 4.1Å
292	S	97.8	Very high	97.6	Very high	74 Å²	74	59.8 Å²	59.8	52%	0.517	30%	0.302	S	S	.	.	H	α-helix	trans	-66.8	-36.5	176.5	-172.7	0	0	0	0	112.5	L288 P289 S290 L294 D295	L288-S292 WeakPolarHBondContact O-CB 3.28Å; L288-S292 PolarHBondContact O-N 3.17Å; P289-S292 PolarHBondContact O-N 3.14Å; S290-S292 VanDerWaalsContact C-N 3.3Å; S290-S292 PolarHBondContact O-N 3Å; S292-L294 VanDerWaalsContact C-N 3.3Å; S292-D295 PolarHBondContact O-N 3.26Å
293	K	98.1	Very high	97.6	Very high	142 Å²	142	60.7 Å²	60.7	62%	0.617	31%	0.31	S	S	*	.	H	α-helix	trans	-73.5	-24.2	175.6	-68.1	-173.4	-156	152.4	0	113	E258 P289 S290 D295	E258-K293 HydrophobicContact CG-CB 4.11Å; E258-K293 HydrophobicContact CG-CD 4.12Å; E258-K293 VanDerWaalsContact OE1-CD 3.31Å; E258-K293 WeakPolarHBondContact OE1-CD 3.47Å; E258-K293 WeakPolarHBondContact OE1-CE 3.48Å; E258-K293 IonicContact OE1-NZ 3.23Å; E258-K293 PolarHBondContact OE1-NZ 3.36Å; P289-K293 WeakPolarHBondContact O-CG 3.43Å; P289-K293 PolarHBondContact O-N 3.36Å; S290-K293 PolarHBondContact O-N 3.35Å; K293-D295 VanDerWaalsContact C-N 3.28Å
294	L	98.1	Very high	97.5	Very high	37 Å²	37	63.4 Å²	63.4	19%	0.194	32%	0.321	C	S	.	.	T	Hydrogen-bonded Turn	trans	-91.8	14.3	174.9	-64.3	173.8	0	0	0	112.6	E258 L261 Q262 S290 L291 S292 Y296	E258-L294 HydrophobicContact CB-CD1 4.38Å; E258-L294 HydrophobicContact CB-CD2 4.3Å; E258-L294 HydrophobicContact CB-CG 4.3Å; E258-L294 HydrophobicContact CG-CG 4.45Å; L261-L294 HydrophobicContact CB-CD1 3.8Å; Q262-L294 HydrophobicContact CB-CD1 4.49Å; Q262-L294 HydrophobicContact CB-CD2 4.3Å; S290-L294 VanDerWaalsContact O-CG 3.3Å; S290-L294 WeakPolarHBondContact O-CG 3.49Å; S290-L294 PolarHBondContact O-N 3.28Å; L291-L294 CarbonylContact O-C 3.49Å; L291-L294 PolarHBondContact O-N 3.41Å; S292-L294 VanDerWaalsContact C-N 3.3Å; L294-Y296 VanDerWaalsContact C-N 3.28Å; L294-Y296 HydrophobicContact CB-CD2 3.72Å; L294-Y296 HydrophobicContact CB-CE2 3.67Å; L294-Y296 HydrophobicContact CD1-CE2 4.18Å; L294-Y296 WeakPolarHBondContact O-CD2 3.3Å; L294-Y296 PolarHBondContact O-N 3Å
295	D	97.5	Very high	97.4	Very high	136 Å²	136	61 Å²	61	73%	0.727	31%	0.311	S	S	*	.	T	Hydrogen-bonded Turn	trans	56.2	32	175.6	-60.7	-49.8	0	0	0	115.3	L291 S292 K293	L291-D295 PolarHBondContact O-N 3.06Å; S292-D295 PolarHBondContact O-N 3.26Å; K293-D295 VanDerWaalsContact C-N 3.28Å
296	Y	98.3	Very high	97.4	Very high	15 Å²	15	56.1 Å²	56.1	6%	0.059	29%	0.291	C	S	.	.			