A0A087XIC6_POEFO Loading...

Probable D-lactate dehydrogenase, mitochondrial

Involved in D-lactate, but not L-lactate catabolic process.

AlphaFold DB , UniProt , Accession A0A087XIC6, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 476 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	35.1	Very low	49.6	Very low	218 Å²	218	120.3 Å²	120.3	100%	1.074	64%	0.637	S	S	*	*				0	-31.5	0	-94.7	-168.9	-84.9	0	0	114.5
2	M	27.3	Very low	51.5	Low	177 Å²	177	121 Å²	121	87%	0.872	63%	0.63	S	S	*	*	H	α-helix	trans	-72.1	-25.1	178.5	-77.9	176.1	172.8	0	0	115	T5	M2-T5 PolarHBondContact O-OG1 3.21Å; M2-T5 VanDerWaalsContact O-OG1 3.1Å
3	D	36.6	Very low	53.4	Low	142 Å²	142	115.2 Å²	115.2	76%	0.759	61%	0.611	S	S	*	*	H	α-helix	trans	-77	-32.4	-177.9	-155	7.4	0	0	0	113	T5 G7	D3-T5 PolarHBondContact O-N 3.46Å; D3-G7 PolarHBondContact O-N 3.43Å
4	C	43.8	Very low	55.4	Low	92 Å²	92	108.8 Å²	108.8	62%	0.622	58%	0.582	S	S	*	*	H	α-helix	trans	-72.6	-28.6	-176.9	-135.7	0	0	0	0	113.1	R8	C4-R8 PolarHBondContact O-N 2.94Å
5	T	45.3	Very low	57.4	Low	86 Å²	86	101.7 Å²	101.7	53%	0.528	54%	0.544	S	S	.	.	H	α-helix	trans	-81	-32.6	-179.6	49.6	0	0	0	0	112.6	M2 D3 R9	M2-T5 PolarHBondContact O-OG1 3.21Å; M2-T5 VanDerWaalsContact O-OG1 3.1Å; D3-T5 PolarHBondContact O-N 3.46Å; T5-R9 WeakPolarHBondContact O-CG 3.22Å; T5-R9 PolarHBondContact O-N 3.47Å
6	C	44.3	Very low	59.4	Low	86 Å²	86	100.9 Å²	100.9	58%	0.581	54%	0.54	S	S	*	.	H	α-helix	trans	-68.1	-47.3	174.4	-167.4	0	0	0	0	111.2	R8 R9 A10	C6-R8 PolarHBondContact O-N 3.5Å; C6-R9 PolarHBondContact O-N 3.48Å; C6-A10 PolarHBondContact O-N 3.02Å; C6-A10 VanDerWaalsContact O-N 3.14Å
7	G	58.9	Low	61.3	Low	39 Å²	39	104.5 Å²	104.5	40%	0.402	55%	0.55	S	S	.	.	H	α-helix	trans	-59.1	-44.7	176.6	0	0	0	0	0	113.5	D3 R9 A10 Q11	D3-G7 PolarHBondContact O-N 3.43Å; G7-R9 PolarHBondContact O-N 2.98Å; G7-A10 PolarHBondContact O-N 2.89Å; G7-Q11 WeakPolarHBondContact O-CB 3.44Å; G7-Q11 PolarHBondContact O-N 3.28Å
8	R	61.5	Low	63.2	Low	169 Å²	169	98.8 Å²	98.8	64%	0.638	52%	0.52	S	S	*	.	H	α-helix	trans	-63.2	-35.2	176.5	-84.6	-172.6	178	-163.4	-2.4	113.7	C4 C6 K12	C4-R8 PolarHBondContact O-N 2.94Å; C6-R8 PolarHBondContact O-N 3.5Å; R8-K12 WeakPolarHBondContact O-CB 3.48Å; R8-K12 PolarHBondContact O-N 3.36Å
9	R	60.7	Low	65	Low	202 Å²	202	94.4 Å²	94.4	76%	0.762	50%	0.497	S	S	*	.	H	α-helix	trans	-70.1	-43.3	177.7	-77.6	-177.6	179.8	-160.4	1	112.1	T5 C6 G7 Q11 A13	T5-R9 WeakPolarHBondContact O-CG 3.22Å; T5-R9 PolarHBondContact O-N 3.47Å; C6-R9 PolarHBondContact O-N 3.48Å; G7-R9 PolarHBondContact O-N 2.98Å; R9-Q11 VanDerWaalsContact C-N 3.29Å; R9-Q11 PolarHBondContact O-N 3.43Å; R9-A13 PolarHBondContact O-N 3.41Å; R9-A13 VanDerWaalsContact O-N 3.17Å
10	A	63.3	Low	66.6	Low	67 Å²	67	94 Å²	94	55%	0.554	50%	0.502	S	S	*	.	H	α-helix	trans	-62.7	-38.8	176.6	0	0	0	0	0	111.7	C6 G7 A13 A14	C6-A10 PolarHBondContact O-N 3.02Å; C6-A10 VanDerWaalsContact O-N 3.14Å; G7-A10 PolarHBondContact O-N 2.89Å; A10-A13 PolarHBondContact O-N 3.09Å; A10-A14 PolarHBondContact O-N 3.49Å
11	Q	69	Low	68.1	Low	45 Å²	45	91.2 Å²	91.2	21%	0.21	49%	0.492	C	S	.	.	H	α-helix	trans	-73.3	-38.8	-179.4	-163.9	152	-14.6	0	0	113.3	G7 R9 A13 A14 V15 K96	G7-Q11 WeakPolarHBondContact O-CB 3.44Å; G7-Q11 PolarHBondContact O-N 3.28Å; R9-Q11 VanDerWaalsContact C-N 3.29Å; R9-Q11 PolarHBondContact O-N 3.43Å; Q11-A13 VanDerWaalsContact C-N 3.3Å; Q11-A13 PolarHBondContact O-N 3.26Å; Q11-A14 WeakPolarHBondContact O-CA 3.39Å; Q11-A14 WeakPolarHBondContact O-CB 3.29Å; Q11-A14 PolarHBondContact O-N 3.04Å; Q11-V15 PolarHBondContact O-N 3.37Å; Q11-K96 VanDerWaalsContact CD-O 3.25Å; Q11-K96 PolarHBondContact NE2-O 3.44Å; Q11-K96 PolarHBondContact OE1-O 2.88Å
12	K	72	Confident	71.1	Confident	129 Å²	129	80.9 Å²	80.9	56%	0.561	44%	0.441	S	S	*	.	H	α-helix	trans	-57.4	-44.1	170.4	-172.5	176.1	179.9	-179.7	0	111.7	R8 A14 V15 D16	R8-K12 WeakPolarHBondContact O-CB 3.48Å; R8-K12 PolarHBondContact O-N 3.36Å; K12-A14 VanDerWaalsContact C-N 3.26Å; K12-A14 PolarHBondContact O-N 2.92Å; K12-V15 PolarHBondContact O-N 3.09Å; K12-D16 PolarHBondContact O-N 3.1Å
13	A	76.7	Confident	74.5	Confident	46 Å²	46	77.4 Å²	77.4	38%	0.38	42%	0.418	S	S	.	.	H	α-helix	trans	-65.6	-27.3	175.5	0	0	0	0	0	113.3	R9 A10 Q11 K17	R9-A13 PolarHBondContact O-N 3.41Å; R9-A13 VanDerWaalsContact O-N 3.17Å; A10-A13 PolarHBondContact O-N 3.09Å; Q11-A13 VanDerWaalsContact C-N 3.3Å; Q11-A13 PolarHBondContact O-N 3.26Å; A13-K17 WeakPolarHBondContact O-CG 3.34Å
14	A	81.7	Confident	77.4	Confident	25 Å²	25	76.1 Å²	76.1	21%	0.207	42%	0.416	C	S	.	.	H	α-helix	trans	-73.1	-40.1	172.9	0	0	0	0	0	111.8	A10 Q11 K12 K17 L77	A10-A14 PolarHBondContact O-N 3.49Å; Q11-A14 WeakPolarHBondContact O-CA 3.39Å; Q11-A14 WeakPolarHBondContact O-CB 3.29Å; Q11-A14 PolarHBondContact O-N 3.04Å; K12-A14 VanDerWaalsContact C-N 3.26Å; K12-A14 PolarHBondContact O-N 2.92Å; A14-K17 PolarHBondContact O-N 2.73Å; A14-L77 HydrophobicContact CB-CD2 3.86Å
15	V	85.3	Confident	80	Confident	3 Å²	3	73.9 Å²	73.9	2%	0.018	40%	0.397	C	S	.	.	H	α-helix	trans	-63.6	-45	175.5	171.9	0	0	0	0	111	Q11 K12 K17 V18 L19 D54 V55 L77	Q11-V15 PolarHBondContact O-N 3.37Å; K12-V15 PolarHBondContact O-N 3.09Å; V15-K17 PolarHBondContact O-N 3.18Å; V15-K17 VanDerWaalsContact O-N 3.14Å; V15-V18 WeakPolarHBondContact O-CG2 3.17Å; V15-V18 PolarHBondContact O-N 3.48Å; V15-L19 HydrophobicContact CG1-CD2 4.08Å; V15-L19 HydrophobicContact CG1-CG 4.49Å; V15-L19 WeakPolarHBondContact O-CG 3.2Å; V15-L19 PolarHBondContact O-N 3.49Å; V15-D54 HydrophobicContact CB-CB 4.46Å; V15-D54 HydrophobicContact CG1-CB 4.45Å; V15-D54 HydrophobicContact CG2-CB 3.78Å; V15-V55 HydrophobicContact CG1-CB 4.07Å; V15-V55 HydrophobicContact CG1-CG1 3.76Å; V15-L77 HydrophobicContact CG2-CD2 4.02Å
16	D	88.7	Confident	82.4	Confident	89 Å²	89	69.8 Å²	69.8	48%	0.476	37%	0.372	S	S	.	.	H	α-helix	trans	-56.5	-33.6	179.3	-70.9	-26.7	0	0	0	112.7	K12 V18	K12-D16 PolarHBondContact O-N 3.1Å; D16-V18 VanDerWaalsContact C-N 3.32Å; D16-V18 PolarHBondContact O-N 3.2Å
17	K	91.8	Very high	85	Confident	162 Å²	162	67 Å²	67	70%	0.704	36%	0.358	S	S	*	.	H	α-helix	trans	-68.1	-28.1	177.3	-69.8	172.4	-175.6	-178.6	0	113.5	A13 A14 V15	A13-K17 WeakPolarHBondContact O-CG 3.34Å; A14-K17 PolarHBondContact O-N 2.73Å; V15-K17 PolarHBondContact O-N 3.18Å; V15-K17 VanDerWaalsContact O-N 3.14Å
18	V	95.4	Very high	86.8	Confident	1 Å²	1	72.3 Å²	72.3	1%	0.006	37%	0.37	C	S	.	.	H	α-helix	trans	-101.2	-9	-174.5	-59.4	0	0	0	0	113.9	V15 D16 S20 A21 F22 V71 H75 L77	V15-V18 WeakPolarHBondContact O-CG2 3.17Å; V15-V18 PolarHBondContact O-N 3.48Å; D16-V18 VanDerWaalsContact C-N 3.32Å; D16-V18 PolarHBondContact O-N 3.2Å; V18-S20 VanDerWaalsContact C-N 3.26Å; V18-S20 PolarHBondContact O-N 2.99Å; V18-A21 WeakPolarHBondContact O-CA 3.45Å; V18-A21 WeakPolarHBondContact O-CB 3.5Å; V18-A21 PolarHBondContact O-N 3.39Å; V18-F22 HydrophobicContact CB-CE1 4.36Å; V18-F22 HydrophobicContact CB-CE2 4.4Å; V18-F22 HydrophobicContact CB-CZ 4.18Å; V18-F22 HydrophobicContact CG2-CD2 4.15Å; V18-F22 HydrophobicContact CG2-CE1 4.21Å; V18-F22 HydrophobicContact CG2-CE2 3.51Å; V18-F22 HydrophobicContact CG2-CZ 3.55Å; V18-F22 PolarHBondContact O-N 3.07Å; V18-V71 HydrophobicContact CB-CG1 3.82Å; V18-V71 HydrophobicContact CG1-CG1 3.83Å; V18-H75 HydrophobicContact CG1-CB 3.94Å; V18-H75 VanDerWaalsContact CG1-CD2 3.43Å; V18-H75 WeakPolarHBondContact CG1-CD2 3.35Å; V18-H75 VanDerWaalsContact CG1-CG 3.41Å; V18-L77 HydrophobicContact CB-CD1 4.43Å; V18-L77 HydrophobicContact CG1-CD1 4.16Å; V18-L77 HydrophobicContact CG2-CD1 3.51Å
19	L	96.8	Very high	88.4	Confident	16 Å²	16	71.4 Å²	71.4	8%	0.084	38%	0.378	C	S	.	.	H	α-helix	trans	-55.6	-39	-178.4	-69.9	176.7	0	0	0	113.4	V15 A21 F22 R23 V31 L33 V55	V15-L19 HydrophobicContact CG1-CD2 4.08Å; V15-L19 HydrophobicContact CG1-CG 4.49Å; V15-L19 WeakPolarHBondContact O-CG 3.2Å; V15-L19 PolarHBondContact O-N 3.49Å; L19-A21 VanDerWaalsContact C-N 3.32Å; L19-A21 PolarHBondContact O-N 2.83Å; L19-F22 PolarHBondContact O-N 3.46Å; L19-R23 WeakPolarHBondContact O-CB 3.39Å; L19-R23 VanDerWaalsContact O-CG 3.23Å; L19-R23 WeakPolarHBondContact O-CG 3.41Å; L19-R23 PolarHBondContact O-N 3.06Å; L19-V31 HydrophobicContact CD2-CG1 4.23Å; L19-L33 HydrophobicContact CD1-CD1 3.82Å; L19-L33 HydrophobicContact CD2-CD1 4.32Å; L19-L33 HydrophobicContact CD2-CD2 4.14Å; L19-L33 HydrophobicContact CD2-CG 4.48Å; L19-V55 HydrophobicContact CD2-CG2 4.16Å
20	S	97.1	Very high	90.2	Very high	86 Å²	86	63 Å²	63	60%	0.601	35%	0.348	S	S	*	.	H	α-helix	trans	-62.5	-41.6	177	-170.8	0	0	0	0	111.5	V18 R23 T24	V18-S20 VanDerWaalsContact C-N 3.26Å; V18-S20 PolarHBondContact O-N 2.99Å; S20-R23 PolarHBondContact O-N 3.02Å; S20-T24 WeakPolarHBondContact O-CB 3.37Å; S20-T24 PolarHBondContact O-N 3.49Å; S20-T24 PolarHBondContact O-OG1 3.11Å
21	A	98.1	Very high	91.9	Very high	36 Å²	36	60.6 Å²	60.6	30%	0.298	33%	0.326	S	S	.	.	H	α-helix	trans	-65.6	-45.9	177.2	0	0	0	0	0	111.2	V18 L19 R23 T24 I25 V71	V18-A21 WeakPolarHBondContact O-CA 3.45Å; V18-A21 WeakPolarHBondContact O-CB 3.5Å; V18-A21 PolarHBondContact O-N 3.39Å; L19-A21 VanDerWaalsContact C-N 3.32Å; L19-A21 PolarHBondContact O-N 2.83Å; A21-R23 PolarHBondContact O-N 3.26Å; A21-T24 WeakPolarHBondContact O-CB 3.38Å; A21-T24 PolarHBondContact O-N 3.43Å; A21-T24 VanDerWaalsContact O-N 3.11Å; A21-I25 WeakPolarHBondContact O-CG1 3.35Å; A21-I25 PolarHBondContact O-N 2.91Å; A21-V71 HydrophobicContact CB-CG1 4.32Å; A21-V71 HydrophobicContact CB-CG2 4.31Å
22	F	98.4	Very high	93.2	Very high	0 Å²	0	59.6 Å²	59.6	0%	0	32%	0.324	C	S	.	.	H	α-helix	trans	-58.3	-46.9	176.7	-65.8	-15.4	0	0	0	112.2	V18 L19 T24 I25 C26 V31 V55 V57 L68 V71 L77 V99	V18-F22 HydrophobicContact CB-CE1 4.36Å; V18-F22 HydrophobicContact CB-CE2 4.4Å; V18-F22 HydrophobicContact CB-CZ 4.18Å; V18-F22 HydrophobicContact CG2-CD2 4.15Å; V18-F22 HydrophobicContact CG2-CE1 4.21Å; V18-F22 HydrophobicContact CG2-CE2 3.51Å; V18-F22 HydrophobicContact CG2-CZ 3.55Å; V18-F22 PolarHBondContact O-N 3.07Å; L19-F22 PolarHBondContact O-N 3.46Å; F22-T24 PolarHBondContact O-N 2.93Å; F22-I25 PolarHBondContact O-N 3.02Å; F22-I25 VanDerWaalsContact O-N 3.12Å; F22-C26 PolarHBondContact O-N 2.65Å; F22-C26 PolarHBondContact O-SG 2.78Å; F22-V31 HydrophobicContact CB-CG1 4.44Å; F22-V31 HydrophobicContact CB-CG2 3.87Å; F22-V55 HydrophobicContact CE2-CG1 4.1Å; F22-V57 HydrophobicContact CB-CG1 4.39Å; F22-V57 HydrophobicContact CD2-CG1 4.02Å; F22-V57 HydrophobicContact CG-CG1 4.27Å; F22-L68 HydrophobicContact CB-CD2 3.99Å; F22-L68 HydrophobicContact CD1-CD2 3.32Å; F22-L68 HydrophobicContact CE1-CD2 3.96Å; F22-L68 HydrophobicContact CG-CD2 3.85Å; F22-V71 HydrophobicContact CD1-CB 4.44Å; F22-V71 HydrophobicContact CD1-CG1 4.07Å; F22-V71 HydrophobicContact CE1-CB 3.85Å; F22-V71 HydrophobicContact CE1-CG1 3.47Å; F22-V71 VanDerWaalsContact CE1-CG1 3.47Å; F22-V71 HydrophobicContact CZ-CG1 4.25Å; F22-L77 HydrophobicContact CZ-CD1 4.35Å; F22-V99 HydrophobicContact CE2-CG1 4.2Å; F22-V99 HydrophobicContact CE2-CG2 3.76Å; F22-V99 HydrophobicContact CZ-CG1 4.36Å; F22-V99 HydrophobicContact CZ-CG2 3.81Å
23	R	98.4	Very high	94.4	Very high	105 Å²	105	56.8 Å²	56.8	40%	0.396	32%	0.315	S	S	.	.	H	α-helix	trans	-64.2	-29.9	177.6	-67.9	173.1	176.3	157.8	2.6	112.9	L19 S20 A21 G27 V31	L19-R23 WeakPolarHBondContact O-CB 3.39Å; L19-R23 VanDerWaalsContact O-CG 3.23Å; L19-R23 WeakPolarHBondContact O-CG 3.41Å; L19-R23 PolarHBondContact O-N 3.06Å; S20-R23 PolarHBondContact O-N 3.02Å; A21-R23 PolarHBondContact O-N 3.26Å; R23-G27 CarbonylContact O-C 3.59Å; R23-G27 VanDerWaalsContact O-C 3.3Å; R23-G27 WeakPolarHBondContact O-CA 3.46Å; R23-G27 PolarHBondContact O-N 3.15Å; R23-V31 HydrophobicContact CG-CB 4.15Å; R23-V31 HydrophobicContact CG-CG2 3.97Å
24	T	98.3	Very high	95.4	Very high	114 Å²	114	56.3 Å²	56.3	70%	0.699	32%	0.315	S	S	*	.	H	α-helix	trans	-71.6	-38.5	174.6	-57.6	0	0	0	0	111.1	S20 A21 F22	S20-T24 WeakPolarHBondContact O-CB 3.37Å; S20-T24 PolarHBondContact O-N 3.49Å; S20-T24 PolarHBondContact O-OG1 3.11Å; A21-T24 WeakPolarHBondContact O-CB 3.38Å; A21-T24 PolarHBondContact O-N 3.43Å; A21-T24 VanDerWaalsContact O-N 3.11Å; F22-T24 PolarHBondContact O-N 2.93Å
25	I	98.4	Very high	96.1	Very high	45 Å²	45	62.1 Å²	62.1	23%	0.231	34%	0.337	C	S	.	.	H	α-helix	trans	-74.2	-57.4	-176.6	-67.5	161.5	0	0	0	111.7	A21 F22 E64 A67 L68 V71	A21-I25 WeakPolarHBondContact O-CG1 3.35Å; A21-I25 PolarHBondContact O-N 2.91Å; F22-I25 PolarHBondContact O-N 3.02Å; F22-I25 VanDerWaalsContact O-N 3.12Å; I25-E64 HydrophobicContact CG2-CB 4.17Å; I25-E64 HydrophobicContact CG2-CG 4.27Å; I25-A67 HydrophobicContact CD1-CB 3.99Å; I25-A67 HydrophobicContact CG1-CB 4.22Å; I25-A67 HydrophobicContact CG2-CB 3.84Å; I25-L68 HydrophobicContact CB-CD2 4.16Å; I25-L68 HydrophobicContact CB-CG 4.46Å; I25-L68 HydrophobicContact CD1-CD2 4.11Å; I25-L68 HydrophobicContact CG2-CD2 4.14Å; I25-L68 HydrophobicContact CG2-CG 3.88Å; I25-V71 HydrophobicContact CD1-CG2 3.82Å
26	C	96.7	Very high	96.7	Very high	0 Å²	0	65.4 Å²	65.4	0%	0	37%	0.365	C	S	.	.	H	α-helix	trans	-106.7	0	-173.5	61.4	0	0	0	0	113.7	F22 N30 E64 L68	F22-C26 PolarHBondContact O-N 2.65Å; F22-C26 PolarHBondContact O-SG 2.78Å; C26-N30 HydrophobicContact CB-CB 4.13Å; C26-N30 WeakPolarHBondContact O-CB 3.46Å; C26-N30 PolarHBondContact O-ND2 3.22Å; C26-E64 HydrophobicContact CB-CG 4.46Å; C26-L68 HydrophobicContact CB-CD1 4.41Å
27	G	97.3	Very high	97.2	Very high	28 Å²	28	63.8 Å²	63.8	29%	0.289	36%	0.356	S	S	.	.			trans	91.5	153.7	-177.3	0	0	0	0	0	113.2	R23 D29 N30	R23-G27 CarbonylContact O-C 3.59Å; R23-G27 VanDerWaalsContact O-C 3.3Å; R23-G27 WeakPolarHBondContact O-CA 3.46Å; R23-G27 PolarHBondContact O-N 3.15Å; G27-D29 VanDerWaalsContact C-N 3.31Å; G27-D29 PolarHBondContact O-N 2.86Å; G27-N30 PolarHBondContact O-N 2.78Å
28	K	96.5	Very high	97.5	Very high	150 Å²	150	59.2 Å²	59.2	65%	0.652	33%	0.334	S	S	*	.	G	3₁₀ helix	trans	-60.1	-39.9	-175	-174.7	-175.6	173.3	-170.1	0	113.1	N30 V31	K28-N30 PolarHBondContact O-N 2.72Å; K28-V31 PolarHBondContact O-N 3.24Å
29	D	96.6	Very high	97.6	Very high	150 Å²	150	63.7 Å²	63.7	80%	0.802	36%	0.355	S	S	*	.	G	3₁₀ helix	trans	-74.9	-16	-175.4	-56.7	-35.3	0	0	0	112.5	G27 V31	G27-D29 VanDerWaalsContact C-N 3.31Å; G27-D29 PolarHBondContact O-N 2.86Å; D29-V31 VanDerWaalsContact C-N 3.34Å
30	N	97.9	Very high	97.6	Very high	27 Å²	27	67.9 Å²	67.9	14%	0.144	37%	0.374	C	S	.	.	G	3₁₀ helix	trans	-95.4	17.4	177.3	-67.2	-39.5	0	0	0	112.9	C26 G27 K28 V57 F58	C26-N30 HydrophobicContact CB-CB 4.13Å; C26-N30 WeakPolarHBondContact O-CB 3.46Å; C26-N30 PolarHBondContact O-ND2 3.22Å; G27-N30 PolarHBondContact O-N 2.78Å; K28-N30 PolarHBondContact O-N 2.72Å; N30-V57 CarbonylContact O-C 3.56Å; N30-V57 WeakPolarHBondContact O-CA 3.37Å; N30-F58 HydrophobicContact CB-CB 4.05Å; N30-F58 WeakPolarHBondContact CB-O 3.48Å; N30-F58 PolarHBondContact O-N 2.85Å
31	V	98.4	Very high	97.6	Very high	15 Å²	15	64.1 Å²	64.1	9%	0.091	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.5	111.7	174.5	-176.1	0	0	0	0	109.6	L19 F22 R23 K28 D29 V55 V57	L19-V31 HydrophobicContact CD2-CG1 4.23Å; F22-V31 HydrophobicContact CB-CG1 4.44Å; F22-V31 HydrophobicContact CB-CG2 3.87Å; R23-V31 HydrophobicContact CG-CB 4.15Å; R23-V31 HydrophobicContact CG-CG2 3.97Å; K28-V31 PolarHBondContact O-N 3.24Å; D29-V31 VanDerWaalsContact C-N 3.34Å; V31-V55 HydrophobicContact CG1-CG2 3.69Å; V31-V57 HydrophobicContact CG1-CG1 4.48Å; V31-V57 HydrophobicContact CG2-CG1 4.31Å
32	S	97.8	Very high	97.6	Very high	25 Å²	25	62.4 Å²	62.4	18%	0.175	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	129.5	-176.7	-173.6	0	0	0	0	113.2	G34 V55 V56	S32-G34 PolarHBondContact OG-N 3.13Å; S32-V55 WeakPolarHBondContact O-CG2 3.36Å; S32-V56 PolarHBondContact N-O 3.32Å; S32-V56 PolarHBondContact O-N 3.41Å
33	L	96.8	Very high	97.4	Very high	70 Å²	70	68.1 Å²	68.1	37%	0.366	36%	0.358	S	S	.	.			trans	-107.3	1.3	169.4	-65.6	172.4	0	0	0	112.3	L19 E35 R38 V55	L19-L33 HydrophobicContact CD1-CD1 3.82Å; L19-L33 HydrophobicContact CD2-CD1 4.32Å; L19-L33 HydrophobicContact CD2-CD2 4.14Å; L19-L33 HydrophobicContact CD2-CG 4.48Å; L33-E35 PolarHBondContact O-N 3.47Å; L33-R38 WeakPolarHBondContact O-CD 3.3Å; L33-V55 HydrophobicContact CD2-CB 3.79Å; L33-V55 HydrophobicContact CD2-CG2 3.84Å
34	G	97.4	Very high	97.2	Very high	36 Å²	36	63.8 Å²	63.8	37%	0.371	34%	0.343	S	S	.	.			trans	-63.4	133.2	-176.5	0	0	0	0	0	111.3	S32 A36 I37 R38	S32-G34 PolarHBondContact OG-N 3.13Å; G34-A36 PolarHBondContact O-N 3Å; G34-I37 PolarHBondContact O-N 3.33Å; G34-R38 VanDerWaalsContact O-CG 3.31Å; G34-R38 WeakPolarHBondContact O-CG 3.31Å; G34-R38 PolarHBondContact O-N 3.4Å
35	E	97.1	Very high	96.9	Very high	146 Å²	146	64 Å²	64	68%	0.682	34%	0.336	S	S	*	.	H	α-helix	trans	-56.1	-50.5	-176.9	-176.8	168.1	-152.7	0	0	111.9	L33 I37 R38 E39	L33-E35 PolarHBondContact O-N 3.47Å; E35-I37 VanDerWaalsContact C-N 3.33Å; E35-I37 PolarHBondContact O-N 2.76Å; E35-R38 PolarHBondContact O-N 3.35Å; E35-R38 VanDerWaalsContact O-N 3.11Å; E35-E39 HydrophobicContact CG-CG 4.45Å; E35-E39 WeakPolarHBondContact O-CG 3.25Å; E35-E39 PolarHBondContact O-N 2.77Å
36	A	97.7	Very high	96.5	Very high	72 Å²	72	62.8 Å²	62.8	60%	0.595	33%	0.331	S	S	*	.	H	α-helix	trans	-57.4	-42.1	179.2	0	0	0	0	0	113.2	G34 E39 Q40	G34-A36 PolarHBondContact O-N 3Å; A36-E39 PolarHBondContact O-N 2.71Å; A36-Q40 WeakPolarHBondContact O-CB 3.21Å; A36-Q40 PolarHBondContact O-N 2.69Å
37	I	97.9	Very high	96	Very high	56 Å²	56	65.8 Å²	65.8	29%	0.287	35%	0.349	S	S	.	.	H	α-helix	trans	-66.6	-42.6	178.3	-62.8	-61.7	0	0	0	110.6	G34 E35 Q40 H41 V56 F58	G34-I37 PolarHBondContact O-N 3.33Å; E35-I37 VanDerWaalsContact C-N 3.33Å; E35-I37 PolarHBondContact O-N 2.76Å; I37-Q40 PolarHBondContact O-N 2.94Å; I37-H41 PolarHBondContact O-N 3.3Å; I37-H41 VanDerWaalsContact O-N 3.09Å; I37-H41 PolarHBondContact O-ND1 3.3Å; I37-V56 HydrophobicContact CG2-CB 4.15Å; I37-V56 HydrophobicContact CG2-CG1 4.48Å; I37-V56 HydrophobicContact CG2-CG2 4.03Å; I37-F58 HydrophobicContact CG2-CE2 4.39Å; I37-F58 HydrophobicContact CG2-CZ 3.94Å
38	R	98.1	Very high	95.6	Very high	66 Å²	66	67.3 Å²	67.3	25%	0.249	35%	0.349	C	S	.	.	H	α-helix	trans	-65.5	-41.1	177.4	-66.6	166.4	58.8	-164	-0.1	111.2	L33 G34 E35 H41 G42 P52 P53 D54 V56	L33-R38 WeakPolarHBondContact O-CD 3.3Å; G34-R38 VanDerWaalsContact O-CG 3.31Å; G34-R38 WeakPolarHBondContact O-CG 3.31Å; G34-R38 PolarHBondContact O-N 3.4Å; E35-R38 PolarHBondContact O-N 3.35Å; E35-R38 VanDerWaalsContact O-N 3.11Å; R38-H41 CarbonylContact O-C 3.56Å; R38-H41 PolarHBondContact O-N 2.77Å; R38-G42 PolarHBondContact O-N 3.06Å; R38-P52 HydrophobicContact CB-CB 4Å; R38-P53 HydrophobicContact CB-CG 4.48Å; R38-P53 PolarHBondContact NE-O 3.31Å; R38-P53 PolarHBondContact NH2-O 3.16Å; R38-P53 VanDerWaalsContact O-CD 3.24Å; R38-P53 WeakPolarHBondContact O-CD 3.26Å; R38-D54 PolarHBondContact NE-O 2.85Å; R38-V56 HydrophobicContact CG-CG2 4.13Å
39	E	97.3	Very high	95.2	Very high	94 Å²	94	70.4 Å²	70.4	44%	0.439	36%	0.356	S	S	.	.	H	α-helix	trans	-63.8	-41.8	175.8	-72.3	-172.9	155.8	0	0	112.4	E35 A36 H41 G42 C50 P52	E35-E39 HydrophobicContact CG-CG 4.45Å; E35-E39 WeakPolarHBondContact O-CG 3.25Å; E35-E39 PolarHBondContact O-N 2.77Å; A36-E39 PolarHBondContact O-N 2.71Å; E39-H41 VanDerWaalsContact C-N 3.26Å; E39-H41 PolarHBondContact O-N 2.95Å; E39-G42 PolarHBondContact O-N 3.19Å; E39-G42 VanDerWaalsContact O-N 3.11Å; E39-C50 PolarHBondContact O-SG 2.71Å; E39-C50 VanDerWaalsContact O-SG 3.42Å; E39-P52 HydrophobicContact CG-CG 3.98Å
40	Q	97.1	Very high	95.1	Very high	104 Å²	104	65.2 Å²	65.2	49%	0.486	33%	0.331	S	S	.	.	H	α-helix	trans	-60.7	-36.3	174.9	-175.4	-179.9	4.9	0	0	112.2	A36 I37 G42	A36-Q40 WeakPolarHBondContact O-CB 3.21Å; A36-Q40 PolarHBondContact O-N 2.69Å; I37-Q40 PolarHBondContact O-N 2.94Å; Q40-G42 VanDerWaalsContact C-N 3.33Å
41	H	98.1	Very high	95	Very high	7 Å²	7	68.4 Å²	68.4	3%	0.032	34%	0.341	C	S	.	.	T	Hydrogen-bonded Turn	trans	-92.7	10.7	177.9	-65.1	77.8	0	0	0	113.2	I37 R38 E39 V56 F58 F82 C100 S102	I37-H41 PolarHBondContact O-N 3.3Å; I37-H41 VanDerWaalsContact O-N 3.09Å; I37-H41 PolarHBondContact O-ND1 3.3Å; R38-H41 CarbonylContact O-C 3.56Å; R38-H41 PolarHBondContact O-N 2.77Å; E39-H41 VanDerWaalsContact C-N 3.26Å; E39-H41 PolarHBondContact O-N 2.95Å; H41-V56 HydrophobicContact CB-CG2 3.98Å; H41-F58 AromaticContact NE2-CE1 3.85Å; H41-F82 HydrophobicContact CB-CD2 4.3Å; H41-F82 HydrophobicContact CB-CE2 4.35Å; H41-F82 AromaticContact CD2-CD1 3.54Å; H41-F82 AromaticContact CD2-CE1 3.72Å; H41-F82 AromaticContact CD2-CG 3.73Å; H41-C100 HydrophobicContact CB-CB 4.5Å; H41-S102 PolarHBondContact NE2-OG 2.9Å
42	G	96.6	Very high	95	Very high	1 Å²	1	69.4 Å²	69.4	1%	0.01	35%	0.348	C	S	.	.	T	Hydrogen-bonded Turn	trans	-110.3	-0.3	-180	0	0	0	0	0	114.1	R38 E39 Q40 C50 R51	R38-G42 PolarHBondContact O-N 3.06Å; E39-G42 PolarHBondContact O-N 3.19Å; E39-G42 VanDerWaalsContact O-N 3.11Å; Q40-G42 VanDerWaalsContact C-N 3.33Å; G42-C50 WeakPolarHBondContact O-CA 3.17Å; G42-R51 WeakPolarHBondContact CA-O 3.35Å; G42-R51 PolarHBondContact O-N 3.42Å
43	K	94.7	Very high	95	Very high	120 Å²	120	68.2 Å²	68.2	52%	0.522	34%	0.34	S	S	.	.			trans	-141.8	152.6	179.7	67.2	-178.8	-176.6	174.8	0	110	C50 V92	K43-C50 HydrophobicContact CB-CB 4.04Å; K43-V92 VanDerWaalsContact C-CG2 3.41Å; K43-V92 WeakPolarHBondContact O-CG2 3.08Å
44	D	94.1	Very high	95	Very high	14 Å²	14	66.1 Å²	66.1	8%	0.075	33%	0.329	C	S	.	.			trans	-113.7	-160.6	164	52.8	20	0	0	0	108.8	S46 G85 G87 G90 G91 V92	D44-S46 PolarHBondContact O-N 2.78Å; D44-S46 WeakPolarHBondContact OD1-CB 3.34Å; D44-S46 PolarHBondContact OD1-N 3.24Å; D44-S46 VanDerWaalsContact OD1-N 3.11Å; D44-S46 PolarHBondContact OD1-OG 3.46Å; D44-G85 VanDerWaalsContact CA-O 3.24Å; D44-G85 WeakPolarHBondContact CA-O 3.5Å; D44-G85 WeakPolarHBondContact CB-O 3.15Å; D44-G87 VanDerWaalsContact CB-O 3.23Å; D44-G87 WeakPolarHBondContact CB-O 3.37Å; D44-G87 VanDerWaalsContact CG-O 3.29Å; D44-G90 VanDerWaalsContact OD2-C 3.31Å; D44-G90 WeakPolarHBondContact OD2-CA 3.38Å; D44-G90 PolarHBondContact OD2-N 3.37Å; D44-G91 PolarHBondContact OD2-N 3.48Å; D44-G91 VanDerWaalsContact OD2-N 3.08Å; D44-V92 HydrophobicContact CB-CG2 3.66Å
45	E	91.8	Very high	95.1	Very high	119 Å²	119	64.4 Å²	64.4	56%	0.556	31%	0.312	S	S	*	.	S	Bend	trans	-79.1	-0.1	179.9	-63.4	-61.9	153.3	0	0	112.8	G87 L88	E45-G87 PolarHBondContact N-O 2.84Å; E45-L88 HydrophobicContact CB-CD2 3.76Å
46	S	89.9	Confident	95.1	Very high	19 Å²	19	57.5 Å²	57.5	13%	0.133	28%	0.279	C	S	.	.	S	Bend	trans	-69.5	166.5	176.1	76.4	0	0	0	0	113	D44 H48 L88	D44-S46 PolarHBondContact O-N 2.78Å; D44-S46 WeakPolarHBondContact OD1-CB 3.34Å; D44-S46 PolarHBondContact OD1-N 3.24Å; D44-S46 VanDerWaalsContact OD1-N 3.11Å; D44-S46 PolarHBondContact OD1-OG 3.46Å; S46-H48 PolarHBondContact O-N 2.86Å; S46-H48 WeakPolarHBondContact OG-CB 3.31Å; S46-H48 PolarHBondContact OG-CD2 2.92Å; S46-H48 PolarHBondContact OG-N 2.75Å; S46-L88 WeakPolarHBondContact CB-O 3.36Å
47	V	86.1	Confident	95.2	Very high	62 Å²	62	54 Å²	54	38%	0.376	25%	0.251	S	S	.	.	S	Bend	trans	-79.2	-3	171.9	-58.7	0	0	0	0	113.5	R49 Y351	V47-R49 PolarHBondContact O-N 2.94Å; V47-Y351 HydrophobicContact CB-CD2 4.11Å; V47-Y351 HydrophobicContact CB-CE2 4.45Å; V47-Y351 HydrophobicContact CG1-CD2 3.57Å; V47-Y351 HydrophobicContact CG1-CE2 4.35Å; V47-Y351 HydrophobicContact CG1-CG 4.17Å; V47-Y351 HydrophobicContact CG2-CD2 3.44Å; V47-Y351 VanDerWaalsContact CG2-CD2 3.44Å; V47-Y351 HydrophobicContact CG2-CE2 3.33Å
48	H	88.9	Confident	95.2	Very high	60 Å²	60	53 Å²	53	28%	0.278	24%	0.244	S	C	.	.	S	Bend	trans	-63.5	139.5	-178.9	-66.6	-66.6	0	0	0	110.7	S46 C50 E89	S46-H48 PolarHBondContact O-N 2.86Å; S46-H48 WeakPolarHBondContact OG-CB 3.31Å; S46-H48 PolarHBondContact OG-CD2 2.92Å; S46-H48 PolarHBondContact OG-N 2.75Å; H48-C50 PolarHBondContact O-N 2.78Å; H48-E89 VanDerWaalsContact CD2-C 3.49Å
49	R	90	Very high	95.3	Very high	216 Å²	216	49.9 Å²	49.9	82%	0.815	23%	0.232	S	C	*	.	P	Polyproline II helix	trans	-54.6	132.1	177	-179	-179.2	176.9	175.5	4.4	110.1	V47 R51	V47-R49 PolarHBondContact O-N 2.94Å; R49-R51 WeakPolarHBondContact O-CG 3.37Å; R49-R51 PolarHBondContact O-N 2.9Å
50	C	94.4	Very high	95.3	Very high	41 Å²	41	51.7 Å²	51.7	28%	0.277	24%	0.235	S	C	.	.	P	Polyproline II helix	trans	-52.1	127.5	172.1	-178.7	0	0	0	0	111.2	E39 G42 K43 H48	E39-C50 PolarHBondContact O-SG 2.71Å; E39-C50 VanDerWaalsContact O-SG 3.42Å; G42-C50 WeakPolarHBondContact O-CA 3.17Å; K43-C50 HydrophobicContact CB-CB 4.04Å; H48-C50 PolarHBondContact O-N 2.78Å
51	R	95.9	Very high	95.4	Very high	93 Å²	93	48.6 Å²	48.6	35%	0.351	23%	0.225	S	C	.	.			trans	-124.4	86.7	175.4	-64.3	-178.1	-171.1	-172.9	-0.6	108.2	G42 R49 A94 V95	G42-R51 WeakPolarHBondContact CA-O 3.35Å; G42-R51 PolarHBondContact O-N 3.42Å; R49-R51 WeakPolarHBondContact O-CG 3.37Å; R49-R51 PolarHBondContact O-N 2.9Å; R51-A94 WeakPolarHBondContact O-CB 3.26Å; R51-A94 PolarHBondContact O-N 2.9Å; R51-V95 VanDerWaalsContact NH1-CG1 3.27Å; R51-V95 VanDerWaalsContact NH1-CG2 3.26Å
52	P	97.3	Very high	95.4	Very high	36 Å²	36	48.8 Å²	48.8	23%	0.234	23%	0.226	C	C	.	.			trans	-61	139.9	-178.8	-22.5	33.3	0	0	0	112	R38 E39	R38-P52 HydrophobicContact CB-CB 4Å; E39-P52 HydrophobicContact CG-CG 3.98Å
53	P	97.5	Very high	95.5	Very high	1 Å²	1	54.8 Å²	54.8	1%	0.006	25%	0.254	C	S	.	.			trans	-65.8	171.6	168.3	32.6	-36.3	0	0	0	110.2	R38 V56 A94 C100	R38-P53 HydrophobicContact CB-CG 4.48Å; R38-P53 PolarHBondContact NE-O 3.31Å; R38-P53 PolarHBondContact NH2-O 3.16Å; R38-P53 VanDerWaalsContact O-CD 3.24Å; R38-P53 WeakPolarHBondContact O-CD 3.26Å; P53-V56 HydrophobicContact CG-CG2 3.84Å; P53-A94 HydrophobicContact CB-CB 3.95Å; P53-C100 HydrophobicContact CB-CB 3.73Å; P53-C100 HydrophobicContact CG-CB 3.56Å
54	D	97.7	Very high	95.7	Very high	26 Å²	26	50.1 Å²	50.1	14%	0.139	23%	0.234	C	C	.	.	S	Bend	trans	-78.7	-33.1	175.1	-66.4	-53.4	0	0	0	111.9	V15 R38 G98	V15-D54 HydrophobicContact CB-CB 4.46Å; V15-D54 HydrophobicContact CG1-CB 4.45Å; V15-D54 HydrophobicContact CG2-CB 3.78Å; R38-D54 PolarHBondContact NE-O 2.85Å; D54-G98 WeakPolarHBondContact CB-O 3.28Å; D54-G98 PolarHBondContact N-O 2.99Å; D54-G98 PolarHBondContact OD2-N 3.43Å
55	V	98.3	Very high	95.9	Very high	0 Å²	0	49.4 Å²	49.4	0%	0	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.7	148.8	178	58.9	0	0	0	0	109.9	V15 L19 F22 V31 S32 L33 G98 V99 C100	V15-V55 HydrophobicContact CG1-CB 4.07Å; V15-V55 HydrophobicContact CG1-CG1 3.76Å; L19-V55 HydrophobicContact CD2-CG2 4.16Å; F22-V55 HydrophobicContact CE2-CG1 4.1Å; V31-V55 HydrophobicContact CG1-CG2 3.69Å; S32-V55 WeakPolarHBondContact O-CG2 3.36Å; L33-V55 HydrophobicContact CD2-CB 3.79Å; L33-V55 HydrophobicContact CD2-CG2 3.84Å; V55-G98 PolarHBondContact N-O 3.09Å; V55-V99 HydrophobicContact CG1-CB 4.18Å; V55-V99 HydrophobicContact CG1-CG1 4.05Å; V55-V99 HydrophobicContact CG1-CG2 3.73Å; V55-C100 PolarHBondContact O-N 3.11Å