trans	-70.2	126.6	172.3	-77.5	-103.3	0	0	0	110.6	I265 Y266 P267 A268 T274 L291 L294 K298	I265-Y296 HydrophobicContact CD1-CE1 4.11Å; I265-Y296 HydrophobicContact CD1-CE2 4.44Å; I265-Y296 WeakPolarHBondContact CD1-OH 3.24Å; Y266-Y296 WeakPolarHBondContact O-CE1 3.44Å; Y266-Y296 PolarHBondContact O-OH 2.73Å; P267-Y296 WeakPolarHBondContact CA-OH 3.28Å; A268-Y296 HydrophobicContact CB-CD1 3.86Å; A268-Y296 HydrophobicContact CB-CD2 4.09Å; A268-Y296 HydrophobicContact CB-CE1 4.1Å; A268-Y296 HydrophobicContact CB-CE2 4.33Å; A268-Y296 HydrophobicContact CB-CG 3.87Å; T274-Y296 WeakPolarHBondContact OG1-CD1 3.48Å; L291-Y296 HydrophobicContact CB-CD2 4.39Å; L291-Y296 HydrophobicContact CB-CG 4.45Å; L291-Y296 HydrophobicContact CD2-CD1 4.02Å; L291-Y296 HydrophobicContact CD2-CD2 3.58Å; L291-Y296 HydrophobicContact CD2-CE1 4.27Å; L291-Y296 HydrophobicContact CD2-CE2 3.86Å; L291-Y296 HydrophobicContact CD2-CG 3.65Å; L291-Y296 PolarHBondContact O-N 3.41Å; L294-Y296 VanDerWaalsContact C-N 3.28Å; L294-Y296 HydrophobicContact CB-CD2 3.72Å; L294-Y296 HydrophobicContact CB-CE2 3.67Å; L294-Y296 HydrophobicContact CD1-CE2 4.18Å; L294-Y296 WeakPolarHBondContact O-CD2 3.3Å; L294-Y296 PolarHBondContact O-N 3Å; Y296-K298 PolarHBondContact O-N 3.2Å
297	P	96	Very high	97.4	Very high	44 Å²	44	58.6 Å²	58.6	29%	0.286	30%	0.303	S	S	.	.			trans	-73.4	130	-173.3	29.3	-34	0	0	0	110.5	N299 M300 I301	P297-N299 WeakPolarHBondContact CB-OD1 3.35Å; P297-N299 PolarHBondContact O-N 3.01Å; P297-N299 VanDerWaalsContact O-N 3.13Å; P297-M300 HydrophobicContact CG-CB 3.96Å; P297-M300 HydrophobicContact CG-CG 3.81Å; P297-M300 WeakPolarHBondContact O-CA 3.49Å; P297-M300 PolarHBondContact O-N 3.41Å; P297-I301 PolarHBondContact O-N 3.24Å
298	K	95	Very high	97.4	Very high	180 Å²	180	62.1 Å²	62.1	78%	0.783	32%	0.321	S	S	*	.	G	3₁₀ helix	trans	-57.9	-31.4	-172.1	-65.9	-176.9	179.6	177	0	113.8	Y296 M300 I301	Y296-K298 PolarHBondContact O-N 3.2Å; K298-M300 PolarHBondContact O-N 3.25Å; K298-I301 PolarHBondContact O-N 2.95Å
299	N	94.1	Very high	97.3	Very high	132 Å²	132	61.9 Å²	61.9	71%	0.706	32%	0.32	S	S	*	.	G	3₁₀ helix	trans	-72	-15.3	176.8	64.9	-37.1	0	0	0	113.5	P297	P297-N299 WeakPolarHBondContact CB-OD1 3.35Å; P297-N299 PolarHBondContact O-N 3.01Å; P297-N299 VanDerWaalsContact O-N 3.13Å
300	M	96.9	Very high	97.2	Very high	19 Å²	19	63 Å²	63	9%	0.094	32%	0.321	C	S	.	.	G	3₁₀ helix	trans	-101.7	9	172.7	-58.7	-62.7	-75.6	0	0	112.4	V173 V175 D270 T272 I273 T274 P297 K298	V173-M300 HydrophobicContact CG1-CE 3.98Å; V173-M300 HydrophobicContact CG1-SD 3.95Å; V175-M300 HydrophobicContact CG1-CE 3.63Å; D270-M300 WeakPolarHBondContact O-CE 3.38Å; T272-M300 WeakPolarHBondContact O-CE 3.38Å; I273-M300 HydrophobicContact CB-CE 4.34Å; I273-M300 WeakPolarHBondContact CG1-O 3.18Å; T274-M300 PolarHBondContact N-O 3.03Å; P297-M300 HydrophobicContact CG-CB 3.96Å; P297-M300 HydrophobicContact CG-CG 3.81Å; P297-M300 WeakPolarHBondContact O-CA 3.49Å; P297-M300 PolarHBondContact O-N 3.41Å; K298-M300 PolarHBondContact O-N 3.25Å