56	V	98.8	Very high	96.3	Very high	0 Å²	0	45.2 Å²	45.2	0%	0	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	130.5	171.7	-171.1	0	0	0	0	108.8	S32 I37 R38 H41 P53 F58 C100	S32-V56 PolarHBondContact N-O 3.32Å; S32-V56 PolarHBondContact O-N 3.41Å; I37-V56 HydrophobicContact CG2-CB 4.15Å; I37-V56 HydrophobicContact CG2-CG1 4.48Å; I37-V56 HydrophobicContact CG2-CG2 4.03Å; R38-V56 HydrophobicContact CG-CG2 4.13Å; H41-V56 HydrophobicContact CB-CG2 3.98Å; P53-V56 HydrophobicContact CG-CG2 3.84Å; V56-F58 HydrophobicContact CB-CE2 4.12Å; V56-F58 HydrophobicContact CB-CZ 4.25Å; V56-F58 HydrophobicContact CG1-CD2 4.44Å; V56-F58 HydrophobicContact CG1-CE1 4.1Å; V56-F58 HydrophobicContact CG1-CE2 3.72Å; V56-F58 HydrophobicContact CG1-CZ 3.52Å; V56-C100 WeakPolarHBondContact CA-O 3.33Å; V56-C100 HydrophobicContact CG1-CB 4.39Å; V56-C100 HydrophobicContact CG2-CB 4.25Å
57	V	98.8	Very high	96.7	Very high	0 Å²	0	46 Å²	46	0%	0	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	144.3	175.1	-65.7	0	0	0	0	109.6	F22 N30 V31 P59 L68 V99 C100 F101 S102	F22-V57 HydrophobicContact CB-CG1 4.39Å; F22-V57 HydrophobicContact CD2-CG1 4.02Å; F22-V57 HydrophobicContact CG-CG1 4.27Å; N30-V57 CarbonylContact O-C 3.56Å; N30-V57 WeakPolarHBondContact O-CA 3.37Å; V31-V57 HydrophobicContact CG1-CG1 4.48Å; V31-V57 HydrophobicContact CG2-CG1 4.31Å; V57-P59 VanDerWaalsContact C-CD 3.46Å; V57-P59 VanDerWaalsContact O-CD 3.31Å; V57-P59 WeakPolarHBondContact O-CD 3.41Å; V57-L68 HydrophobicContact CB-CD1 4.16Å; V57-L68 HydrophobicContact CG1-CD2 4.48Å; V57-L68 HydrophobicContact CG2-CD1 3.97Å; V57-V99 HydrophobicContact CG1-CG1 4.07Å; V57-V99 HydrophobicContact CG2-CG1 3.73Å; V57-C100 WeakPolarHBondContact CG2-O 3.21Å; V57-C100 PolarHBondContact N-O 3.41Å; V57-F101 HydrophobicContact CG2-CB 4.44Å; V57-F101 HydrophobicContact CG2-CD1 4.16Å; V57-F101 HydrophobicContact CG2-CD2 3.96Å; V57-F101 HydrophobicContact CG2-CE1 4.47Å; V57-F101 HydrophobicContact CG2-CE2 4.25Å; V57-F101 HydrophobicContact CG2-CG 3.9Å; V57-F101 HydrophobicContact CG2-CZ 4.5Å; V57-S102 PolarHBondContact O-N 3.43Å
58	F	98.7	Very high	97.3	Very high	34 Å²	34	43 Å²	43	15%	0.149	20%	0.204	C	C	.	.			trans	-121	71.2	-176.3	-59.9	-91.4	0	0	0	110.6	N30 I37 H41 V56 S102	N30-F58 HydrophobicContact CB-CB 4.05Å; N30-F58 WeakPolarHBondContact CB-O 3.48Å; N30-F58 PolarHBondContact O-N 2.85Å; I37-F58 HydrophobicContact CG2-CE2 4.39Å; I37-F58 HydrophobicContact CG2-CZ 3.94Å; H41-F58 AromaticContact NE2-CE1 3.85Å; V56-F58 HydrophobicContact CB-CE2 4.12Å; V56-F58 HydrophobicContact CB-CZ 4.25Å; V56-F58 HydrophobicContact CG1-CD2 4.44Å; V56-F58 HydrophobicContact CG1-CE1 4.1Å; V56-F58 HydrophobicContact CG1-CE2 3.72Å; V56-F58 HydrophobicContact CG1-CZ 3.52Å; F58-S102 VanDerWaalsContact CD1-CB 3.48Å; F58-S102 VanDerWaalsContact CE1-CB 3.48Å; F58-S102 WeakPolarHBondContact CE1-OG 3.14Å
59	P	98.6	Very high	97.8	Very high	0 Å²	0	40.2 Å²	40.2	0%	0	19%	0.191	C	C	.	.			trans	-63.7	153.6	177.3	29	-34.9	0	0	0	111.4	V57 E64 V65 L68 L103	V57-P59 VanDerWaalsContact C-CD 3.46Å; V57-P59 VanDerWaalsContact O-CD 3.31Å; V57-P59 WeakPolarHBondContact O-CD 3.41Å; P59-E64 VanDerWaalsContact CA-OE2 3.28Å; P59-E64 WeakPolarHBondContact CA-OE2 3.3Å; P59-E64 HydrophobicContact CB-CB 3.85Å; P59-V65 HydrophobicContact CB-CG2 3.69Å; P59-V65 HydrophobicContact CG-CG2 3.6Å; P59-L68 HydrophobicContact CB-CD1 4.01Å; P59-L68 HydrophobicContact CG-CD1 4.39Å; P59-L103 HydrophobicContact CG-CD2 4.28Å
60	R	98.3	Very high	98.2	Very high	132 Å²	132	35.2 Å²	35.2	50%	0.498	18%	0.175	S	C	.	.			trans	-118.1	-5.7	-176	-63.3	172.1	-64.2	174.5	5.3	113.8	E64 N105	R60-E64 IonicContact CZ-OE1 3.83Å; R60-E64 PolarHBondContact N-OE2 3.04Å; R60-E64 IonicContact NE-OE1 3.45Å; R60-E64 PolarHBondContact NE-OE1 2.98Å; R60-E64 IonicContact NE-OE2 3.96Å; R60-E64 IonicContact NH2-OE1 3.18Å; R60-E64 PolarHBondContact NH2-OE1 2.89Å; R60-N105 HydrophobicContact CG-CB 4.27Å
61	C	98.5	Very high	98.4	Very high	39 Å²	39	34.3 Å²	34.3	26%	0.264	17%	0.168	S	C	.	.	S	Bend	trans	-155.7	166.7	174.6	69.2	0	0	0	0	110.9	E63 E64 V65	C61-E63 WeakPolarHBondContact CB-OE2 3.4Å; C61-E63 PolarHBondContact O-N 3.45Å; C61-E63 PolarHBondContact SG-OE2 3.19Å; C61-E64 PolarHBondContact O-N 3.2Å; C61-V65 WeakPolarHBondContact O-CG2 3.34Å; C61-V65 PolarHBondContact O-N 3.4Å; C61-V65 VanDerWaalsContact O-N 3.13Å
62	V	98.7	Very high	98.5	Very high	12 Å²	12	29.9 Å²	29.9	7%	0.073	15%	0.152	C	C	.	.	H	α-helix	trans	-61.6	-31.2	-178.7	64.2	0	0	0	0	112.6	V65 S66 E178 V180 V186 T220	V62-V65 PolarHBondContact O-N 3.14Å; V62-S66 VanDerWaalsContact O-CB 3.26Å; V62-S66 WeakPolarHBondContact O-CB 3.28Å; V62-S66 PolarHBondContact O-N 2.81Å; V62-E178 WeakPolarHBondContact CB-OE1 3.44Å; V62-E178 VanDerWaalsContact CG2-OE1 3.31Å; V62-E178 WeakPolarHBondContact CG2-OE1 3.38Å; V62-V180 HydrophobicContact CG2-CG2 3.82Å; V62-V186 HydrophobicContact CG2-CG1 4.05Å; V62-V186 HydrophobicContact CG2-CG2 3.91Å; V62-T220 HydrophobicContact CG2-CG2 4.18Å; V62-T220 WeakPolarHBondContact CG2-OG1 3.41Å
63	E	98.8	Very high	98.5	Very high	126 Å²	126	29.5 Å²	29.5	59%	0.589	15%	0.146	S	C	*	.	H	α-helix	trans	-65.7	-42.4	177.3	-63.3	71.6	-156.8	0	0	111.5	C61 S66 A67	C61-E63 WeakPolarHBondContact CB-OE2 3.4Å; C61-E63 PolarHBondContact O-N 3.45Å; C61-E63 PolarHBondContact SG-OE2 3.19Å; E63-S66 PolarHBondContact O-N 3.23Å; E63-A67 WeakPolarHBondContact O-CB 3.5Å; E63-A67 PolarHBondContact O-N 3.26Å
64	E	98.8	Very high	98.5	Very high	22 Å²	22	33.4 Å²	33.4	10%	0.103	17%	0.167	C	C	.	.	H	α-helix	trans	-64.7	-44.1	174.2	-71.3	-178.6	177.8	0	0	110.4	I25 C26 P59 R60 C61 S66 A67 L68	I25-E64 HydrophobicContact CG2-CB 4.17Å; I25-E64 HydrophobicContact CG2-CG 4.27Å; C26-E64 HydrophobicContact CB-CG 4.46Å; P59-E64 VanDerWaalsContact CA-OE2 3.28Å; P59-E64 WeakPolarHBondContact CA-OE2 3.3Å; P59-E64 HydrophobicContact CB-CB 3.85Å; R60-E64 IonicContact CZ-OE1 3.83Å; R60-E64 PolarHBondContact N-OE2 3.04Å; R60-E64 IonicContact NE-OE1 3.45Å; R60-E64 PolarHBondContact NE-OE1 2.98Å; R60-E64 IonicContact NE-OE2 3.96Å; R60-E64 IonicContact NH2-OE1 3.18Å; R60-E64 PolarHBondContact NH2-OE1 2.89Å; C61-E64 PolarHBondContact O-N 3.2Å; E64-S66 PolarHBondContact O-N 3.05Å; E64-A67 PolarHBondContact O-N 2.82Å; E64-L68 WeakPolarHBondContact O-CB 3.38Å; E64-L68 WeakPolarHBondContact O-CD1 3.41Å; E64-L68 WeakPolarHBondContact O-CG 3.26Å; E64-L68 PolarHBondContact O-N 3.35Å
65	V	98.9	Very high	98.5	Very high	0 Å²	0	36.3 Å²	36.3	0%	0	18%	0.18	C	C	.	.	H	α-helix	trans	-58.6	-48.5	176.2	-179.4	0	0	0	0	111	P59 C61 V62 L68 A69 F101 L103 M106 V180 I218 T220	P59-V65 HydrophobicContact CB-CG2 3.69Å; P59-V65 HydrophobicContact CG-CG2 3.6Å; C61-V65 WeakPolarHBondContact O-CG2 3.34Å; C61-V65 PolarHBondContact O-N 3.4Å; C61-V65 VanDerWaalsContact O-N 3.13Å; V62-V65 PolarHBondContact O-N 3.14Å; V65-L68 PolarHBondContact O-N 3.24Å; V65-A69 VanDerWaalsContact O-CB 3.28Å; V65-A69 WeakPolarHBondContact O-CB 3.35Å; V65-A69 PolarHBondContact O-N 2.64Å; V65-F101 HydrophobicContact CG1-CD1 4.23Å; V65-F101 HydrophobicContact CG1-CE1 4.41Å; V65-L103 HydrophobicContact CG2-CD2 4.15Å; V65-M106 HydrophobicContact CG2-SD 3.79Å; V65-V180 HydrophobicContact CB-CG2 4.21Å; V65-V180 HydrophobicContact CG1-CB 3.95Å; V65-V180 HydrophobicContact CG1-CG1 4.12Å; V65-V180 HydrophobicContact CG1-CG2 3.75Å; V65-I218 HydrophobicContact CG1-CB 4.28Å; V65-I218 HydrophobicContact CG1-CD1 3.6Å; V65-I218 HydrophobicContact CG1-CG2 4.05Å; V65-T220 HydrophobicContact CB-CG2 4.15Å; V65-T220 HydrophobicContact CG1-CG2 3.94Å; V65-T220 HydrophobicContact CG2-CG2 4.04Å
66	S	98.9	Very high	98.4	Very high	31 Å²	31	40.9 Å²	40.9	22%	0.217	20%	0.204	C	C	.	.	H	α-helix	trans	-58.8	-48.9	178.3	172.1	0	0	0	0	112	V62 E63 E64 A69 K70 G184	V62-S66 VanDerWaalsContact O-CB 3.26Å; V62-S66 WeakPolarHBondContact O-CB 3.28Å; V62-S66 PolarHBondContact O-N 2.81Å; E63-S66 PolarHBondContact O-N 3.23Å; E64-S66 PolarHBondContact O-N 3.05Å; S66-A69 PolarHBondContact O-N 2.84Å; S66-K70 PolarHBondContact O-N 3.42Å; S66-G184 WeakPolarHBondContact CB-O 3.43Å; S66-G184 WeakPolarHBondContact O-CA 3.15Å; S66-G184 PolarHBondContact OG-O 3.22Å
67	A	98.9	Very high	98.3	Very high	35 Å²	35	41 Å²	41	29%	0.289	21%	0.205	S	C	.	.	H	α-helix	trans	-65.6	-42.5	-180	0	0	0	0	0	112.3	I25 E63 E64 K70 V71	I25-A67 HydrophobicContact CD1-CB 3.99Å; I25-A67 HydrophobicContact CG1-CB 4.22Å; I25-A67 HydrophobicContact CG2-CB 3.84Å; E63-A67 WeakPolarHBondContact O-CB 3.5Å; E63-A67 PolarHBondContact O-N 3.26Å; E64-A67 PolarHBondContact O-N 2.82Å; A67-K70 WeakPolarHBondContact O-CB 3.25Å; A67-K70 PolarHBondContact O-N 3.44Å; A67-V71 WeakPolarHBondContact O-CG2 3.32Å; A67-V71 PolarHBondContact O-N 2.76Å; A67-V71 VanDerWaalsContact O-N 3.08Å
68	L	98.8	Very high	98.3	Very high	0 Å²	0	41.5 Å²	41.5	0%	0	21%	0.208	C	C	.	.	H	α-helix	trans	-63.7	-43	175.6	-70.9	167.9	0	0	0	111.6	F22 I25 C26 V57 P59 E64 V65 K70 V71 C72 F101	F22-L68 HydrophobicContact CB-CD2 3.99Å; F22-L68 HydrophobicContact CD1-CD2 3.32Å; F22-L68 HydrophobicContact CE1-CD2 3.96Å; F22-L68 HydrophobicContact CG-CD2 3.85Å; I25-L68 HydrophobicContact CB-CD2 4.16Å; I25-L68 HydrophobicContact CB-CG 4.46Å; I25-L68 HydrophobicContact CD1-CD2 4.11Å; I25-L68 HydrophobicContact CG2-CD2 4.14Å; I25-L68 HydrophobicContact CG2-CG 3.88Å; C26-L68 HydrophobicContact CB-CD1 4.41Å; V57-L68 HydrophobicContact CB-CD1 4.16Å; V57-L68 HydrophobicContact CG1-CD2 4.48Å; V57-L68 HydrophobicContact CG2-CD1 3.97Å; P59-L68 HydrophobicContact CB-CD1 4.01Å; P59-L68 HydrophobicContact CG-CD1 4.39Å; E64-L68 WeakPolarHBondContact O-CB 3.38Å; E64-L68 WeakPolarHBondContact O-CD1 3.41Å; E64-L68 WeakPolarHBondContact O-CG 3.26Å; E64-L68 PolarHBondContact O-N 3.35Å; V65-L68 PolarHBondContact O-N 3.24Å; L68-K70 VanDerWaalsContact C-N 3.32Å; L68-K70 PolarHBondContact O-N 3.45Å; L68-V71 PolarHBondContact O-N 3.06Å; L68-C72 PolarHBondContact O-N 3.12Å; L68-C72 PolarHBondContact O-SG 2.92Å; L68-F101 HydrophobicContact CB-CE1 3.44Å; L68-F101 VanDerWaalsContact CB-CE1 3.44Å; L68-F101 HydrophobicContact CB-CZ 3.63Å; L68-F101 HydrophobicContact CD1-CE1 4.25Å; L68-F101 HydrophobicContact CG-CE1 4.49Å
69	A	98.8	Very high	98.3	Very high	0 Å²	0	39.9 Å²	39.9	0%	0	20%	0.201	C	C	.	.	H	α-helix	trans	-62.5	-39.3	176.4	0	0	0	0	0	111.5	V65 S66 C72 H73 I79 V180	V65-A69 VanDerWaalsContact O-CB 3.28Å; V65-A69 WeakPolarHBondContact O-CB 3.35Å; V65-A69 PolarHBondContact O-N 2.64Å; S66-A69 PolarHBondContact O-N 2.84Å; A69-C72 WeakPolarHBondContact O-CB 3.42Å; A69-C72 PolarHBondContact O-N 2.81Å; A69-H73 WeakPolarHBondContact O-CB 3.27Å; A69-H73 PolarHBondContact O-N 3.41Å; A69-I79 HydrophobicContact CB-CD1 4.14Å; A69-V180 HydrophobicContact CB-CG1 3.91Å
70	K	98.8	Very high	98.3	Very high	111 Å²	111	40 Å²	40	48%	0.483	20%	0.202	S	C	.	.	H	α-helix	trans	-60.7	-45	173.2	-176.7	177.1	174.9	57	0	112.4	S66 A67 L68 C72 H73 D74	S66-K70 PolarHBondContact O-N 3.42Å; A67-K70 WeakPolarHBondContact O-CB 3.25Å; A67-K70 PolarHBondContact O-N 3.44Å; L68-K70 VanDerWaalsContact C-N 3.32Å; L68-K70 PolarHBondContact O-N 3.45Å; K70-C72 VanDerWaalsContact C-N 3.32Å; K70-C72 PolarHBondContact O-N 2.96Å; K70-H73 VanDerWaalsContact O-CB 3.32Å; K70-H73 WeakPolarHBondContact O-CB 3.21Å; K70-H73 PolarHBondContact O-N 2.86Å; K70-D74 IonicContact NZ-OD2 2.76Å; K70-D74 VanDerWaalsContact O-CG 3.3Å; K70-D74 PolarHBondContact O-N 2.9Å
71	V	98.6	Very high	98.3	Very high	23 Å²	23	34.8 Å²	34.8	14%	0.139	19%	0.185	C	C	.	.	H	α-helix	trans	-61.8	-42.9	175.3	173.5	0	0	0	0	110.7	V18 A21 F22 I25 A67 L68 H73 D74 H75	V18-V71 HydrophobicContact CB-CG1 3.82Å; V18-V71 HydrophobicContact CG1-CG1 3.83Å; A21-V71 HydrophobicContact CB-CG1 4.32Å; A21-V71 HydrophobicContact CB-CG2 4.31Å; F22-V71 HydrophobicContact CD1-CB 4.44Å; F22-V71 HydrophobicContact CD1-CG1 4.07Å; F22-V71 HydrophobicContact CE1-CB 3.85Å; F22-V71 HydrophobicContact CE1-CG1 3.47Å; F22-V71 VanDerWaalsContact CE1-CG1 3.47Å; F22-V71 HydrophobicContact CZ-CG1 4.25Å; I25-V71 HydrophobicContact CD1-CG2 3.82Å; A67-V71 WeakPolarHBondContact O-CG2 3.32Å; A67-V71 PolarHBondContact O-N 2.76Å; A67-V71 VanDerWaalsContact O-N 3.08Å; L68-V71 PolarHBondContact O-N 3.06Å; V71-H73 VanDerWaalsContact C-N 3.31Å; V71-H73 PolarHBondContact O-N 2.8Å; V71-D74 PolarHBondContact O-N 3.34Å; V71-H75 PolarHBondContact O-CD2 2.93Å; V71-H75 VanDerWaalsContact O-CD2 3.28Å; V71-H75 PolarHBondContact O-N 2.96Å; V71-H75 VanDerWaalsContact O-N 3.15Å
72	C	98.4	Very high	98.3	Very high	0 Å²	0	33.4 Å²	33.4	0%	0	17%	0.174	C	C	.	.	H	α-helix	trans	-61.2	-42	175.3	-64.8	0	0	0	0	111.6	L68 A69 K70 H75 N76 L77 I79	L68-C72 PolarHBondContact O-N 3.12Å; L68-C72 PolarHBondContact O-SG 2.92Å; A69-C72 WeakPolarHBondContact O-CB 3.42Å; A69-C72 PolarHBondContact O-N 2.81Å; K70-C72 VanDerWaalsContact C-N 3.32Å; K70-C72 PolarHBondContact O-N 2.96Å; C72-H75 CarbonylContact O-C 3.52Å; C72-H75 PolarHBondContact O-N 3.27Å; C72-N76 PolarHBondContact O-N 3.06Å; C72-L77 HydrophobicContact CB-CB 4.1Å; C72-L77 PolarHBondContact O-N 3.09Å; C72-I79 HydrophobicContact CB-CD1 3.74Å; C72-I79 HydrophobicContact CB-CG1 3.66Å
73	H	98.1	Very high	98.2	Very high	27 Å²	27	33.7 Å²	33.7	13%	0.125	18%	0.18	C	C	.	.	H	α-helix	trans	-57	-55.6	175.6	-170.2	83.2	0	0	0	111.9	A69 K70 V71 H75 N76 S182 R462 L464	A69-H73 WeakPolarHBondContact O-CB 3.27Å; A69-H73 PolarHBondContact O-N 3.41Å; K70-H73 VanDerWaalsContact O-CB 3.32Å; K70-H73 WeakPolarHBondContact O-CB 3.21Å; K70-H73 PolarHBondContact O-N 2.86Å; V71-H73 VanDerWaalsContact C-N 3.31Å; V71-H73 PolarHBondContact O-N 2.8Å; H73-H75 PolarHBondContact O-N 3.36Å; H73-N76 PolarHBondContact O-N 3.33Å; H73-N76 VanDerWaalsContact O-N 3.12Å; H73-S182 WeakPolarHBondContact CB-O 3.33Å; H73-S182 PolarHBondContact ND1-O 3.4Å; H73-R462 PolarHBondContact NE2-NE 2.91Å; H73-R462 PolarHBondContact O-NH1 2.95Å; H73-L464 HydrophobicContact CB-CD1 4.38Å
74	D	97.3	Very high	98.1	Very high	83 Å²	83	29 Å²	29	44%	0.444	16%	0.16	S	C	.	.	H	α-helix	trans	-62.1	-28.5	-174.9	-67.5	-19.7	0	0	0	111.9	K70 V71	K70-D74 IonicContact NZ-OD2 2.76Å; K70-D74 VanDerWaalsContact O-CG 3.3Å; K70-D74 PolarHBondContact O-N 2.9Å; V71-D74 PolarHBondContact O-N 3.34Å
75	H	96.9	Very high	98	Very high	87 Å²	87	28.5 Å²	28.5	40%	0.403	16%	0.161	S	C	.	.	H	α-helix	trans	-102.6	5.3	179.3	-70.5	-87.6	0	0	0	115.3	V18 V71 C72 H73 L77	V18-H75 HydrophobicContact CG1-CB 3.94Å; V18-H75 VanDerWaalsContact CG1-CD2 3.43Å; V18-H75 WeakPolarHBondContact CG1-CD2 3.35Å; V18-H75 VanDerWaalsContact CG1-CG 3.41Å; V71-H75 PolarHBondContact O-CD2 2.93Å; V71-H75 VanDerWaalsContact O-CD2 3.28Å; V71-H75 PolarHBondContact O-N 2.96Å; V71-H75 VanDerWaalsContact O-N 3.15Å; C72-H75 CarbonylContact O-C 3.52Å; C72-H75 PolarHBondContact O-N 3.27Å; H73-H75 PolarHBondContact O-N 3.36Å; H75-L77 VanDerWaalsContact C-N 3.32Å; H75-L77 HydrophobicContact CB-CD1 4.17Å; H75-L77 HydrophobicContact CB-CG 4.07Å; H75-L77 PolarHBondContact O-N 3Å
76	N	96.4	Very high	97.8	Very high	96 Å²	96	30.5 Å²	30.5	51%	0.513	17%	0.173	S	C	.	.	T	Hydrogen-bonded Turn	trans	55.2	42.3	-177.8	-54.8	-77.3	0	0	0	113.6	C72 H73 R462 L464	C72-N76 PolarHBondContact O-N 3.06Å; H73-N76 PolarHBondContact O-N 3.33Å; H73-N76 VanDerWaalsContact O-N 3.12Å; N76-R462 WeakPolarHBondContact OD1-CD 3.42Å; N76-R462 PolarHBondContact OD1-NH1 3.35Å; N76-L464 HydrophobicContact CB-CD2 4.45Å
77	L	97.4	Very high	97.6	Very high	2 Å²	2	30.4 Å²	30.4	1%	0.01	18%	0.177	C	C	.	.			trans	-94	128.9	177.2	-62.8	174.3	0	0	0	110.3	A14 V15 V18 F22 C72 H75 V99	A14-L77 HydrophobicContact CB-CD2 3.86Å; V15-L77 HydrophobicContact CG2-CD2 4.02Å; V18-L77 HydrophobicContact CB-CD1 4.43Å; V18-L77 HydrophobicContact CG1-CD1 4.16Å; V18-L77 HydrophobicContact CG2-CD1 3.51Å; F22-L77 HydrophobicContact CZ-CD1 4.35Å; C72-L77 HydrophobicContact CB-CB 4.1Å; C72-L77 PolarHBondContact O-N 3.09Å; H75-L77 VanDerWaalsContact C-N 3.32Å; H75-L77 HydrophobicContact CB-CD1 4.17Å; H75-L77 HydrophobicContact CB-CG 4.07Å; H75-L77 PolarHBondContact O-N 3Å; L77-V99 HydrophobicContact CB-CG2 4.33Å; L77-V99 HydrophobicContact CD1-CG2 4.26Å
78	P	97.9	Very high	97.4	Very high	12 Å²	12	30.6 Å²	30.6	8%	0.078	17%	0.173	C	C	.	.			trans	-57.9	144.5	170.2	-25.7	35.7	0	0	0	112.4	I80 K96 G98 V99 L464 P467	P78-I80 HydrophobicContact CB-CD1 4.38Å; P78-K96 HydrophobicContact CG-CB 4.11Å; P78-G98 WeakPolarHBondContact O-CA 3.25Å; P78-V99 PolarHBondContact O-N 3.12Å; P78-L464 CarbonylContact C-O 3.55Å; P78-L464 VanDerWaalsContact CA-O 3.29Å; P78-L464 WeakPolarHBondContact CA-O 3.41Å; P78-P467 HydrophobicContact CB-CG 3.88Å; P78-P467 HydrophobicContact CG-CG 4.34Å
79	I	98.7	Very high	97.2	Very high	0 Å²	0	31 Å²	31	0%	0	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	126.7	-179	-63.4	170.9	0	0	0	107.6	A69 C72 V99 F101 I218 L464 M465 N466	A69-I79 HydrophobicContact CB-CD1 4.14Å; C72-I79 HydrophobicContact CB-CD1 3.74Å; C72-I79 HydrophobicContact CB-CG1 3.66Å; I79-V99 WeakPolarHBondContact CA-O 3.19Å; I79-F101 HydrophobicContact CB-CE2 4.32Å; I79-F101 HydrophobicContact CG1-CE2 4.05Å; I79-F101 HydrophobicContact CG1-CZ 4.47Å; I79-F101 HydrophobicContact CG2-CD2 3.74Å; I79-F101 HydrophobicContact CG2-CE2 3.74Å; I79-F101 HydrophobicContact CG2-CG 4.37Å; I79-F101 HydrophobicContact CG2-CZ 4.33Å; I79-I218 HydrophobicContact CG2-CD1 3.86Å; I79-I218 HydrophobicContact CG2-CG1 4.21Å; I79-L464 PolarHBondContact N-O 3.33Å; I79-M465 HydrophobicContact CB-CE 4.08Å; I79-M465 HydrophobicContact CB-SD 3.93Å; I79-M465 HydrophobicContact CD1-CE 3.66Å; I79-M465 HydrophobicContact CG1-CE 4.48Å; I79-M465 HydrophobicContact CG2-CE 3.88Å; I79-M465 HydrophobicContact CG2-SD 3.59Å; I79-M465 VanDerWaalsContact CG2-SD 3.59Å; I79-N466 WeakPolarHBondContact O-CA 3.38Å; I79-N466 PolarHBondContact O-N 2.96Å
80	I	98.7	Very high	97	Very high	1 Å²	1	31.1 Å²	31.1	1%	0.005	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	105.6	177.3	-61.5	84.9	0	0	0	107.8	P78 V92 A94 G97 V99 C100 F101	P78-I80 HydrophobicContact CB-CD1 4.38Å; I80-V92 WeakPolarHBondContact CG2-O 3.14Å; I80-A94 HydrophobicContact CD1-CB 3.98Å; I80-A94 HydrophobicContact CG1-CB 4.17Å; I80-G97 WeakPolarHBondContact CD1-O 3.38Å; I80-V99 PolarHBondContact N-O 3.3Å; I80-C100 HydrophobicContact CB-CB 4.49Å; I80-C100 CarbonylContact O-C 3.53Å; I80-C100 WeakPolarHBondContact O-CA 3.4Å; I80-F101 PolarHBondContact O-N 3.21Å
81	P	98.5	Very high	96.8	Very high	23 Å²	23	26.6 Å²	26.6	15%	0.149	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.1	137.2	172.4	-15.9	30.3	0	0	0	110.4	I218 M465	P81-I218 HydrophobicContact CB-CG2 4.46Å; P81-I218 HydrophobicContact CG-CG1 4.13Å; P81-M465 HydrophobicContact CG-SD 4.27Å
82	F	98.6	Very high	96.7	Very high	10 Å²	10	26.4 Å²	26.4	4%	0.044	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135	120.2	179	-172.8	-78.5	0	0	0	111	H41 G85 V92 C100 F101 L103	H41-F82 HydrophobicContact CB-CD2 4.3Å; H41-F82 HydrophobicContact CB-CE2 4.35Å; H41-F82 AromaticContact CD2-CD1 3.54Å; H41-F82 AromaticContact CD2-CE1 3.72Å; H41-F82 AromaticContact CD2-CG 3.73Å; F82-G85 VanDerWaalsContact CZ-CA 3.49Å; F82-V92 HydrophobicContact CD2-CB 3.82Å; F82-V92 HydrophobicContact CD2-CG1 3.8Å; F82-V92 HydrophobicContact CD2-CG2 4.34Å; F82-V92 HydrophobicContact CE2-CB 4.11Å; F82-V92 HydrophobicContact CE2-CG1 4.13Å; F82-V92 HydrophobicContact CE2-CG2 4.12Å; F82-C100 WeakPolarHBondContact CB-SG 3.42Å; F82-F101 PolarHBondContact N-O 3.08Å; F82-L103 PolarHBondContact O-N 3.49Å
83	G	97.1	Very high	96.6	Very high	18 Å²	18	26.6 Å²	26.6	19%	0.186	16%	0.162	C	C	.	.	S	Bend	trans	-91.3	-109.7	172.3	0	0	0	0	0	111.4	R104	G83-R104 VanDerWaalsContact O-CD 3.26Å; G83-R104 WeakPolarHBondContact O-CD 3.34Å; G83-R104 WeakPolarHBondContact O-CG 3.32Å
84	T	96.1	Very high	96.6	Very high	28 Å²	28	25.5 Å²	25.5	17%	0.172	16%	0.157	C	C	.	.	S	Bend	trans	-97.6	-6.4	179	48.1	0	0	0	0	114.9	T86 T126 S150	T84-T86 VanDerWaalsContact C-N 3.35Å; T84-T86 PolarHBondContact OG1-OG1 3.47Å; T84-T126 HydrophobicContact CG2-CG2 4.09Å; T84-S150 PolarHBondContact OG1-N 2.9Å
85	G	95.6	Very high	96.4	Very high	11 Å²	11	23.4 Å²	23.4	11%	0.113	15%	0.147	C	C	.	.	S	Bend	trans	75.7	17.3	178.9	0	0	0	0	0	115	D44 F82 G87	D44-G85 VanDerWaalsContact CA-O 3.24Å; D44-G85 WeakPolarHBondContact CA-O 3.5Å; D44-G85 WeakPolarHBondContact CB-O 3.15Å; F82-G85 VanDerWaalsContact CZ-CA 3.49Å; G85-G87 PolarHBondContact O-N 3.44Å
86	T	95.2	Very high	96.3	Very high	43 Å²	43	25.2 Å²	25.2	26%	0.264	15%	0.154	S	C	.	.			trans	-91.4	12.4	-174.5	57.5	0	0	0	0	114.2	T84 A147	T84-T86 VanDerWaalsContact C-N 3.35Å; T84-T86 PolarHBondContact OG1-OG1 3.47Å; T86-A147 HydrophobicContact CG2-CB 4.18Å
87	G	94.8	Very high	96.2	Very high	29 Å²	29	21.2 Å²	21.2	30%	0.299	14%	0.135	S	C	.	.			trans	-71.8	164.7	179.2	0	0	0	0	0	112.9	D44 E45 G85	D44-G87 VanDerWaalsContact CB-O 3.23Å; D44-G87 WeakPolarHBondContact CB-O 3.37Å; D44-G87 VanDerWaalsContact CG-O 3.29Å; E45-G87 PolarHBondContact N-O 2.84Å; G85-G87 PolarHBondContact O-N 3.44Å
88	L	94	Very high	96.1	Very high	38 Å²	38	21.1 Å²	21.1	20%	0.199	14%	0.135	C	C	.	.	S	Bend	trans	-121.8	-1.3	-174	-68.2	170.9	0	0	0	114.5	E45 S46 H430	E45-L88 HydrophobicContact CB-CD2 3.76Å; S46-L88 WeakPolarHBondContact CB-O 3.36Å; L88-H430 HydrophobicContact CB-CB 4.35Å; L88-H430 WeakPolarHBondContact CD1-NE2 3.5Å
89	E	94.5	Very high	96.1	Very high	10 Å²	10	20.5 Å²	20.5	5%	0.047	13%	0.131	C	C	.	.	S	Bend	trans	-117.1	13.6	-174	-60.1	-66.3	161.2	0	0	113.2	H48 G91 H430 G431 G433 L434 K436	H48-E89 VanDerWaalsContact CD2-C 3.49Å; E89-G91 VanDerWaalsContact C-N 3.35Å; E89-G91 PolarHBondContact O-N 2.79Å; E89-H430 HydrophobicContact CG-CB 3.82Å; E89-G431 WeakPolarHBondContact CG-O 3.45Å; E89-G433 CarbonylContact O-C 3.57Å; E89-G433 WeakPolarHBondContact O-CA 3.15Å; E89-L434 PolarHBondContact O-N 3.41Å; E89-K436 WeakPolarHBondContact OE1-CE 3.29Å; E89-K436 IonicContact OE1-NZ 2.81Å; E89-K436 PolarHBondContact OE1-NZ 3.06Å
90	G	95.1	Very high	96.1	Very high	2 Å²	2	20.5 Å²	20.5	2%	0.021	13%	0.131	C	C	.	.			trans	76.8	20.5	177.2	0	0	0	0	0	114	D44 V92 G93 L434	D44-G90 VanDerWaalsContact OD2-C 3.31Å; D44-G90 WeakPolarHBondContact OD2-CA 3.38Å; D44-G90 PolarHBondContact OD2-N 3.37Å; G90-V92 PolarHBondContact O-N 3.19Å; G90-G93 PolarHBondContact O-N 3.2Å; G90-G93 VanDerWaalsContact O-N 3.11Å; G90-L434 WeakPolarHBondContact O-CD1 3.14Å
91	G	95.6	Very high	96.1	Very high	16 Å²	16	20.5 Å²	20.5	17%	0.165	13%	0.131	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.1	-28.4	-172.8	0	0	0	0	0	113.9	D44 E89 N466 K469	D44-G91 PolarHBondContact OD2-N 3.48Å; D44-G91 VanDerWaalsContact OD2-N 3.08Å; E89-G91 VanDerWaalsContact C-N 3.35Å; E89-G91 PolarHBondContact O-N 2.79Å; G91-N466 PolarHBondContact O-ND2 3.41Å; G91-N466 PolarHBondContact O-OD1 3.41Å; G91-K469 WeakPolarHBondContact O-CE 3.41Å
92	V	96.4	Very high	96.2	Very high	18 Å²	18	19.4 Å²	19.4	11%	0.109	12%	0.124	C	C	.	.	T	Hydrogen-bonded Turn	trans	-91.6	-6.5	-179.2	-56.5	0	0	0	0	114.1	K43 D44 I80 F82 G90 A94	K43-V92 VanDerWaalsContact C-CG2 3.41Å; K43-V92 WeakPolarHBondContact O-CG2 3.08Å; D44-V92 HydrophobicContact CB-CG2 3.66Å; I80-V92 WeakPolarHBondContact CG2-O 3.14Å; F82-V92 HydrophobicContact CD2-CB 3.82Å; F82-V92 HydrophobicContact CD2-CG1 3.8Å; F82-V92 HydrophobicContact CD2-CG2 4.34Å; F82-V92 HydrophobicContact CE2-CB 4.11Å; F82-V92 HydrophobicContact CE2-CG1 4.13Å; F82-V92 HydrophobicContact CE2-CG2 4.12Å; G90-V92 PolarHBondContact O-N 3.19Å; V92-A94 PolarHBondContact O-N 3.48Å
93	G	96.4	Very high	96.1	Very high	5 Å²	5	19.3 Å²	19.3	5%	0.052	12%	0.124	C	C	.	.			trans	-68	125.5	-178	0	0	0	0	0	112.4	G90 V95 K469	G90-G93 PolarHBondContact O-N 3.2Å; G90-G93 VanDerWaalsContact O-N 3.11Å; G93-V95 VanDerWaalsContact C-N 3.29Å; G93-V95 PolarHBondContact O-N 2.76Å; G93-K469 WeakPolarHBondContact O-CE 3.37Å; G93-K469 PolarHBondContact O-NZ 3.05Å
94	A	96.8	Very high	96.1	Very high	3 Å²	3	24 Å²	24	3%	0.025	14%	0.136	C	C	.	.			trans	-79.2	70.3	-178.9	0	0	0	0	0	112.4	R51 P53 I80 V92 K96 G97	R51-A94 WeakPolarHBondContact O-CB 3.26Å; R51-A94 PolarHBondContact O-N 2.9Å; P53-A94 HydrophobicContact CB-CB 3.95Å; I80-A94 HydrophobicContact CD1-CB 3.98Å; I80-A94 HydrophobicContact CG1-CB 4.17Å; V92-A94 PolarHBondContact O-N 3.48Å; A94-K96 PolarHBondContact O-N 3.22Å; A94-K96 VanDerWaalsContact O-N 3.1Å; A94-G97 PolarHBondContact O-N 2.84Å
95	V	94.1	Very high	96.1	Very high	39 Å²	39	26.1 Å²	26.1	24%	0.236	15%	0.146	C	C	.	.	T	Hydrogen-bonded Turn	trans	-50.8	-37.7	-177.2	179.2	0	0	0	0	113.7	R51 G93 L434	R51-V95 VanDerWaalsContact NH1-CG1 3.27Å; R51-V95 VanDerWaalsContact NH1-CG2 3.26Å; G93-V95 VanDerWaalsContact C-N 3.29Å; G93-V95 PolarHBondContact O-N 2.76Å; V95-L434 HydrophobicContact CG2-CD1 4.28Å; V95-L434 HydrophobicContact CG2-CD2 3.61Å
96	K	93.8	Very high	96.2	Very high	125 Å²	125	25.6 Å²	25.6	54%	0.543	14%	0.141	S	C	.	.	T	Hydrogen-bonded Turn	trans	-107.7	19.4	-179.1	-58.6	-63.9	-175	176.3	0	112.2	Q11 P78 A94 P467	Q11-K96 VanDerWaalsContact CD-O 3.25Å; Q11-K96 PolarHBondContact NE2-O 3.44Å; Q11-K96 PolarHBondContact OE1-O 2.88Å; P78-K96 HydrophobicContact CG-CB 4.11Å; A94-K96 PolarHBondContact O-N 3.22Å; A94-K96 VanDerWaalsContact O-N 3.1Å; K96-P467 HydrophobicContact CB-CG 4.09Å; K96-P467 HydrophobicContact CG-CB 4.27Å; K96-P467 HydrophobicContact CG-CG 4Å
97	G	94.3	Very high	96.4	Very high	12 Å²	12	27.8 Å²	27.8	12%	0.124	15%	0.151	C	C	.	.			trans	64.2	-150.4	-169.5	0	0	0	0	0	111.4	I80 A94	I80-G97 WeakPolarHBondContact CD1-O 3.38Å; A94-G97 PolarHBondContact O-N 2.84Å
98	G	96.3	Very high	96.6	Very high	0 Å²	0	31.6 Å²	31.6	0%	0	16%	0.161	C	C	.	.			trans	99.2	-153.9	176.6	0	0	0	0	0	114.2	D54 V55 P78	D54-G98 WeakPolarHBondContact CB-O 3.28Å; D54-G98 PolarHBondContact N-O 2.99Å; D54-G98 PolarHBondContact OD2-N 3.43Å; V55-G98 PolarHBondContact N-O 3.09Å; P78-G98 WeakPolarHBondContact O-CA 3.25Å
99	V	98.6	Very high	96.8	Very high	0 Å²	0	31.6 Å²	31.6	0%	0	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110	120.7	-169.1	-175.9	0	0	0	0	109.2	F22 V55 V57 L77 P78 I79 I80 F101	F22-V99 HydrophobicContact CE2-CG1 4.2Å; F22-V99 HydrophobicContact CE2-CG2 3.76Å; F22-V99 HydrophobicContact CZ-CG1 4.36Å; F22-V99 HydrophobicContact CZ-CG2 3.81Å; V55-V99 HydrophobicContact CG1-CB 4.18Å; V55-V99 HydrophobicContact CG1-CG1 4.05Å; V55-V99 HydrophobicContact CG1-CG2 3.73Å; V57-V99 HydrophobicContact CG1-CG1 4.07Å; V57-V99 HydrophobicContact CG2-CG1 3.73Å; L77-V99 HydrophobicContact CB-CG2 4.33Å; L77-V99 HydrophobicContact CD1-CG2 4.26Å; P78-V99 PolarHBondContact O-N 3.12Å; I79-V99 WeakPolarHBondContact CA-O 3.19Å; I80-V99 PolarHBondContact N-O 3.3Å; V99-F101 HydrophobicContact CB-CD2 4.34Å; V99-F101 HydrophobicContact CB-CE2 3.9Å; V99-F101 HydrophobicContact CG1-CD2 3.8Å; V99-F101 HydrophobicContact CG1-CE2 3.48Å; V99-F101 VanDerWaalsContact CG1-CE2 3.48Å; V99-F101 HydrophobicContact CG1-CZ 4.4Å
100	C	98.7	Very high	96.9	Very high	0 Å²	0	34.2 Å²	34.2	0%	0	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.5	126.2	170.2	177.5	0	0	0	0	110	H41 P53 V55 V56 V57 I80 F82	H41-C100 HydrophobicContact CB-CB 4.5Å; P53-C100 HydrophobicContact CB-CB 3.73Å; P53-C100 HydrophobicContact CG-CB 3.56Å; V55-C100 PolarHBondContact O-N 3.11Å; V56-C100 WeakPolarHBondContact CA-O 3.33Å; V56-C100 HydrophobicContact CG1-CB 4.39Å; V56-C100 HydrophobicContact CG2-CB 4.25Å; V57-C100 WeakPolarHBondContact CG2-O 3.21Å; V57-C100 PolarHBondContact N-O 3.41Å; I80-C100 HydrophobicContact CB-CB 4.49Å; I80-C100 CarbonylContact O-C 3.53Å; I80-C100 WeakPolarHBondContact O-CA 3.4Å; F82-C100 WeakPolarHBondContact CB-SG 3.42Å
101	F	98.8	Very high	97	Very high	0 Å²	0	38.2 Å²	38.2	0%	0	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98	97.1	176.8	-75.7	-123.6	0	0	0	107.5	V57 V65 L68 I79 I80 F82 V99 L103 I218	V57-F101 HydrophobicContact CG2-CB 4.44Å; V57-F101 HydrophobicContact CG2-CD1 4.16Å; V57-F101 HydrophobicContact CG2-CD2 3.96Å; V57-F101 HydrophobicContact CG2-CE1 4.47Å; V57-F101 HydrophobicContact CG2-CE2 4.25Å; V57-F101 HydrophobicContact CG2-CG 3.9Å; V57-F101 HydrophobicContact CG2-CZ 4.5Å; V65-F101 HydrophobicContact CG1-CD1 4.23Å; V65-F101 HydrophobicContact CG1-CE1 4.41Å; L68-F101 HydrophobicContact CB-CE1 3.44Å; L68-F101 VanDerWaalsContact CB-CE1 3.44Å; L68-F101 HydrophobicContact CB-CZ 3.63Å; L68-F101 HydrophobicContact CD1-CE1 4.25Å; L68-F101 HydrophobicContact CG-CE1 4.49Å; I79-F101 HydrophobicContact CB-CE2 4.32Å; I79-F101 HydrophobicContact CG1-CE2 4.05Å; I79-F101 HydrophobicContact CG1-CZ 4.47Å; I79-F101 HydrophobicContact CG2-CD2 3.74Å; I79-F101 HydrophobicContact CG2-CE2 3.74Å; I79-F101 HydrophobicContact CG2-CG 4.37Å; I79-F101 HydrophobicContact CG2-CZ 4.33Å; I80-F101 PolarHBondContact O-N 3.21Å; F82-F101 PolarHBondContact N-O 3.08Å; V99-F101 HydrophobicContact CB-CD2 4.34Å; V99-F101 HydrophobicContact CB-CE2 3.9Å; V99-F101 HydrophobicContact CG1-CD2 3.8Å; V99-F101 HydrophobicContact CG1-CE2 3.48Å; V99-F101 VanDerWaalsContact CG1-CE2 3.48Å; V99-F101 HydrophobicContact CG1-CZ 4.4Å; F101-L103 HydrophobicContact CB-CD2 4.47Å; F101-L103 PolarHBondContact O-N 3.39Å; F101-I218 HydrophobicContact CD1-CD1 3.76Å; F101-I218 HydrophobicContact CE1-CD1 3.99Å; F101-I218 HydrophobicContact CG-CD1 4.16Å
102	S	98.6	Very high	97.1	Very high	0 Å²	0	39.3 Å²	39.3	0%	0	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.6	107.3	175.7	-168	0	0	0	0	109	H41 V57 F58 R104	H41-S102 PolarHBondContact NE2-OG 2.9Å; V57-S102 PolarHBondContact O-N 3.43Å; F58-S102 VanDerWaalsContact CD1-CB 3.48Å; F58-S102 VanDerWaalsContact CE1-CB 3.48Å; F58-S102 WeakPolarHBondContact CE1-OG 3.14Å; S102-R104 PolarHBondContact O-N 2.93Å
103	L	98.3	Very high	97.2	Very high	8 Å²	8	40.8 Å²	40.8	4%	0.042	20%	0.203	C	C	.	.	G	3₁₀ helix	trans	-87.4	6	-173.3	-58.3	174	0	0	0	113.1	P59 V65 F82 F101 N105 M106 P123 G124 I218	P59-L103 HydrophobicContact CG-CD2 4.28Å; V65-L103 HydrophobicContact CG2-CD2 4.15Å; F82-L103 PolarHBondContact O-N 3.49Å; F101-L103 HydrophobicContact CB-CD2 4.47Å; F101-L103 PolarHBondContact O-N 3.39Å; L103-N105 PolarHBondContact O-N 2.96Å; L103-M106 HydrophobicContact CD2-SD 4.44Å; L103-M106 PolarHBondContact O-N 3.33Å; L103-M106 VanDerWaalsContact O-N 3.13Å; L103-P123 HydrophobicContact CB-CB 3.78Å; L103-P123 HydrophobicContact CB-CG 3.69Å; L103-P123 HydrophobicContact CD1-CB 3.88Å; L103-P123 HydrophobicContact CD1-CG 4.12Å; L103-P123 HydrophobicContact CG-CB 4.43Å; L103-P123 HydrophobicContact CG-CG 4.34Å; L103-G124 PolarHBondContact O-N 3.19Å; L103-I218 HydrophobicContact CD1-CG2 3.64Å; L103-I218 HydrophobicContact CD2-CG2 3.88Å; L103-I218 HydrophobicContact CG-CG2 4.32Å
104	R	95.9	Very high	97.2	Very high	117 Å²	117	43.6 Å²	43.6	44%	0.442	22%	0.22	S	C	.	.	G	3₁₀ helix	trans	-65.5	-21.9	-172.1	-57.6	-176	86.7	-147.4	5.9	113.7	G83 S102 M106	G83-R104 VanDerWaalsContact O-CD 3.26Å; G83-R104 WeakPolarHBondContact O-CD 3.34Å; G83-R104 WeakPolarHBondContact O-CG 3.32Å; S102-R104 PolarHBondContact O-N 2.93Å; R104-M106 VanDerWaalsContact C-N 3.3Å
105	N	97.1	Very high	97.2	Very high	73 Å²	73	52 Å²	52	39%	0.39	26%	0.259	S	S	.	.	G	3₁₀ helix	trans	-85.2	-3.2	179.4	-68.5	4.5	0	0	0	113.2	R60 L103	R60-N105 HydrophobicContact CG-CB 4.27Å; L103-N105 PolarHBondContact O-N 2.96Å
106	M	98.3	Very high	97.4	Very high	0 Å²	0	53.9 Å²	53.9	0%	0	27%	0.268	C	S	.	.			trans	-100.1	76.9	170.2	-63.3	176.1	62.3	0	0	107.5	V65 L103 R104 E122 P123 G124 T220	V65-M106 HydrophobicContact CG2-SD 3.79Å; L103-M106 HydrophobicContact CD2-SD 4.44Å; L103-M106 PolarHBondContact O-N 3.33Å; L103-M106 VanDerWaalsContact O-N 3.13Å; R104-M106 VanDerWaalsContact C-N 3.3Å; M106-E122 VanDerWaalsContact C-CB 3.49Å; M106-E122 VanDerWaalsContact CA-OE2 3.27Å; M106-E122 WeakPolarHBondContact CA-OE2 3.46Å; M106-E122 HydrophobicContact CB-CB 4.07Å; M106-E122 CarbonylContact O-C 3.41Å; M106-E122 WeakPolarHBondContact O-CB 3.22Å; M106-P123 HydrophobicContact CB-CG 3.89Å; M106-P123 HydrophobicContact CE-CG 4.29Å; M106-P123 HydrophobicContact SD-CG 4.21Å; M106-G124 VanDerWaalsContact O-CA 3.22Å; M106-G124 WeakPolarHBondContact O-CA 3.35Å; M106-G124 PolarHBondContact O-N 2.92Å; M106-T220 HydrophobicContact CE-CG2 4.38Å
107	D	97.8	Very high	97.6	Very high	88 Å²	88	52.3 Å²	52.3	47%	0.471	26%	0.261	S	S	.	.			trans	-115.1	22.4	-167.3	65.7	-5.5	0	0	0	113.9	E122 V125	D107-E122 PolarHBondContact N-OE2 3.37Å; D107-V125 VanDerWaalsContact C-CG2 3.48Å; D107-V125 VanDerWaalsContact O-CG2 3.31Å; D107-V125 WeakPolarHBondContact O-CG2 3.32Å
108	Q	98.6	Very high	97.8	Very high	110 Å²	110	51.8 Å²	51.8	51%	0.514	26%	0.255	S	S	.	.			trans	-85.5	138	-178.4	-56	-61.1	-57.6	0	0	112.5	L110 E122 V125	Q108-L110 HydrophobicContact CB-CD2 3.88Å; Q108-E122 HydrophobicContact CB-CG 4.2Å; Q108-E122 WeakPolarHBondContact CB-OE2 3.2Å; Q108-E122 WeakPolarHBondContact CG-OE2 3.29Å; Q108-E122 PolarHBondContact N-OE2 2.96Å; Q108-E122 WeakPolarHBondContact O-CB 3.36Å; Q108-E122 PolarHBondContact O-N 3.48Å; Q108-V125 WeakPolarHBondContact O-CG2 3.46Å
109	I	98.6	Very high	97.9	Very high	37 Å²	37	51.8 Å²	51.8	19%	0.19	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.3	114.9	161.6	-60.6	171.8	0	0	0	106	V119 V121 V125 L130 Y133	I109-V119 HydrophobicContact CG2-CG2 3.66Å; I109-V121 HydrophobicContact CG1-CG1 4.21Å; I109-V121 HydrophobicContact CG2-CG1 4.31Å; I109-V125 HydrophobicContact CD1-CG1 4.35Å; I109-V125 HydrophobicContact CG1-CG1 3.94Å; I109-V125 HydrophobicContact CG1-CG2 4.05Å; I109-L130 HydrophobicContact CD1-CD1 4.04Å; I109-Y133 HydrophobicContact CD1-CD1 3.65Å; I109-Y133 HydrophobicContact CD1-CD2 3.92Å; I109-Y133 HydrophobicContact CD1-CE1 4.38Å; I109-Y133 HydrophobicContact CD1-CG 3.37Å; I109-Y133 HydrophobicContact CG2-CD1 3.98Å; I109-Y133 HydrophobicContact CG2-CE1 3.73Å
110	L	97.7	Very high	97.9	Very high	65 Å²	65	52.4 Å²	52.4	34%	0.34	26%	0.259	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.3	-63.1	-165.3	-61.9	173.6	0	0	0	112	Q108 T120 E122 K221	Q108-L110 HydrophobicContact CB-CD2 3.88Å; L110-T120 HydrophobicContact CD1-CG2 4.27Å; L110-T120 PolarHBondContact N-O 3.12Å; L110-E122 HydrophobicContact CD1-CG 3.83Å; L110-E122 HydrophobicContact CD2-CG 4.1Å; L110-E122 HydrophobicContact CG-CG 4Å; L110-K221 HydrophobicContact CD1-CD 3.57Å; L110-K221 HydrophobicContact CD1-CG 4.02Å
111	D	96.3	Very high	97.9	Very high	87 Å²	87	52.4 Å²	52.4	47%	0.465	26%	0.259	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	109	-171.6	-57.9	-61.5	0	0	0	109.3	V119 T120	D111-V119 CarbonylContact O-C 3.59Å; D111-V119 VanDerWaalsContact O-CA 3.24Å; D111-V119 WeakPolarHBondContact O-CA 3.18Å; D111-T120 PolarHBondContact N-O 3.49Å; D111-T120 PolarHBondContact O-N 2.88Å
112	L	98.3	Very high	97.9	Very high	39 Å²	39	53.5 Å²	53.5	20%	0.204	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.8	127.7	170.5	173.5	64.7	0	0	0	109.1	P114 V119 Y133 L134 T137 L226	L112-P114 HydrophobicContact CD2-CG 4.17Å; L112-P114 HydrophobicContact CG-CG 4.02Å; L112-P114 WeakPolarHBondContact O-CD 3.25Å; L112-V119 HydrophobicContact CB-CG2 4.41Å; L112-V119 HydrophobicContact CD1-CB 4.15Å; L112-V119 HydrophobicContact CD1-CG2 4.34Å; L112-Y133 HydrophobicContact CB-CE1 4.31Å; L112-Y133 HydrophobicContact CD2-CE1 3.88Å; L112-L134 HydrophobicContact CD1-CD2 3.57Å; L112-L134 HydrophobicContact CD2-CD2 4.05Å; L112-L134 HydrophobicContact CG-CD2 4.46Å; L112-T137 HydrophobicContact CD2-CG2 3.85Å; L112-L226 HydrophobicContact CD1-CD1 3.54Å
113	H	97.9	Very high	97.9	Very high	48 Å²	48	53.5 Å²	53.5	22%	0.222	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	88.6	175.8	-52.1	98	0	0	0	109.5	E115 D116 F117 D118 R195	H113-E115 VanDerWaalsContact C-N 3.33Å; H113-E115 PolarHBondContact O-N 3.38Å; H113-D116 HydrophobicContact CB-CB 3.82Å; H113-D116 PolarHBondContact O-N 3.5Å; H113-F117 PolarHBondContact O-N 2.86Å; H113-D118 IonicContact CE1-OD1 2.63Å; H113-D118 IonicContact CG-OD1 3.06Å; H113-D118 PolarHBondContact N-O 2.81Å; H113-D118 IonicContact ND1-OD1 3.28Å; H113-D118 PolarHBondContact ND1-OD1 3.14Å; H113-D118 PolarHBondContact O-N 3.31Å; H113-R195 PolarHBondContact CD2-NH2 3.39Å; H113-R195 VanDerWaalsContact CD2-NH2 3.31Å; H113-R195 VanDerWaalsContact CE1-CZ 3.47Å; H113-R195 PolarHBondContact CE1-NE 3.3Å; H113-R195 PolarHBondContact ND1-NE 2.82Å; H113-R195 PolarHBondContact NE2-NH2 2.99Å
114	P	97.4	Very high	97.8	Very high	64 Å²	64	53.8 Å²	53.8	42%	0.416	27%	0.269	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.8	-40.2	-174.4	-24.4	35	0	0	0	113.1	L112 D116 F117 L139	L112-P114 HydrophobicContact CD2-CG 4.17Å; L112-P114 HydrophobicContact CG-CG 4.02Å; L112-P114 WeakPolarHBondContact O-CD 3.25Å; P114-D116 VanDerWaalsContact C-N 3.29Å; P114-D116 PolarHBondContact O-N 3.41Å; P114-F117 PolarHBondContact O-N 3.01Å; P114-L139 HydrophobicContact CB-CD1 4.19Å
115	E	96.7	Very high	98	Very high	181 Å²	181	48.3 Å²	48.3	85%	0.846	25%	0.249	S	C	*	.	T	Hydrogen-bonded Turn	trans	-68	-29.4	179.4	-62.7	179.9	-176.1	0	0	112.7	H113 F117	H113-E115 VanDerWaalsContact C-N 3.33Å; H113-E115 PolarHBondContact O-N 3.38Å; E115-F117 WeakPolarHBondContact O-CD2 3.24Å
116	D	97.4	Very high	98	Very high	78 Å²	78	46.1 Å²	46.1	42%	0.417	24%	0.238	S	C	.	.	T	Hydrogen-bonded Turn	trans	-92.3	-9.1	178.7	-66.4	-37.9	0	0	0	112.7	H113 P114 D118 R195 R197	H113-D116 HydrophobicContact CB-CB 3.82Å; H113-D116 PolarHBondContact O-N 3.5Å; P114-D116 VanDerWaalsContact C-N 3.29Å; P114-D116 PolarHBondContact O-N 3.41Å; D116-D118 WeakPolarHBondContact CB-OD2 3.38Å; D116-R195 IonicContact OD2-CZ 2.81Å; D116-R195 IonicContact OD2-NH1 3.43Å; D116-R195 PolarHBondContact OD2-NH1 2.9Å; D116-R195 IonicContact OD2-NH2 3.46Å; D116-R195 PolarHBondContact OD2-NH2 2.66Å; D116-R197 PolarHBondContact O-NH2 2.82Å
117	F	98.2	Very high	98	Very high	91 Å²	91	47.1 Å²	47.1	40%	0.399	24%	0.242	S	C	.	.	T	Hydrogen-bonded Turn	trans	58.7	47	-176.7	-60.4	-109.1	0	0	0	112.8	H113 P114 E115 L139 R197 L226	H113-F117 PolarHBondContact O-N 2.86Å; P114-F117 PolarHBondContact O-N 3.01Å; E115-F117 WeakPolarHBondContact O-CD2 3.24Å; F117-L139 HydrophobicContact CD1-CD2 3.34Å; F117-L139 HydrophobicContact CE1-CD2 3.45Å; F117-L139 VanDerWaalsContact CE1-CD2 3.45Å; F117-L139 HydrophobicContact CG-CD2 4.29Å; F117-L139 HydrophobicContact CZ-CD2 4.46Å; F117-R197 VanDerWaalsContact C-NH2 3.31Å; F117-R197 PolarHBondContact O-NH2 3.47Å; F117-L226 PolarHBondContact O-N 2.8Å
118	D	98.6	Very high	98	Very high	1 Å²	1	48.6 Å²	48.6	1%	0.005	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.7	162.3	176.2	71.5	68.7	0	0	0	113.4	H113 D116 M175 R195 L224	H113-D118 IonicContact CE1-OD1 2.63Å; H113-D118 IonicContact CG-OD1 3.06Å; H113-D118 PolarHBondContact N-O 2.81Å; H113-D118 IonicContact ND1-OD1 3.28Å; H113-D118 PolarHBondContact ND1-OD1 3.14Å; H113-D118 PolarHBondContact O-N 3.31Å; D116-D118 WeakPolarHBondContact CB-OD2 3.38Å; D118-M175 HydrophobicContact CB-SD 3.97Å; D118-R195 VanDerWaalsContact OD1-CD 3.25Å; D118-R195 WeakPolarHBondContact OD1-CD 3.28Å; D118-R195 IonicContact OD1-CZ 3.5Å; D118-R195 IonicContact OD1-NE 3.41Å; D118-R195 IonicContact OD1-NH1 3.44Å; D118-R195 IonicContact OD2-CZ 2.71Å; D118-R195 IonicContact OD2-NH1 2.73Å; D118-R195 PolarHBondContact OD2-NH1 2.81Å; D118-L224 WeakPolarHBondContact CA-O 3.42Å; D118-L224 VanDerWaalsContact CB-O 3.28Å; D118-L224 WeakPolarHBondContact CB-O 3.41Å
119	V	98.8	Very high	97.9	Very high	0 Å²	0	45.7 Å²	45.7	0%	0	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.5	141.1	177.8	65	0	0	0	0	111.2	I109 D111 L112 V121 L130 T223 L224 L226	I109-V119 HydrophobicContact CG2-CG2 3.66Å; D111-V119 CarbonylContact O-C 3.59Å; D111-V119 VanDerWaalsContact O-CA 3.24Å; D111-V119 WeakPolarHBondContact O-CA 3.18Å; L112-V119 HydrophobicContact CB-CG2 4.41Å; L112-V119 HydrophobicContact CD1-CB 4.15Å; L112-V119 HydrophobicContact CD1-CG2 4.34Å; V119-V121 HydrophobicContact CG1-CG1 4.35Å; V119-V121 HydrophobicContact CG2-CG1 3.98Å; V119-L130 HydrophobicContact CG1-CD1 4.01Å; V119-L130 HydrophobicContact CG1-CD2 3.96Å; V119-L130 HydrophobicContact CG2-CD1 4.14Å; V119-T223 CarbonylContact O-C 3.57Å; V119-T223 WeakPolarHBondContact O-CA 3.45Å; V119-L224 HydrophobicContact CG1-CB 4.14Å; V119-L224 PolarHBondContact N-O 3.4Å; V119-L224 PolarHBondContact O-N 3.07Å; V119-L226 HydrophobicContact CB-CD1 4.07Å; V119-L226 HydrophobicContact CB-CG 4.41Å; V119-L226 HydrophobicContact CG1-CD1 4.16Å; V119-L226 HydrophobicContact CG1-CD2 3.75Å; V119-L226 HydrophobicContact CG1-CG 4.05Å
120	T	98.8	Very high	97.9	Very high	14 Å²	14	43.9 Å²	43.9	9%	0.086	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	129.7	168.6	-57.5	0	0	0	0	110.3	L110 D111 K221 T222 T223	L110-T120 HydrophobicContact CD1-CG2 4.27Å; L110-T120 PolarHBondContact N-O 3.12Å; D111-T120 PolarHBondContact N-O 3.49Å; D111-T120 PolarHBondContact O-N 2.88Å; T120-K221 HydrophobicContact CG2-CB 4.18Å; T120-K221 HydrophobicContact CG2-CD 4.36Å; T120-T222 WeakPolarHBondContact CA-O 3.44Å; T120-T223 PolarHBondContact OG1-OG1 2.92Å
121	V	98.8	Very high	98	Very high	0 Å²	0	42.7 Å²	42.7	0%	0	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.5	151.7	-176.4	-60.9	0	0	0	0	111.9	I109 V119 V125 L130 L151 K221 T222 L224	I109-V121 HydrophobicContact CG1-CG1 4.21Å; I109-V121 HydrophobicContact CG2-CG1 4.31Å; V119-V121 HydrophobicContact CG1-CG1 4.35Å; V119-V121 HydrophobicContact CG2-CG1 3.98Å; V121-V125 HydrophobicContact CB-CB 4.04Å; V121-V125 HydrophobicContact CB-CG1 4.32Å; V121-V125 HydrophobicContact CB-CG2 3.99Å; V121-V125 HydrophobicContact CG1-CB 4.49Å; V121-V125 HydrophobicContact CG1-CG1 4.22Å; V121-V125 HydrophobicContact CG1-CG2 4.49Å; V121-L130 HydrophobicContact CG1-CD1 4.25Å; V121-L151 HydrophobicContact CB-CD1 4.4Å; V121-L151 HydrophobicContact CG1-CD1 4.24Å; V121-L151 HydrophobicContact CG2-CB 4.05Å; V121-L151 HydrophobicContact CG2-CD1 3.78Å; V121-K221 VanDerWaalsContact O-CA 3.29Å; V121-K221 WeakPolarHBondContact O-CA 3.29Å; V121-T222 PolarHBondContact N-O 3.36Å; V121-T222 PolarHBondContact O-N 3.38Å; V121-L224 HydrophobicContact CG2-CD1 4.26Å
122	E	98.7	Very high	98	Very high	22 Å²	22	41 Å²	41	10%	0.103	22%	0.222	C	C	.	.			trans	-80.4	162.2	169.1	-67.2	-165.9	142.9	0	0	112.7	M106 D107 Q108 L110 G124 V125	M106-E122 VanDerWaalsContact C-CB 3.49Å; M106-E122 VanDerWaalsContact CA-OE2 3.27Å; M106-E122 WeakPolarHBondContact CA-OE2 3.46Å; M106-E122 HydrophobicContact CB-CB 4.07Å; M106-E122 CarbonylContact O-C 3.41Å; M106-E122 WeakPolarHBondContact O-CB 3.22Å; D107-E122 PolarHBondContact N-OE2 3.37Å; Q108-E122 HydrophobicContact CB-CG 4.2Å; Q108-E122 WeakPolarHBondContact CB-OE2 3.2Å; Q108-E122 WeakPolarHBondContact CG-OE2 3.29Å; Q108-E122 PolarHBondContact N-OE2 2.96Å; Q108-E122 WeakPolarHBondContact O-CB 3.36Å; Q108-E122 PolarHBondContact O-N 3.48Å; L110-E122 HydrophobicContact CD1-CG 3.83Å; L110-E122 HydrophobicContact CD2-CG 4.1Å; L110-E122 HydrophobicContact CG-CG 4Å; E122-G124 VanDerWaalsContact C-N 3.31Å; E122-G124 PolarHBondContact O-N 3.2Å; E122-V125 WeakPolarHBondContact O-CB 3.38Å; E122-V125 WeakPolarHBondContact O-CG2 3.42Å; E122-V125 PolarHBondContact O-N 2.82Å; E122-V125 VanDerWaalsContact O-N 3.16Å
123	P	97.9	Very high	98.1	Very high	1 Å²	1	45.1 Å²	45.1	1%	0.006	24%	0.235	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68.3	-17.7	-170.3	24.5	-38.3	0	0	0	116.7	L103 M106 S150 C152 T220	L103-P123 HydrophobicContact CB-CB 3.78Å; L103-P123 HydrophobicContact CB-CG 3.69Å; L103-P123 HydrophobicContact CD1-CB 3.88Å; L103-P123 HydrophobicContact CD1-CG 4.12Å; L103-P123 HydrophobicContact CG-CB 4.43Å; L103-P123 HydrophobicContact CG-CG 4.34Å; M106-P123 HydrophobicContact CB-CG 3.89Å; M106-P123 HydrophobicContact CE-CG 4.29Å; M106-P123 HydrophobicContact SD-CG 4.21Å; P123-S150 WeakPolarHBondContact O-CB 3.48Å; P123-C152 WeakPolarHBondContact CA-SG 3.32Å; P123-C152 HydrophobicContact CB-CB 3.63Å; P123-T220 WeakPolarHBondContact CD-O 3.31Å
124	G	97.1	Very high	98.1	Very high	13 Å²	13	42.9 Å²	42.9	13%	0.134	23%	0.225	C	C	.	.	T	Hydrogen-bonded Turn	trans	-80.1	-16.2	174.1	0	0	0	0	0	113.7	L103 M106 E122 T126	L103-G124 PolarHBondContact O-N 3.19Å; M106-G124 VanDerWaalsContact O-CA 3.22Å; M106-G124 WeakPolarHBondContact O-CA 3.35Å; M106-G124 PolarHBondContact O-N 2.92Å; E122-G124 VanDerWaalsContact C-N 3.31Å; E122-G124 PolarHBondContact O-N 3.2Å; G124-T126 PolarHBondContact O-N 3.13Å
125	V	98.8	Very high	98	Very high	3 Å²	3	48.9 Å²	48.9	2%	0.018	24%	0.239	C	C	.	.			trans	-67	120.6	179.3	-177.3	0	0	0	0	110	D107 Q108 I109 V121 E122 A129 L130 S150 L151	D107-V125 VanDerWaalsContact C-CG2 3.48Å; D107-V125 VanDerWaalsContact O-CG2 3.31Å; D107-V125 WeakPolarHBondContact O-CG2 3.32Å; Q108-V125 WeakPolarHBondContact O-CG2 3.46Å; I109-V125 HydrophobicContact CD1-CG1 4.35Å; I109-V125 HydrophobicContact CG1-CG1 3.94Å; I109-V125 HydrophobicContact CG1-CG2 4.05Å; V121-V125 HydrophobicContact CB-CB 4.04Å; V121-V125 HydrophobicContact CB-CG1 4.32Å; V121-V125 HydrophobicContact CB-CG2 3.99Å; V121-V125 HydrophobicContact CG1-CB 4.49Å; V121-V125 HydrophobicContact CG1-CG1 4.22Å; V121-V125 HydrophobicContact CG1-CG2 4.49Å; E122-V125 WeakPolarHBondContact O-CB 3.38Å; E122-V125 WeakPolarHBondContact O-CG2 3.42Å; E122-V125 PolarHBondContact O-N 2.82Å; E122-V125 VanDerWaalsContact O-N 3.16Å; V125-A129 HydrophobicContact CG1-CB 4.48Å; V125-L130 HydrophobicContact CG1-CB 4.11Å; V125-S150 WeakPolarHBondContact O-CA 3.45Å; V125-L151 HydrophobicContact CB-CD1 4.32Å; V125-L151 HydrophobicContact CG1-CD1 3.82Å; V125-L151 PolarHBondContact O-N 2.83Å
126	T	98.6	Very high	97.9	Very high	26 Å²	26	47.8 Å²	47.8	16%	0.16	24%	0.239	C	C	.	.	B	Isolated β-bridge	trans	-85.5	159	174.8	76.4	0	0	0	0	111.7	T84 G124 K128 A129 L130 D148 A149	T84-T126 HydrophobicContact CG2-CG2 4.09Å; G124-T126 PolarHBondContact O-N 3.13Å; T126-K128 VanDerWaalsContact C-N 3.32Å; T126-K128 PolarHBondContact O-N 2.89Å; T126-A129 PolarHBondContact O-N 2.79Å; T126-A129 WeakPolarHBondContact OG1-CB 3.42Å; T126-A129 PolarHBondContact OG1-N 2.81Å; T126-L130 PolarHBondContact O-N 2.84Å; T126-D148 VanDerWaalsContact CB-OD1 3.3Å; T126-D148 WeakPolarHBondContact CB-OD1 3.46Å; T126-D148 PolarHBondContact OG1-OD1 3.21Å; T126-D148 PolarHBondContact OG1-OD2 3.34Å; T126-D148 VanDerWaalsContact OG1-OD2 3.12Å; T126-A149 WeakPolarHBondContact CA-O 3.44Å
127	R	97.3	Very high	97.9	Very high	22 Å²	22	46.6 Å²	46.6	8%	0.083	24%	0.235	C	C	.	.	H	α-helix	trans	-54.9	-46.6	175.4	178.9	-171.7	64.7	92.1	-15.1	112.3	A129 L130 N131 F141 V143 D144 A149 L151 M154	R127-A129 VanDerWaalsContact C-N 3.35Å; R127-L130 PolarHBondContact O-N 2.81Å; R127-N131 PolarHBondContact O-N 3.1Å; R127-F141 HydrophobicContact CG-CD1 4.42Å; R127-V143 WeakPolarHBondContact CD-O 3.35Å; R127-D144 IonicContact CZ-OD1 3.6Å; R127-D144 IonicContact NE-OD1 3.34Å; R127-D144 PolarHBondContact NE-OD1 3.38Å; R127-D144 IonicContact NH1-OD1 2.66Å; R127-D144 PolarHBondContact NH1-OD1 3.43Å; R127-D144 IonicContact NH2-OD1 3.2Å; R127-D144 PolarHBondContact NH2-OD1 3.16Å; R127-A149 PolarHBondContact N-O 2.81Å; R127-L151 HydrophobicContact CB-CD2 4.37Å; R127-M154 HydrophobicContact CB-SD 4.18Å
128	K	97.1	Very high	97.8	Very high	119 Å²	119	44.3 Å²	44.3	52%	0.517	24%	0.237	S	C	.	.	H	α-helix	trans	-66.2	-38.1	179	-70.2	-179	-177.2	174.5	0	111.6	T126 N131 A132 D148	T126-K128 VanDerWaalsContact C-N 3.32Å; T126-K128 PolarHBondContact O-N 2.89Å; K128-N131 PolarHBondContact O-N 3.01Å; K128-A132 VanDerWaalsContact O-CB 3.29Å; K128-A132 WeakPolarHBondContact O-CB 3.36Å; K128-A132 PolarHBondContact O-N 3.41Å; K128-D148 WeakPolarHBondContact CB-OD1 3.23Å; K128-D148 HydrophobicContact CD-CB 3.92Å; K128-D148 HydrophobicContact CG-CB 4.25Å; K128-D148 VanDerWaalsContact CG-OD1 3.31Å; K128-D148 WeakPolarHBondContact CG-OD1 3.2Å; K128-D148 PolarHBondContact N-OD1 3.32Å
129	A	98.3	Very high	97.8	Very high	48 Å²	48	44.8 Å²	44.8	40%	0.397	24%	0.239	S	C	.	.	H	α-helix	trans	-61.9	-45.3	176.1	0	0	0	0	0	111.7	V125 T126 R127 A132 Y133	V125-A129 HydrophobicContact CG1-CB 4.48Å; T126-A129 PolarHBondContact O-N 2.79Å; T126-A129 WeakPolarHBondContact OG1-CB 3.42Å; T126-A129 PolarHBondContact OG1-N 2.81Å; R127-A129 VanDerWaalsContact C-N 3.35Å; A129-A132 PolarHBondContact O-N 2.81Å; A129-Y133 PolarHBondContact O-N 3.36Å
130	L	98.6	Very high	97.7	Very high	0 Å²	0	46.6 Å²	46.6	0%	0	25%	0.246	C	C	.	.	H	α-helix	trans	-61.9	-49.8	176.2	176	60.8	0	0	0	111.8	I109 V119 V121 V125 T126 R127 A132 Y133 L134 F141 L151 L224	I109-L130 HydrophobicContact CD1-CD1 4.04Å; V119-L130 HydrophobicContact CG1-CD1 4.01Å; V119-L130 HydrophobicContact CG1-CD2 3.96Å; V119-L130 HydrophobicContact CG2-CD1 4.14Å; V121-L130 HydrophobicContact CG1-CD1 4.25Å; V125-L130 HydrophobicContact CG1-CB 4.11Å; T126-L130 PolarHBondContact O-N 2.84Å; R127-L130 PolarHBondContact O-N 2.81Å; L130-A132 VanDerWaalsContact C-N 3.26Å; L130-A132 PolarHBondContact O-N 3.48Å; L130-Y133 WeakPolarHBondContact O-CB 3.41Å; L130-Y133 PolarHBondContact O-N 2.9Å; L130-Y133 VanDerWaalsContact O-N 3.1Å; L130-L134 HydrophobicContact CD1-CD1 3.86Å; L130-L134 HydrophobicContact CD1-CD2 4.41Å; L130-L134 HydrophobicContact CD1-CG 3.94Å; L130-L134 HydrophobicContact CD2-CD1 4.44Å; L130-L134 HydrophobicContact CG-CD1 3.83Å; L130-L134 HydrophobicContact CG-CG 4.32Å; L130-L134 WeakPolarHBondContact O-CG 3.35Å; L130-L134 PolarHBondContact O-N 3.47Å; L130-F141 HydrophobicContact CD2-CB 3.79Å; L130-F141 HydrophobicContact CD2-CD1 4.49Å; L130-F141 HydrophobicContact CD2-CG 4.06Å; L130-F141 HydrophobicContact CG-CB 4.47Å; L130-L151 HydrophobicContact CB-CD1 3.79Å; L130-L151 HydrophobicContact CD2-CD1 3.48Å; L130-L151 VanDerWaalsContact CD2-CD1 3.48Å; L130-L151 HydrophobicContact CD2-CD2 4.46Å; L130-L151 HydrophobicContact CG-CD1 4.22Å; L130-L224 HydrophobicContact CD2-CD1 4.14Å
131	N	98	Very high	97.7	Very high	39 Å²	39	46 Å²	46	21%	0.209	24%	0.242	C	C	.	.	H	α-helix	trans	-66.5	-28.4	-179.9	-81.7	-26.3	0	0	0	112.9	R127 K128 R135 F141	R127-N131 PolarHBondContact O-N 3.1Å; K128-N131 PolarHBondContact O-N 3.01Å; N131-R135 PolarHBondContact O-N 3.43Å; N131-F141 PolarHBondContact ND2-O 3.33Å; N131-F141 PolarHBondContact OD1-N 3.41Å; N131-F141 PolarHBondContact OD1-O 2.96Å
132	A	98.1	Very high	97.6	Very high	52 Å²	52	46 Å²	46	43%	0.43	24%	0.242	S	C	.	.	H	α-helix	trans	-66.7	-42.2	170.4	0	0	0	0	0	111.7	K128 A129 L130 R135	K128-A132 VanDerWaalsContact O-CB 3.29Å; K128-A132 WeakPolarHBondContact O-CB 3.36Å; K128-A132 PolarHBondContact O-N 3.41Å; A129-A132 PolarHBondContact O-N 2.81Å; L130-A132 VanDerWaalsContact C-N 3.26Å; L130-A132 PolarHBondContact O-N 3.48Å; A132-R135 WeakPolarHBondContact O-CB 3.24Å; A132-R135 PolarHBondContact O-N 3Å
133	Y	98.4	Very high	97.5	Very high	126 Å²	126	45 Å²	45	49%	0.494	24%	0.238	S	C	.	.	H	α-helix	trans	-64.4	-37	176.4	177.2	-96.2	0	0	0	112.9	I109 L112 A129 L130 R135	I109-Y133 HydrophobicContact CD1-CD1 3.65Å; I109-Y133 HydrophobicContact CD1-CD2 3.92Å; I109-Y133 HydrophobicContact CD1-CE1 4.38Å; I109-Y133 HydrophobicContact CD1-CG 3.37Å; I109-Y133 HydrophobicContact CG2-CD1 3.98Å; I109-Y133 HydrophobicContact CG2-CE1 3.73Å; L112-Y133 HydrophobicContact CB-CE1 4.31Å; L112-Y133 HydrophobicContact CD2-CE1 3.88Å; A129-Y133 PolarHBondContact O-N 3.36Å; L130-Y133 WeakPolarHBondContact O-CB 3.41Å; L130-Y133 PolarHBondContact O-N 2.9Å; L130-Y133 VanDerWaalsContact O-N 3.1Å; Y133-R135 VanDerWaalsContact C-N 3.3Å; Y133-R135 PolarHBondContact O-N 2.78Å
134	L	98.3	Very high	97.2	Very high	1 Å²	1	45.6 Å²	45.6	1%	0.005	24%	0.241	C	C	.	.	T	Hydrogen-bonded Turn	trans	-78.1	-8.7	-178.4	-65.8	173.3	0	0	0	114.5	L112 L130 D136 T137 L139 L226	L112-L134 HydrophobicContact CD1-CD2 3.57Å; L112-L134 HydrophobicContact CD2-CD2 4.05Å; L112-L134 HydrophobicContact CG-CD2 4.46Å; L130-L134 HydrophobicContact CD1-CD1 3.86Å; L130-L134 HydrophobicContact CD1-CD2 4.41Å; L130-L134 HydrophobicContact CD1-CG 3.94Å; L130-L134 HydrophobicContact CD2-CD1 4.44Å; L130-L134 HydrophobicContact CG-CD1 3.83Å; L130-L134 HydrophobicContact CG-CG 4.32Å; L130-L134 WeakPolarHBondContact O-CG 3.35Å; L130-L134 PolarHBondContact O-N 3.47Å; L134-D136 VanDerWaalsContact C-N 3.25Å; L134-D136 PolarHBondContact O-N 3.04Å; L134-T137 WeakPolarHBondContact O-CB 3.31Å; L134-T137 WeakPolarHBondContact O-CG2 3.41Å; L134-T137 PolarHBondContact O-N 3.42Å; L134-T137 PolarHBondContact O-OG1 3.17Å; L134-L139 WeakPolarHBondContact CB-O 3.48Å; L134-L226 HydrophobicContact CD1-CD1 3.97Å; L134-L226 HydrophobicContact CD1-CD2 3.54Å; L134-L226 HydrophobicContact CD1-CG 4.38Å; L134-L226 HydrophobicContact CD2-CD1 3.7Å
135	R	95.4	Very high	96.9	Very high	189 Å²	189	45.7 Å²	45.7	71%	0.713	24%	0.239	S	C	*	.	G	3₁₀ helix	trans	-50	-41	-167.1	-174.5	-179.2	-65.5	169.2	0.6	114.3	N131 A132 Y133	N131-R135 PolarHBondContact O-N 3.43Å; A132-R135 WeakPolarHBondContact O-CB 3.24Å; A132-R135 PolarHBondContact O-N 3Å; Y133-R135 VanDerWaalsContact C-N 3.3Å; Y133-R135 PolarHBondContact O-N 2.78Å
136	D	95.3	Very high	96.3	Very high	159 Å²	159	48.5 Å²	48.5	85%	0.85	27%	0.269	S	S	*	.	G	3₁₀ helix	trans	-93.7	5.5	-174.5	-57.3	-32.8	0	0	0	113.3	L134	L134-D136 VanDerWaalsContact C-N 3.25Å; L134-D136 PolarHBondContact O-N 3.04Å
137	T	97.1	Very high	95.8	Very high	52 Å²	52	49 Å²	49	32%	0.319	28%	0.275	S	S	.	.	G	3₁₀ helix	trans	-94.8	-12.9	-174.8	70.8	0	0	0	0	113.4	L112 L134 L139	L112-T137 HydrophobicContact CD2-CG2 3.85Å; L134-T137 WeakPolarHBondContact O-CB 3.31Å; L134-T137 WeakPolarHBondContact O-CG2 3.41Å; L134-T137 PolarHBondContact O-N 3.42Å; L134-T137 PolarHBondContact O-OG1 3.17Å; T137-L139 PolarHBondContact O-N 2.82Å; T137-L139 WeakPolarHBondContact OG1-CB 3.29Å; T137-L139 PolarHBondContact OG1-N 3.17Å; T137-L139 VanDerWaalsContact OG1-N 3.11Å
138	G	96.4	Very high	95.7	Very high	43 Å²	43	50.4 Å²	50.4	44%	0.443	29%	0.285	S	S	.	.	T	Hydrogen-bonded Turn	trans	74.6	6.1	-168.3	0	0	0	0	0	113.9	G228 V229	G138-G228 WeakPolarHBondContact O-CA 3.23Å; G138-V229 PolarHBondContact O-N 3.16Å
139	L	98.3	Very high	95.6	Very high	11 Å²	11	45.2 Å²	45.2	6%	0.058	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	161	177.3	-56.9	-178.9	0	0	0	112.1	P114 F117 L134 T137 L226 Y227	P114-L139 HydrophobicContact CB-CD1 4.19Å; F117-L139 HydrophobicContact CD1-CD2 3.34Å; F117-L139 HydrophobicContact CE1-CD2 3.45Å; F117-L139 VanDerWaalsContact CE1-CD2 3.45Å; F117-L139 HydrophobicContact CG-CD2 4.29Å; F117-L139 HydrophobicContact CZ-CD2 4.46Å; L134-L139 WeakPolarHBondContact CB-O 3.48Å; T137-L139 PolarHBondContact O-N 2.82Å; T137-L139 WeakPolarHBondContact OG1-CB 3.29Å; T137-L139 PolarHBondContact OG1-N 3.17Å; T137-L139 VanDerWaalsContact OG1-N 3.11Å; L139-L226 HydrophobicContact CB-CB 4.31Å; L139-L226 HydrophobicContact CB-CD1 4.22Å; L139-L226 HydrophobicContact CD1-CB 4.31Å; L139-L226 HydrophobicContact CD1-CD1 3.91Å; L139-Y227 CarbonylContact C-O 3.52Å; L139-Y227 WeakPolarHBondContact CA-O 3.47Å