301	I	98	Very high	97.1	Very high	33 Å²	33	67.1 Å²	67.1	17%	0.169	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	123.1	173.1	-60.5	171.7	0	0	0	108.8	T274 I276 L288 L291 P297 K298	T274-I301 CarbonylContact O-C 3.55Å; T274-I301 VanDerWaalsContact O-CA 3.32Å; T274-I301 WeakPolarHBondContact O-CA 3.31Å; I276-I301 HydrophobicContact CD1-CG2 3.63Å; I276-I301 HydrophobicContact CG1-CG2 4.28Å; L288-I301 HydrophobicContact CD2-CG2 4.12Å; L291-I301 HydrophobicContact CB-CD1 4.16Å; L291-I301 HydrophobicContact CD1-CD1 4.1Å; P297-I301 PolarHBondContact O-N 3.24Å; K298-I301 PolarHBondContact O-N 2.95Å
302	H	98.1	Very high	97	Very high	7 Å²	7	72.3 Å²	72.3	3%	0.032	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	121.1	172.5	-170	83.4	0	0	0	110.7	R151 L152 T274 L275 I276	R151-H302 PolarHBondContact NH2-CE1 2.91Å; L152-H302 HydrophobicContact CD1-CB 4.14Å; T274-H302 PolarHBondContact O-N 3.32Å; L275-H302 CarbonylContact C-O 3.57Å; L275-H302 WeakPolarHBondContact CA-O 2.94Å; L275-H302 HydrophobicContact CD2-CB 3.74Å; I276-H302 PolarHBondContact N-O 3.4Å
303	V	97.9	Very high	96.9	Very high	43 Å²	43	72.2 Å²	72.2	26%	0.261	36%	0.356	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.4	123.7	168.8	-173.8	0	0	0	0	108.4	R151 I276 I283 L288	R151-V303 PolarHBondContact NH2-O 2.74Å; I276-V303 HydrophobicContact CB-CG2 4.36Å; I276-V303 HydrophobicContact CD1-CG2 4.38Å; I276-V303 WeakPolarHBondContact O-CA 3.43Å; I283-V303 HydrophobicContact CD1-CG1 3.86Å; I283-V303 HydrophobicContact CG2-CG1 4.07Å; I283-V303 HydrophobicContact CG2-CG2 4.3Å; L288-V303 HydrophobicContact CD2-CG2 4.33Å
304	F	95.2	Very high	96.8	Very high	78 Å²	78	65.8 Å²	65.8	34%	0.342	33%	0.332	S	S	.	.			trans	-69.9	0	177	-78.8	-81.6	0	0	0	113	L152 P189 M190 L193 L275 I276 C277	L152-F304 HydrophobicContact CD1-CZ 4.39Å; L152-F304 HydrophobicContact CD2-CE1 4.45Å; L152-F304 HydrophobicContact CD2-CZ 4.29Å; P189-F304 HydrophobicContact CB-CD1 3.91Å; P189-F304 HydrophobicContact CB-CD2 4.17Å; P189-F304 HydrophobicContact CB-CE1 3.95Å; P189-F304 HydrophobicContact CB-CE2 4.17Å; P189-F304 HydrophobicContact CB-CG 4.04Å; P189-F304 HydrophobicContact CB-CZ 4.08Å; P189-F304 HydrophobicContact CG-CB 4.42Å; P189-F304 HydrophobicContact CG-CD1 4.42Å; P189-F304 HydrophobicContact CG-CD2 4.13Å; P189-F304 HydrophobicContact CG-CG 4.07Å; M190-F304 HydrophobicContact CE-CD2 3.82Å; M190-F304 HydrophobicContact CE-CE2 3.8Å; M190-F304 HydrophobicContact SD-CE2 3.97Å; L193-F304 HydrophobicContact CD1-CE2 4.33Å; L193-F304 HydrophobicContact CD1-CZ 3.64Å; L275-F304 HydrophobicContact CB-CE2 4.06Å; L275-F304 HydrophobicContact CD1-CE2 4.31Å; I276-F304 PolarHBondContact O-N 2.96Å; I276-F304 VanDerWaalsContact O-N 3.11Å; C277-F304 HydrophobicContact CB-CB 4.1Å; C277-F304 HydrophobicContact CB-CD2 4.14Å

Retrieved 304 of 304 residues in 107.2 ms (Link to these results)

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