140	W	97.8	Very high	95.6	Very high	38 Å²	38	43 Å²	43	14%	0.144	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.6	163.3	172.5	72.9	-61.9	0	0	0	111.8	P142 N163 Y167 L226 Y227 G228 V229	W140-P142 HydrophobicContact CD2-CB 4.43Å; W140-P142 HydrophobicContact CE3-CB 4.25Å; W140-P142 HydrophobicContact CH2-CB 3.57Å; W140-P142 HydrophobicContact CZ2-CB 3.75Å; W140-P142 VanDerWaalsContact CZ3-CA 3.44Å; W140-P142 HydrophobicContact CZ3-CB 3.86Å; W140-N163 WeakPolarHBondContact CH2-ND2 3.41Å; W140-Y167 HydrophobicContact CH2-CD2 4.41Å; W140-Y167 HydrophobicContact CH2-CE2 4.04Å; W140-Y167 HydrophobicContact CZ2-CD2 4.31Å; W140-Y167 HydrophobicContact CZ2-CE1 4.27Å; W140-Y167 AromaticContact CZ2-CE2 3.71Å; W140-Y167 HydrophobicContact CZ2-CE2 3.71Å; W140-Y167 AromaticContact CZ2-CZ 3.69Å; W140-L226 WeakPolarHBondContact O-CA 3.48Å; W140-Y227 PolarHBondContact N-O 3.19Å; W140-Y227 PolarHBondContact O-N 3.29Å; W140-G228 PolarHBondContact NE1-O 3.22Å; W140-G228 VanDerWaalsContact NE1-O 3.1Å; W140-V229 HydrophobicContact CB-CG2 4.15Å; W140-V229 HydrophobicContact CG-CG2 4.25Å
141	F	98.3	Very high	95.6	Very high	1 Å²	1	43 Å²	43	0%	0.004	25%	0.246	C	C	.	.			trans	-103.8	121.8	172.1	-179.1	-108.1	0	0	0	110.4	R127 L130 N131 V143 L151 M154 M170 N173 L224 R225 L226	R127-F141 HydrophobicContact CG-CD1 4.42Å; L130-F141 HydrophobicContact CD2-CB 3.79Å; L130-F141 HydrophobicContact CD2-CD1 4.49Å; L130-F141 HydrophobicContact CD2-CG 4.06Å; L130-F141 HydrophobicContact CG-CB 4.47Å; N131-F141 PolarHBondContact ND2-O 3.33Å; N131-F141 PolarHBondContact OD1-N 3.41Å; N131-F141 PolarHBondContact OD1-O 2.96Å; F141-V143 HydrophobicContact CE1-CB 3.7Å; F141-V143 HydrophobicContact CE1-CG2 4.21Å; F141-V143 HydrophobicContact CE2-CG2 4.24Å; F141-V143 HydrophobicContact CZ-CB 3.69Å; F141-V143 HydrophobicContact CZ-CG2 3.69Å; F141-L151 HydrophobicContact CD1-CD2 3.79Å; F141-L151 HydrophobicContact CE1-CD2 3.49Å; F141-L151 VanDerWaalsContact CE1-CD2 3.49Å; F141-L151 HydrophobicContact CZ-CD2 4.17Å; F141-M154 HydrophobicContact CE1-CE 4Å; F141-M170 HydrophobicContact CE1-SD 4.36Å; F141-M170 HydrophobicContact CZ-SD 3.67Å; F141-N173 HydrophobicContact CE2-CB 4.16Å; F141-L224 HydrophobicContact CD2-CB 4.22Å; F141-L224 HydrophobicContact CD2-CD1 4.19Å; F141-L224 HydrophobicContact CE2-CB 4.03Å; F141-L224 HydrophobicContact CE2-CD1 3.92Å; F141-L224 HydrophobicContact CE2-CD2 3.99Å; F141-L224 HydrophobicContact CE2-CG 4.21Å; F141-L224 HydrophobicContact CZ-CD1 4.13Å; F141-L224 HydrophobicContact CZ-CD2 4.23Å; F141-R225 WeakPolarHBondContact CD2-O 3.48Å; F141-L226 HydrophobicContact CB-CD2 3.97Å; F141-L226 HydrophobicContact CD2-CD2 4.43Å
142	P	96.2	Very high	95.6	Very high	0 Å²	0	41.4 Å²	41.4	0%	0	24%	0.237	C	C	.	.			trans	-92.2	-21.9	-162.6	34.6	-38.3	0	0	0	116	W140 D144 N163 Y167 Y227	W140-P142 HydrophobicContact CD2-CB 4.43Å; W140-P142 HydrophobicContact CE3-CB 4.25Å; W140-P142 HydrophobicContact CH2-CB 3.57Å; W140-P142 HydrophobicContact CZ2-CB 3.75Å; W140-P142 VanDerWaalsContact CZ3-CA 3.44Å; W140-P142 HydrophobicContact CZ3-CB 3.86Å; P142-D144 PolarHBondContact O-N 3.13Å; P142-N163 WeakPolarHBondContact O-CB 3.11Å; P142-N163 PolarHBondContact O-ND2 3.1Å; P142-Y167 HydrophobicContact CB-CD1 4.15Å; P142-Y167 HydrophobicContact CB-CD2 3.82Å; P142-Y167 HydrophobicContact CB-CG 3.6Å; P142-Y167 HydrophobicContact CG-CD1 4.25Å; P142-Y167 HydrophobicContact CG-CG 3.9Å; P142-Y227 HydrophobicContact CB-CD2 4.45Å; P142-Y227 VanDerWaalsContact CD-CD2 3.49Å; P142-Y227 HydrophobicContact CG-CD2 3.44Å; P142-Y227 VanDerWaalsContact CG-CD2 3.44Å; P142-Y227 HydrophobicContact CG-CE2 3.45Å; P142-Y227 VanDerWaalsContact CG-CE2 3.45Å; P142-Y227 HydrophobicContact CG-CG 4.35Å
143	V	96.6	Very high	95.6	Very high	3 Å²	3	40 Å²	40	2%	0.018	23%	0.228	C	C	.	.			trans	-67.9	118.8	-177.1	-172.2	0	0	0	0	108.7	R127 F141 M154 S160 M170 N173	R127-V143 WeakPolarHBondContact CD-O 3.35Å; F141-V143 HydrophobicContact CE1-CB 3.7Å; F141-V143 HydrophobicContact CE1-CG2 4.21Å; F141-V143 HydrophobicContact CE2-CG2 4.24Å; F141-V143 HydrophobicContact CZ-CB 3.69Å; F141-V143 HydrophobicContact CZ-CG2 3.69Å; V143-M154 HydrophobicContact CB-CE 3.94Å; V143-M154 HydrophobicContact CG1-CE 3.64Å; V143-S160 VanDerWaalsContact CG1-O 3.29Å; V143-S160 WeakPolarHBondContact CG1-O 3.04Å; V143-M170 HydrophobicContact CB-SD 4.3Å; V143-M170 HydrophobicContact CG1-CG 4.19Å; V143-M170 HydrophobicContact CG1-SD 4.23Å; V143-M170 HydrophobicContact CG2-SD 4.28Å; V143-N173 HydrophobicContact CG2-CB 4.18Å; V143-N173 WeakPolarHBondContact CG2-ND2 3.49Å
144	D	91.6	Very high	95.6	Very high	13 Å²	13	34.1 Å²	34.1	7%	0.07	21%	0.205	C	C	.	.			trans	-131.9	72.8	-164.8	-170.8	19.2	0	0	0	110.9	R127 P142 G161 R262 H335	R127-D144 IonicContact CZ-OD1 3.6Å; R127-D144 IonicContact NE-OD1 3.34Å; R127-D144 PolarHBondContact NE-OD1 3.38Å; R127-D144 IonicContact NH1-OD1 2.66Å; R127-D144 PolarHBondContact NH1-OD1 3.43Å; R127-D144 IonicContact NH2-OD1 3.2Å; R127-D144 PolarHBondContact NH2-OD1 3.16Å; P142-D144 PolarHBondContact O-N 3.13Å; D144-G161 WeakPolarHBondContact O-CA 3.43Å; D144-R262 IonicContact OD2-NH2 3.61Å; D144-R262 PolarHBondContact OD2-NH2 3.37Å; D144-H335 IonicContact OD1-NE2 3.82Å; D144-H335 IonicContact OD2-CE1 3.88Å; D144-H335 IonicContact OD2-NE2 3.99Å; D144-H335 PolarHBondContact OD2-NE2 3.13Å
145	P	91.1	Very high	95.6	Very high	15 Å²	15	34.1 Å²	34.1	10%	0.097	21%	0.205	C	C	.	.			trans	-65	153.9	168.7	30.4	-36.3	0	0	0	109.2	A147 M154	P145-A147 PolarHBondContact O-N 3.2Å; P145-A147 VanDerWaalsContact O-O 3.12Å; P145-M154 VanDerWaalsContact CD-CE 3.45Å; P145-M154 HydrophobicContact CG-CE 3.73Å; P145-M154 HydrophobicContact CG-CG 4.35Å; P145-M154 HydrophobicContact CG-SD 4.01Å
146	G	84.9	Confident	95.8	Very high	61 Å²	61	25.8 Å²	25.8	63%	0.629	18%	0.177	S	C	*	.	S	Bend	trans	-56.6	-27.1	-178.7	0	0	0	0	0	114.3
147	A	88.9	Confident	95.9	Very high	36 Å²	36	20.5 Å²	20.5	30%	0.298	15%	0.15	S	C	.	.	S	Bend	trans	-89.7	153.7	176.7	0	0	0	0	0	113.4	T86 P145 A149	T86-A147 HydrophobicContact CG2-CB 4.18Å; P145-A147 PolarHBondContact O-N 3.2Å; P145-A147 VanDerWaalsContact O-O 3.12Å; A147-A149 PolarHBondContact O-N 2.81Å
148	D	94.2	Very high	95.9	Very high	53 Å²	53	19.6 Å²	19.6	28%	0.283	15%	0.146	S	C	.	.			trans	-81.9	73.6	165.6	-170.4	30.2	0	0	0	110.5	T126 K128	T126-D148 VanDerWaalsContact CB-OD1 3.3Å; T126-D148 WeakPolarHBondContact CB-OD1 3.46Å; T126-D148 PolarHBondContact OG1-OD1 3.21Å; T126-D148 PolarHBondContact OG1-OD2 3.34Å; T126-D148 VanDerWaalsContact OG1-OD2 3.12Å; K128-D148 WeakPolarHBondContact CB-OD1 3.23Å; K128-D148 HydrophobicContact CD-CB 3.92Å; K128-D148 HydrophobicContact CG-CB 4.25Å; K128-D148 VanDerWaalsContact CG-OD1 3.31Å; K128-D148 WeakPolarHBondContact CG-OD1 3.2Å; K128-D148 PolarHBondContact N-OD1 3.32Å
149	A	96.2	Very high	95.9	Very high	10 Å²	10	18 Å²	18	8%	0.083	13%	0.128	C	C	.	.			trans	-79.5	153.6	-178.5	0	0	0	0	0	112.4	T126 R127 A147 M154	T126-A149 WeakPolarHBondContact CA-O 3.44Å; R127-A149 PolarHBondContact N-O 2.81Å; A147-A149 PolarHBondContact O-N 2.81Å; A149-M154 HydrophobicContact CB-CG 3.67Å; A149-M154 HydrophobicContact CB-SD 4.18Å
150	S	98.1	Very high	95.8	Very high	2 Å²	2	17.8 Å²	17.8	1%	0.014	13%	0.128	C	C	.	.	B	Isolated β-bridge	trans	-62.7	138.6	164	49.8	0	0	0	0	111.2	T84 P123 V125 C152 G153 M154	T84-S150 PolarHBondContact OG1-N 2.9Å; P123-S150 WeakPolarHBondContact O-CB 3.48Å; V125-S150 WeakPolarHBondContact O-CA 3.45Å; S150-C152 PolarHBondContact O-N 3.01Å; S150-G153 CarbonylContact O-C 3.43Å; S150-G153 WeakPolarHBondContact O-CA 3.33Å; S150-G153 PolarHBondContact O-N 2.96Å; S150-G153 PolarHBondContact OG-N 3.11Å; S150-M154 WeakPolarHBondContact O-CG 3.45Å; S150-M154 PolarHBondContact O-N 2.82Å
151	L	98.4	Very high	95.5	Very high	0 Å²	0	16 Å²	16	0%	0	12%	0.122	C	C	.	.	H	α-helix	trans	-64.2	-36.4	-178	-68.9	164.8	0	0	0	113.5	V121 V125 R127 L130 F141 G153 M154 A155 M170 L224	V121-L151 HydrophobicContact CB-CD1 4.4Å; V121-L151 HydrophobicContact CG1-CD1 4.24Å; V121-L151 HydrophobicContact CG2-CB 4.05Å; V121-L151 HydrophobicContact CG2-CD1 3.78Å; V125-L151 HydrophobicContact CB-CD1 4.32Å; V125-L151 HydrophobicContact CG1-CD1 3.82Å; V125-L151 PolarHBondContact O-N 2.83Å; R127-L151 HydrophobicContact CB-CD2 4.37Å; L130-L151 HydrophobicContact CB-CD1 3.79Å; L130-L151 HydrophobicContact CD2-CD1 3.48Å; L130-L151 VanDerWaalsContact CD2-CD1 3.48Å; L130-L151 HydrophobicContact CD2-CD2 4.46Å; L130-L151 HydrophobicContact CG-CD1 4.22Å; F141-L151 HydrophobicContact CD1-CD2 3.79Å; F141-L151 HydrophobicContact CE1-CD2 3.49Å; F141-L151 VanDerWaalsContact CE1-CD2 3.49Å; F141-L151 HydrophobicContact CZ-CD2 4.17Å; L151-G153 VanDerWaalsContact C-N 3.34Å; L151-M154 HydrophobicContact CD2-SD 4Å; L151-M154 WeakPolarHBondContact O-CB 3.45Å; L151-M154 PolarHBondContact O-N 2.84Å; L151-A155 PolarHBondContact O-N 3.36Å; L151-M170 WeakPolarHBondContact O-CE 3.23Å; L151-L224 HydrophobicContact CB-CD1 4.11Å; L151-L224 HydrophobicContact CD1-CD1 3.84Å; L151-L224 HydrophobicContact CD2-CD1 3.81Å; L151-L224 HydrophobicContact CG-CD1 4.13Å
152	C	98.4	Very high	95.3	Very high	5 Å²	5	16.3 Å²	16.3	3%	0.034	12%	0.124	C	C	.	.	H	α-helix	trans	-70.7	-31.9	172.7	-68	0	0	0	0	112.2	P123 S150 A155 A156 I219 T222	P123-C152 WeakPolarHBondContact CA-SG 3.32Å; P123-C152 HydrophobicContact CB-CB 3.63Å; S150-C152 PolarHBondContact O-N 3.01Å; C152-A155 PolarHBondContact O-N 3.22Å; C152-A156 WeakPolarHBondContact O-CB 3.5Å; C152-A156 PolarHBondContact O-N 3.31Å; C152-I219 HydrophobicContact CB-CB 4.18Å; C152-I219 HydrophobicContact CB-CG2 3.79Å; C152-T222 PolarHBondContact SG-OG1 3.43Å
153	G	98.1	Very high	95.3	Very high	23 Å²	23	16.4 Å²	16.4	24%	0.237	12%	0.124	C	C	.	.	H	α-helix	trans	-64.5	-44.5	171.1	0	0	0	0	0	111.6	S150 L151 A155 A156 T157	S150-G153 CarbonylContact O-C 3.43Å; S150-G153 WeakPolarHBondContact O-CA 3.33Å; S150-G153 PolarHBondContact O-N 2.96Å; S150-G153 PolarHBondContact OG-N 3.11Å; L151-G153 VanDerWaalsContact C-N 3.34Å; G153-A155 VanDerWaalsContact C-N 3.28Å; G153-A155 PolarHBondContact O-N 2.84Å; G153-A156 WeakPolarHBondContact O-CB 3.47Å; G153-A156 PolarHBondContact O-N 3.44Å; G153-A156 VanDerWaalsContact O-N 3.13Å; G153-T157 PolarHBondContact O-N 3.07Å; G153-T157 PolarHBondContact O-OG1 2.78Å
154	M	98.4	Very high	95.2	Very high	2 Å²	2	16.8 Å²	16.8	1%	0.01	13%	0.128	C	C	.	.	H	α-helix	trans	-57.8	-41.4	173	-68.1	172.7	61.5	0	0	111.5	R127 F141 V143 P145 A149 S150 L151 T157 S158 A159 M170	R127-M154 HydrophobicContact CB-SD 4.18Å; F141-M154 HydrophobicContact CE1-CE 4Å; V143-M154 HydrophobicContact CB-CE 3.94Å; V143-M154 HydrophobicContact CG1-CE 3.64Å; P145-M154 VanDerWaalsContact CD-CE 3.45Å; P145-M154 HydrophobicContact CG-CE 3.73Å; P145-M154 HydrophobicContact CG-CG 4.35Å; P145-M154 HydrophobicContact CG-SD 4.01Å; A149-M154 HydrophobicContact CB-CG 3.67Å; A149-M154 HydrophobicContact CB-SD 4.18Å; S150-M154 WeakPolarHBondContact O-CG 3.45Å; S150-M154 PolarHBondContact O-N 2.82Å; L151-M154 HydrophobicContact CD2-SD 4Å; L151-M154 WeakPolarHBondContact O-CB 3.45Å; L151-M154 PolarHBondContact O-N 2.84Å; M154-T157 PolarHBondContact O-N 3.29Å; M154-T157 PolarHBondContact O-OG1 2.84Å; M154-S158 PolarHBondContact O-N 2.7Å; M154-A159 HydrophobicContact CB-CB 3.84Å; M154-A159 HydrophobicContact CE-CB 4.43Å; M154-A159 HydrophobicContact CG-CB 4.07Å; M154-A159 PolarHBondContact O-N 3.19Å; M154-M170 HydrophobicContact CB-CE 3.82Å; M154-M170 HydrophobicContact CB-CG 3.84Å; M154-M170 HydrophobicContact CB-SD 3.9Å; M154-M170 HydrophobicContact CE-CG 4.36Å; M154-M170 HydrophobicContact CE-SD 3.88Å; M154-M170 WeakPolarHBondContact O-CG 3.41Å
155	A	98.6	Very high	95.4	Very high	0 Å²	0	18.1 Å²	18.1	0%	0	14%	0.136	C	C	.	.	H	α-helix	trans	-64.2	-46.2	175	0	0	0	0	0	110.9	L151 C152 G153 T157 S158 M170 V174 L177 V210 G211 I219 T222	L151-A155 PolarHBondContact O-N 3.36Å; C152-A155 PolarHBondContact O-N 3.22Å; G153-A155 VanDerWaalsContact C-N 3.28Å; G153-A155 PolarHBondContact O-N 2.84Å; A155-T157 PolarHBondContact O-N 3.39Å; A155-S158 PolarHBondContact O-N 3.11Å; A155-S158 VanDerWaalsContact O-N 3.14Å; A155-M170 HydrophobicContact CB-CE 3.74Å; A155-V174 HydrophobicContact CB-CG2 3.96Å; A155-L177 HydrophobicContact CB-CD2 4.37Å; A155-V210 CarbonylContact O-C 3.57Å; A155-V210 VanDerWaalsContact O-CA 3.25Å; A155-V210 WeakPolarHBondContact O-CA 3.21Å; A155-G211 PolarHBondContact O-N 3.4Å; A155-I219 HydrophobicContact CB-CD1 4.08Å; A155-T222 HydrophobicContact CB-CG2 4.43Å
156	A	98.4	Very high	95.6	Very high	15 Å²	15	23.4 Å²	23.4	12%	0.124	15%	0.154	C	C	.	.	H	α-helix	trans	-60.1	-32	179	0	0	0	0	0	113	C152 G153 G211 S212 E213 I219	C152-A156 WeakPolarHBondContact O-CB 3.5Å; C152-A156 PolarHBondContact O-N 3.31Å; G153-A156 WeakPolarHBondContact O-CB 3.47Å; G153-A156 PolarHBondContact O-N 3.44Å; G153-A156 VanDerWaalsContact O-N 3.13Å; A156-G211 CarbonylContact O-C 3.59Å; A156-G211 WeakPolarHBondContact O-CA 3.4Å; A156-G211 PolarHBondContact O-N 3.4Å; A156-S212 PolarHBondContact O-N 3.05Å; A156-S212 VanDerWaalsContact O-N 3.15Å; A156-E213 WeakPolarHBondContact O-CA 3.49Å; A156-E213 PolarHBondContact O-N 2.87Å; A156-I219 HydrophobicContact CB-CD1 4.09Å
157	T	97.5	Very high	96.2	Very high	48 Å²	48	21.8 Å²	21.8	29%	0.294	13%	0.129	S	C	.	.	H	α-helix	trans	-97.2	0.1	178.3	63.6	0	0	0	0	113.9	G153 M154 A155 A159	G153-T157 PolarHBondContact O-N 3.07Å; G153-T157 PolarHBondContact O-OG1 2.78Å; M154-T157 PolarHBondContact O-N 3.29Å; M154-T157 PolarHBondContact O-OG1 2.84Å; A155-T157 PolarHBondContact O-N 3.39Å; T157-A159 VanDerWaalsContact C-N 3.26Å; T157-A159 PolarHBondContact O-N 3.27Å
158	S	97.4	Very high	96.6	Very high	33 Å²	33	20.8 Å²	20.8	23%	0.231	12%	0.123	C	C	.	.	T	Hydrogen-bonded Turn	trans	53.1	42.5	-171.5	-168.5	0	0	0	0	113.1	M154 A155	M154-S158 PolarHBondContact O-N 2.7Å; A155-S158 PolarHBondContact O-N 3.11Å; A155-S158 VanDerWaalsContact O-N 3.14Å
159	A	96.9	Very high	96.7	Very high	8 Å²	8	19.7 Å²	19.7	7%	0.066	12%	0.118	C	C	.	.			trans	-53.8	146.6	-173.9	0	0	0	0	0	113.5	M154 T157 M170	M154-A159 HydrophobicContact CB-CB 3.84Å; M154-A159 HydrophobicContact CE-CB 4.43Å; M154-A159 HydrophobicContact CG-CB 4.07Å; M154-A159 PolarHBondContact O-N 3.19Å; T157-A159 VanDerWaalsContact C-N 3.26Å; T157-A159 PolarHBondContact O-N 3.27Å; A159-M170 HydrophobicContact CB-CG 3.98Å; A159-M170 WeakPolarHBondContact O-CB 3.41Å; A159-M170 VanDerWaalsContact O-CG 3.25Å; A159-M170 WeakPolarHBondContact O-CG 3.29Å; A159-M170 PolarHBondContact O-N 3.36Å
160	S	95.1	Very high	96.8	Very high	7 Å²	7	19.2 Å²	19.2	5%	0.049	11%	0.114	C	C	.	.			trans	-108.9	-149.1	173.1	-165.4	0	0	0	0	110.2	V143 A164 E429	V143-S160 VanDerWaalsContact CG1-O 3.29Å; V143-S160 WeakPolarHBondContact CG1-O 3.04Å; S160-A164 WeakPolarHBondContact OG-CB 3.29Å; S160-E429 WeakPolarHBondContact CB-OE2 3.28Å
161	G	92.8	Very high	96.7	Very high	2 Å²	2	25.8 Å²	25.8	2%	0.021	14%	0.139	C	C	.	.			trans	154.3	-177.6	170.1	0	0	0	0	0	112	D144 N163 A164	D144-G161 WeakPolarHBondContact O-CA 3.43Å; G161-N163 PolarHBondContact O-N 2.93Å; G161-A164 VanDerWaalsContact O-CB 3.23Å; G161-A164 WeakPolarHBondContact O-CB 3.47Å; G161-A164 PolarHBondContact O-N 2.94Å
162	T	93.8	Very high	96.7	Very high	7 Å²	7	30.3 Å²	30.3	4%	0.043	16%	0.16	C	C	.	.	T	Hydrogen-bonded Turn	trans	-54.6	-26.5	-172.8	56	0	0	0	0	115.3	R262 E264 W331	T162-R262 WeakPolarHBondContact O-CG 3.1Å; T162-R262 PolarHBondContact OG1-NE 2.94Å; T162-E264 HydrophobicContact CG2-CG 4.31Å; T162-W331 HydrophobicContact CG2-CZ3 4.49Å
163	N	95.5	Very high	96.6	Very high	1 Å²	1	30.1 Å²	30.1	1%	0.005	16%	0.158	C	C	.	.	T	Hydrogen-bonded Turn	trans	-91.9	-2.9	-177.7	-79.9	-33.6	0	0	0	114.2	W140 P142 G161 V165 R166 Y167 R262	W140-N163 WeakPolarHBondContact CH2-ND2 3.41Å; P142-N163 WeakPolarHBondContact O-CB 3.11Å; P142-N163 PolarHBondContact O-ND2 3.1Å; G161-N163 PolarHBondContact O-N 2.93Å; N163-V165 VanDerWaalsContact C-N 3.29Å; N163-V165 PolarHBondContact O-N 2.89Å; N163-R166 PolarHBondContact O-N 2.95Å; N163-R166 VanDerWaalsContact O-N 3.12Å; N163-Y167 HydrophobicContact CB-CD2 3.99Å; N163-Y167 PolarHBondContact O-N 3.2Å; N163-R262 PolarHBondContact ND2-NH2 3.27Å; N163-R262 VanDerWaalsContact ND2-NH2 3.13Å; N163-R262 VanDerWaalsContact OD1-CG 3.32Å; N163-R262 WeakPolarHBondContact OD1-CG 3.43Å; N163-R262 PolarHBondContact OD1-NE 2.86Å
164	A	95.4	Very high	96.7	Very high	11 Å²	11	29.5 Å²	29.5	9%	0.091	15%	0.15	C	C	.	.	H	α-helix	trans	-62.8	-34.7	-171	0	0	0	0	0	112.9	S160 G161 R166 Y167 G168 T169	S160-A164 WeakPolarHBondContact OG-CB 3.29Å; G161-A164 VanDerWaalsContact O-CB 3.23Å; G161-A164 WeakPolarHBondContact O-CB 3.47Å; G161-A164 PolarHBondContact O-N 2.94Å; A164-R166 PolarHBondContact O-N 2.97Å; A164-R166 VanDerWaalsContact O-N 3.09Å; A164-Y167 PolarHBondContact O-N 3.04Å; A164-G168 VanDerWaalsContact O-CA 3.28Å; A164-G168 WeakPolarHBondContact O-CA 3.45Å; A164-G168 PolarHBondContact O-N 3.21Å; A164-T169 HydrophobicContact CB-CG2 4.14Å
165	V	95.7	Very high	96.6	Very high	42 Å²	42	30.6 Å²	30.6	26%	0.255	16%	0.156	S	C	.	.	H	α-helix	trans	-53.1	-32.9	175.6	67	0	0	0	0	112.8	N163 L254 I260 A261	N163-V165 VanDerWaalsContact C-N 3.29Å; N163-V165 PolarHBondContact O-N 2.89Å; V165-L254 HydrophobicContact CG2-CD2 3.78Å; V165-I260 HydrophobicContact CG1-CG2 4.38Å; V165-I260 HydrophobicContact CG2-CG2 4.22Å; V165-A261 WeakPolarHBondContact CG1-O 3.31Å
166	R	95.9	Very high	96.6	Very high	126 Å²	126	30.9 Å²	30.9	48%	0.475	16%	0.157	S	C	.	.	H	α-helix	trans	-100.2	-40.3	-178.9	-176.6	57.7	178.4	166.8	-2.6	113.8	N163 A164 P259 I260	N163-R166 PolarHBondContact O-N 2.95Å; N163-R166 VanDerWaalsContact O-N 3.12Å; A164-R166 PolarHBondContact O-N 2.97Å; A164-R166 VanDerWaalsContact O-N 3.09Å; R166-P259 VanDerWaalsContact NH1-CB 3.28Å; R166-I260 WeakPolarHBondContact CB-O 3.38Å
167	Y	96.6	Very high	96.6	Very high	26 Å²	26	30.2 Å²	30.2	10%	0.102	15%	0.151	C	C	.	.	H	α-helix	trans	-114.1	-0.3	-165.9	-60.8	-76.9	0	0	0	113.7	W140 P142 N163 A164 N173 Y227 H293	W140-Y167 HydrophobicContact CH2-CD2 4.41Å; W140-Y167 HydrophobicContact CH2-CE2 4.04Å; W140-Y167 HydrophobicContact CZ2-CD2 4.31Å; W140-Y167 HydrophobicContact CZ2-CE1 4.27Å; W140-Y167 AromaticContact CZ2-CE2 3.71Å; W140-Y167 HydrophobicContact CZ2-CE2 3.71Å; W140-Y167 AromaticContact CZ2-CZ 3.69Å; P142-Y167 HydrophobicContact CB-CD1 4.15Å; P142-Y167 HydrophobicContact CB-CD2 3.82Å; P142-Y167 HydrophobicContact CB-CG 3.6Å; P142-Y167 HydrophobicContact CG-CD1 4.25Å; P142-Y167 HydrophobicContact CG-CG 3.9Å; N163-Y167 HydrophobicContact CB-CD2 3.99Å; N163-Y167 PolarHBondContact O-N 3.2Å; A164-Y167 PolarHBondContact O-N 3.04Å; Y167-N173 PolarHBondContact O-ND2 3Å; Y167-Y227 AromaticContact CD1-CD1 3.6Å; Y167-Y227 HydrophobicContact CD1-CD1 3.6Å; Y167-Y227 HydrophobicContact CD1-CD2 4.34Å; Y167-Y227 AromaticContact CD1-CE1 3.74Å; Y167-Y227 HydrophobicContact CD1-CE1 3.74Å; Y167-Y227 HydrophobicContact CD1-CE2 4.46Å; Y167-Y227 AromaticContact CD1-CG 3.91Å; Y167-Y227 HydrophobicContact CD1-CG 3.91Å; Y167-Y227 AromaticContact CE1-CD1 3.94Å; Y167-Y227 HydrophobicContact CE1-CD1 3.94Å; Y167-Y227 HydrophobicContact CE1-CE1 4.48Å; Y167-Y227 HydrophobicContact CE1-CG 4.21Å; Y167-Y227 PolarHBondContact O-OH 2.96Å; Y167-H293 AromaticContact CE2-ND1 3.75Å; Y167-H293 AromaticContact CZ-ND1 3.76Å; Y167-H293 PolarHBondContact OH-ND1 2.81Å
168	G	96.4	Very high	96.7	Very high	16 Å²	16	28.6 Å²	28.6	17%	0.165	14%	0.14	C	C	.	.			trans	72.9	178.4	-174.8	0	0	0	0	0	113.2	A164 N173	A164-G168 VanDerWaalsContact O-CA 3.28Å; A164-G168 WeakPolarHBondContact O-CA 3.45Å; A164-G168 PolarHBondContact O-N 3.21Å; G168-N173 PolarHBondContact O-ND2 2.81Å
169	T	97.4	Very high	96.8	Very high	30 Å²	30	27 Å²	27	18%	0.184	13%	0.129	C	C	.	.			trans	-94.6	-172	-178.2	72.1	0	0	0	0	110.8	A164 R171 E172 N173	A164-T169 HydrophobicContact CB-CG2 4.14Å; T169-R171 PolarHBondContact O-N 3.01Å; T169-R171 VanDerWaalsContact OG1-CB 3.22Å; T169-R171 WeakPolarHBondContact OG1-CB 3.16Å; T169-R171 PolarHBondContact OG1-N 3.3Å; T169-E172 WeakPolarHBondContact CB-OE2 3.39Å; T169-E172 PolarHBondContact N-OE2 3.47Å; T169-E172 PolarHBondContact O-N 3.34Å; T169-E172 PolarHBondContact OG1-OE2 3.46Å; T169-N173 WeakPolarHBondContact O-CB 3.43Å; T169-N173 PolarHBondContact O-N 3.48Å; T169-N173 VanDerWaalsContact O-N 3.11Å; T169-N173 PolarHBondContact O-ND2 2.73Å
170	M	98.1	Very high	96.9	Very high	0 Å²	0	26.6 Å²	26.6	0%	0	13%	0.126	C	C	.	.	H	α-helix	trans	-56.1	-29.5	167.6	-71.9	-58.6	-71.8	0	0	113.1	F141 V143 L151 M154 A155 A159 E172 N173 V174 L224	F141-M170 HydrophobicContact CE1-SD 4.36Å; F141-M170 HydrophobicContact CZ-SD 3.67Å; V143-M170 HydrophobicContact CB-SD 4.3Å; V143-M170 HydrophobicContact CG1-CG 4.19Å; V143-M170 HydrophobicContact CG1-SD 4.23Å; V143-M170 HydrophobicContact CG2-SD 4.28Å; L151-M170 WeakPolarHBondContact O-CE 3.23Å; M154-M170 HydrophobicContact CB-CE 3.82Å; M154-M170 HydrophobicContact CB-CG 3.84Å; M154-M170 HydrophobicContact CB-SD 3.9Å; M154-M170 HydrophobicContact CE-CG 4.36Å; M154-M170 HydrophobicContact CE-SD 3.88Å; M154-M170 WeakPolarHBondContact O-CG 3.41Å; A155-M170 HydrophobicContact CB-CE 3.74Å; A159-M170 HydrophobicContact CB-CG 3.98Å; A159-M170 WeakPolarHBondContact O-CB 3.41Å; A159-M170 VanDerWaalsContact O-CG 3.25Å; A159-M170 WeakPolarHBondContact O-CG 3.29Å; A159-M170 PolarHBondContact O-N 3.36Å; M170-E172 VanDerWaalsContact C-N 3.28Å; M170-E172 PolarHBondContact O-N 3.13Å; M170-N173 PolarHBondContact O-N 2.94Å; M170-V174 HydrophobicContact CB-CG2 4.46Å; M170-V174 HydrophobicContact CE-CG2 3.54Å; M170-V174 WeakPolarHBondContact O-CB 3.43Å; M170-V174 WeakPolarHBondContact O-CG2 3.36Å; M170-V174 PolarHBondContact O-N 3.17Å; M170-L224 HydrophobicContact CE-CD2 3.86Å
171	R	96.8	Very high	97.1	Very high	140 Å²	140	27.2 Å²	27.2	53%	0.528	13%	0.129	S	C	.	.	H	α-helix	trans	-60.7	-36.1	177.1	-170.4	179.2	-163.5	-102	5.4	113.2	T169 N207	T169-R171 PolarHBondContact O-N 3.01Å; T169-R171 VanDerWaalsContact OG1-CB 3.22Å; T169-R171 WeakPolarHBondContact OG1-CB 3.16Å; T169-R171 PolarHBondContact OG1-N 3.3Å; R171-N207 PolarHBondContact O-OD1 2.96Å
172	E	96.9	Very high	97.3	Very high	95 Å²	95	27.2 Å²	27.2	44%	0.444	13%	0.128	S	C	.	.	H	α-helix	trans	-89.9	-25.7	179	-69.5	67	-133.5	0	0	112.3	T169 M170	T169-E172 WeakPolarHBondContact CB-OE2 3.39Å; T169-E172 PolarHBondContact N-OE2 3.47Å; T169-E172 PolarHBondContact O-N 3.34Å; T169-E172 PolarHBondContact OG1-OE2 3.46Å; M170-E172 VanDerWaalsContact C-N 3.28Å; M170-E172 PolarHBondContact O-N 3.13Å
173	N	98	Very high	97.5	Very high	0 Å²	0	30 Å²	30	0%	0	14%	0.143	C	C	.	.	H	α-helix	trans	-97.2	-14.4	-171	-72.4	-68	0	0	0	114.8	F141 V143 Y167 G168 T169 M170 L224 R225 Y227	F141-N173 HydrophobicContact CE2-CB 4.16Å; V143-N173 HydrophobicContact CG2-CB 4.18Å; V143-N173 WeakPolarHBondContact CG2-ND2 3.49Å; Y167-N173 PolarHBondContact O-ND2 3Å; G168-N173 PolarHBondContact O-ND2 2.81Å; T169-N173 WeakPolarHBondContact O-CB 3.43Å; T169-N173 PolarHBondContact O-N 3.48Å; T169-N173 VanDerWaalsContact O-N 3.11Å; T169-N173 PolarHBondContact O-ND2 2.73Å; M170-N173 PolarHBondContact O-N 2.94Å; N173-L224 WeakPolarHBondContact O-CA 3.48Å; N173-R225 PolarHBondContact O-N 2.93Å; N173-Y227 WeakPolarHBondContact OD1-CE2 3.43Å; N173-Y227 PolarHBondContact OD1-OH 3.44Å
174	V	98.4	Very high	97.7	Very high	10 Å²	10	30.2 Å²	30.2	6%	0.061	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.9	123.4	173.6	175.7	0	0	0	0	110.5	A155 M170 L177 T206 V210 T222 L224	A155-V174 HydrophobicContact CB-CG2 3.96Å; M170-V174 HydrophobicContact CB-CG2 4.46Å; M170-V174 HydrophobicContact CE-CG2 3.54Å; M170-V174 WeakPolarHBondContact O-CB 3.43Å; M170-V174 WeakPolarHBondContact O-CG2 3.36Å; M170-V174 PolarHBondContact O-N 3.17Å; V174-L177 HydrophobicContact CG1-CD1 4.3Å; V174-L177 HydrophobicContact CG1-CD2 3.62Å; V174-L177 HydrophobicContact CG1-CG 3.82Å; V174-T206 HydrophobicContact CB-CG2 4.39Å; V174-T206 HydrophobicContact CG1-CG2 3.58Å; V174-V210 HydrophobicContact CB-CG2 3.98Å; V174-V210 HydrophobicContact CG1-CG2 3.95Å; V174-V210 HydrophobicContact CG2-CG2 4.17Å; V174-T222 HydrophobicContact CG1-CG2 4.06Å; V174-T222 HydrophobicContact CG2-CG2 3.96Å; V174-L224 HydrophobicContact CG2-CD2 3.87Å
175	M	97.8	Very high	97.8	Very high	26 Å²	26	32.8 Å²	32.8	13%	0.128	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.3	-39.5	-178.8	-61.7	178	61.7	0	0	112.7	D118 R195 R197 T223 R225	D118-M175 HydrophobicContact CB-SD 3.97Å; M175-R195 HydrophobicContact CE-CB 4.2Å; M175-R195 WeakPolarHBondContact CE-O 3.41Å; M175-R197 PolarHBondContact SD-NH1 2.76Å; M175-T223 HydrophobicContact CB-CG2 4.27Å; M175-T223 PolarHBondContact N-O 3.41Å; M175-R225 HydrophobicContact SD-CB 4.36Å
176	N	98.4	Very high	98	Very high	6 Å²	6	33.5 Å²	33.5	3%	0.032	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-157.3	146.8	-175.1	-165.7	5	0	0	0	110.2	T189 A190 G191 R194 T223	N176-T189 PolarHBondContact OD1-N 2.89Å; N176-T189 PolarHBondContact OD1-OG1 2.77Å; N176-A190 HydrophobicContact CB-CB 3.99Å; N176-A190 WeakPolarHBondContact OD1-CB 3.38Å; N176-A190 PolarHBondContact OD1-N 3.29Å; N176-G191 PolarHBondContact ND2-O 2.92Å; N176-R194 PolarHBondContact ND2-O 3.47Å; N176-T223 PolarHBondContact O-N 3Å
177	L	98.8	Very high	98.1	Very high	1 Å²	1	29.5 Å²	29.5	1%	0.005	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	135.6	178.6	-59.9	171.7	0	0	0	110	A155 V174 V179 H188 T189 T206 F209 V210 I219 K221 T222	A155-L177 HydrophobicContact CB-CD2 4.37Å; V174-L177 HydrophobicContact CG1-CD1 4.3Å; V174-L177 HydrophobicContact CG1-CD2 3.62Å; V174-L177 HydrophobicContact CG1-CG 3.82Å; L177-V179 HydrophobicContact CB-CG2 3.77Å; L177-H188 CarbonylContact O-C 3.44Å; L177-H188 VanDerWaalsContact O-CA 3.28Å; L177-H188 WeakPolarHBondContact O-CA 3.34Å; L177-T189 HydrophobicContact CB-CG2 3.86Å; L177-T189 HydrophobicContact CD1-CG2 4.47Å; L177-T189 PolarHBondContact N-OG1 3.21Å; L177-T189 PolarHBondContact O-N 2.76Å; L177-T206 HydrophobicContact CD1-CG2 4.42Å; L177-T206 HydrophobicContact CG-CG2 4.39Å; L177-F209 HydrophobicContact CD1-CB 3.66Å; L177-V210 HydrophobicContact CD1-CG2 4.2Å; L177-I219 HydrophobicContact CD1-CD1 4.18Å; L177-I219 HydrophobicContact CD2-CD1 4.38Å; L177-I219 HydrophobicContact CD2-CG2 3.88Å; L177-K221 WeakPolarHBondContact CA-O 3.06Å; L177-T222 HydrophobicContact CD2-CG2 3.72Å; L177-T222 VanDerWaalsContact CD2-OG1 3.28Å; L177-T222 WeakPolarHBondContact CD2-OG1 3.4Å
178	E	98.9	Very high	98.2	Very high	13 Å²	13	30.7 Å²	30.7	6%	0.061	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.1	123.7	159.5	-170.1	-171.2	79.2	0	0	107.2	V62 V186 I187 H188 T220 K221	V62-E178 WeakPolarHBondContact CB-OE1 3.44Å; V62-E178 VanDerWaalsContact CG2-OE1 3.31Å; V62-E178 WeakPolarHBondContact CG2-OE1 3.38Å; E178-V186 HydrophobicContact CG-CG1 3.75Å; E178-I187 WeakPolarHBondContact CA-O 3.26Å; E178-H188 IonicContact OE2-NE2 2.82Å; E178-T220 WeakPolarHBondContact CG-OG1 3.31Å; E178-T220 PolarHBondContact O-N 2.74Å; E178-T220 PolarHBondContact O-OG1 3.32Å; E178-T220 PolarHBondContact OE1-OG1 2.88Å; E178-K221 HydrophobicContact CB-CB 3.75Å; E178-K221 HydrophobicContact CB-CD 4.31Å; E178-K221 HydrophobicContact CB-CG 4.12Å; E178-K221 PolarHBondContact N-O 2.83Å; E178-K221 PolarHBondContact O-N 3.04Å; E178-K221 WeakPolarHBondContact OE1-CE 3Å; E178-K221 IonicContact OE1-NZ 3.78Å; E178-K221 WeakPolarHBondContact OE2-CE 3.48Å; E178-K221 IonicContact OE2-NZ 3.99Å; E178-K221 PolarHBondContact OE2-NZ 3Å
179	V	98.9	Very high	98.3	Very high	0 Å²	0	30.5 Å²	30.5	0%	0	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.5	133.2	-172.9	-175	0	0	0	0	110.4	L177 L181 V186 I187 T189 F209 I218 I219	L177-V179 HydrophobicContact CB-CG2 3.77Å; V179-L181 HydrophobicContact CG1-CD2 4.38Å; V179-V186 WeakPolarHBondContact O-CA 3.4Å; V179-I187 HydrophobicContact CB-CD1 4.5Å; V179-I187 HydrophobicContact CB-CG1 3.95Å; V179-I187 PolarHBondContact N-O 3.36Å; V179-I187 PolarHBondContact O-N 2.77Å; V179-T189 HydrophobicContact CG2-CG2 4.25Å; V179-F209 HydrophobicContact CB-CE1 4.47Å; V179-F209 HydrophobicContact CG1-CD1 3.88Å; V179-F209 HydrophobicContact CG1-CE1 3.69Å; V179-F209 HydrophobicContact CG1-CZ 4.34Å; V179-F209 HydrophobicContact CG2-CD1 4.19Å; V179-F209 HydrophobicContact CG2-CG 4.19Å; V179-I218 CarbonylContact C-O 3.1Å; V179-I218 VanDerWaalsContact CA-O 3.31Å; V179-I218 WeakPolarHBondContact CA-O 3.3Å; V179-I219 HydrophobicContact CG2-CG1 4.32Å
180	V	98.9	Very high	98.2	Very high	0 Å²	0	30.8 Å²	30.8	0%	0	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.8	116.8	169.3	-179.5	0	0	0	0	109.5	V62 V65 A69 T185 V186 G217 I218 T220	V62-V180 HydrophobicContact CG2-CG2 3.82Å; V65-V180 HydrophobicContact CB-CG2 4.21Å; V65-V180 HydrophobicContact CG1-CB 3.95Å; V65-V180 HydrophobicContact CG1-CG1 4.12Å; V65-V180 HydrophobicContact CG1-CG2 3.75Å; A69-V180 HydrophobicContact CB-CG1 3.91Å; V180-T185 WeakPolarHBondContact CA-O 3.46Å; V180-V186 HydrophobicContact CG2-CG2 4.25Å; V180-G217 CarbonylContact O-C 3.49Å; V180-G217 WeakPolarHBondContact O-CA 3.46Å; V180-I218 HydrophobicContact CB-CB 4.27Å; V180-I218 PolarHBondContact N-O 3.33Å; V180-I218 PolarHBondContact O-N 3.2Å; V180-T220 HydrophobicContact CG2-CG2 3.74Å
181	L	98.8	Very high	98.1	Very high	20 Å²	20	32.1 Å²	32.1	11%	0.105	17%	0.173	C	C	.	.			trans	-76.1	170.4	176.9	-59	-177.1	0	0	0	111.9	V179 N183 G184 T185 I187 F209 L459	V179-L181 HydrophobicContact CG1-CD2 4.38Å; L181-N183 PolarHBondContact O-N 2.93Å; L181-G184 PolarHBondContact O-N 3.2Å; L181-T185 PolarHBondContact N-O 2.76Å; L181-I187 HydrophobicContact CD1-CD1 4.48Å; L181-I187 HydrophobicContact CD1-CG2 4.03Å; L181-I187 HydrophobicContact CD2-CD1 4.03Å; L181-I187 HydrophobicContact CD2-CG1 4.42Å; L181-I187 HydrophobicContact CG-CD1 4.43Å; L181-I187 HydrophobicContact CG-CG1 4.47Å; L181-I187 HydrophobicContact CG-CG2 4.4Å; L181-F209 HydrophobicContact CD2-CE1 4.09Å; L181-F209 HydrophobicContact CD2-CZ 3.91Å; L181-L459 HydrophobicContact CD1-CD2 4.38Å; L181-L459 HydrophobicContact CD2-CD2 4.41Å
182	S	98	Very high	98.1	Very high	1 Å²	1	33.7 Å²	33.7	1%	0.007	18%	0.183	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.1	-14.3	-174.1	78.4	0	0	0	0	115.4	H73 D460	H73-S182 WeakPolarHBondContact CB-O 3.33Å; H73-S182 PolarHBondContact ND1-O 3.4Å; S182-D460 WeakPolarHBondContact CB-OD1 3.31Å; S182-D460 PolarHBondContact OG-OD1 3.25Å
183	N	98.2	Very high	97.9	Very high	67 Å²	67	32.2 Å²	32.2	36%	0.358	19%	0.194	S	C	.	.	T	Hydrogen-bonded Turn	trans	-96.6	4.1	173.5	69.3	-1.2	0	0	0	113.7	L181 T185	L181-N183 PolarHBondContact O-N 2.93Å; N183-T185 VanDerWaalsContact CG-OG1 3.3Å; N183-T185 PolarHBondContact ND2-OG1 2.76Å; N183-T185 WeakPolarHBondContact OD1-CB 3.33Å; N183-T185 PolarHBondContact OD1-N 3.12Å; N183-T185 PolarHBondContact OD1-OG1 3.45Å
184	G	98.6	Very high	97.7	Very high	5 Å²	5	39.9 Å²	39.9	5%	0.052	22%	0.223	C	C	.	.	S	Bend	trans	87.3	-2	-176.1	0	0	0	0	0	115	S66 L181 V186	S66-G184 WeakPolarHBondContact CB-O 3.43Å; S66-G184 WeakPolarHBondContact O-CA 3.15Å; S66-G184 PolarHBondContact OG-O 3.22Å; L181-G184 PolarHBondContact O-N 3.2Å; G184-V186 PolarHBondContact O-N 3.05Å
185	T	98.7	Very high	97.5	Very high	65 Å²	65	42.8 Å²	42.8	40%	0.399	23%	0.233	S	C	.	.			trans	-65.4	131	177.8	-56.6	0	0	0	0	110.7	V180 L181 N183 I187	V180-T185 WeakPolarHBondContact CA-O 3.46Å; L181-T185 PolarHBondContact N-O 2.76Å; N183-T185 VanDerWaalsContact CG-OG1 3.3Å; N183-T185 PolarHBondContact ND2-OG1 2.76Å; N183-T185 WeakPolarHBondContact OD1-CB 3.33Å; N183-T185 PolarHBondContact OD1-N 3.12Å; N183-T185 PolarHBondContact OD1-OG1 3.45Å; T185-I187 HydrophobicContact CG2-CG2 4.13Å
186	V	98.8	Very high	97.3	Very high	56 Å²	56	44.5 Å²	44.5	34%	0.339	25%	0.246	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.9	125.1	174	-173.3	0	0	0	0	109.3	V62 E178 V179 V180 G184	V62-V186 HydrophobicContact CG2-CG1 4.05Å; V62-V186 HydrophobicContact CG2-CG2 3.91Å; E178-V186 HydrophobicContact CG-CG1 3.75Å; V179-V186 WeakPolarHBondContact O-CA 3.4Å; V180-V186 HydrophobicContact CG2-CG2 4.25Å; G184-V186 PolarHBondContact O-N 3.05Å
187	I	98.4	Very high	97	Very high	42 Å²	42	49.6 Å²	49.6	22%	0.215	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121	161.2	174.2	67.3	165.6	0	0	0	111	E178 V179 L181 T185 F209	E178-I187 WeakPolarHBondContact CA-O 3.26Å; V179-I187 HydrophobicContact CB-CD1 4.5Å; V179-I187 HydrophobicContact CB-CG1 3.95Å; V179-I187 PolarHBondContact N-O 3.36Å; V179-I187 PolarHBondContact O-N 2.77Å; L181-I187 HydrophobicContact CD1-CD1 4.48Å; L181-I187 HydrophobicContact CD1-CG2 4.03Å; L181-I187 HydrophobicContact CD2-CD1 4.03Å; L181-I187 HydrophobicContact CD2-CG1 4.42Å; L181-I187 HydrophobicContact CG-CD1 4.43Å; L181-I187 HydrophobicContact CG-CG1 4.47Å; L181-I187 HydrophobicContact CG-CG2 4.4Å; T185-I187 HydrophobicContact CG2-CG2 4.13Å; I187-F209 HydrophobicContact CD1-CE2 3.74Å; I187-F209 HydrophobicContact CD1-CZ 3.71Å
188	H	98.4	Very high	96.7	Very high	52 Å²	52	58.6 Å²	58.6	24%	0.241	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	119.5	171.3	-62.2	70.6	0	0	0	108.6	L177 E178 A190 G191	L177-H188 CarbonylContact O-C 3.44Å; L177-H188 VanDerWaalsContact O-CA 3.28Å; L177-H188 WeakPolarHBondContact O-CA 3.34Å; E178-H188 IonicContact OE2-NE2 2.82Å; H188-A190 VanDerWaalsContact C-N 3.3Å; H188-A190 PolarHBondContact O-N 2.84Å; H188-G191 VanDerWaalsContact CB-C 3.46Å; H188-G191 PolarHBondContact O-N 3.24Å; H188-G191 VanDerWaalsContact O-N 3.14Å
189	T	98	Very high	96.4	Very high	12 Å²	12	62.6 Å²	62.6	7%	0.074	33%	0.329	C	S	.	.	T	Hydrogen-bonded Turn	trans	-67.9	-27.6	-167.4	59.2	0	0	0	0	114	N176 L177 V179 L205 T206 F209	N176-T189 PolarHBondContact OD1-N 2.89Å; N176-T189 PolarHBondContact OD1-OG1 2.77Å; L177-T189 HydrophobicContact CB-CG2 3.86Å; L177-T189 HydrophobicContact CD1-CG2 4.47Å; L177-T189 PolarHBondContact N-OG1 3.21Å; L177-T189 PolarHBondContact O-N 2.76Å; V179-T189 HydrophobicContact CG2-CG2 4.25Å; T189-L205 HydrophobicContact CG2-CB 4.25Å; T189-T206 WeakPolarHBondContact CB-OG1 3.46Å; T189-T206 PolarHBondContact OG1-OG1 2.89Å; T189-F209 HydrophobicContact CG2-CD2 3.56Å; T189-F209 HydrophobicContact CG2-CE2 4.05Å; T189-F209 HydrophobicContact CG2-CG 4.38Å
190	A	96.5	Very high	96.2	Very high	35 Å²	35	68.8 Å²	68.8	29%	0.289	37%	0.373	S	S	.	.	T	Hydrogen-bonded Turn	trans	-112.9	9.1	173.4	0	0	0	0	0	113	N176 H188 R194	N176-A190 HydrophobicContact CB-CB 3.99Å; N176-A190 WeakPolarHBondContact OD1-CB 3.38Å; N176-A190 PolarHBondContact OD1-N 3.29Å; H188-A190 VanDerWaalsContact C-N 3.3Å; H188-A190 PolarHBondContact O-N 2.84Å; A190-R194 WeakPolarHBondContact O-CB 3.25Å; A190-R194 WeakPolarHBondContact O-CG 3.44Å
191	G	95.9	Very high	95.9	Very high	28 Å²	28	73 Å²	73	29%	0.289	41%	0.407	S	S	.	.			trans	93.4	153.3	-173	0	0	0	0	0	113.7	N176 H188 G193 R194	N176-G191 PolarHBondContact ND2-O 2.92Å; H188-G191 VanDerWaalsContact CB-C 3.46Å; H188-G191 PolarHBondContact O-N 3.24Å; H188-G191 VanDerWaalsContact O-N 3.14Å; G191-G193 PolarHBondContact O-N 3.42Å; G191-R194 WeakPolarHBondContact O-CB 3.33Å; G191-R194 PolarHBondContact O-N 3.31Å
192	K	96.1	Very high	95.7	Very high	173 Å²	173	75.2 Å²	75.2	75%	0.752	44%	0.435	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.2	125.6	-174.8	-173.7	171.5	-175.6	176.7	0	111.9	R194	K192-R194 PolarHBondContact O-N 3.1Å
193	G	92.5	Very high	95.6	Very high	65 Å²	65	85.4 Å²	85.4	67%	0.67	48%	0.475	S	S	*	.	T	Hydrogen-bonded Turn	trans	64.2	15.2	179.8	0	0	0	0	0	114.9	G191	G191-G193 PolarHBondContact O-N 3.42Å
194	R	94.9	Very high	95.5	Very high	161 Å²	161	87 Å²	87	61%	0.608	48%	0.483	S	S	*	.			trans	-86.3	133.7	-179.1	-61.6	-57	-175.3	-178	-0.9	110.8	N176 A190 G191 K192 P196	N176-R194 PolarHBondContact ND2-O 3.47Å; A190-R194 WeakPolarHBondContact O-CB 3.25Å; A190-R194 WeakPolarHBondContact O-CG 3.44Å; G191-R194 WeakPolarHBondContact O-CB 3.33Å; G191-R194 PolarHBondContact O-N 3.31Å; K192-R194 PolarHBondContact O-N 3.1Å; R194-P196 VanDerWaalsContact C-CD 3.49Å
195	R	94.6	Very high	95.4	Very high	70 Å²	70	89.9 Å²	89.9	26%	0.264	50%	0.497	S	S	.	.			trans	-134.3	34.8	-178.3	-49.5	-175.8	-77.1	103.2	-6.9	113.5	H113 D116 D118 M175 T223	H113-R195 PolarHBondContact CD2-NH2 3.39Å; H113-R195 VanDerWaalsContact CD2-NH2 3.31Å; H113-R195 VanDerWaalsContact CE1-CZ 3.47Å; H113-R195 PolarHBondContact CE1-NE 3.3Å; H113-R195 PolarHBondContact ND1-NE 2.82Å; H113-R195 PolarHBondContact NE2-NH2 2.99Å; D116-R195 IonicContact OD2-CZ 2.81Å; D116-R195 IonicContact OD2-NH1 3.43Å; D116-R195 PolarHBondContact OD2-NH1 2.9Å; D116-R195 IonicContact OD2-NH2 3.46Å; D116-R195 PolarHBondContact OD2-NH2 2.66Å; D118-R195 VanDerWaalsContact OD1-CD 3.25Å; D118-R195 WeakPolarHBondContact OD1-CD 3.28Å; D118-R195 IonicContact OD1-CZ 3.5Å; D118-R195 IonicContact OD1-NE 3.41Å; D118-R195 IonicContact OD1-NH1 3.44Å; D118-R195 IonicContact OD2-CZ 2.71Å; D118-R195 IonicContact OD2-NH1 2.73Å; D118-R195 PolarHBondContact OD2-NH1 2.81Å; M175-R195 HydrophobicContact CE-CB 4.2Å; M175-R195 WeakPolarHBondContact CE-O 3.41Å; R195-T223 HydrophobicContact CG-CG2 4.18Å
196	P	93.7	Very high	95.4	Very high	62 Å²	62	87.1 Å²	87.1	40%	0.403	48%	0.481	S	S	.	.			trans	-70.3	140.5	-178.2	32.4	-35.9	0	0	0	111	R194 K198	R194-P196 VanDerWaalsContact C-CD 3.49Å; P196-K198 VanDerWaalsContact C-N 3.27Å; P196-K198 PolarHBondContact O-N 3.49Å
197	R	91	Very high	95.3	Very high	113 Å²	113	86.8 Å²	86.8	43%	0.426	48%	0.477	S	S	.	.	S	Bend	trans	-70.5	-24.3	173.1	-65.6	-60.7	-171.9	-178.9	3.8	113.7	D116 F117 M175 R225	D116-R197 PolarHBondContact O-NH2 2.82Å; F117-R197 VanDerWaalsContact C-NH2 3.31Å; F117-R197 PolarHBondContact O-NH2 3.47Å; M175-R197 PolarHBondContact SD-NH1 2.76Å; R197-R225 VanDerWaalsContact NH1-CB 3.32Å; R197-R225 VanDerWaalsContact NH1-CD 3.3Å
198	K	92.4	Very high	95.3	Very high	191 Å²	191	87 Å²	87	83%	0.83	48%	0.478	S	S	*	.			trans	-141.2	136.4	-178	-63.9	178	64.2	176.2	0	108.7	P196	P196-K198 VanDerWaalsContact C-N 3.27Å; P196-K198 PolarHBondContact O-N 3.49Å
199	T	92.4	Very high	95.3	Very high	96 Å²	96	84.7 Å²	84.7	59%	0.589	47%	0.467	S	S	*	.			trans	-149.9	144.8	175.1	-179.1	0	0	0	0	110	A201	T199-A201 PolarHBondContact OG1-N 3.39Å; T199-A201 VanDerWaalsContact OG1-N 3.16Å
200	S	94.4	Very high	95.3	Very high	131 Å²	131	84.7 Å²	84.7	92%	0.916	47%	0.468	S	S	*	.			trans	-126.2	21	167.8	-53.5	0	0	0	0	110.3	G202	S200-G202 PolarHBondContact O-N 3.07Å; S200-G202 VanDerWaalsContact O-N 3.13Å
201	A	93	Very high	95.4	Very high	87 Å²	87	84.4 Å²	84.4	72%	0.719	47%	0.468	S	S	*	.	S	Bend	trans	-81.9	87.3	-178.8	0	0	0	0	0	110.6	T199	T199-A201 PolarHBondContact OG1-N 3.39Å; T199-A201 VanDerWaalsContact OG1-N 3.16Å
202	G	94.9	Very high	95.5	Very high	68 Å²	68	83.4 Å²	83.4	70%	0.701	46%	0.456	S	S	*	.	S	Bend	trans	77	-155.8	175.2	0	0	0	0	0	114.1	S200	S200-G202 PolarHBondContact O-N 3.07Å; S200-G202 VanDerWaalsContact O-N 3.13Å
203	Y	95.9	Very high	95.6	Very high	214 Å²	214	76.1 Å²	76.1	84%	0.839	43%	0.425	S	S	*	.			trans	-74.9	146.3	-177.4	-52.9	-40.3	0	0	0	112.1	L205	Y203-L205 VanDerWaalsContact C-N 3.31Å; Y203-L205 PolarHBondContact O-N 3.09Å
204	N	95.9	Very high	95.8	Very high	100 Å²	100	73.3 Å²	73.3	54%	0.535	40%	0.396	S	S	.	.			trans	-78.7	80	174.3	-174.3	-7.4	0	0	0	110.6	T206 N207	N204-T206 VanDerWaalsContact C-N 3.26Å; N204-T206 PolarHBondContact O-N 3.36Å; N204-T206 PolarHBondContact OD1-N 3.07Å; N204-N207 PolarHBondContact ND2-ND2 2.95Å; N204-N207 VanDerWaalsContact ND2-ND2 3.14Å; N204-N207 PolarHBondContact OD1-N 3.29Å; N204-N207 VanDerWaalsContact OD1-N 3.07Å
205	L	97.4	Very high	96	Very high	66 Å²	66	66.1 Å²	66.1	35%	0.346	37%	0.37	S	S	.	.			trans	-66.2	-29.1	175.9	-63.4	-179	0	0	0	112	T189 Y203 N207 L208 F209	T189-L205 HydrophobicContact CG2-CB 4.25Å; Y203-L205 VanDerWaalsContact C-N 3.31Å; Y203-L205 PolarHBondContact O-N 3.09Å; L205-N207 VanDerWaalsContact C-N 3.34Å; L205-N207 PolarHBondContact O-N 3.37Å; L205-L208 HydrophobicContact CD2-CD2 4.19Å; L205-L208 WeakPolarHBondContact O-CB 3.43Å; L205-L208 PolarHBondContact O-N 3.14Å; L205-F209 VanDerWaalsContact O-CD2 3.28Å; L205-F209 WeakPolarHBondContact O-CD2 3.28Å; L205-F209 PolarHBondContact O-N 3.39Å
206	T	97.8	Very high	96.2	Very high	8 Å²	8	63.4 Å²	63.4	5%	0.049	36%	0.361	C	S	.	.	H	α-helix	trans	-57.1	-50.3	-179.7	-60.8	0	0	0	0	110.3	V174 L177 T189 N204 L208 F209 V210	V174-T206 HydrophobicContact CB-CG2 4.39Å; V174-T206 HydrophobicContact CG1-CG2 3.58Å; L177-T206 HydrophobicContact CD1-CG2 4.42Å; L177-T206 HydrophobicContact CG-CG2 4.39Å; T189-T206 WeakPolarHBondContact CB-OG1 3.46Å; T189-T206 PolarHBondContact OG1-OG1 2.89Å; N204-T206 VanDerWaalsContact C-N 3.26Å; N204-T206 PolarHBondContact O-N 3.36Å; N204-T206 PolarHBondContact OD1-N 3.07Å; T206-L208 PolarHBondContact O-N 3.14Å; T206-F209 PolarHBondContact O-N 2.76Å; T206-F209 VanDerWaalsContact O-N 3.12Å; T206-V210 HydrophobicContact CG2-CG2 4.41Å; T206-V210 WeakPolarHBondContact O-CG2 3.46Å; T206-V210 PolarHBondContact O-N 3.29Å
207	N	96.9	Very high	96.4	Very high	48 Å²	48	60.5 Å²	60.5	26%	0.257	34%	0.342	S	S	.	.	H	α-helix	trans	-76.4	-6.8	179.2	-71.4	-5.1	0	0	0	114.3	R171 N204 L205	R171-N207 PolarHBondContact O-OD1 2.96Å; N204-N207 PolarHBondContact ND2-ND2 2.95Å; N204-N207 VanDerWaalsContact ND2-ND2 3.14Å; N204-N207 PolarHBondContact OD1-N 3.29Å; N204-N207 VanDerWaalsContact OD1-N 3.07Å; L205-N207 VanDerWaalsContact C-N 3.34Å; L205-N207 PolarHBondContact O-N 3.37Å
208	L	97.6	Very high	96.8	Very high	48 Å²	48	55.1 Å²	55.1	25%	0.251	32%	0.322	S	S	.	.	H	α-helix	trans	-75	-34	166.8	178	63.1	0	0	0	111.3	L205 T206 L216 L455 L459	L205-L208 HydrophobicContact CD2-CD2 4.19Å; L205-L208 WeakPolarHBondContact O-CB 3.43Å; L205-L208 PolarHBondContact O-N 3.14Å; T206-L208 PolarHBondContact O-N 3.14Å; L208-L216 HydrophobicContact CD1-CD1 3.92Å; L208-L216 HydrophobicContact CG-CD1 3.91Å; L208-L455 HydrophobicContact CD1-CD1 3.89Å; L208-L459 HydrophobicContact CD2-CD1 4.23Å
209	F	98.6	Very high	97.1	Very high	2 Å²	2	46.5 Å²	46.5	1%	0.009	28%	0.284	C	S	.	.	H	α-helix	trans	-90.6	-28.3	179.2	-72.8	-83.5	0	0	0	113.2	L177 V179 L181 I187 T189 L205 T206 G211 S212 L216 L459	L177-F209 HydrophobicContact CD1-CB 3.66Å; V179-F209 HydrophobicContact CB-CE1 4.47Å; V179-F209 HydrophobicContact CG1-CD1 3.88Å; V179-F209 HydrophobicContact CG1-CE1 3.69Å; V179-F209 HydrophobicContact CG1-CZ 4.34Å; V179-F209 HydrophobicContact CG2-CD1 4.19Å; V179-F209 HydrophobicContact CG2-CG 4.19Å; L181-F209 HydrophobicContact CD2-CE1 4.09Å; L181-F209 HydrophobicContact CD2-CZ 3.91Å; I187-F209 HydrophobicContact CD1-CE2 3.74Å; I187-F209 HydrophobicContact CD1-CZ 3.71Å; T189-F209 HydrophobicContact CG2-CD2 3.56Å; T189-F209 HydrophobicContact CG2-CE2 4.05Å; T189-F209 HydrophobicContact CG2-CG 4.38Å; L205-F209 VanDerWaalsContact O-CD2 3.28Å; L205-F209 WeakPolarHBondContact O-CD2 3.28Å; L205-F209 PolarHBondContact O-N 3.39Å; T206-F209 PolarHBondContact O-N 2.76Å; T206-F209 VanDerWaalsContact O-N 3.12Å; F209-G211 PolarHBondContact O-N 2.99Å; F209-S212 VanDerWaalsContact O-CB 3.28Å; F209-S212 WeakPolarHBondContact O-CB 3.4Å; F209-S212 PolarHBondContact O-N 2.99Å; F209-S212 VanDerWaalsContact O-N 3.13Å; F209-S212 PolarHBondContact O-OG 3.49Å; F209-L216 HydrophobicContact CD1-CB 3.91Å; F209-L216 HydrophobicContact CE1-CB 3.64Å; F209-L459 HydrophobicContact CZ-CD1 4.12Å
210	V	98.6	Very high	97.4	Very high	13 Å²	13	41.9 Å²	41.9	8%	0.079	26%	0.256	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.6	125.1	169.7	176	0	0	0	0	109.2	A155 V174 L177 T206 S212	A155-V210 CarbonylContact O-C 3.57Å; A155-V210 VanDerWaalsContact O-CA 3.25Å; A155-V210 WeakPolarHBondContact O-CA 3.21Å; V174-V210 HydrophobicContact CB-CG2 3.98Å; V174-V210 HydrophobicContact CG1-CG2 3.95Å; V174-V210 HydrophobicContact CG2-CG2 4.17Å; L177-V210 HydrophobicContact CD1-CG2 4.2Å; T206-V210 HydrophobicContact CG2-CG2 4.41Å; T206-V210 WeakPolarHBondContact O-CG2 3.46Å; T206-V210 PolarHBondContact O-N 3.29Å; V210-S212 VanDerWaalsContact C-N 3.3Å
211	G	97.8	Very high	97.6	Very high	28 Å²	28	38.2 Å²	38.2	29%	0.289	22%	0.224	S	C	.	.	T	Hydrogen-bonded Turn	trans	78.9	5.9	-174.7	0	0	0	0	0	115.1	A155 A156 F209 E213	A155-G211 PolarHBondContact O-N 3.4Å; A156-G211 CarbonylContact O-C 3.59Å; A156-G211 WeakPolarHBondContact O-CA 3.4Å; A156-G211 PolarHBondContact O-N 3.4Å; F209-G211 PolarHBondContact O-N 2.99Å; G211-E213 PolarHBondContact O-N 2.98Å
212	S	98.1	Very high	97.9	Very high	7 Å²	7	34 Å²	34	5%	0.049	19%	0.19	C	C	.	.			trans	-75.6	-7.4	179.3	67.9	0	0	0	0	114.6	A156 F209 V210 G214 T215 I470	A156-S212 PolarHBondContact O-N 3.05Å; A156-S212 VanDerWaalsContact O-N 3.15Å; F209-S212 VanDerWaalsContact O-CB 3.28Å; F209-S212 WeakPolarHBondContact O-CB 3.4Å; F209-S212 PolarHBondContact O-N 2.99Å; F209-S212 VanDerWaalsContact O-N 3.13Å; F209-S212 PolarHBondContact O-OG 3.49Å; V210-S212 VanDerWaalsContact C-N 3.3Å; S212-G214 PolarHBondContact O-N 3.3Å; S212-G214 VanDerWaalsContact O-N 3.08Å; S212-T215 WeakPolarHBondContact O-CB 3.22Å; S212-T215 WeakPolarHBondContact O-CG2 3.4Å; S212-T215 PolarHBondContact O-N 3.06Å; S212-T215 PolarHBondContact O-OG1 3.49Å; S212-I470 WeakPolarHBondContact O-CD1 3.42Å
213	E	98.4	Very high	98.1	Very high	20 Å²	20	31.3 Å²	31.3	9%	0.093	16%	0.159	C	C	.	.	T	Hydrogen-bonded Turn	trans	49.5	34.5	-177.2	-58.3	178.3	-134.8	0	0	113.8	A156 G211 T215 V432 G433 N466 I470	A156-E213 WeakPolarHBondContact O-CA 3.49Å; A156-E213 PolarHBondContact O-N 2.87Å; G211-E213 PolarHBondContact O-N 2.98Å; E213-T215 PolarHBondContact O-N 3.32Å; E213-V432 PolarHBondContact OE1-N 3.19Å; E213-G433 PolarHBondContact OE1-N 3.29Å; E213-G433 WeakPolarHBondContact OE2-CA 3.37Å; E213-G433 PolarHBondContact OE2-N 2.83Å; E213-N466 PolarHBondContact O-ND2 3.5Å; E213-I470 HydrophobicContact CB-CD1 3.81Å; E213-I470 HydrophobicContact CB-CG1 4.26Å; E213-I470 HydrophobicContact CG-CD1 3.82Å; E213-I470 HydrophobicContact CG-CG1 4.32Å
214	G	98.1	Very high	98.2	Very high	6 Å²	6	21.1 Å²	21.1	6%	0.062	12%	0.119	C	C	.	.	T	Hydrogen-bonded Turn	trans	67.2	16.7	-178.9	0	0	0	0	0	113.6	S212 G217 M465 N466	S212-G214 PolarHBondContact O-N 3.3Å; S212-G214 VanDerWaalsContact O-N 3.08Å; G214-G217 WeakPolarHBondContact CA-O 3.44Å; G214-M465 VanDerWaalsContact O-CG 3.23Å; G214-M465 WeakPolarHBondContact O-CG 3.48Å; G214-N466 WeakPolarHBondContact O-CB 3.5Å
215	T	98.6	Very high	98.3	Very high	10 Å²	10	21.1 Å²	21.1	6%	0.061	11%	0.112	C	C	.	.	S	Bend	trans	-80.9	-19.9	175.9	66.6	0	0	0	0	112.3	S212 E213 K456 M465 N466 K469 I470	S212-T215 WeakPolarHBondContact O-CB 3.22Å; S212-T215 WeakPolarHBondContact O-CG2 3.4Å; S212-T215 PolarHBondContact O-N 3.06Å; S212-T215 PolarHBondContact O-OG1 3.49Å; E213-T215 PolarHBondContact O-N 3.32Å; T215-K456 WeakPolarHBondContact O-CD 3.35Å; T215-K456 PolarHBondContact O-NZ 2.81Å; T215-M465 WeakPolarHBondContact O-CB 3.49Å; T215-N466 HydrophobicContact CG2-CB 4.26Å; T215-K469 HydrophobicContact CG2-CB 4.35Å; T215-I470 HydrophobicContact CG2-CB 4.44Å; T215-I470 HydrophobicContact CG2-CD1 4.16Å; T215-I470 HydrophobicContact CG2-CG1 4.16Å
216	L	98.5	Very high	98.3	Very high	13 Å²	13	18.1 Å²	18.1	7%	0.068	10%	0.096	C	C	.	.	S	Bend	trans	-103.3	-18	-179.8	-59.1	-176.4	0	0	0	113.5	L208 F209 K456 L459	L208-L216 HydrophobicContact CD1-CD1 3.92Å; L208-L216 HydrophobicContact CG-CD1 3.91Å; F209-L216 HydrophobicContact CD1-CB 3.91Å; F209-L216 HydrophobicContact CE1-CB 3.64Å; L216-K456 HydrophobicContact CD2-CB 4.24Å; L216-K456 HydrophobicContact CD2-CD 4.05Å; L216-L459 HydrophobicContact CB-CD1 4.15Å; L216-L459 HydrophobicContact CD1-CD1 4.17Å; L216-L459 HydrophobicContact CD2-CD1 4.21Å; L216-L459 HydrophobicContact CG-CD1 4.4Å
217	G	98.6	Very high	98.4	Very high	1 Å²	1	19.2 Å²	19.2	1%	0.01	10%	0.099	C	C	.	.			trans	171.3	176.7	179.1	0	0	0	0	0	112.8	V180 G214	V180-G217 CarbonylContact O-C 3.49Å; V180-G217 WeakPolarHBondContact O-CA 3.46Å; G214-G217 WeakPolarHBondContact CA-O 3.44Å
218	I	98.9	Very high	98.4	Very high	0 Å²	0	18.7 Å²	18.7	0%	0	11%	0.105	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.7	116.7	176.4	-49.6	171.7	0	0	0	108.2	V65 I79 P81 F101 L103 V179 V180 T220 M465	V65-I218 HydrophobicContact CG1-CB 4.28Å; V65-I218 HydrophobicContact CG1-CD1 3.6Å; V65-I218 HydrophobicContact CG1-CG2 4.05Å; I79-I218 HydrophobicContact CG2-CD1 3.86Å; I79-I218 HydrophobicContact CG2-CG1 4.21Å; P81-I218 HydrophobicContact CB-CG2 4.46Å; P81-I218 HydrophobicContact CG-CG1 4.13Å; F101-I218 HydrophobicContact CD1-CD1 3.76Å; F101-I218 HydrophobicContact CE1-CD1 3.99Å; F101-I218 HydrophobicContact CG-CD1 4.16Å; L103-I218 HydrophobicContact CD1-CG2 3.64Å; L103-I218 HydrophobicContact CD2-CG2 3.88Å; L103-I218 HydrophobicContact CG-CG2 4.32Å; V179-I218 CarbonylContact C-O 3.1Å; V179-I218 VanDerWaalsContact CA-O 3.31Å; V179-I218 WeakPolarHBondContact CA-O 3.3Å; V180-I218 HydrophobicContact CB-CB 4.27Å; V180-I218 PolarHBondContact N-O 3.33Å; V180-I218 PolarHBondContact O-N 3.2Å; I218-T220 HydrophobicContact CG2-CG2 4.37Å; I218-T220 PolarHBondContact O-N 2.97Å; I218-M465 HydrophobicContact CG1-CE 4.12Å; I218-M465 HydrophobicContact CG1-SD 3.97Å
219	I	98.9	Very high	98.3	Very high	10 Å²	10	20 Å²	20	5%	0.051	12%	0.115	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.7	118.1	174.5	-58.6	176.3	0	0	0	108.8	C152 A155 A156 L177 V179 T222	C152-I219 HydrophobicContact CB-CB 4.18Å; C152-I219 HydrophobicContact CB-CG2 3.79Å; A155-I219 HydrophobicContact CB-CD1 4.08Å; A156-I219 HydrophobicContact CB-CD1 4.09Å; L177-I219 HydrophobicContact CD1-CD1 4.18Å; L177-I219 HydrophobicContact CD2-CD1 4.38Å; L177-I219 HydrophobicContact CD2-CG2 3.88Å; V179-I219 HydrophobicContact CG2-CG1 4.32Å; I219-T222 WeakPolarHBondContact CG2-OG1 3.45Å
220	T	98.8	Very high	98.1	Very high	0 Å²	0	21.1 Å²	21.1	0%	0	12%	0.122	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	-14.4	-179.5	54	0	0	0	0	114.4	V62 V65 M106 P123 E178 V180 I218	V62-T220 HydrophobicContact CG2-CG2 4.18Å; V62-T220 WeakPolarHBondContact CG2-OG1 3.41Å; V65-T220 HydrophobicContact CB-CG2 4.15Å; V65-T220 HydrophobicContact CG1-CG2 3.94Å; V65-T220 HydrophobicContact CG2-CG2 4.04Å; M106-T220 HydrophobicContact CE-CG2 4.38Å; P123-T220 WeakPolarHBondContact CD-O 3.31Å; E178-T220 WeakPolarHBondContact CG-OG1 3.31Å; E178-T220 PolarHBondContact O-N 2.74Å; E178-T220 PolarHBondContact O-OG1 3.32Å; E178-T220 PolarHBondContact OE1-OG1 2.88Å; V180-T220 HydrophobicContact CG2-CG2 3.74Å; I218-T220 HydrophobicContact CG2-CG2 4.37Å; I218-T220 PolarHBondContact O-N 2.97Å
221	K	98.6	Very high	97.9	Very high	53 Å²	53	27.4 Å²	27.4	23%	0.23	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.9	148.1	164.5	-60.6	175.9	-172.6	149.2	0	110.4	L110 T120 V121 L177 E178	L110-K221 HydrophobicContact CD1-CD 3.57Å; L110-K221 HydrophobicContact CD1-CG 4.02Å; T120-K221 HydrophobicContact CG2-CB 4.18Å; T120-K221 HydrophobicContact CG2-CD 4.36Å; V121-K221 VanDerWaalsContact O-CA 3.29Å; V121-K221 WeakPolarHBondContact O-CA 3.29Å; L177-K221 WeakPolarHBondContact CA-O 3.06Å; E178-K221 HydrophobicContact CB-CB 3.75Å; E178-K221 HydrophobicContact CB-CD 4.31Å; E178-K221 HydrophobicContact CB-CG 4.12Å; E178-K221 PolarHBondContact N-O 2.83Å; E178-K221 PolarHBondContact O-N 3.04Å; E178-K221 WeakPolarHBondContact OE1-CE 3Å; E178-K221 IonicContact OE1-NZ 3.78Å; E178-K221 WeakPolarHBondContact OE2-CE 3.48Å; E178-K221 IonicContact OE2-NZ 3.99Å; E178-K221 PolarHBondContact OE2-NZ 3Å
222	T	98.6	Very high	97.8	Very high	0 Å²	0	26.7 Å²	26.7	0%	0	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	131.4	170.2	-61.1	0	0	0	0	110	T120 V121 C152 A155 V174 L177 I219 L224	T120-T222 WeakPolarHBondContact CA-O 3.44Å; V121-T222 PolarHBondContact N-O 3.36Å; V121-T222 PolarHBondContact O-N 3.38Å; C152-T222 PolarHBondContact SG-OG1 3.43Å; A155-T222 HydrophobicContact CB-CG2 4.43Å; V174-T222 HydrophobicContact CG1-CG2 4.06Å; V174-T222 HydrophobicContact CG2-CG2 3.96Å; L177-T222 HydrophobicContact CD2-CG2 3.72Å; L177-T222 VanDerWaalsContact CD2-OG1 3.28Å; L177-T222 WeakPolarHBondContact CD2-OG1 3.4Å; I219-T222 WeakPolarHBondContact CG2-OG1 3.45Å; T222-L224 HydrophobicContact CG2-CD2 3.41Å; T222-L224 VanDerWaalsContact CG2-CD2 3.41Å; T222-L224 HydrophobicContact CG2-CG 3.79Å
223	T	98.8	Very high	97.7	Very high	10 Å²	10	28.6 Å²	28.6	6%	0.061	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99	123	169.1	-54.3	0	0	0	0	109.1	V119 T120 M175 N176 R195	V119-T223 CarbonylContact O-C 3.57Å; V119-T223 WeakPolarHBondContact O-CA 3.45Å; T120-T223 PolarHBondContact OG1-OG1 2.92Å; M175-T223 HydrophobicContact CB-CG2 4.27Å; M175-T223 PolarHBondContact N-O 3.41Å; N176-T223 PolarHBondContact O-N 3Å; R195-T223 HydrophobicContact CG-CG2 4.18Å
224	L	98.6	Very high	97.6	Very high	0 Å²	0	27.7 Å²	27.7	0%	0	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	144.6	-170.3	-63.4	172.3	0	0	0	111.5	D118 V119 V121 L130 F141 L151 M170 N173 V174 T222	D118-L224 WeakPolarHBondContact CA-O 3.42Å; D118-L224 VanDerWaalsContact CB-O 3.28Å; D118-L224 WeakPolarHBondContact CB-O 3.41Å; V119-L224 HydrophobicContact CG1-CB 4.14Å; V119-L224 PolarHBondContact N-O 3.4Å; V119-L224 PolarHBondContact O-N 3.07Å; V121-L224 HydrophobicContact CG2-CD1 4.26Å; L130-L224 HydrophobicContact CD2-CD1 4.14Å; F141-L224 HydrophobicContact CD2-CB 4.22Å; F141-L224 HydrophobicContact CD2-CD1 4.19Å; F141-L224 HydrophobicContact CE2-CB 4.03Å; F141-L224 HydrophobicContact CE2-CD1 3.92Å; F141-L224 HydrophobicContact CE2-CD2 3.99Å; F141-L224 HydrophobicContact CE2-CG 4.21Å; F141-L224 HydrophobicContact CZ-CD1 4.13Å; F141-L224 HydrophobicContact CZ-CD2 4.23Å; L151-L224 HydrophobicContact CB-CD1 4.11Å; L151-L224 HydrophobicContact CD1-CD1 3.84Å; L151-L224 HydrophobicContact CD2-CD1 3.81Å; L151-L224 HydrophobicContact CG-CD1 4.13Å; M170-L224 HydrophobicContact CE-CD2 3.86Å; N173-L224 WeakPolarHBondContact O-CA 3.48Å; V174-L224 HydrophobicContact CG2-CD2 3.87Å; T222-L224 HydrophobicContact CG2-CD2 3.41Å; T222-L224 VanDerWaalsContact CG2-CD2 3.41Å; T222-L224 HydrophobicContact CG2-CG 3.79Å
225	R	98.1	Very high	97.5	Very high	101 Å²	101	27.6 Å²	27.6	38%	0.381	15%	0.145	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.1	135.6	165.9	178.2	166.4	-173.7	-167.8	2	110.8	F141 N173 M175 R197 Y227	F141-R225 WeakPolarHBondContact CD2-O 3.48Å; N173-R225 PolarHBondContact O-N 2.93Å; M175-R225 HydrophobicContact SD-CB 4.36Å; R197-R225 VanDerWaalsContact NH1-CB 3.32Å; R197-R225 VanDerWaalsContact NH1-CD 3.3Å; R225-Y227 HydrophobicContact CB-CE2 4.38Å; R225-Y227 WeakPolarHBondContact CD-OH 3.25Å; R225-Y227 HydrophobicContact CG-CD2 4.28Å; R225-Y227 HydrophobicContact CG-CE2 3.66Å; R225-Y227 PolarHBondContact NE-OH 3.37Å; R225-Y227 PolarHBondContact NH1-OH 3.49Å
226	L	98.5	Very high	97.5	Very high	2 Å²	2	27.1 Å²	27.1	1%	0.01	14%	0.143	C	C	.	.			trans	-106.4	165.3	167.8	-57.2	-178.2	0	0	0	110.6	L112 F117 V119 L134 L139 W140 F141	L112-L226 HydrophobicContact CD1-CD1 3.54Å; F117-L226 PolarHBondContact O-N 2.8Å; V119-L226 HydrophobicContact CB-CD1 4.07Å; V119-L226 HydrophobicContact CB-CG 4.41Å; V119-L226 HydrophobicContact CG1-CD1 4.16Å; V119-L226 HydrophobicContact CG1-CD2 3.75Å; V119-L226 HydrophobicContact CG1-CG 4.05Å; L134-L226 HydrophobicContact CD1-CD1 3.97Å; L134-L226 HydrophobicContact CD1-CD2 3.54Å; L134-L226 HydrophobicContact CD1-CG 4.38Å; L134-L226 HydrophobicContact CD2-CD1 3.7Å; L139-L226 HydrophobicContact CB-CB 4.31Å; L139-L226 HydrophobicContact CB-CD1 4.22Å; L139-L226 HydrophobicContact CD1-CB 4.31Å; L139-L226 HydrophobicContact CD1-CD1 3.91Å; W140-L226 WeakPolarHBondContact O-CA 3.48Å; F141-L226 HydrophobicContact CB-CD2 3.97Å; F141-L226 HydrophobicContact CD2-CD2 4.43Å
227	Y	98	Very high	97.4	Very high	32 Å²	32	26.7 Å²	26.7	13%	0.125	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.5	154	179	-64.4	-101.2	0	0	0	109.4	L139 W140 P142 Y167 N173 R225	L139-Y227 CarbonylContact C-O 3.52Å; L139-Y227 WeakPolarHBondContact CA-O 3.47Å; W140-Y227 PolarHBondContact N-O 3.19Å; W140-Y227 PolarHBondContact O-N 3.29Å; P142-Y227 HydrophobicContact CB-CD2 4.45Å; P142-Y227 VanDerWaalsContact CD-CD2 3.49Å; P142-Y227 HydrophobicContact CG-CD2 3.44Å; P142-Y227 VanDerWaalsContact CG-CD2 3.44Å; P142-Y227 HydrophobicContact CG-CE2 3.45Å; P142-Y227 VanDerWaalsContact CG-CE2 3.45Å; P142-Y227 HydrophobicContact CG-CG 4.35Å; Y167-Y227 AromaticContact CD1-CD1 3.6Å; Y167-Y227 HydrophobicContact CD1-CD1 3.6Å; Y167-Y227 HydrophobicContact CD1-CD2 4.34Å; Y167-Y227 AromaticContact CD1-CE1 3.74Å; Y167-Y227 HydrophobicContact CD1-CE1 3.74Å; Y167-Y227 HydrophobicContact CD1-CE2 4.46Å; Y167-Y227 AromaticContact CD1-CG 3.91Å; Y167-Y227 HydrophobicContact CD1-CG 3.91Å; Y167-Y227 AromaticContact CE1-CD1 3.94Å; Y167-Y227 HydrophobicContact CE1-CD1 3.94Å; Y167-Y227 HydrophobicContact CE1-CE1 4.48Å; Y167-Y227 HydrophobicContact CE1-CG 4.21Å; Y167-Y227 PolarHBondContact O-OH 2.96Å; N173-Y227 WeakPolarHBondContact OD1-CE2 3.43Å; N173-Y227 PolarHBondContact OD1-OH 3.44Å; R225-Y227 HydrophobicContact CB-CE2 4.38Å; R225-Y227 WeakPolarHBondContact CD-OH 3.25Å; R225-Y227 HydrophobicContact CG-CD2 4.28Å; R225-Y227 HydrophobicContact CG-CE2 3.66Å; R225-Y227 PolarHBondContact NE-OH 3.37Å; R225-Y227 PolarHBondContact NH1-OH 3.49Å
228	G	97.3	Very high	97.4	Very high	36 Å²	36	26.7 Å²	26.7	37%	0.371	14%	0.14	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-63.3	141.3	169.2	0	0	0	0	0	110.8	G138 W140	G138-G228 WeakPolarHBondContact O-CA 3.23Å; W140-G228 PolarHBondContact NE1-O 3.22Å; W140-G228 VanDerWaalsContact NE1-O 3.1Å
229	V	96	Very high	97.4	Very high	76 Å²	76	26.8 Å²	26.8	46%	0.461	14%	0.141	S	C	.	.	P	Polyproline II helix	trans	-65.9	128	168	177.5	0	0	0	0	107.6	G138 W140	G138-V229 PolarHBondContact O-N 3.16Å; W140-V229 HydrophobicContact CB-CG2 4.15Å; W140-V229 HydrophobicContact CG-CG2 4.25Å
230	P	94.2	Very high	97.3	Very high	25 Å²	25	26.4 Å²	26.4	16%	0.162	14%	0.139	C	C	.	.	P	Polyproline II helix	trans	-66.3	148.8	179.5	29.3	-35.4	0	0	0	110.9	A232 M233 H293	P230-A232 VanDerWaalsContact C-N 3.31Å; P230-A232 PolarHBondContact O-N 3.46Å; P230-M233 HydrophobicContact CG-CE 3.27Å; P230-M233 HydrophobicContact CG-CG 3.85Å; P230-M233 HydrophobicContact CG-SD 4.4Å; P230-H293 HydrophobicContact CB-CB 3.85Å; P230-H293 HydrophobicContact CG-CB 3.96Å
231	E	94.8	Very high	97.2	Very high	145 Å²	145	30.2 Å²	30.2	68%	0.678	16%	0.164	S	C	*	.	S	Bend	trans	-57.7	-44.1	179.2	179.2	-169.8	147.6	0	0	111.7	S295	E231-S295 WeakPolarHBondContact OE2-CA 3.23Å; E231-S295 WeakPolarHBondContact OE2-CB 3.18Å
232	A	94.9	Very high	97	Very high	14 Å²	14	30 Å²	30	12%	0.116	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.8	159.9	178.2	0	0	0	0	0	111.5	P230 G294 E296 L299	P230-A232 VanDerWaalsContact C-N 3.31Å; P230-A232 PolarHBondContact O-N 3.46Å; A232-G294 PolarHBondContact N-O 2.92Å; A232-G294 PolarHBondContact O-N 3.48Å; A232-E296 HydrophobicContact CB-CG 4.48Å; A232-L299 VanDerWaalsContact C-CD1 3.5Å; A232-L299 HydrophobicContact CB-CD1 3.34Å
233	M	96.1	Very high	96.7	Very high	47 Å²	47	30.6 Å²	30.6	23%	0.232	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.7	137.9	177.5	-56.9	176.1	175	0	0	110.2	P230 F292 R327	P230-M233 HydrophobicContact CG-CE 3.27Å; P230-M233 HydrophobicContact CG-CG 3.85Å; P230-M233 HydrophobicContact CG-SD 4.4Å; M233-F292 VanDerWaalsContact CA-O 3.3Å; M233-F292 WeakPolarHBondContact CA-O 3.38Å; M233-R327 PolarHBondContact O-NH1 3.44Å
234	V	96.9	Very high	96.4	Very high	1 Å²	1	34.2 Å²	34.2	1%	0.006	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122	130.9	171.7	171.2	0	0	0	0	108.3	E291 F292 L299 V303 W320 R322	V234-E291 CarbonylContact O-C 3.45Å; V234-E291 VanDerWaalsContact O-CA 3.27Å; V234-E291 WeakPolarHBondContact O-CA 3.34Å; V234-F292 HydrophobicContact CB-CD2 4.42Å; V234-F292 HydrophobicContact CG1-CD2 4.36Å; V234-F292 PolarHBondContact N-O 3.05Å; V234-F292 PolarHBondContact O-N 2.93Å; V234-L299 HydrophobicContact CG2-CB 4.29Å; V234-L299 HydrophobicContact CG2-CD1 4.14Å; V234-V303 HydrophobicContact CB-CG2 4.15Å; V234-V303 HydrophobicContact CG1-CG2 3.75Å; V234-V303 HydrophobicContact CG2-CG2 4.49Å; V234-W320 HydrophobicContact CG1-CB 3.89Å; V234-W320 HydrophobicContact CG1-CD2 4.49Å; V234-W320 HydrophobicContact CG1-CE3 4.14Å; V234-W320 HydrophobicContact CG1-CG 4.44Å; V234-R322 HydrophobicContact CG2-CG 3.68Å
235	S	96.9	Very high	96.3	Very high	3 Å²	3	34.6 Å²	34.6	2%	0.021	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	143.2	166.5	-41	0	0	0	0	109.7	L290 E291 W320 A321 R327 W331	S235-L290 CarbonylContact C-O 3.37Å; S235-L290 WeakPolarHBondContact CA-O 3.18Å; S235-E291 PolarHBondContact OG-OE2 2.96Å; S235-W320 CarbonylContact O-C 3.58Å; S235-W320 WeakPolarHBondContact O-CA 3.47Å; S235-A321 PolarHBondContact N-O 3.48Å; S235-A321 VanDerWaalsContact N-O 3.15Å; S235-A321 PolarHBondContact O-N 3.22Å; S235-R327 WeakPolarHBondContact OG-CB 3.47Å; S235-R327 VanDerWaalsContact OG-CD 3.25Å; S235-R327 WeakPolarHBondContact OG-CD 3.32Å; S235-R327 WeakPolarHBondContact OG-CG 3.28Å; S235-W331 PolarHBondContact OG-NE1 3.2Å
236	A	97.1	Very high	96.2	Very high	1 Å²	1	29.8 Å²	29.8	1%	0.008	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	157.8	177	0	0	0	0	0	111.8	F289 L290 F292 F318 Q319 W320	A236-F289 WeakPolarHBondContact O-CA 3.48Å; A236-L290 HydrophobicContact CB-CB 4.14Å; A236-L290 HydrophobicContact CB-CD1 4.21Å; A236-L290 PolarHBondContact N-O 2.92Å; A236-L290 PolarHBondContact O-N 2.77Å; A236-F292 HydrophobicContact CB-CE2 4.24Å; A236-F318 HydrophobicContact CB-CE1 4Å; A236-F318 HydrophobicContact CB-CE2 4.3Å; A236-F318 HydrophobicContact CB-CZ 3.7Å; A236-Q319 CarbonylContact C-O 3.47Å; A236-Q319 WeakPolarHBondContact CA-O 3.35Å; A236-W320 HydrophobicContact CB-CB 3.73Å
237	V	97.4	Very high	95.8	Very high	4 Å²	4	29.8 Å²	29.8	2%	0.024	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	135.9	175.6	-178.8	0	0	0	0	108.1	Y282 T287 L288 F289 F318 Q319 L330	V237-Y282 HydrophobicContact CB-CE1 4.23Å; V237-Y282 HydrophobicContact CG1-CD1 4.04Å; V237-Y282 HydrophobicContact CG1-CE1 3.98Å; V237-Y282 HydrophobicContact CG1-CG 4.45Å; V237-Y282 HydrophobicContact CG2-CE1 4.21Å; V237-Y282 HydrophobicContact CG2-CE2 4.5Å; V237-T287 HydrophobicContact CG1-CG2 3.63Å; V237-L288 WeakPolarHBondContact CA-O 3.3Å; V237-F289 HydrophobicContact CB-CD1 4.34Å; V237-F289 HydrophobicContact CG1-CD1 3.88Å; V237-F289 HydrophobicContact CG1-CE1 3.79Å; V237-F289 HydrophobicContact CG2-CD1 3.82Å; V237-F289 HydrophobicContact CG2-CE1 4.04Å; V237-F318 WeakPolarHBondContact O-CA 3.37Å; V237-Q319 PolarHBondContact N-O 3.43Å; V237-Q319 PolarHBondContact O-N 3.34Å; V237-L330 HydrophobicContact CG2-CD1 3.35Å; V237-L330 HydrophobicContact CG2-CD2 3.54Å; V237-L330 HydrophobicContact CG2-CG 4.08Å
238	C	98.1	Very high	95.6	Very high	0 Å²	0	30.8 Å²	30.8	0%	0	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.2	131.7	175	-174.4	0	0	0	0	110.3	F240 T287 L288 T310 S316 F318	C238-F240 HydrophobicContact CB-CE2 3.82Å; C238-F240 HydrophobicContact CB-CZ 4.11Å; C238-F240 WeakPolarHBondContact O-CD2 3.35Å; C238-F240 WeakPolarHBondContact O-CE2 3.49Å; C238-F240 VanDerWaalsContact SG-CZ 3.56Å; C238-T287 CarbonylContact O-C 3.54Å; C238-T287 WeakPolarHBondContact O-CA 3.42Å; C238-T287 WeakPolarHBondContact O-CG2 3.03Å; C238-L288 PolarHBondContact N-O 2.91Å; C238-L288 PolarHBondContact O-N 3.29Å; C238-T310 HydrophobicContact CB-CG2 4.49Å; C238-S316 PolarHBondContact SG-O 3.01Å; C238-F318 HydrophobicContact CB-CD2 3.75Å; C238-F318 HydrophobicContact CB-CE2 4.38Å
239	S	97.9	Very high	95.6	Very high	2 Å²	2	29 Å²	29	1%	0.014	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.5	148.7	177.2	-70.5	0	0	0	0	110.3	T285 G315 S316	S239-T285 WeakPolarHBondContact CB-OG1 3.27Å; S239-G315 CarbonylContact O-C 3.57Å; S239-G315 WeakPolarHBondContact O-CA 3.43Å; S239-S316 PolarHBondContact N-O 3.11Å; S239-S316 PolarHBondContact O-N 3.26Å
240	F	97.9	Very high	95.5	Very high	3 Å²	3	25.4 Å²	25.4	1%	0.013	14%	0.141	C	C	.	.			trans	-133.2	148.8	-174.6	-68.2	-88.2	0	0	0	111.7	C238 S242 A245 A246 S249 P286 L288 T310	C238-F240 HydrophobicContact CB-CE2 3.82Å; C238-F240 HydrophobicContact CB-CZ 4.11Å; C238-F240 WeakPolarHBondContact O-CD2 3.35Å; C238-F240 WeakPolarHBondContact O-CE2 3.49Å; C238-F240 VanDerWaalsContact SG-CZ 3.56Å; F240-S242 PolarHBondContact O-N 3.38Å; F240-A245 HydrophobicContact CB-CB 4.25Å; F240-A245 HydrophobicContact CD1-CB 3.92Å; F240-A245 HydrophobicContact CG-CB 4.49Å; F240-A246 HydrophobicContact CB-CB 4.1Å; F240-A246 HydrophobicContact CD1-CB 4.4Å; F240-A246 HydrophobicContact CD2-CB 3.65Å; F240-A246 HydrophobicContact CE2-CB 4.18Å; F240-A246 HydrophobicContact CG-CB 3.78Å; F240-S249 WeakPolarHBondContact CE1-OG 3.5Å; F240-P286 HydrophobicContact CB-CB 4.45Å; F240-P286 PolarHBondContact N-O 3.16Å; F240-P286 WeakPolarHBondContact O-CD 3.28Å; F240-L288 HydrophobicContact CD2-CD1 4.46Å; F240-L288 HydrophobicContact CD2-CG 4.15Å; F240-L288 HydrophobicContact CE2-CB 3.96Å; F240-L288 HydrophobicContact CE2-CD1 3.5Å; F240-L288 VanDerWaalsContact CE2-CD1 3.5Å; F240-L288 HydrophobicContact CE2-CG 3.5Å; F240-L288 HydrophobicContact CZ-CD1 3.73Å; F240-L288 HydrophobicContact CZ-CG 4.26Å; F240-T310 HydrophobicContact CE1-CG2 4.46Å; F240-T310 HydrophobicContact CZ-CG2 3.79Å
241	P	96.6	Very high	95.5	Very high	80 Å²	80	25.6 Å²	25.6	52%	0.519	14%	0.142	S	C	.	.	S	Bend	trans	-70.4	-19.6	176.9	28.5	-35.5	0	0	0	112.9	A245 E314	P241-A245 HydrophobicContact CG-CB 4.3Å; P241-E314 VanDerWaalsContact CD-O 3.31Å; P241-E314 WeakPolarHBondContact CD-O 3.1Å; P241-E314 HydrophobicContact CG-CB 3.88Å
242	S	94.9	Very high	95.5	Very high	49 Å²	49	21.6 Å²	21.6	34%	0.343	12%	0.123	S	C	.	.	S	Bend	trans	-152.7	162.5	-178.8	73.6	0	0	0	0	112.9	F240 Q244 A245 A246	F240-S242 PolarHBondContact O-N 3.38Å; S242-Q244 VanDerWaalsContact C-N 3.27Å; S242-Q244 PolarHBondContact O-N 2.87Å; S242-Q244 PolarHBondContact OG-N 2.91Å; S242-A245 PolarHBondContact O-N 3.01Å; S242-A245 WeakPolarHBondContact OG-CB 3.48Å; S242-A245 PolarHBondContact OG-N 3.38Å; S242-A245 VanDerWaalsContact OG-N 3.13Å; S242-A246 PolarHBondContact O-N 2.91Å
243	V	92	Very high	95.6	Very high	12 Å²	12	21 Å²	21	7%	0.073	12%	0.118	C	C	.	.	H	α-helix	trans	-58.8	-41.7	170.8	179.8	0	0	0	0	110.8	A245 A246 V247 F265 P286 I366 V367 K370	V243-A245 PolarHBondContact O-N 3.27Å; V243-A246 PolarHBondContact O-N 2.75Å; V243-V247 HydrophobicContact CG1-CG2 4.29Å; V243-V247 WeakPolarHBondContact O-CG2 3.39Å; V243-V247 PolarHBondContact O-N 2.67Å; V243-F265 HydrophobicContact CB-CZ 4.45Å; V243-F265 HydrophobicContact CG1-CE2 4.44Å; V243-F265 HydrophobicContact CG1-CZ 4.13Å; V243-F265 HydrophobicContact CG2-CZ 4.02Å; V243-P286 HydrophobicContact CG2-CG 4.43Å; V243-I366 HydrophobicContact CB-CG2 4.5Å; V243-I366 HydrophobicContact CG1-CB 3.83Å; V243-I366 HydrophobicContact CG1-CD1 4.32Å; V243-I366 HydrophobicContact CG1-CG2 3.55Å; V243-I366 HydrophobicContact CG2-CG2 4.14Å; V243-V367 HydrophobicContact CB-CG2 4.05Å; V243-V367 HydrophobicContact CG1-CG2 4.33Å; V243-V367 HydrophobicContact CG2-CG2 4.36Å; V243-K370 HydrophobicContact CG2-CD 4.43Å
244	Q	92.4	Very high	95.5	Very high	85 Å²	85	20.9 Å²	20.9	40%	0.397	12%	0.118	S	C	.	.	H	α-helix	trans	-58.6	-49.2	-179.4	-173	65.1	59.3	0	0	111.1	S242 A246 V247 D248	S242-Q244 VanDerWaalsContact C-N 3.27Å; S242-Q244 PolarHBondContact O-N 2.87Å; S242-Q244 PolarHBondContact OG-N 2.91Å; Q244-A246 VanDerWaalsContact C-N 3.34Å; Q244-A246 PolarHBondContact O-N 3.13Å; Q244-V247 PolarHBondContact O-N 3.45Å; Q244-D248 WeakPolarHBondContact CG-OD2 3.22Å; Q244-D248 VanDerWaalsContact NE2-CG 3.33Å; Q244-D248 PolarHBondContact NE2-OD1 2.83Å; Q244-D248 PolarHBondContact NE2-OD2 3.46Å; Q244-D248 WeakPolarHBondContact O-CB 3.19Å; Q244-D248 PolarHBondContact O-N 3.05Å
245	A	95.7	Very high	95.3	Very high	9 Å²	9	28.1 Å²	28.1	7%	0.074	15%	0.152	C	C	.	.	H	α-helix	trans	-58.5	-41.8	178.6	0	0	0	0	0	113.3	F240 P241 S242 V243 S249 N313	F240-A245 HydrophobicContact CB-CB 4.25Å; F240-A245 HydrophobicContact CD1-CB 3.92Å; F240-A245 HydrophobicContact CG-CB 4.49Å; P241-A245 HydrophobicContact CG-CB 4.3Å; S242-A245 PolarHBondContact O-N 3.01Å; S242-A245 WeakPolarHBondContact OG-CB 3.48Å; S242-A245 PolarHBondContact OG-N 3.38Å; S242-A245 VanDerWaalsContact OG-N 3.13Å; V243-A245 PolarHBondContact O-N 3.27Å; A245-S249 PolarHBondContact O-N 2.9Å; A245-S249 VanDerWaalsContact O-N 3.12Å; A245-S249 PolarHBondContact O-OG 3.3Å; A245-N313 WeakPolarHBondContact CB-O 3.46Å
246	A	95.4	Very high	95.2	Very high	0 Å²	0	32.1 Å²	32.1	0%	0	18%	0.176	C	C	.	.	H	α-helix	trans	-65.8	-43.7	176.9	0	0	0	0	0	112.1	F240 S242 V243 Q244 S249 T250 F265 L288	F240-A246 HydrophobicContact CB-CB 4.1Å; F240-A246 HydrophobicContact CD1-CB 4.4Å; F240-A246 HydrophobicContact CD2-CB 3.65Å; F240-A246 HydrophobicContact CE2-CB 4.18Å; F240-A246 HydrophobicContact CG-CB 3.78Å; S242-A246 PolarHBondContact O-N 2.91Å; V243-A246 PolarHBondContact O-N 2.75Å; Q244-A246 VanDerWaalsContact C-N 3.34Å; Q244-A246 PolarHBondContact O-N 3.13Å; A246-S249 WeakPolarHBondContact O-CB 3.43Å; A246-S249 PolarHBondContact O-N 3.16Å; A246-T250 PolarHBondContact O-N 2.58Å; A246-T250 VanDerWaalsContact O-N 3.07Å; A246-T250 PolarHBondContact O-OG1 3.1Å; A246-F265 HydrophobicContact CB-CD2 4.04Å; A246-F265 HydrophobicContact CB-CE2 4Å; A246-L288 HydrophobicContact CB-CD1 4.46Å; A246-L288 HydrophobicContact CB-CD2 4.14Å; A246-L288 HydrophobicContact CB-CG 4.11Å; A246-L288 WeakPolarHBondContact O-CD1 3Å
247	V	91.8	Very high	95.1	Very high	1 Å²	1	34.7 Å²	34.7	1%	0.006	20%	0.203	C	C	.	.	H	α-helix	trans	-73.7	-36.9	-179.7	-179.9	0	0	0	0	111.7	V243 Q244 S249 T250 V251 L362 P363	V243-V247 HydrophobicContact CG1-CG2 4.29Å; V243-V247 WeakPolarHBondContact O-CG2 3.39Å; V243-V247 PolarHBondContact O-N 2.67Å; Q244-V247 PolarHBondContact O-N 3.45Å; V247-S249 VanDerWaalsContact C-N 3.28Å; V247-S249 PolarHBondContact O-N 3.25Å; V247-T250 WeakPolarHBondContact O-CA 3.09Å; V247-T250 VanDerWaalsContact O-CB 3.29Å; V247-T250 WeakPolarHBondContact O-CB 3.44Å; V247-T250 PolarHBondContact O-N 3.03Å; V247-V251 HydrophobicContact CG1-CG2 4.34Å; V247-V251 WeakPolarHBondContact O-CG2 3.34Å; V247-V251 PolarHBondContact O-N 3.35Å; V247-L362 HydrophobicContact CG1-CB 4.02Å; V247-L362 HydrophobicContact CG1-CD2 4.07Å; V247-L362 HydrophobicContact CG1-CG 4.24Å; V247-L362 HydrophobicContact CG2-CD2 4.36Å; V247-L362 HydrophobicContact CG2-CG 4.29Å; V247-P363 HydrophobicContact CB-CB 4.23Å; V247-P363 HydrophobicContact CB-CG 3.79Å; V247-P363 HydrophobicContact CG1-CB 4.39Å; V247-P363 HydrophobicContact CG1-CG 3.5Å; V247-P363 VanDerWaalsContact CG1-CG 3.5Å; V247-P363 HydrophobicContact CG2-CG 4.45Å
248	D	93.6	Very high	95.1	Very high	53 Å²	53	35.2 Å²	35.2	28%	0.283	21%	0.206	S	C	.	.	H	α-helix	trans	-59.9	-41.1	173.8	-71.3	-20.4	0	0	0	111.1	Q244 T250 V251 Q252	Q244-D248 WeakPolarHBondContact CG-OD2 3.22Å; Q244-D248 VanDerWaalsContact NE2-CG 3.33Å; Q244-D248 PolarHBondContact NE2-OD1 2.83Å; Q244-D248 PolarHBondContact NE2-OD2 3.46Å; Q244-D248 WeakPolarHBondContact O-CB 3.19Å; Q244-D248 PolarHBondContact O-N 3.05Å; D248-T250 PolarHBondContact O-N 3.05Å; D248-V251 PolarHBondContact O-N 3.01Å; D248-Q252 WeakPolarHBondContact O-CB 3.45Å; D248-Q252 VanDerWaalsContact O-CG 3.25Å; D248-Q252 WeakPolarHBondContact O-CG 3.46Å; D248-Q252 PolarHBondContact O-N 2.89Å
249	S	96.5	Very high	94.9	Very high	0 Å²	0	37 Å²	37	0%	0	22%	0.218	C	C	.	.	H	α-helix	trans	-60.5	-44.6	172.2	-59.3	0	0	0	0	111.9	F240 A245 A246 V247 Q252 I253 N313	F240-S249 WeakPolarHBondContact CE1-OG 3.5Å; A245-S249 PolarHBondContact O-N 2.9Å; A245-S249 VanDerWaalsContact O-N 3.12Å; A245-S249 PolarHBondContact O-OG 3.3Å; A246-S249 WeakPolarHBondContact O-CB 3.43Å; A246-S249 PolarHBondContact O-N 3.16Å; V247-S249 VanDerWaalsContact C-N 3.28Å; V247-S249 PolarHBondContact O-N 3.25Å; S249-Q252 PolarHBondContact O-N 2.84Å; S249-I253 WeakPolarHBondContact O-CB 3.38Å; S249-I253 WeakPolarHBondContact O-CD1 3.21Å; S249-I253 WeakPolarHBondContact O-CG1 3.32Å; S249-I253 PolarHBondContact O-N 3.49Å; S249-N313 VanDerWaalsContact OG-CB 3.29Å; S249-N313 WeakPolarHBondContact OG-CB 3.47Å; S249-N313 PolarHBondContact OG-ND2 3.17Å
250	T	94.8	Very high	94.8	Very high	0 Å²	0	37.1 Å²	37.1	0%	0	22%	0.218	C	C	.	.	H	α-helix	trans	-58.5	-49.6	177	-61.1	0	0	0	0	111.1	A246 V247 D248 Q252 I253 L254 I263 V386	A246-T250 PolarHBondContact O-N 2.58Å; A246-T250 VanDerWaalsContact O-N 3.07Å; A246-T250 PolarHBondContact O-OG1 3.1Å; V247-T250 WeakPolarHBondContact O-CA 3.09Å; V247-T250 VanDerWaalsContact O-CB 3.29Å; V247-T250 WeakPolarHBondContact O-CB 3.44Å; V247-T250 PolarHBondContact O-N 3.03Å; D248-T250 PolarHBondContact O-N 3.05Å; T250-Q252 PolarHBondContact O-N 2.86Å; T250-I253 PolarHBondContact O-N 3.14Å; T250-L254 HydrophobicContact CG2-CD1 4.28Å; T250-L254 WeakPolarHBondContact O-CG 3.33Å; T250-L254 PolarHBondContact O-N 3.3Å; T250-L254 VanDerWaalsContact O-N 3.11Å; T250-I263 HydrophobicContact CG2-CD1 3.78Å; T250-I263 HydrophobicContact CG2-CG1 4.21Å; T250-I263 HydrophobicContact CG2-CG2 4.34Å; T250-I263 WeakPolarHBondContact OG1-CD1 3.25Å; T250-V386 HydrophobicContact CG2-CB 4.19Å; T250-V386 HydrophobicContact CG2-CG2 3.83Å; T250-V386 WeakPolarHBondContact CG2-O 3.47Å
251	V	92.8	Very high	94.7	Very high	29 Å²	29	37 Å²	37	18%	0.176	22%	0.218	C	C	.	.	H	α-helix	trans	-61.8	-45.7	179.4	172.3	0	0	0	0	111	V247 D248 L254 Q255 L359	V247-V251 HydrophobicContact CG1-CG2 4.34Å; V247-V251 WeakPolarHBondContact O-CG2 3.34Å; V247-V251 PolarHBondContact O-N 3.35Å; D248-V251 PolarHBondContact O-N 3.01Å; V251-L254 PolarHBondContact O-N 2.89Å; V251-Q255 HydrophobicContact CG1-CG 4.16Å; V251-Q255 WeakPolarHBondContact O-CB 3.29Å; V251-Q255 VanDerWaalsContact O-CG 3.26Å; V251-Q255 WeakPolarHBondContact O-CG 3.4Å; V251-Q255 PolarHBondContact O-N 3.02Å; V251-L359 HydrophobicContact CG2-CB 4.18Å
252	Q	95.8	Very high	94.7	Very high	61 Å²	61	34.1 Å²	34.1	29%	0.285	20%	0.197	S	C	.	.	H	α-helix	trans	-66.4	-39.7	-179.7	-72.7	170.3	37.5	0	0	112.5	D248 S249 T250 L254 Q255 T256 I309 N313	D248-Q252 WeakPolarHBondContact O-CB 3.45Å; D248-Q252 VanDerWaalsContact O-CG 3.25Å; D248-Q252 WeakPolarHBondContact O-CG 3.46Å; D248-Q252 PolarHBondContact O-N 2.89Å; S249-Q252 PolarHBondContact O-N 2.84Å; T250-Q252 PolarHBondContact O-N 2.86Å; Q252-L254 VanDerWaalsContact C-N 3.32Å; Q252-L254 PolarHBondContact O-N 3.44Å; Q252-Q255 PolarHBondContact O-N 2.93Å; Q252-T256 WeakPolarHBondContact O-CB 3.41Å; Q252-T256 PolarHBondContact O-N 3.47Å; Q252-T256 PolarHBondContact O-OG1 3.28Å; Q252-I309 HydrophobicContact CB-CG2 3.59Å; Q252-N313 PolarHBondContact NE2-ND2 3.11Å; Q252-N313 PolarHBondContact NE2-OD1 3.21Å; Q252-N313 PolarHBondContact OE1-ND2 3.43Å
253	I	96.8	Very high	94.8	Very high	0 Å²	0	31.9 Å²	31.9	0%	0	18%	0.181	C	C	.	.	H	α-helix	trans	-57.3	-47.5	173.5	-74.7	167.1	0	0	0	110	S249 T250 G257 V258 I260 I263 L290 A306 I309 T310	S249-I253 WeakPolarHBondContact O-CB 3.38Å; S249-I253 WeakPolarHBondContact O-CD1 3.21Å; S249-I253 WeakPolarHBondContact O-CG1 3.32Å; S249-I253 PolarHBondContact O-N 3.49Å; T250-I253 PolarHBondContact O-N 3.14Å; I253-G257 PolarHBondContact O-N 3.44Å; I253-V258 HydrophobicContact CG2-CB 3.89Å; I253-V258 HydrophobicContact CG2-CG1 4.23Å; I253-V258 HydrophobicContact CG2-CG2 4.41Å; I253-V258 PolarHBondContact O-N 3.01Å; I253-I260 HydrophobicContact CG2-CB 4.39Å; I253-I260 HydrophobicContact CG2-CD1 4.07Å; I253-I260 HydrophobicContact CG2-CG2 4.42Å; I253-I263 HydrophobicContact CD1-CD1 4.11Å; I253-L290 HydrophobicContact CD1-CD2 4.37Å; I253-A306 HydrophobicContact CD1-CB 4.22Å; I253-A306 HydrophobicContact CG1-CB 4.46Å; I253-I309 HydrophobicContact CG1-CB 4.29Å; I253-I309 HydrophobicContact CG1-CD1 3.95Å; I253-I309 HydrophobicContact CG1-CG2 3.98Å; I253-T310 HydrophobicContact CD1-CG2 4.45Å
254	L	94.1	Very high	95	Very high	46 Å²	46	31.4 Å²	31.4	24%	0.241	18%	0.178	C	C	.	.	H	α-helix	trans	-67.7	-43.2	178.8	-65.9	173.4	0	0	0	112.6	V165 T250 V251 Q252 T256 G257 I260 L359 G387	V165-L254 HydrophobicContact CG2-CD2 3.78Å; T250-L254 HydrophobicContact CG2-CD1 4.28Å; T250-L254 WeakPolarHBondContact O-CG 3.33Å; T250-L254 PolarHBondContact O-N 3.3Å; T250-L254 VanDerWaalsContact O-N 3.11Å; V251-L254 PolarHBondContact O-N 2.89Å; Q252-L254 VanDerWaalsContact C-N 3.32Å; Q252-L254 PolarHBondContact O-N 3.44Å; L254-T256 VanDerWaalsContact C-N 3.29Å; L254-T256 PolarHBondContact O-N 2.63Å; L254-G257 PolarHBondContact O-N 3.12Å; L254-I260 HydrophobicContact CD2-CG2 4Å; L254-L359 HydrophobicContact CD1-CD1 3.55Å; L254-L359 HydrophobicContact CD1-CD2 4.42Å; L254-G387 WeakPolarHBondContact CD1-O 3.47Å
255	Q	92.7	Very high	95.3	Very high	152 Å²	152	27.3 Å²	27.3	71%	0.71	16%	0.159	S	C	*	.	H	α-helix	trans	-63.9	-33.6	178.8	-77.5	177	-15.5	0	0	112.9	V251 Q252 G257	V251-Q255 HydrophobicContact CG1-CG 4.16Å; V251-Q255 WeakPolarHBondContact O-CB 3.29Å; V251-Q255 VanDerWaalsContact O-CG 3.26Å; V251-Q255 WeakPolarHBondContact O-CG 3.4Å; V251-Q255 PolarHBondContact O-N 3.02Å; Q252-Q255 PolarHBondContact O-N 2.93Å; Q255-G257 PolarHBondContact O-N 3.3Å
256	T	94.9	Very high	95.4	Very high	87 Å²	87	26.9 Å²	26.9	53%	0.534	16%	0.155	S	C	.	.	T	Hydrogen-bonded Turn	trans	-74.4	-8.3	175.8	-52.2	0	0	0	0	111.8	Q252 L254 V258 T305	Q252-T256 WeakPolarHBondContact O-CB 3.41Å; Q252-T256 PolarHBondContact O-N 3.47Å; Q252-T256 PolarHBondContact O-OG1 3.28Å; L254-T256 VanDerWaalsContact C-N 3.29Å; L254-T256 PolarHBondContact O-N 2.63Å; T256-V258 VanDerWaalsContact C-N 3.33Å; T256-V258 HydrophobicContact CG2-CG2 4.46Å; T256-T305 HydrophobicContact CG2-CG2 3.92Å
257	G	94.8	Very high	95.4	Very high	56 Å²	56	27 Å²	27	58%	0.577	16%	0.155	S	C	*	.	T	Hydrogen-bonded Turn	trans	76.5	20.9	177.7	0	0	0	0	0	113.4	I253 L254 Q255 P259	I253-G257 PolarHBondContact O-N 3.44Å; L254-G257 PolarHBondContact O-N 3.12Å; Q255-G257 PolarHBondContact O-N 3.3Å; G257-P259 VanDerWaalsContact O-CD 3.31Å; G257-P259 WeakPolarHBondContact O-CD 3.16Å
258	V	96.6	Very high	95.6	Very high	14 Å²	14	29.6 Å²	29.6	9%	0.085	17%	0.169	C	C	.	.			trans	-61.9	121	173.4	179.3	0	0	0	0	107.9	I253 T256 I260 F292 Q302 T305	I253-V258 HydrophobicContact CG2-CB 3.89Å; I253-V258 HydrophobicContact CG2-CG1 4.23Å; I253-V258 HydrophobicContact CG2-CG2 4.41Å; I253-V258 PolarHBondContact O-N 3.01Å; T256-V258 VanDerWaalsContact C-N 3.33Å; T256-V258 HydrophobicContact CG2-CG2 4.46Å; V258-I260 PolarHBondContact O-N 3.29Å; V258-F292 HydrophobicContact CG1-CD1 4.36Å; V258-F292 HydrophobicContact CG1-CE1 4.06Å; V258-Q302 HydrophobicContact CG1-CB 4.15Å; V258-Q302 HydrophobicContact CG1-CG 4.14Å; V258-T305 HydrophobicContact CG2-CG2 3.71Å
259	P	94.6	Very high	95.7	Very high	38 Å²	38	29.4 Å²	29.4	25%	0.247	17%	0.17	C	C	.	.			trans	-77.3	57.4	-176.4	32.5	-37.7	0	0	0	112.3	R166 G257 Q302	R166-P259 VanDerWaalsContact NH1-CB 3.28Å; G257-P259 VanDerWaalsContact O-CD 3.31Å; G257-P259 WeakPolarHBondContact O-CD 3.16Å; P259-Q302 HydrophobicContact CG-CG 4.03Å; P259-Q302 PolarHBondContact O-OE1 2.83Å
260	I	96.6	Very high	95.8	Very high	4 Å²	4	29.4 Å²	29.4	2%	0.021	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-60.7	136.1	-178.4	-164.9	154.8	0	0	0	111	V165 R166 I253 L254 V258 R262 I263 L290 E291 F292	V165-I260 HydrophobicContact CG1-CG2 4.38Å; V165-I260 HydrophobicContact CG2-CG2 4.22Å; R166-I260 WeakPolarHBondContact CB-O 3.38Å; I253-I260 HydrophobicContact CG2-CB 4.39Å; I253-I260 HydrophobicContact CG2-CD1 4.07Å; I253-I260 HydrophobicContact CG2-CG2 4.42Å; L254-I260 HydrophobicContact CD2-CG2 4Å; V258-I260 PolarHBondContact O-N 3.29Å; I260-R262 WeakPolarHBondContact CD1-O 3.44Å; I260-R262 VanDerWaalsContact CG1-O 3.26Å; I260-R262 WeakPolarHBondContact CG1-O 3.28Å; I260-I263 HydrophobicContact CD1-CB 3.81Å; I260-I263 HydrophobicContact CD1-CD1 3.98Å; I260-I263 HydrophobicContact CD1-CG1 4.35Å; I260-I263 HydrophobicContact CG1-CB 4.42Å; I260-I263 HydrophobicContact CG2-CG2 4.41Å; I260-L290 HydrophobicContact CD1-CB 4.34Å; I260-L290 HydrophobicContact CD1-CD2 3.51Å; I260-E291 WeakPolarHBondContact CG1-O 3.33Å; I260-F292 HydrophobicContact CB-CE1 4.48Å; I260-F292 HydrophobicContact CD1-CE1 3.84Å; I260-F292 HydrophobicContact CD1-CZ 4.15Å; I260-F292 HydrophobicContact CG1-CD1 4.22Å; I260-F292 HydrophobicContact CG1-CE1 4.02Å
261	A	96.4	Very high	95.9	Very high	0 Å²	0	29.4 Å²	29.4	0%	0	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.6	-38.7	179.9	0	0	0	0	0	112	V165 E291 H293	V165-A261 WeakPolarHBondContact CG1-O 3.31Å; A261-E291 WeakPolarHBondContact CA-O 3.31Å; A261-E291 HydrophobicContact CB-CG 4.33Å; A261-E291 VanDerWaalsContact CB-O 3.28Å; A261-E291 WeakPolarHBondContact CB-O 3.07Å; A261-E291 PolarHBondContact N-O 3.06Å; A261-H293 HydrophobicContact CB-CB 4.18Å; A261-H293 VanDerWaalsContact CB-CE1 3.5Å; A261-H293 WeakPolarHBondContact CB-CE1 3.43Å; A261-H293 VanDerWaalsContact CB-CG 3.47Å; A261-H293 WeakPolarHBondContact CB-ND1 3.25Å
262	R	96.3	Very high	96.1	Very high	21 Å²	21	30.2 Å²	30.2	8%	0.079	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.5	141.7	178.7	-51	-178.8	167.7	169.1	-22.3	110.5	D144 T162 N163 I260 L290 E291 W331	D144-R262 IonicContact OD2-NH2 3.61Å; D144-R262 PolarHBondContact OD2-NH2 3.37Å; T162-R262 WeakPolarHBondContact O-CG 3.1Å; T162-R262 PolarHBondContact OG1-NE 2.94Å; N163-R262 PolarHBondContact ND2-NH2 3.27Å; N163-R262 VanDerWaalsContact ND2-NH2 3.13Å; N163-R262 VanDerWaalsContact OD1-CG 3.32Å; N163-R262 WeakPolarHBondContact OD1-CG 3.43Å; N163-R262 PolarHBondContact OD1-NE 2.86Å; I260-R262 WeakPolarHBondContact CD1-O 3.44Å; I260-R262 VanDerWaalsContact CG1-O 3.26Å; I260-R262 WeakPolarHBondContact CG1-O 3.28Å; R262-L290 CarbonylContact O-C 3.42Å; R262-L290 WeakPolarHBondContact O-CA 3.1Å; R262-E291 HydrophobicContact CB-CB 4.02Å; R262-E291 VanDerWaalsContact CD-OE1 3.25Å; R262-E291 WeakPolarHBondContact CD-OE1 3.36Å; R262-E291 HydrophobicContact CG-CB 4.1Å; R262-E291 IonicContact CZ-OE1 3.6Å; R262-E291 VanDerWaalsContact CZ-OE1 3.26Å; R262-E291 PolarHBondContact N-O 3.13Å; R262-E291 VanDerWaalsContact N-O 3.14Å; R262-E291 IonicContact NE-OE1 3.97Å; R262-E291 PolarHBondContact NE-OE1 3.2Å; R262-E291 IonicContact NH1-OE1 2.58Å; R262-E291 PolarHBondContact NH1-OE1 3.41Å; R262-E291 PolarHBondContact O-N 3.47Å; R262-W331 HydrophobicContact CB-CH2 3.41Å; R262-W331 VanDerWaalsContact CB-CH2 3.41Å; R262-W331 HydrophobicContact CB-CZ2 3.86Å; R262-W331 HydrophobicContact CB-CZ3 4.14Å; R262-W331 VanDerWaalsContact CD-CH2 3.42Å; R262-W331 HydrophobicContact CG-CH2 4.04Å; R262-W331 HydrophobicContact CG-CZ2 4.26Å; R262-W331 HydrophobicContact CG-CZ3 4.48Å
263	I	96.8	Very high	96.1	Very high	2 Å²	2	27.4 Å²	27.4	1%	0.01	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.1	99.8	172	-176.6	157.9	0	0	0	108.9	T250 I253 I260 L288 F289 L290 V386	T250-I263 HydrophobicContact CG2-CD1 3.78Å; T250-I263 HydrophobicContact CG2-CG1 4.21Å; T250-I263 HydrophobicContact CG2-CG2 4.34Å; T250-I263 WeakPolarHBondContact OG1-CD1 3.25Å; I253-I263 HydrophobicContact CD1-CD1 4.11Å; I260-I263 HydrophobicContact CD1-CB 3.81Å; I260-I263 HydrophobicContact CD1-CD1 3.98Å; I260-I263 HydrophobicContact CD1-CG1 4.35Å; I260-I263 HydrophobicContact CG1-CB 4.42Å; I260-I263 HydrophobicContact CG2-CG2 4.41Å; I263-L288 HydrophobicContact CD1-CD1 4.38Å; I263-L288 HydrophobicContact CG1-CD2 4.48Å; I263-F289 WeakPolarHBondContact CA-O 3.34Å; I263-L290 HydrophobicContact CB-CD2 4.07Å; I263-L290 HydrophobicContact CD1-CD2 3.43Å; I263-L290 VanDerWaalsContact CD1-CD2 3.43Å; I263-L290 HydrophobicContact CG1-CD2 3.54Å; I263-V386 HydrophobicContact CG1-CG2 4.03Å; I263-V386 WeakPolarHBondContact O-CG2 3.49Å; I263-V386 PolarHBondContact O-N 3.33Å
264	E	96.9	Very high	96.1	Very high	1 Å²	1	27.4 Å²	27.4	1%	0.005	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	132.1	-173.5	-60.1	-64.4	116.9	0	0	110.7	T162 L266 L288 F289 W331 R334 G384 H385	T162-E264 HydrophobicContact CG2-CG 4.31Å; E264-L266 HydrophobicContact CB-CD1 4.43Å; E264-L288 CarbonylContact O-C 3.54Å; E264-L288 VanDerWaalsContact O-CA 3.24Å; E264-L288 WeakPolarHBondContact O-CA 3.26Å; E264-F289 HydrophobicContact CB-CB 4.24Å; E264-F289 PolarHBondContact N-O 2.9Å; E264-F289 PolarHBondContact O-N 3.22Å; E264-W331 HydrophobicContact CG-CH2 3.93Å; E264-W331 HydrophobicContact CG-CZ3 3.63Å; E264-R334 HydrophobicContact CG-CG 4.18Å; E264-R334 IonicContact OE2-CZ 3.84Å; E264-R334 IonicContact OE2-NE 3.65Å; E264-R334 PolarHBondContact OE2-NE 2.97Å; E264-R334 IonicContact OE2-NH2 3.66Å; E264-R334 PolarHBondContact OE2-NH2 2.71Å; E264-G384 CarbonylContact C-O 3.47Å; E264-G384 VanDerWaalsContact CA-O 3.26Å; E264-G384 WeakPolarHBondContact CA-O 3.4Å; E264-H385 IonicContact OE1-CE1 2.92Å; E264-H385 IonicContact OE1-CG 3.47Å; E264-H385 IonicContact OE1-ND1 3.26Å; E264-H385 PolarHBondContact OE1-ND1 2.87Å; E264-H385 IonicContact OE2-CE1 3.35Å; E264-H385 PolarHBondContact OE2-CE1 3.13Å; E264-H385 IonicContact OE2-CG 3.25Å; E264-H385 IonicContact OE2-ND1 3.63Å; E264-H385 PolarHBondContact OE2-ND1 3.48Å
265	F	97.1	Very high	96.2	Very high	0 Å²	0	26.1 Å²	26.1	0%	0	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.5	138.3	172	176	-100.3	0	0	0	110.8	V243 A246 D267 P286 L288 I366 I382 A383 G384 V386	V243-F265 HydrophobicContact CB-CZ 4.45Å; V243-F265 HydrophobicContact CG1-CE2 4.44Å; V243-F265 HydrophobicContact CG1-CZ 4.13Å; V243-F265 HydrophobicContact CG2-CZ 4.02Å; A246-F265 HydrophobicContact CB-CD2 4.04Å; A246-F265 HydrophobicContact CB-CE2 4Å; F265-D267 HydrophobicContact CE1-CB 3.91Å; F265-D267 HydrophobicContact CZ-CB 4.12Å; F265-P286 HydrophobicContact CE2-CB 3.88Å; F265-P286 HydrophobicContact CZ-CB 4.22Å; F265-L288 HydrophobicContact CB-CD2 4.15Å; F265-L288 HydrophobicContact CD2-CD2 4.15Å; F265-I366 HydrophobicContact CD1-CD1 4.22Å; F265-I366 HydrophobicContact CE1-CD1 4.27Å; F265-I366 HydrophobicContact CE1-CG2 4.08Å; F265-I366 HydrophobicContact CZ-CG2 4.47Å; F265-I382 HydrophobicContact CD1-CG2 4.29Å; F265-I382 HydrophobicContact CE1-CG2 4.2Å; F265-A383 CarbonylContact O-C 3.59Å; F265-A383 WeakPolarHBondContact O-CA 3.28Å; F265-G384 PolarHBondContact N-O 2.81Å; F265-G384 PolarHBondContact O-N 3.11Å; F265-V386 HydrophobicContact CB-CB 4.24Å; F265-V386 HydrophobicContact CB-CG1 3.25Å; F265-V386 HydrophobicContact CB-CG2 3.94Å; F265-V386 HydrophobicContact CG-CG1 4.12Å
266	L	97.8	Very high	96.4	Very high	0 Å²	0	25.7 Å²	25.7	0%	0	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	131.9	165.7	-71.9	75.2	0	0	0	108.1	E264 M270 I271 T287 F289	E264-L266 HydrophobicContact CB-CD1 4.43Å; L266-M270 HydrophobicContact CB-CB 4.14Å; L266-M270 HydrophobicContact CB-CG 4.13Å; L266-M270 HydrophobicContact CD2-CG 3.85Å; L266-M270 HydrophobicContact CG-CB 4.44Å; L266-M270 HydrophobicContact CG-CG 3.86Å; L266-I271 HydrophobicContact CB-CB 4.49Å; L266-I271 HydrophobicContact CD2-CD1 4.06Å; L266-T287 PolarHBondContact N-O 3.39Å; L266-T287 PolarHBondContact O-N 3.22Å; L266-F289 HydrophobicContact CD1-CD2 4.03Å; L266-F289 HydrophobicContact CD1-CE2 4.12Å; L266-F289 HydrophobicContact CD1-CG 4.23Å; L266-F289 HydrophobicContact CD1-CZ 4.41Å; L266-F289 HydrophobicContact CD2-CE2 4.06Å; L266-F289 HydrophobicContact CD2-CZ 4.03Å
267	D	96.8	Very high	96.4	Very high	1 Å²	1	26 Å²	26	1%	0.005	14%	0.144	C	C	.	.			trans	-76.3	173	169.6	80.7	-22.8	0	0	0	112.2	F265 V269 M270 I271 K370 I382	F265-D267 HydrophobicContact CE1-CB 3.91Å; F265-D267 HydrophobicContact CZ-CB 4.12Å; D267-V269 PolarHBondContact O-N 3.42Å; D267-V269 PolarHBondContact OD1-N 3.21Å; D267-M270 PolarHBondContact O-N 2.81Å; D267-M270 VanDerWaalsContact O-N 3.16Å; D267-M270 WeakPolarHBondContact OD1-CB 3.26Å; D267-M270 PolarHBondContact OD1-N 3.13Å; D267-I271 WeakPolarHBondContact O-CG2 3.12Å; D267-I271 PolarHBondContact O-N 3.02Å; D267-K370 HydrophobicContact CB-CD 4.37Å; D267-K370 WeakPolarHBondContact OD2-CE 3.37Å; D267-K370 IonicContact OD2-NZ 2.73Å; D267-I382 HydrophobicContact CB-CB 4.17Å; D267-I382 PolarHBondContact N-O 3.46Å; D267-I382 PolarHBondContact OD1-N 3.28Å
268	D	95.8	Very high	96.3	Very high	56 Å²	56	24.6 Å²	24.6	30%	0.299	13%	0.126	S	C	.	.	H	α-helix	trans	-58.5	-35.9	-179.9	58.2	-59.1	0	0	0	112.3	I271 D272 V284 K370	D268-I271 WeakPolarHBondContact O-CG2 3.46Å; D268-D272 WeakPolarHBondContact O-CB 3.43Å; D268-D272 PolarHBondContact O-N 2.99Å; D268-D272 VanDerWaalsContact O-N 3.14Å; D268-V284 HydrophobicContact CB-CG1 4.08Å; D268-V284 WeakPolarHBondContact O-CG1 3.36Å; D268-K370 IonicContact OD1-NZ 2.88Å; D268-K370 PolarHBondContact OD1-NZ 2.83Å
269	V	96.3	Very high	96.1	Very high	50 Å²	50	29 Å²	29	30%	0.303	16%	0.157	S	C	.	.	H	α-helix	trans	-69	-42.5	177.1	-165.8	0	0	0	0	110.9	D267 A273 L344 P381	D267-V269 PolarHBondContact O-N 3.42Å; D267-V269 PolarHBondContact OD1-N 3.21Å; V269-A273 WeakPolarHBondContact O-CB 3.19Å; V269-A273 PolarHBondContact O-N 3.34Å; V269-L344 HydrophobicContact CG1-CD1 4.31Å; V269-P381 HydrophobicContact CB-CB 4.36Å; V269-P381 HydrophobicContact CB-CG 4.41Å; V269-P381 HydrophobicContact CG1-CB 4.27Å; V269-P381 HydrophobicContact CG1-CG 3.79Å
270	M	97.1	Very high	95.9	Very high	0 Å²	0	27.9 Å²	27.9	0%	0	15%	0.149	C	C	.	.	H	α-helix	trans	-69	-42.6	179.6	-173.1	62.6	82.9	0	0	112.5	L266 D267 D272 A273 C274 A337 P381 I382 A383 L394	L266-M270 HydrophobicContact CB-CB 4.14Å; L266-M270 HydrophobicContact CB-CG 4.13Å; L266-M270 HydrophobicContact CD2-CG 3.85Å; L266-M270 HydrophobicContact CG-CB 4.44Å; L266-M270 HydrophobicContact CG-CG 3.86Å; D267-M270 PolarHBondContact O-N 2.81Å; D267-M270 VanDerWaalsContact O-N 3.16Å; D267-M270 WeakPolarHBondContact OD1-CB 3.26Å; D267-M270 PolarHBondContact OD1-N 3.13Å; M270-D272 VanDerWaalsContact C-N 3.32Å; M270-D272 PolarHBondContact O-N 2.78Å; M270-A273 WeakPolarHBondContact O-CB 3.33Å; M270-A273 PolarHBondContact O-N 3.33Å; M270-C274 WeakPolarHBondContact O-CB 3.4Å; M270-C274 PolarHBondContact O-N 3.38Å; M270-C274 PolarHBondContact O-SG 3.4Å; M270-A337 HydrophobicContact CE-CB 4.38Å; M270-A337 HydrophobicContact SD-CB 3.89Å; M270-P381 HydrophobicContact CB-CB 3.88Å; M270-P381 HydrophobicContact CE-CB 3.46Å; M270-P381 VanDerWaalsContact CE-CB 3.46Å; M270-P381 HydrophobicContact CG-CB 4.45Å; M270-P381 HydrophobicContact SD-CB 3.82Å; M270-I382 WeakPolarHBondContact CB-O 3.43Å; M270-A383 HydrophobicContact CE-CB 3.76Å; M270-A383 HydrophobicContact CG-CB 4.24Å; M270-L394 HydrophobicContact CE-CB 4.17Å; M270-L394 HydrophobicContact CE-CD1 3.38Å; M270-L394 HydrophobicContact CE-CG 3.76Å
271	I	96.9	Very high	95.8	Very high	0 Å²	0	33 Å²	33	0%	0	19%	0.185	C	C	.	.	H	α-helix	trans	-66.1	-37.2	178.2	-165.7	65.8	0	0	0	111.1	L266 D267 D268 C274 N275 Y282 V284 T287 F289	L266-I271 HydrophobicContact CB-CB 4.49Å; L266-I271 HydrophobicContact CD2-CD1 4.06Å; D267-I271 WeakPolarHBondContact O-CG2 3.12Å; D267-I271 PolarHBondContact O-N 3.02Å; D268-I271 WeakPolarHBondContact O-CG2 3.46Å; I271-C274 PolarHBondContact O-N 2.81Å; I271-N275 WeakPolarHBondContact O-CB 3.45Å; I271-N275 VanDerWaalsContact O-CG 3.25Å; I271-N275 PolarHBondContact O-N 2.91Å; I271-N275 PolarHBondContact O-ND2 3.26Å; I271-Y282 HydrophobicContact CD1-CD2 4.16Å; I271-V284 HydrophobicContact CG2-CG1 4.41Å; I271-T287 HydrophobicContact CD1-CG2 4.37Å; I271-F289 HydrophobicContact CD1-CE1 3.97Å; I271-F289 HydrophobicContact CD1-CZ 3.77Å
272	D	97	Very high	95.7	Very high	46 Å²	46	34.5 Å²	34.5	25%	0.246	19%	0.191	C	C	.	.	H	α-helix	trans	-63.9	-43.1	173.6	-179.5	49.6	0	0	0	111.8	D268 M270 C274 N275 K276 V284	D268-D272 WeakPolarHBondContact O-CB 3.43Å; D268-D272 PolarHBondContact O-N 2.99Å; D268-D272 VanDerWaalsContact O-N 3.14Å; M270-D272 VanDerWaalsContact C-N 3.32Å; M270-D272 PolarHBondContact O-N 2.78Å; D272-C274 VanDerWaalsContact C-N 3.34Å; D272-C274 PolarHBondContact O-N 3.13Å; D272-N275 PolarHBondContact O-N 3.24Å; D272-K276 VanDerWaalsContact CG-NZ 3.33Å; D272-K276 WeakPolarHBondContact O-CG 3.35Å; D272-K276 PolarHBondContact O-N 2.77Å; D272-K276 WeakPolarHBondContact OD1-CE 3.49Å; D272-K276 IonicContact OD1-NZ 2.79Å; D272-K276 PolarHBondContact OD1-NZ 3.21Å; D272-K276 WeakPolarHBondContact OD2-CE 3.49Å; D272-K276 IonicContact OD2-NZ 3.77Å; D272-K276 PolarHBondContact OD2-NZ 3.02Å; D272-V284 HydrophobicContact CB-CG1 3.87Å; D272-V284 HydrophobicContact CB-CG2 4.12Å
273	A	96.6	Very high	95.7	Very high	2 Å²	2	35.7 Å²	35.7	2%	0.017	20%	0.202	C	C	.	.	H	α-helix	trans	-58.5	-46.7	173.1	0	0	0	0	0	111.5	V269 M270 K276 F277 A340 L344	V269-A273 WeakPolarHBondContact O-CB 3.19Å; V269-A273 PolarHBondContact O-N 3.34Å; M270-A273 WeakPolarHBondContact O-CB 3.33Å; M270-A273 PolarHBondContact O-N 3.33Å; A273-K276 PolarHBondContact O-N 2.8Å; A273-F277 VanDerWaalsContact O-CB 3.29Å; A273-F277 WeakPolarHBondContact O-CB 3.46Å; A273-F277 PolarHBondContact O-N 3.14Å; A273-A340 HydrophobicContact CB-CB 4.14Å; A273-L344 HydrophobicContact CB-CD1 4.07Å; A273-L344 HydrophobicContact CB-CD2 3.8Å; A273-L344 HydrophobicContact CB-CG 4Å
274	C	96.6	Very high	95.7	Very high	0 Å²	0	39.2 Å²	39.2	0%	0	22%	0.223	C	C	.	.	H	α-helix	trans	-65.2	-40.5	178.8	-68.8	0	0	0	0	112.3	M270 I271 D272 K276 F277 S278	M270-C274 WeakPolarHBondContact O-CB 3.4Å; M270-C274 PolarHBondContact O-N 3.38Å; M270-C274 PolarHBondContact O-SG 3.4Å; I271-C274 PolarHBondContact O-N 2.81Å; D272-C274 VanDerWaalsContact C-N 3.34Å; D272-C274 PolarHBondContact O-N 3.13Å; C274-K276 PolarHBondContact O-N 3.14Å; C274-F277 PolarHBondContact O-N 3.28Å; C274-S278 WeakPolarHBondContact O-CA 3.36Å; C274-S278 VanDerWaalsContact O-CB 3.25Å; C274-S278 WeakPolarHBondContact O-CB 3.27Å; C274-S278 PolarHBondContact O-N 3.4Å
275	N	96.3	Very high	95.7	Very high	18 Å²	18	41.3 Å²	41.3	10%	0.096	24%	0.236	C	C	.	.	H	α-helix	trans	-56.7	-50	174.5	-78.2	-22.2	0	0	0	111.2	I271 D272 S279 L280 S281 Y282	I271-N275 WeakPolarHBondContact O-CB 3.45Å; I271-N275 VanDerWaalsContact O-CG 3.25Å; I271-N275 PolarHBondContact O-N 2.91Å; I271-N275 PolarHBondContact O-ND2 3.26Å; D272-N275 PolarHBondContact O-N 3.24Å; N275-S279 WeakPolarHBondContact O-CA 3.44Å; N275-S279 PolarHBondContact O-N 2.83Å; N275-S279 VanDerWaalsContact O-N 3.09Å; N275-L280 PolarHBondContact O-N 3.44Å; N275-L280 VanDerWaalsContact O-N 3.13Å; N275-L280 VanDerWaalsContact OD1-C 3.24Å; N275-L280 VanDerWaalsContact OD1-CB 3.23Å; N275-L280 WeakPolarHBondContact OD1-CB 3.4Å; N275-L280 PolarHBondContact OD1-O 2.87Å; N275-S281 PolarHBondContact OD1-N 3.31Å; N275-Y282 PolarHBondContact ND2-O 2.94Å; N275-Y282 PolarHBondContact OD1-N 3.09Å; N275-Y282 VanDerWaalsContact OD1-N 3.1Å
276	K	95.4	Very high	95.7	Very high	143 Å²	143	42 Å²	42	62%	0.622	24%	0.24	S	C	*	.	H	α-helix	trans	-66.5	-43.4	-179.9	-70.2	166.7	179.7	166.1	0	112.9	D272 A273 C274	D272-K276 VanDerWaalsContact CG-NZ 3.33Å; D272-K276 WeakPolarHBondContact O-CG 3.35Å; D272-K276 PolarHBondContact O-N 2.77Å; D272-K276 WeakPolarHBondContact OD1-CE 3.49Å; D272-K276 IonicContact OD1-NZ 2.79Å; D272-K276 PolarHBondContact OD1-NZ 3.21Å; D272-K276 WeakPolarHBondContact OD2-CE 3.49Å; D272-K276 IonicContact OD2-NZ 3.77Å; D272-K276 PolarHBondContact OD2-NZ 3.02Å; A273-K276 PolarHBondContact O-N 2.8Å; C274-K276 PolarHBondContact O-N 3.14Å
277	F	95.3	Very high	95.7	Very high	93 Å²	93	42 Å²	42	41%	0.408	24%	0.24	S	C	.	.	H	α-helix	trans	-79.2	-41.5	-174.6	-172.2	-93.4	0	0	0	112.9	A273 C274 D336 A340 A343	A273-F277 VanDerWaalsContact O-CB 3.29Å; A273-F277 WeakPolarHBondContact O-CB 3.46Å; A273-F277 PolarHBondContact O-N 3.14Å; C274-F277 PolarHBondContact O-N 3.28Å; F277-D336 HydrophobicContact CD1-CB 4.14Å; F277-D336 HydrophobicContact CE1-CB 3.91Å; F277-A340 HydrophobicContact CB-CB 3.63Å; F277-A340 HydrophobicContact CD1-CB 4.18Å; F277-A340 HydrophobicContact CG-CB 3.89Å; F277-A343 HydrophobicContact CD2-CB 3.78Å; F277-A343 HydrophobicContact CE2-CB 4.22Å
278	S	93.7	Very high	95.8	Very high	28 Å²	28	41.9 Å²	41.9	20%	0.196	24%	0.24	C	C	.	.	H	α-helix	trans	-102.7	7.5	-172.3	-54	0	0	0	0	113.5	C274 L280	C274-S278 WeakPolarHBondContact O-CA 3.36Å; C274-S278 VanDerWaalsContact O-CB 3.25Å; C274-S278 WeakPolarHBondContact O-CB 3.27Å; C274-S278 PolarHBondContact O-N 3.4Å; S278-L280 VanDerWaalsContact C-N 3.31Å; S278-L280 PolarHBondContact O-N 2.6Å
279	S	92	Very high	95.8	Very high	106 Å²	106	39.2 Å²	39.2	74%	0.741	23%	0.226	S	C	*	.	T	Hydrogen-bonded Turn	trans	55.2	44.1	-177.4	-53.9	0	0	0	0	113	N275	N275-S279 WeakPolarHBondContact O-CA 3.44Å; N275-S279 PolarHBondContact O-N 2.83Å; N275-S279 VanDerWaalsContact O-N 3.09Å
280	L	91.4	Very high	95.9	Very high	14 Å²	14	36.9 Å²	36.9	7%	0.073	21%	0.211	C	C	.	.			trans	-94.4	167.4	171.2	-57.6	173.4	0	0	0	110.5	N275 S278 Y282 R329 A333	N275-L280 PolarHBondContact O-N 3.44Å; N275-L280 VanDerWaalsContact O-N 3.13Å; N275-L280 VanDerWaalsContact OD1-C 3.24Å; N275-L280 VanDerWaalsContact OD1-CB 3.23Å; N275-L280 WeakPolarHBondContact OD1-CB 3.4Å; N275-L280 PolarHBondContact OD1-O 2.87Å; S278-L280 VanDerWaalsContact C-N 3.31Å; S278-L280 PolarHBondContact O-N 2.6Å; L280-Y282 HydrophobicContact CB-CD2 4.02Å; L280-Y282 HydrophobicContact CB-CE2 4.22Å; L280-Y282 HydrophobicContact CD1-CD2 4.02Å; L280-Y282 HydrophobicContact CD1-CE2 3.83Å; L280-Y282 HydrophobicContact CD2-CE2 4.12Å; L280-Y282 HydrophobicContact CG-CE2 4.29Å; L280-R329 HydrophobicContact CD2-CG 4.11Å; L280-A333 HydrophobicContact CD1-CB 3.36Å; L280-A333 HydrophobicContact CG-CB 4.3Å
281	S	93	Very high	95.9	Very high	113 Å²	113	37.1 Å²	37.1	79%	0.79	21%	0.212	S	C	*	.			trans	-137.5	33.3	-175.4	64.7	0	0	0	0	112.7	N275	N275-S281 PolarHBondContact OD1-N 3.31Å
282	Y	94.8	Very high	96	Very high	30 Å²	30	37.1 Å²	37.1	12%	0.118	21%	0.212	C	C	.	.			trans	-76.5	154.7	179.4	-64.3	-61.8	0	0	0	111.6	V237 I271 N275 L280 F289 L330	V237-Y282 HydrophobicContact CB-CE1 4.23Å; V237-Y282 HydrophobicContact CG1-CD1 4.04Å; V237-Y282 HydrophobicContact CG1-CE1 3.98Å; V237-Y282 HydrophobicContact CG1-CG 4.45Å; V237-Y282 HydrophobicContact CG2-CE1 4.21Å; V237-Y282 HydrophobicContact CG2-CE2 4.5Å; I271-Y282 HydrophobicContact CD1-CD2 4.16Å; N275-Y282 PolarHBondContact ND2-O 2.94Å; N275-Y282 PolarHBondContact OD1-N 3.09Å; N275-Y282 VanDerWaalsContact OD1-N 3.1Å; L280-Y282 HydrophobicContact CB-CD2 4.02Å; L280-Y282 HydrophobicContact CB-CE2 4.22Å; L280-Y282 HydrophobicContact CD1-CD2 4.02Å; L280-Y282 HydrophobicContact CD1-CE2 3.83Å; L280-Y282 HydrophobicContact CD2-CE2 4.12Å; L280-Y282 HydrophobicContact CG-CE2 4.29Å; Y282-F289 HydrophobicContact CD2-CZ 4.49Å; Y282-F289 HydrophobicContact CE2-CZ 4.41Å; Y282-L330 HydrophobicContact CE2-CD1 4.01Å
283	P	96	Very high	95.9	Very high	47 Å²	47	35.5 Å²	35.5	31%	0.305	20%	0.203	S	C	.	.			trans	-55.1	138.7	172.6	-24.8	34.7	0	0	0	112.4	T285	P283-T285 PolarHBondContact O-N 3.19Å
284	V	97.1	Very high	95.9	Very high	76 Å²	76	36.3 Å²	36.3	46%	0.461	21%	0.211	S	C	.	.	S	Bend	trans	-80.4	74.4	178.1	-178.4	0	0	0	0	109.7	D268 I271 D272	D268-V284 HydrophobicContact CB-CG1 4.08Å; D268-V284 WeakPolarHBondContact O-CG1 3.36Å; I271-V284 HydrophobicContact CG2-CG1 4.41Å; D272-V284 HydrophobicContact CB-CG1 3.87Å; D272-V284 HydrophobicContact CB-CG2 4.12Å
285	T	97.1	Very high	95.9	Very high	44 Å²	44	38.6 Å²	38.6	27%	0.27	23%	0.228	S	C	.	.	S	Bend	trans	-145.8	161	-177.1	55.7	0	0	0	0	109.5	S239 P283 T287	S239-T285 WeakPolarHBondContact CB-OG1 3.27Å; P283-T285 PolarHBondContact O-N 3.19Å; T285-T287 PolarHBondContact O-N 3.13Å; T285-T287 PolarHBondContact O-OG1 3.25Å
286	P	96.8	Very high	95.8	Very high	14 Å²	14	41.5 Å²	41.5	9%	0.091	24%	0.241	C	C	.	.			trans	-46.2	127	169	-28.2	35.5	0	0	0	111.1	F240 V243 F265	F240-P286 HydrophobicContact CB-CB 4.45Å; F240-P286 PolarHBondContact N-O 3.16Å; F240-P286 WeakPolarHBondContact O-CD 3.28Å; V243-P286 HydrophobicContact CG2-CG 4.43Å; F265-P286 HydrophobicContact CE2-CB 3.88Å; F265-P286 HydrophobicContact CZ-CB 4.22Å
287	T	97.9	Very high	95.8	Very high	0 Å²	0	43.5 Å²	43.5	0%	0	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.1	138.5	-168.9	-64	0	0	0	0	110.5	V237 C238 L266 I271 T285 F289	V237-T287 HydrophobicContact CG1-CG2 3.63Å; C238-T287 CarbonylContact O-C 3.54Å; C238-T287 WeakPolarHBondContact O-CA 3.42Å; C238-T287 WeakPolarHBondContact O-CG2 3.03Å; L266-T287 PolarHBondContact N-O 3.39Å; L266-T287 PolarHBondContact O-N 3.22Å; I271-T287 HydrophobicContact CD1-CG2 4.37Å; T285-T287 PolarHBondContact O-N 3.13Å; T285-T287 PolarHBondContact O-OG1 3.25Å; T287-F289 HydrophobicContact CG2-CD1 3.88Å; T287-F289 HydrophobicContact CG2-CE1 3.63Å
288	L	97.9	Very high	95.8	Very high	0 Å²	0	40.9 Å²	40.9	0%	0	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.6	132.8	168.8	-62.8	178.8	0	0	0	110.7	V237 C238 F240 A246 I263 E264 F265 L290 V386	V237-L288 WeakPolarHBondContact CA-O 3.3Å; C238-L288 PolarHBondContact N-O 2.91Å; C238-L288 PolarHBondContact O-N 3.29Å; F240-L288 HydrophobicContact CD2-CD1 4.46Å; F240-L288 HydrophobicContact CD2-CG 4.15Å; F240-L288 HydrophobicContact CE2-CB 3.96Å; F240-L288 HydrophobicContact CE2-CD1 3.5Å; F240-L288 VanDerWaalsContact CE2-CD1 3.5Å; F240-L288 HydrophobicContact CE2-CG 3.5Å; F240-L288 HydrophobicContact CZ-CD1 3.73Å; F240-L288 HydrophobicContact CZ-CG 4.26Å; A246-L288 HydrophobicContact CB-CD1 4.46Å; A246-L288 HydrophobicContact CB-CD2 4.14Å; A246-L288 HydrophobicContact CB-CG 4.11Å; A246-L288 WeakPolarHBondContact O-CD1 3Å; I263-L288 HydrophobicContact CD1-CD1 4.38Å; I263-L288 HydrophobicContact CG1-CD2 4.48Å; E264-L288 CarbonylContact O-C 3.54Å; E264-L288 VanDerWaalsContact O-CA 3.24Å; E264-L288 WeakPolarHBondContact O-CA 3.26Å; F265-L288 HydrophobicContact CB-CD2 4.15Å; F265-L288 HydrophobicContact CD2-CD2 4.15Å; L288-L290 HydrophobicContact CB-CD2 4.41Å; L288-L290 HydrophobicContact CB-CG 4.35Å; L288-V386 HydrophobicContact CD2-CG2 4.08Å
289	F	97.6	Very high	95.9	Very high	0 Å²	0	39.6 Å²	39.6	0%	0	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.9	126.1	161.7	-63	-5.3	0	0	0	108.9	A236 V237 I263 E264 L266 I271 Y282 T287 L330 W331 R334	A236-F289 WeakPolarHBondContact O-CA 3.48Å; V237-F289 HydrophobicContact CB-CD1 4.34Å; V237-F289 HydrophobicContact CG1-CD1 3.88Å; V237-F289 HydrophobicContact CG1-CE1 3.79Å; V237-F289 HydrophobicContact CG2-CD1 3.82Å; V237-F289 HydrophobicContact CG2-CE1 4.04Å; I263-F289 WeakPolarHBondContact CA-O 3.34Å; E264-F289 HydrophobicContact CB-CB 4.24Å; E264-F289 PolarHBondContact N-O 2.9Å; E264-F289 PolarHBondContact O-N 3.22Å; L266-F289 HydrophobicContact CD1-CD2 4.03Å; L266-F289 HydrophobicContact CD1-CE2 4.12Å; L266-F289 HydrophobicContact CD1-CG 4.23Å; L266-F289 HydrophobicContact CD1-CZ 4.41Å; L266-F289 HydrophobicContact CD2-CE2 4.06Å; L266-F289 HydrophobicContact CD2-CZ 4.03Å; I271-F289 HydrophobicContact CD1-CE1 3.97Å; I271-F289 HydrophobicContact CD1-CZ 3.77Å; Y282-F289 HydrophobicContact CD2-CZ 4.49Å; Y282-F289 HydrophobicContact CE2-CZ 4.41Å; T287-F289 HydrophobicContact CG2-CD1 3.88Å; T287-F289 HydrophobicContact CG2-CE1 3.63Å; F289-L330 HydrophobicContact CB-CD2 4.3Å; F289-L330 HydrophobicContact CD1-CD1 3.82Å; F289-L330 HydrophobicContact CD2-CD1 3.57Å; F289-L330 HydrophobicContact CD2-CD2 4.48Å; F289-L330 HydrophobicContact CD2-CG 3.86Å; F289-L330 HydrophobicContact CE1-CD1 3.69Å; F289-L330 HydrophobicContact CE2-CD1 3.44Å; F289-L330 VanDerWaalsContact CE2-CD1 3.44Å; F289-L330 HydrophobicContact CE2-CG 4.13Å; F289-L330 HydrophobicContact CG-CD1 3.78Å; F289-L330 HydrophobicContact CG-CD2 4.27Å; F289-L330 HydrophobicContact CG-CG 4.1Å; F289-L330 HydrophobicContact CZ-CD1 3.5Å; F289-W331 HydrophobicContact CB-CH2 4.21Å; F289-R334 HydrophobicContact CD2-CB 4.05Å; F289-R334 HydrophobicContact CE2-CB 4.28Å
290	L	97.8	Very high	96.1	Very high	0 Å²	0	39.7 Å²	39.7	0%	0	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	145.2	-172.1	-56.8	157.5	0	0	0	108.7	S235 A236 I253 I260 R262 I263 L288 F292 F318	S235-L290 CarbonylContact C-O 3.37Å; S235-L290 WeakPolarHBondContact CA-O 3.18Å; A236-L290 HydrophobicContact CB-CB 4.14Å; A236-L290 HydrophobicContact CB-CD1 4.21Å; A236-L290 PolarHBondContact N-O 2.92Å; A236-L290 PolarHBondContact O-N 2.77Å; I253-L290 HydrophobicContact CD1-CD2 4.37Å; I260-L290 HydrophobicContact CD1-CB 4.34Å; I260-L290 HydrophobicContact CD1-CD2 3.51Å; R262-L290 CarbonylContact O-C 3.42Å; R262-L290 WeakPolarHBondContact O-CA 3.1Å; I263-L290 HydrophobicContact CB-CD2 4.07Å; I263-L290 HydrophobicContact CD1-CD2 3.43Å; I263-L290 VanDerWaalsContact CD1-CD2 3.43Å; I263-L290 HydrophobicContact CG1-CD2 3.54Å; L288-L290 HydrophobicContact CB-CD2 4.41Å; L288-L290 HydrophobicContact CB-CG 4.35Å; L290-F292 HydrophobicContact CB-CE2 3.87Å; L290-F292 HydrophobicContact CB-CZ 4.04Å; L290-F292 HydrophobicContact CD1-CZ 4.48Å; L290-F318 HydrophobicContact CD1-CE2 3.75Å; L290-F318 HydrophobicContact CD1-CZ 4.28Å
291	E	97.5	Very high	96.3	Very high	6 Å²	6	44 Å²	44	3%	0.028	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.4	140.7	165.6	173	159.8	81.2	0	0	111.4	V234 S235 I260 A261 R262 H293 W331	V234-E291 CarbonylContact O-C 3.45Å; V234-E291 VanDerWaalsContact O-CA 3.27Å; V234-E291 WeakPolarHBondContact O-CA 3.34Å; S235-E291 PolarHBondContact OG-OE2 2.96Å; I260-E291 WeakPolarHBondContact CG1-O 3.33Å; A261-E291 WeakPolarHBondContact CA-O 3.31Å; A261-E291 HydrophobicContact CB-CG 4.33Å; A261-E291 VanDerWaalsContact CB-O 3.28Å; A261-E291 WeakPolarHBondContact CB-O 3.07Å; A261-E291 PolarHBondContact N-O 3.06Å; R262-E291 HydrophobicContact CB-CB 4.02Å; R262-E291 VanDerWaalsContact CD-OE1 3.25Å; R262-E291 WeakPolarHBondContact CD-OE1 3.36Å; R262-E291 HydrophobicContact CG-CB 4.1Å; R262-E291 IonicContact CZ-OE1 3.6Å; R262-E291 VanDerWaalsContact CZ-OE1 3.26Å; R262-E291 PolarHBondContact N-O 3.13Å; R262-E291 VanDerWaalsContact N-O 3.14Å; R262-E291 IonicContact NE-OE1 3.97Å; R262-E291 PolarHBondContact NE-OE1 3.2Å; R262-E291 IonicContact NH1-OE1 2.58Å; R262-E291 PolarHBondContact NH1-OE1 3.41Å; R262-E291 PolarHBondContact O-N 3.47Å; E291-H293 IonicContact OE1-NE2 2.77Å; E291-W331 HydrophobicContact CB-CH2 4.4Å; E291-W331 HydrophobicContact CB-CZ2 3.41Å; E291-W331 VanDerWaalsContact CB-CZ2 3.41Å; E291-W331 HydrophobicContact CG-CZ2 4.47Å; E291-W331 PolarHBondContact OE1-NE1 3.33Å; E291-W331 PolarHBondContact OE2-NE1 3.32Å
292	F	97.4	Very high	96.6	Very high	0 Å²	0	39 Å²	39	0%	0	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	137.6	-175.1	-54.8	-83.9	0	0	0	108.8	M233 V234 A236 V258 I260 L290 L299 Q302 V303 A306	M233-F292 VanDerWaalsContact CA-O 3.3Å; M233-F292 WeakPolarHBondContact CA-O 3.38Å; V234-F292 HydrophobicContact CB-CD2 4.42Å; V234-F292 HydrophobicContact CG1-CD2 4.36Å; V234-F292 PolarHBondContact N-O 3.05Å; V234-F292 PolarHBondContact O-N 2.93Å; A236-F292 HydrophobicContact CB-CE2 4.24Å; V258-F292 HydrophobicContact CG1-CD1 4.36Å; V258-F292 HydrophobicContact CG1-CE1 4.06Å; I260-F292 HydrophobicContact CB-CE1 4.48Å; I260-F292 HydrophobicContact CD1-CE1 3.84Å; I260-F292 HydrophobicContact CD1-CZ 4.15Å; I260-F292 HydrophobicContact CG1-CD1 4.22Å; I260-F292 HydrophobicContact CG1-CE1 4.02Å; L290-F292 HydrophobicContact CB-CE2 3.87Å; L290-F292 HydrophobicContact CB-CZ 4.04Å; L290-F292 HydrophobicContact CD1-CZ 4.48Å; F292-L299 HydrophobicContact CB-CD2 3.51Å; F292-L299 VanDerWaalsContact O-CD2 3.31Å; F292-L299 WeakPolarHBondContact O-CD2 3.36Å; F292-Q302 HydrophobicContact CD1-CB 3.82Å; F292-Q302 HydrophobicContact CE1-CB 4.4Å; F292-Q302 HydrophobicContact CG-CB 4.35Å; F292-V303 HydrophobicContact CD2-CG2 3.77Å; F292-V303 HydrophobicContact CE2-CG2 4.05Å; F292-V303 HydrophobicContact CG-CG2 4.26Å; F292-A306 HydrophobicContact CE1-CB 3.93Å; F292-A306 HydrophobicContact CZ-CB 3.55Å
293	H	96.3	Very high	96.7	Very high	12 Å²	12	38.1 Å²	38.1	6%	0.056	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122	139.6	179.2	-67.4	173.6	0	0	0	109.9	Y167 P230 A261 E291 Q302	Y167-H293 AromaticContact CE2-ND1 3.75Å; Y167-H293 AromaticContact CZ-ND1 3.76Å; Y167-H293 PolarHBondContact OH-ND1 2.81Å; P230-H293 HydrophobicContact CB-CB 3.85Å; P230-H293 HydrophobicContact CG-CB 3.96Å; A261-H293 HydrophobicContact CB-CB 4.18Å; A261-H293 VanDerWaalsContact CB-CE1 3.5Å; A261-H293 WeakPolarHBondContact CB-CE1 3.43Å; A261-H293 VanDerWaalsContact CB-CG 3.47Å; A261-H293 WeakPolarHBondContact CB-ND1 3.25Å; E291-H293 IonicContact OE1-NE2 2.77Å; H293-Q302 PolarHBondContact O-NE2 2.84Å
294	G	95.8	Very high	96.8	Very high	18 Å²	18	38.6 Å²	38.6	19%	0.186	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	165	-163.9	177	0	0	0	0	0	113.5	A232	A232-G294 PolarHBondContact N-O 2.92Å; A232-G294 PolarHBondContact O-N 3.48Å
295	S	96.1	Very high	96.8	Very high	49 Å²	49	37 Å²	37	34%	0.343	19%	0.193	S	C	.	.			trans	-77.7	161.1	162.9	61.6	0	0	0	0	110.3	E231 R297 S298 L299	E231-S295 WeakPolarHBondContact OE2-CA 3.23Å; E231-S295 WeakPolarHBondContact OE2-CB 3.18Å; S295-R297 VanDerWaalsContact C-N 3.27Å; S295-R297 PolarHBondContact O-N 3.44Å; S295-S298 PolarHBondContact O-N 3.23Å; S295-S298 PolarHBondContact OG-N 3.24Å; S295-L299 WeakPolarHBondContact O-CG 3.21Å; S295-L299 PolarHBondContact O-N 2.69Å
296	E	94.5	Very high	96.8	Very high	79 Å²	79	34.9 Å²	34.9	37%	0.369	18%	0.181	S	C	.	.	H	α-helix	trans	-50.7	-46.2	179.7	-70.2	-70.3	171	0	0	112.6	A232 S298 L299 E300 R322	A232-E296 HydrophobicContact CB-CG 4.48Å; E296-S298 PolarHBondContact O-N 3.28Å; E296-L299 PolarHBondContact O-N 2.89Å; E296-E300 WeakPolarHBondContact O-CG 3.44Å; E296-E300 PolarHBondContact O-N 3.38Å; E296-E300 VanDerWaalsContact O-N 3.09Å; E296-R322 IonicContact OE2-CZ 2.66Å; E296-R322 IonicContact OE2-NH1 3.61Å; E296-R322 PolarHBondContact OE2-NH1 3.06Å
297	R	95.4	Very high	96.9	Very high	185 Å²	185	37.9 Å²	37.9	70%	0.698	19%	0.193	S	C	*	.	H	α-helix	trans	-64.3	-41.1	178.5	-177.2	178.2	174.5	166.4	4	112.8	S295 L299 E300 E301	S295-R297 VanDerWaalsContact C-N 3.27Å; S295-R297 PolarHBondContact O-N 3.44Å; R297-L299 VanDerWaalsContact C-N 3.3Å; R297-L299 PolarHBondContact O-N 3.27Å; R297-E300 PolarHBondContact O-N 3.32Å; R297-E301 IonicContact NE-OE1 3.63Å; R297-E301 PolarHBondContact NE-OE1 2.86Å; R297-E301 PolarHBondContact O-N 2.99Å
298	S	96.2	Very high	96.9	Very high	37 Å²	37	43.2 Å²	43.2	26%	0.259	22%	0.218	S	C	.	.	H	α-helix	trans	-67.4	-35.6	178.6	-176.7	0	0	0	0	111.2	S295 E296 E301 Q302	S295-S298 PolarHBondContact O-N 3.23Å; S295-S298 PolarHBondContact OG-N 3.24Å; E296-S298 PolarHBondContact O-N 3.28Å; S298-E301 PolarHBondContact O-N 2.6Å; S298-Q302 WeakPolarHBondContact O-CB 3.39Å; S298-Q302 WeakPolarHBondContact O-CG 3.45Å; S298-Q302 PolarHBondContact O-N 3.25Å; S298-Q302 PolarHBondContact OG-NE2 2.73Å
299	L	96.4	Very high	96.9	Very high	1 Å²	1	44 Å²	44	1%	0.005	22%	0.222	C	C	.	.	H	α-helix	trans	-67.3	-39.3	177.5	-68.2	172.2	0	0	0	112	A232 V234 F292 S295 E296 R297 E301 Q302 V303	A232-L299 VanDerWaalsContact C-CD1 3.5Å; A232-L299 HydrophobicContact CB-CD1 3.34Å; V234-L299 HydrophobicContact CG2-CB 4.29Å; V234-L299 HydrophobicContact CG2-CD1 4.14Å; F292-L299 HydrophobicContact CB-CD2 3.51Å; F292-L299 VanDerWaalsContact O-CD2 3.31Å; F292-L299 WeakPolarHBondContact O-CD2 3.36Å; S295-L299 WeakPolarHBondContact O-CG 3.21Å; S295-L299 PolarHBondContact O-N 2.69Å; E296-L299 PolarHBondContact O-N 2.89Å; R297-L299 VanDerWaalsContact C-N 3.3Å; R297-L299 PolarHBondContact O-N 3.27Å; L299-E301 VanDerWaalsContact C-N 3.34Å; L299-E301 PolarHBondContact O-N 3.41Å; L299-Q302 PolarHBondContact O-N 2.94Å; L299-V303 WeakPolarHBondContact O-CB 3.37Å; L299-V303 WeakPolarHBondContact O-CG2 3.32Å; L299-V303 PolarHBondContact O-N 3.4Å
300	E	95.6	Very high	96.9	Very high	108 Å²	108	44 Å²	44	51%	0.505	22%	0.222	S	C	.	.	H	α-helix	trans	-58.7	-46.6	174.3	-73	171.7	-179.3	0	0	111.5	E296 R297 S304 R322	E296-E300 WeakPolarHBondContact O-CG 3.44Å; E296-E300 PolarHBondContact O-N 3.38Å; E296-E300 VanDerWaalsContact O-N 3.09Å; R297-E300 PolarHBondContact O-N 3.32Å; E300-S304 VanDerWaalsContact O-CB 3.29Å; E300-S304 WeakPolarHBondContact O-CB 3.47Å; E300-S304 PolarHBondContact O-N 3.2Å; E300-R322 IonicContact OE1-NH2 3.39Å; E300-R322 PolarHBondContact OE1-NH2 3.26Å
301	E	96.4	Very high	96.9	Very high	106 Å²	106	50.7 Å²	50.7	50%	0.495	25%	0.253	S	S	.	.	H	α-helix	trans	-62.6	-48.1	176.1	-68.7	170.8	-172.1	0	0	111.3	R297 S298 L299 V303 S304 T305	R297-E301 IonicContact NE-OE1 3.63Å; R297-E301 PolarHBondContact NE-OE1 2.86Å; R297-E301 PolarHBondContact O-N 2.99Å; S298-E301 PolarHBondContact O-N 2.6Å; L299-E301 VanDerWaalsContact C-N 3.34Å; L299-E301 PolarHBondContact O-N 3.41Å; E301-V303 PolarHBondContact O-N 2.67Å; E301-S304 PolarHBondContact O-N 3.08Å; E301-T305 PolarHBondContact O-N 3.15Å; E301-T305 PolarHBondContact O-OG1 3.01Å; E301-T305 VanDerWaalsContact O-OG1 3.09Å
302	Q	97.7	Very high	96.9	Very high	8 Å²	8	54.9 Å²	54.9	4%	0.037	28%	0.283	C	S	.	.	H	α-helix	trans	-60.2	-47.1	179.9	-74.5	177.9	57.7	0	0	112.9	V258 P259 F292 H293 S298 L299 A306	V258-Q302 HydrophobicContact CG1-CB 4.15Å; V258-Q302 HydrophobicContact CG1-CG 4.14Å; P259-Q302 HydrophobicContact CG-CG 4.03Å; P259-Q302 PolarHBondContact O-OE1 2.83Å; F292-Q302 HydrophobicContact CD1-CB 3.82Å; F292-Q302 HydrophobicContact CE1-CB 4.4Å; F292-Q302 HydrophobicContact CG-CB 4.35Å; H293-Q302 PolarHBondContact O-NE2 2.84Å; S298-Q302 WeakPolarHBondContact O-CB 3.39Å; S298-Q302 WeakPolarHBondContact O-CG 3.45Å; S298-Q302 PolarHBondContact O-N 3.25Å; S298-Q302 PolarHBondContact OG-NE2 2.73Å; L299-Q302 PolarHBondContact O-N 2.94Å; Q302-A306 WeakPolarHBondContact O-CB 3.48Å; Q302-A306 PolarHBondContact O-N 2.91Å
303	V	97.3	Very high	96.9	Very high	11 Å²	11	55.9 Å²	55.9	7%	0.067	29%	0.289	C	S	.	.	H	α-helix	trans	-68.2	-43.9	-178	173.2	0	0	0	0	110.4	V234 F292 L299 E301 T305 A306 E307 F318 W320	V234-V303 HydrophobicContact CB-CG2 4.15Å; V234-V303 HydrophobicContact CG1-CG2 3.75Å; V234-V303 HydrophobicContact CG2-CG2 4.49Å; F292-V303 HydrophobicContact CD2-CG2 3.77Å; F292-V303 HydrophobicContact CE2-CG2 4.05Å; F292-V303 HydrophobicContact CG-CG2 4.26Å; L299-V303 WeakPolarHBondContact O-CB 3.37Å; L299-V303 WeakPolarHBondContact O-CG2 3.32Å; L299-V303 PolarHBondContact O-N 3.4Å; E301-V303 PolarHBondContact O-N 2.67Å; V303-T305 PolarHBondContact O-N 3.34Å; V303-A306 PolarHBondContact O-N 3.14Å; V303-E307 WeakPolarHBondContact O-CB 3.48Å; V303-E307 PolarHBondContact O-N 2.95Å; V303-F318 HydrophobicContact CG1-CE1 3.99Å; V303-F318 HydrophobicContact CG1-CZ 4.43Å; V303-W320 HydrophobicContact CG1-CG 4.15Å
304	S	97.4	Very high	97	Very high	56 Å²	56	62.4 Å²	62.4	39%	0.392	32%	0.32	S	S	.	.	H	α-helix	trans	-59.4	-47	177.6	-170.3	0	0	0	0	111.5	E300 E301 E307 E308	E300-S304 VanDerWaalsContact O-CB 3.29Å; E300-S304 WeakPolarHBondContact O-CB 3.47Å; E300-S304 PolarHBondContact O-N 3.2Å; E301-S304 PolarHBondContact O-N 3.08Å; S304-E307 PolarHBondContact O-N 3.11Å; S304-E308 WeakPolarHBondContact O-CG 3.39Å; S304-E308 PolarHBondContact O-N 2.88Å
305	T	97.9	Very high	97	Very high	43 Å²	43	62.4 Å²	62.4	26%	0.264	32%	0.319	S	S	.	.	H	α-helix	trans	-64.1	-42.2	177.4	-59.2	0	0	0	0	111.8	T256 V258 E301 V303 I309	T256-T305 HydrophobicContact CG2-CG2 3.92Å; V258-T305 HydrophobicContact CG2-CG2 3.71Å; E301-T305 PolarHBondContact O-N 3.15Å; E301-T305 PolarHBondContact O-OG1 3.01Å; E301-T305 VanDerWaalsContact O-OG1 3.09Å; V303-T305 PolarHBondContact O-N 3.34Å; T305-I309 HydrophobicContact CG2-CD1 3.89Å; T305-I309 VanDerWaalsContact O-CG1 3.26Å; T305-I309 WeakPolarHBondContact O-CG1 3.18Å; T305-I309 PolarHBondContact O-N 2.86Å; T305-I309 VanDerWaalsContact O-N 3.07Å
306	A	97.8	Very high	96.9	Very high	0 Å²	0	62.5 Å²	62.5	0%	0	32%	0.32	C	S	.	.	H	α-helix	trans	-64	-42.8	177.2	0	0	0	0	0	111.8	I253 F292 Q302 V303 I309 T310	I253-A306 HydrophobicContact CD1-CB 4.22Å; I253-A306 HydrophobicContact CG1-CB 4.46Å; F292-A306 HydrophobicContact CE1-CB 3.93Å; F292-A306 HydrophobicContact CZ-CB 3.55Å; Q302-A306 WeakPolarHBondContact O-CB 3.48Å; Q302-A306 PolarHBondContact O-N 2.91Å; V303-A306 PolarHBondContact O-N 3.14Å; A306-I309 PolarHBondContact O-N 3.5Å; A306-T310 VanDerWaalsContact O-CG2 3.3Å; A306-T310 WeakPolarHBondContact O-CG2 3.36Å; A306-T310 PolarHBondContact O-N 3.26Å; A306-T310 PolarHBondContact O-OG1 3.4Å
307	E	97.9	Very high	96.7	Very high	76 Å²	76	63 Å²	63	36%	0.355	33%	0.325	S	S	.	.	H	α-helix	trans	-60.5	-48.7	177.3	-173.1	169.3	-158.9	0	0	111.2	V303 S304 I309 T310 Q311 F318	V303-E307 WeakPolarHBondContact O-CB 3.48Å; V303-E307 PolarHBondContact O-N 2.95Å; S304-E307 PolarHBondContact O-N 3.11Å; E307-I309 VanDerWaalsContact C-N 3.32Å; E307-I309 PolarHBondContact O-N 2.81Å; E307-T310 WeakPolarHBondContact CA-OG1 3.3Å; E307-T310 PolarHBondContact O-N 2.95Å; E307-T310 PolarHBondContact O-OG1 2.99Å; E307-Q311 WeakPolarHBondContact O-CB 3.45Å; E307-Q311 PolarHBondContact O-N 3.45Å; E307-F318 HydrophobicContact CB-CD1 4.06Å; E307-F318 HydrophobicContact CB-CE1 3.96Å; E307-F318 HydrophobicContact CB-CE2 4.41Å; E307-F318 HydrophobicContact CB-CG 4.35Å; E307-F318 HydrophobicContact CB-CZ 4.15Å; E307-F318 HydrophobicContact CG-CB 4.35Å; E307-F318 HydrophobicContact CG-CD1 3.84Å; E307-F318 HydrophobicContact CG-CD2 4.48Å; E307-F318 HydrophobicContact CG-CE1 4.25Å; E307-F318 HydrophobicContact CG-CG 3.98Å
308	E	98	Very high	96.6	Very high	112 Å²	112	55.7 Å²	55.7	52%	0.523	30%	0.299	S	S	.	.	H	α-helix	trans	-56.6	-43.5	175.6	-74.5	172.4	-159.5	0	0	112.6	S304 S312	S304-E308 WeakPolarHBondContact O-CG 3.39Å; S304-E308 PolarHBondContact O-N 2.88Å; E308-S312 WeakPolarHBondContact O-CB 3.28Å; E308-S312 PolarHBondContact O-N 3.2Å; E308-S312 PolarHBondContact O-OG 2.93Å
309	I	98.1	Very high	96.5	Very high	16 Å²	16	59 Å²	59	8%	0.082	31%	0.31	C	S	.	.	H	α-helix	trans	-65.6	-49.5	177.5	-70	168.1	0	0	0	110.5	Q252 I253 T305 A306 E307 Q311 S312 N313	Q252-I309 HydrophobicContact CB-CG2 3.59Å; I253-I309 HydrophobicContact CG1-CB 4.29Å; I253-I309 HydrophobicContact CG1-CD1 3.95Å; I253-I309 HydrophobicContact CG1-CG2 3.98Å; T305-I309 HydrophobicContact CG2-CD1 3.89Å; T305-I309 VanDerWaalsContact O-CG1 3.26Å; T305-I309 WeakPolarHBondContact O-CG1 3.18Å; T305-I309 PolarHBondContact O-N 2.86Å; T305-I309 VanDerWaalsContact O-N 3.07Å; A306-I309 PolarHBondContact O-N 3.5Å; E307-I309 VanDerWaalsContact C-N 3.32Å; E307-I309 PolarHBondContact O-N 2.81Å; I309-Q311 VanDerWaalsContact C-N 3.32Å; I309-Q311 PolarHBondContact O-N 2.89Å; I309-S312 PolarHBondContact O-N 2.96Å; I309-N313 PolarHBondContact O-N 3.4Å; I309-N313 PolarHBondContact O-ND2 3.32Å
310	T	97.9	Very high	96.5	Very high	1 Å²	1	64.6 Å²	64.6	1%	0.006	33%	0.331	C	S	.	.	H	α-helix	trans	-61.8	-41.7	-179.7	57.6	0	0	0	0	111.4	C238 F240 I253 A306 E307 S312 N313 E314 G315 F318	C238-T310 HydrophobicContact CB-CG2 4.49Å; F240-T310 HydrophobicContact CE1-CG2 4.46Å; F240-T310 HydrophobicContact CZ-CG2 3.79Å; I253-T310 HydrophobicContact CD1-CG2 4.45Å; A306-T310 VanDerWaalsContact O-CG2 3.3Å; A306-T310 WeakPolarHBondContact O-CG2 3.36Å; A306-T310 PolarHBondContact O-N 3.26Å; A306-T310 PolarHBondContact O-OG1 3.4Å; E307-T310 WeakPolarHBondContact CA-OG1 3.3Å; E307-T310 PolarHBondContact O-N 2.95Å; E307-T310 PolarHBondContact O-OG1 2.99Å; T310-S312 VanDerWaalsContact C-N 3.35Å; T310-S312 PolarHBondContact O-N 3.38Å; T310-N313 CarbonylContact O-C 3.48Å; T310-N313 PolarHBondContact O-N 3.48Å; T310-N313 VanDerWaalsContact O-N 3.14Å; T310-E314 PolarHBondContact O-N 3.48Å; T310-G315 WeakPolarHBondContact O-CA 3.34Å; T310-G315 PolarHBondContact O-N 2.9Å; T310-F318 HydrophobicContact CG2-CD2 4.36Å; T310-F318 HydrophobicContact CG2-CE2 4.23Å; T310-F318 WeakPolarHBondContact OG1-CD2 3.43Å
311	Q	97.6	Very high	96.4	Very high	140 Å²	140	60.1 Å²	60.1	65%	0.654	31%	0.312	S	S	*	.	H	α-helix	trans	-62.7	-40.3	175.8	-173.3	177.9	29.7	0	0	112.2	E307 I309 N313 E314	E307-Q311 WeakPolarHBondContact O-CB 3.45Å; E307-Q311 PolarHBondContact O-N 3.45Å; I309-Q311 VanDerWaalsContact C-N 3.32Å; I309-Q311 PolarHBondContact O-N 2.89Å; Q311-N313 PolarHBondContact O-N 3.22Å; Q311-E314 PolarHBondContact O-N 2.75Å
312	S	97.6	Very high	96.2	Very high	94 Å²	94	59.7 Å²	59.7	66%	0.657	31%	0.306	S	S	*	.	H	α-helix	trans	-64.3	-22.4	177.3	-61	0	0	0	0	113.1	E308 I309 T310	E308-S312 WeakPolarHBondContact O-CB 3.28Å; E308-S312 PolarHBondContact O-N 3.2Å; E308-S312 PolarHBondContact O-OG 2.93Å; I309-S312 PolarHBondContact O-N 2.96Å; T310-S312 VanDerWaalsContact C-N 3.35Å; T310-S312 PolarHBondContact O-N 3.38Å
313	N	97.4	Very high	96	Very high	22 Å²	22	62.9 Å²	62.9	12%	0.118	32%	0.324	C	S	.	.	T	Hydrogen-bonded Turn	trans	-104.1	29.2	174.3	-61.9	-74.5	0	0	0	111.9	A245 S249 Q252 I309 T310 Q311 G315	A245-N313 WeakPolarHBondContact CB-O 3.46Å; S249-N313 VanDerWaalsContact OG-CB 3.29Å; S249-N313 WeakPolarHBondContact OG-CB 3.47Å; S249-N313 PolarHBondContact OG-ND2 3.17Å; Q252-N313 PolarHBondContact NE2-ND2 3.11Å; Q252-N313 PolarHBondContact NE2-OD1 3.21Å; Q252-N313 PolarHBondContact OE1-ND2 3.43Å; I309-N313 PolarHBondContact O-N 3.4Å; I309-N313 PolarHBondContact O-ND2 3.32Å; T310-N313 CarbonylContact O-C 3.48Å; T310-N313 PolarHBondContact O-N 3.48Å; T310-N313 VanDerWaalsContact O-N 3.14Å; Q311-N313 PolarHBondContact O-N 3.22Å; N313-G315 PolarHBondContact O-N 3.23Å
314	E	97.9	Very high	95.6	Very high	149 Å²	149	64.8 Å²	64.8	70%	0.696	34%	0.34	S	S	*	.	T	Hydrogen-bonded Turn	trans	64.4	20.5	174.7	-52.5	176.1	-127.6	0	0	114.9	P241 T310 Q311	P241-E314 VanDerWaalsContact CD-O 3.31Å; P241-E314 WeakPolarHBondContact CD-O 3.1Å; P241-E314 HydrophobicContact CG-CB 3.88Å; T310-E314 PolarHBondContact O-N 3.48Å; Q311-E314 PolarHBondContact O-N 2.75Å
315	G	96.6	Very high	95.3	Very high	17 Å²	17	69.6 Å²	69.6	18%	0.175	36%	0.357	C	S	.	.			trans	-61.6	138.7	170.9	0	0	0	0	0	111.7	S239 T310 N313	S239-G315 CarbonylContact O-C 3.57Å; S239-G315 WeakPolarHBondContact O-CA 3.43Å; T310-G315 WeakPolarHBondContact O-CA 3.34Å; T310-G315 PolarHBondContact O-N 2.9Å; N313-G315 PolarHBondContact O-N 3.23Å
316	S	93.8	Very high	94.9	Very high	52 Å²	52	69.6 Å²	69.6	36%	0.364	36%	0.357	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	163.8	177.5	77.6	0	0	0	0	111.6	C238 S239 F318	C238-S316 PolarHBondContact SG-O 3.01Å; S239-S316 PolarHBondContact N-O 3.11Å; S239-S316 PolarHBondContact O-N 3.26Å; S316-F318 PolarHBondContact O-N 2.66Å; S316-F318 VanDerWaalsContact O-N 3.12Å
317	D	89.6	Confident	94.7	Very high	89 Å²	89	71.4 Å²	71.4	48%	0.476	36%	0.364	S	S	.	.	E	Extended strand (participates in β ladder)	trans	53.1	37.6	170.8	-53.7	-59.6	0	0	0	113.8	Q319	D317-Q319 WeakPolarHBondContact O-CG 3.45Å; D317-Q319 PolarHBondContact O-N 3.04Å; D317-Q319 PolarHBondContact O-NE2 3.24Å
318	F	94.3	Very high	94.3	Very high	32 Å²	32	72.9 Å²	72.9	14%	0.14	37%	0.374	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.5	104.6	177.4	-167.2	-84.4	0	0	0	109.5	A236 V237 C238 L290 V303 E307 T310 S316 W320	A236-F318 HydrophobicContact CB-CE1 4Å; A236-F318 HydrophobicContact CB-CE2 4.3Å; A236-F318 HydrophobicContact CB-CZ 3.7Å; V237-F318 WeakPolarHBondContact O-CA 3.37Å; C238-F318 HydrophobicContact CB-CD2 3.75Å; C238-F318 HydrophobicContact CB-CE2 4.38Å; L290-F318 HydrophobicContact CD1-CE2 3.75Å; L290-F318 HydrophobicContact CD1-CZ 4.28Å; V303-F318 HydrophobicContact CG1-CE1 3.99Å; V303-F318 HydrophobicContact CG1-CZ 4.43Å; E307-F318 HydrophobicContact CB-CD1 4.06Å; E307-F318 HydrophobicContact CB-CE1 3.96Å; E307-F318 HydrophobicContact CB-CE2 4.41Å; E307-F318 HydrophobicContact CB-CG 4.35Å; E307-F318 HydrophobicContact CB-CZ 4.15Å; E307-F318 HydrophobicContact CG-CB 4.35Å; E307-F318 HydrophobicContact CG-CD1 3.84Å; E307-F318 HydrophobicContact CG-CD2 4.48Å; E307-F318 HydrophobicContact CG-CE1 4.25Å; E307-F318 HydrophobicContact CG-CG 3.98Å; T310-F318 HydrophobicContact CG2-CD2 4.36Å; T310-F318 HydrophobicContact CG2-CE2 4.23Å; T310-F318 WeakPolarHBondContact OG1-CD2 3.43Å; S316-F318 PolarHBondContact O-N 2.66Å; S316-F318 VanDerWaalsContact O-N 3.12Å; F318-W320 HydrophobicContact CE1-CB 4.39Å; F318-W320 AromaticContact CE1-CD1 3.83Å; F318-W320 HydrophobicContact CE1-CG 4.47Å
319	Q	94.3	Very high	94	Very high	105 Å²	105	73.3 Å²	73.3	49%	0.491	37%	0.371	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	128.7	-176	-76.2	167.7	76.8	0	0	108.6	A236 V237 D317	A236-Q319 CarbonylContact C-O 3.47Å; A236-Q319 WeakPolarHBondContact CA-O 3.35Å; V237-Q319 PolarHBondContact N-O 3.43Å; V237-Q319 PolarHBondContact O-N 3.34Å; D317-Q319 WeakPolarHBondContact O-CG 3.45Å; D317-Q319 PolarHBondContact O-N 3.04Å; D317-Q319 PolarHBondContact O-NE2 3.24Å
320	W	95.1	Very high	93.7	Very high	119 Å²	119	72.8 Å²	72.8	45%	0.451	37%	0.368	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	153	177.9	62.4	-96.9	0	0	0	112.1	V234 S235 A236 V303 F318 R322	V234-W320 HydrophobicContact CG1-CB 3.89Å; V234-W320 HydrophobicContact CG1-CD2 4.49Å; V234-W320 HydrophobicContact CG1-CE3 4.14Å; V234-W320 HydrophobicContact CG1-CG 4.44Å; S235-W320 CarbonylContact O-C 3.58Å; S235-W320 WeakPolarHBondContact O-CA 3.47Å; A236-W320 HydrophobicContact CB-CB 3.73Å; V303-W320 HydrophobicContact CG1-CG 4.15Å; F318-W320 HydrophobicContact CE1-CB 4.39Å; F318-W320 AromaticContact CE1-CD1 3.83Å; F318-W320 HydrophobicContact CE1-CG 4.47Å; W320-R322 HydrophobicContact CE3-CG 4.35Å; W320-R322 HydrophobicContact CZ3-CG 3.88Å
321	A	93.5	Very high	93.4	Very high	14 Å²	14	73.2 Å²	73.2	12%	0.116	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.6	141.1	-177	0	0	0	0	0	112.3	S235 T326	S235-A321 PolarHBondContact N-O 3.48Å; S235-A321 VanDerWaalsContact N-O 3.15Å; S235-A321 PolarHBondContact O-N 3.22Å; A321-T326 HydrophobicContact CB-CG2 3.41Å; A321-T326 VanDerWaalsContact CB-CG2 3.41Å
322	R	92.2	Very high	93.1	Very high	97 Å²	97	72.6 Å²	72.6	37%	0.366	37%	0.365	S	S	.	.			trans	-105	-18.3	174.5	-74.2	178.5	-167.9	-165	9.5	112.9	V234 E296 E300 W320 R327	V234-R322 HydrophobicContact CG2-CG 3.68Å; E296-R322 IonicContact OE2-CZ 2.66Å; E296-R322 IonicContact OE2-NH1 3.61Å; E296-R322 PolarHBondContact OE2-NH1 3.06Å; E300-R322 IonicContact OE1-NH2 3.39Å; E300-R322 PolarHBondContact OE1-NH2 3.26Å; W320-R322 HydrophobicContact CE3-CG 4.35Å; W320-R322 HydrophobicContact CZ3-CG 3.88Å; R322-R327 PolarHBondContact O-NH1 3.16Å
323	D	93.1	Very high	92.9	Very high	75 Å²	75	68.1 Å²	68.1	40%	0.401	33%	0.333	S	S	.	.	S	Bend	trans	-75	138.3	179.4	66.8	101.5	0	0	0	110.4	E325 T326 R327	D323-E325 PolarHBondContact O-N 3.27Å; D323-T326 VanDerWaalsContact CG-OG1 3.28Å; D323-T326 PolarHBondContact O-N 2.92Å; D323-T326 WeakPolarHBondContact OD1-CB 3.13Å; D323-T326 PolarHBondContact OD1-N 2.88Å; D323-T326 PolarHBondContact OD1-OG1 3.21Å; D323-T326 WeakPolarHBondContact OD2-CB 3.47Å; D323-T326 PolarHBondContact OD2-OG1 3.48Å; D323-T326 VanDerWaalsContact OD2-OG1 3.13Å; D323-R327 WeakPolarHBondContact O-CG 3.16Å; D323-R327 PolarHBondContact O-N 2.9Å
324	A	89.9	Confident	92.6	Very high	51 Å²	51	68.2 Å²	68.2	42%	0.421	33%	0.332	S	S	.	.	H	α-helix	trans	-61.9	-31.5	-175.8	0	0	0	0	0	112.5	N328	A324-N328 WeakPolarHBondContact O-CB 3.45Å; A324-N328 PolarHBondContact O-N 3.37Å; A324-N328 PolarHBondContact O-ND2 3.05Å; A324-N328 VanDerWaalsContact O-ND2 3.09Å
325	E	90.8	Very high	92.3	Very high	158 Å²	158	63.6 Å²	63.6	74%	0.738	31%	0.31	S	S	*	.	H	α-helix	trans	-63.9	-51.4	-179.8	-175.6	178.3	172.5	0	0	111.6	D323 N328 R329	D323-E325 PolarHBondContact O-N 3.27Å; E325-N328 PolarHBondContact O-N 2.92Å; E325-R329 WeakPolarHBondContact O-CB 3.39Å; E325-R329 PolarHBondContact O-N 3.29Å
326	T	89.6	Confident	92.1	Very high	42 Å²	42	64 Å²	64	26%	0.258	31%	0.309	S	S	.	.	H	α-helix	trans	-65.3	-43.2	-179.6	-59.7	0	0	0	0	111.5	A321 D323 R329 L330	A321-T326 HydrophobicContact CB-CG2 3.41Å; A321-T326 VanDerWaalsContact CB-CG2 3.41Å; D323-T326 VanDerWaalsContact CG-OG1 3.28Å; D323-T326 PolarHBondContact O-N 2.92Å; D323-T326 WeakPolarHBondContact OD1-CB 3.13Å; D323-T326 PolarHBondContact OD1-N 2.88Å; D323-T326 PolarHBondContact OD1-OG1 3.21Å; D323-T326 WeakPolarHBondContact OD2-CB 3.47Å; D323-T326 PolarHBondContact OD2-OG1 3.48Å; D323-T326 VanDerWaalsContact OD2-OG1 3.13Å; T326-R329 PolarHBondContact O-N 3.01Å; T326-L330 PolarHBondContact O-N 2.95Å; T326-L330 VanDerWaalsContact O-N 3.08Å
327	R	92.8	Very high	92	Very high	39 Å²	39	61.6 Å²	61.6	15%	0.147	29%	0.292	C	S	.	.	H	α-helix	trans	-59.7	-48.8	174.3	-64.4	-162.3	-49.3	-101	-16.2	111.6	M233 S235 R322 D323 R329 L330 W331	M233-R327 PolarHBondContact O-NH1 3.44Å; S235-R327 WeakPolarHBondContact OG-CB 3.47Å; S235-R327 VanDerWaalsContact OG-CD 3.25Å; S235-R327 WeakPolarHBondContact OG-CD 3.32Å; S235-R327 WeakPolarHBondContact OG-CG 3.28Å; R322-R327 PolarHBondContact O-NH1 3.16Å; D323-R327 WeakPolarHBondContact O-CG 3.16Å; D323-R327 PolarHBondContact O-N 2.9Å; R327-R329 VanDerWaalsContact C-N 3.28Å; R327-R329 PolarHBondContact O-N 2.9Å; R327-L330 PolarHBondContact O-N 3.37Å; R327-W331 PolarHBondContact O-N 3.07Å
328	N	90.9	Very high	92.1	Very high	107 Å²	107	59.8 Å²	59.8	57%	0.572	28%	0.278	S	S	*	.	H	α-helix	trans	-62.2	-37.5	179.8	-74.1	-20	0	0	0	111.7	A324 E325 K332	A324-N328 WeakPolarHBondContact O-CB 3.45Å; A324-N328 PolarHBondContact O-N 3.37Å; A324-N328 PolarHBondContact O-ND2 3.05Å; A324-N328 VanDerWaalsContact O-ND2 3.09Å; E325-N328 PolarHBondContact O-N 2.92Å; N328-K332 WeakPolarHBondContact O-CB 3.42Å; N328-K332 PolarHBondContact O-N 3Å
329	R	91.4	Very high	92	Very high	120 Å²	120	64.4 Å²	64.4	45%	0.453	30%	0.296	S	S	.	.	H	α-helix	trans	-63.1	-44	176	-176.5	174.6	59.2	126.8	-0.1	111.8	L280 E325 T326 R327 A333	L280-R329 HydrophobicContact CD2-CG 4.11Å; E325-R329 WeakPolarHBondContact O-CB 3.39Å; E325-R329 PolarHBondContact O-N 3.29Å; T326-R329 PolarHBondContact O-N 3.01Å; R327-R329 VanDerWaalsContact C-N 3.28Å; R327-R329 PolarHBondContact O-N 2.9Å; R329-A333 PolarHBondContact O-N 3.03Å; R329-A333 VanDerWaalsContact O-N 3.17Å
330	L	91.4	Very high	92	Very high	5 Å²	5	59.4 Å²	59.4	3%	0.026	27%	0.273	C	S	.	.	H	α-helix	trans	-61.9	-53.6	176.8	-177.1	66.9	0	0	0	111.5	V237 Y282 F289 T326 R327 K332 A333 R334	V237-L330 HydrophobicContact CG2-CD1 3.35Å; V237-L330 HydrophobicContact CG2-CD2 3.54Å; V237-L330 HydrophobicContact CG2-CG 4.08Å; Y282-L330 HydrophobicContact CE2-CD1 4.01Å; F289-L330 HydrophobicContact CB-CD2 4.3Å; F289-L330 HydrophobicContact CD1-CD1 3.82Å; F289-L330 HydrophobicContact CD2-CD1 3.57Å; F289-L330 HydrophobicContact CD2-CD2 4.48Å; F289-L330 HydrophobicContact CD2-CG 3.86Å; F289-L330 HydrophobicContact CE1-CD1 3.69Å; F289-L330 HydrophobicContact CE2-CD1 3.44Å; F289-L330 VanDerWaalsContact CE2-CD1 3.44Å; F289-L330 HydrophobicContact CE2-CG 4.13Å; F289-L330 HydrophobicContact CG-CD1 3.78Å; F289-L330 HydrophobicContact CG-CD2 4.27Å; F289-L330 HydrophobicContact CG-CG 4.1Å; F289-L330 HydrophobicContact CZ-CD1 3.5Å; T326-L330 PolarHBondContact O-N 2.95Å; T326-L330 VanDerWaalsContact O-N 3.08Å; R327-L330 PolarHBondContact O-N 3.37Å; L330-K332 VanDerWaalsContact C-N 3.31Å; L330-K332 PolarHBondContact O-N 3.11Å; L330-A333 WeakPolarHBondContact O-CB 3.4Å; L330-A333 PolarHBondContact O-N 2.9Å; L330-A333 VanDerWaalsContact O-N 3.16Å; L330-R334 PolarHBondContact O-N 3.49Å; L330-R334 VanDerWaalsContact O-N 3.17Å
331	W	92.3	Very high	92	Very high	11 Å²	11	53.8 Å²	53.8	4%	0.042	25%	0.251	C	S	.	.	H	α-helix	trans	-68.4	-32.4	-177.8	-71.4	115.1	0	0	0	112.7	T162 S235 R262 E264 F289 E291 R327 A333 R334 H335	T162-W331 HydrophobicContact CG2-CZ3 4.49Å; S235-W331 PolarHBondContact OG-NE1 3.2Å; R262-W331 HydrophobicContact CB-CH2 3.41Å; R262-W331 VanDerWaalsContact CB-CH2 3.41Å; R262-W331 HydrophobicContact CB-CZ2 3.86Å; R262-W331 HydrophobicContact CB-CZ3 4.14Å; R262-W331 VanDerWaalsContact CD-CH2 3.42Å; R262-W331 HydrophobicContact CG-CH2 4.04Å; R262-W331 HydrophobicContact CG-CZ2 4.26Å; R262-W331 HydrophobicContact CG-CZ3 4.48Å; E264-W331 HydrophobicContact CG-CH2 3.93Å; E264-W331 HydrophobicContact CG-CZ3 3.63Å; F289-W331 HydrophobicContact CB-CH2 4.21Å; E291-W331 HydrophobicContact CB-CH2 4.4Å; E291-W331 HydrophobicContact CB-CZ2 3.41Å; E291-W331 VanDerWaalsContact CB-CZ2 3.41Å; E291-W331 HydrophobicContact CG-CZ2 4.47Å; E291-W331 PolarHBondContact OE1-NE1 3.33Å; E291-W331 PolarHBondContact OE2-NE1 3.32Å; R327-W331 PolarHBondContact O-N 3.07Å; W331-A333 VanDerWaalsContact C-N 3.33Å; W331-R334 HydrophobicContact CE3-CB 4.25Å; W331-R334 HydrophobicContact CE3-CG 4.33Å; W331-R334 HydrophobicContact CZ3-CG 4.27Å; W331-R334 PolarHBondContact O-N 3.34Å; W331-H335 PolarHBondContact O-N 3.38Å; W331-H335 PolarHBondContact O-ND1 2.78Å
332	K	91.4	Very high	91.9	Very high	126 Å²	126	56.5 Å²	56.5	55%	0.548	26%	0.261	S	S	.	.	H	α-helix	trans	-59.5	-45.3	171.6	176.9	164.5	173.9	44	0	111.1	N328 L330 R334 H335 D336	N328-K332 WeakPolarHBondContact O-CB 3.42Å; N328-K332 PolarHBondContact O-N 3Å; L330-K332 VanDerWaalsContact C-N 3.31Å; L330-K332 PolarHBondContact O-N 3.11Å; K332-R334 VanDerWaalsContact C-N 3.33Å; K332-R334 PolarHBondContact O-N 2.75Å; K332-H335 PolarHBondContact O-N 3.33Å; K332-D336 WeakPolarHBondContact CE-OD2 3.49Å; K332-D336 WeakPolarHBondContact CG-OD2 3.33Å; K332-D336 IonicContact NZ-OD1 3.87Å; K332-D336 PolarHBondContact NZ-OD1 3.48Å; K332-D336 IonicContact NZ-OD2 3.26Å; K332-D336 PolarHBondContact NZ-OD2 3.36Å; K332-D336 WeakPolarHBondContact O-CB 3.31Å; K332-D336 PolarHBondContact O-N 2.75Å
333	A	91.9	Very high	92	Very high	0 Å²	0	54.3 Å²	54.3	0%	0	26%	0.264	C	S	.	.	H	α-helix	trans	-61.7	-40.6	177.5	0	0	0	0	0	112.3	L280 R329 L330 W331 D336 A337	L280-A333 HydrophobicContact CD1-CB 3.36Å; L280-A333 HydrophobicContact CG-CB 4.3Å; R329-A333 PolarHBondContact O-N 3.03Å; R329-A333 VanDerWaalsContact O-N 3.17Å; L330-A333 WeakPolarHBondContact O-CB 3.4Å; L330-A333 PolarHBondContact O-N 2.9Å; L330-A333 VanDerWaalsContact O-N 3.16Å; W331-A333 VanDerWaalsContact C-N 3.33Å; A333-D336 CarbonylContact O-C 3.56Å; A333-D336 PolarHBondContact O-N 3.09Å; A333-A337 PolarHBondContact O-N 2.84Å; A333-A337 VanDerWaalsContact O-N 3.1Å
334	R	92.8	Very high	92.1	Very high	24 Å²	24	53.3 Å²	53.3	9%	0.091	26%	0.258	C	S	.	.	H	α-helix	trans	-65.1	-39.3	175	176.4	60	-171.3	88.7	0.2	113.1	E264 F289 L330 W331 K332 D336 A337 H385	E264-R334 HydrophobicContact CG-CG 4.18Å; E264-R334 IonicContact OE2-CZ 3.84Å; E264-R334 IonicContact OE2-NE 3.65Å; E264-R334 PolarHBondContact OE2-NE 2.97Å; E264-R334 IonicContact OE2-NH2 3.66Å; E264-R334 PolarHBondContact OE2-NH2 2.71Å; F289-R334 HydrophobicContact CD2-CB 4.05Å; F289-R334 HydrophobicContact CE2-CB 4.28Å; L330-R334 PolarHBondContact O-N 3.49Å; L330-R334 VanDerWaalsContact O-N 3.17Å; W331-R334 HydrophobicContact CE3-CB 4.25Å; W331-R334 HydrophobicContact CE3-CG 4.33Å; W331-R334 HydrophobicContact CZ3-CG 4.27Å; W331-R334 PolarHBondContact O-N 3.34Å; K332-R334 VanDerWaalsContact C-N 3.33Å; K332-R334 PolarHBondContact O-N 2.75Å; R334-D336 VanDerWaalsContact C-N 3.33Å; R334-A337 WeakPolarHBondContact O-CB 3.47Å; R334-A337 PolarHBondContact O-N 3.22Å; R334-H385 PolarHBondContact NH2-CE1 2.73Å; R334-H385 VanDerWaalsContact NH2-CE1 3.27Å
335	H	90.1	Very high	92.2	Very high	52 Å²	52	54.2 Å²	54.2	24%	0.241	25%	0.251	C	S	.	.	H	α-helix	trans	-67.6	-35.8	174.1	-77.4	92.9	0	0	0	111.9	D144 W331 K332 A337	D144-H335 IonicContact OD1-NE2 3.82Å; D144-H335 IonicContact OD2-CE1 3.88Å; D144-H335 IonicContact OD2-NE2 3.99Å; D144-H335 PolarHBondContact OD2-NE2 3.13Å; W331-H335 PolarHBondContact O-N 3.38Å; W331-H335 PolarHBondContact O-ND1 2.78Å; K332-H335 PolarHBondContact O-N 3.33Å; H335-A337 PolarHBondContact O-N 3.31Å
336	D	92.3	Very high	92.2	Very high	26 Å²	26	52.3 Å²	52.3	14%	0.139	25%	0.252	C	S	.	.	T	Hydrogen-bonded Turn	trans	-78.6	-1.8	178.2	-67.8	-16.3	0	0	0	112.7	F277 K332 A333 R334 W338 Y339 A340	F277-D336 HydrophobicContact CD1-CB 4.14Å; F277-D336 HydrophobicContact CE1-CB 3.91Å; K332-D336 WeakPolarHBondContact CE-OD2 3.49Å; K332-D336 WeakPolarHBondContact CG-OD2 3.33Å; K332-D336 IonicContact NZ-OD1 3.87Å; K332-D336 PolarHBondContact NZ-OD1 3.48Å; K332-D336 IonicContact NZ-OD2 3.26Å; K332-D336 PolarHBondContact NZ-OD2 3.36Å; K332-D336 WeakPolarHBondContact O-CB 3.31Å; K332-D336 PolarHBondContact O-N 2.75Å; A333-D336 CarbonylContact O-C 3.56Å; A333-D336 PolarHBondContact O-N 3.09Å; R334-D336 VanDerWaalsContact C-N 3.33Å; D336-W338 PolarHBondContact O-N 3.44Å; D336-W338 VanDerWaalsContact O-N 3.1Å; D336-Y339 CarbonylContact O-C 3.49Å; D336-Y339 WeakPolarHBondContact O-CA 3.46Å; D336-Y339 PolarHBondContact O-N 3.42Å; D336-A340 PolarHBondContact O-N 3.21Å
337	A	92.6	Very high	92.1	Very high	1 Å²	1	54.1 Å²	54.1	1%	0.008	28%	0.279	C	S	.	.	H	α-helix	trans	-53	-35.2	-177.5	0	0	0	0	0	113.4	M270 A333 R334 H335 A340 A341	M270-A337 HydrophobicContact CE-CB 4.38Å; M270-A337 HydrophobicContact SD-CB 3.89Å; A333-A337 PolarHBondContact O-N 2.84Å; A333-A337 VanDerWaalsContact O-N 3.1Å; R334-A337 WeakPolarHBondContact O-CB 3.47Å; R334-A337 PolarHBondContact O-N 3.22Å; H335-A337 PolarHBondContact O-N 3.31Å; A337-A340 PolarHBondContact O-N 3.27Å; A337-A341 WeakPolarHBondContact O-CB 3.24Å; A337-A341 PolarHBondContact O-N 2.73Å
338	W	90.8	Very high	92	Very high	51 Å²	51	53.1 Å²	53.1	19%	0.193	28%	0.278	C	S	.	.	H	α-helix	trans	-59.7	-49	172.4	173.7	-101.9	0	0	0	112.7	D336 A341 Q342 A350 L394	D336-W338 PolarHBondContact O-N 3.44Å; D336-W338 VanDerWaalsContact O-N 3.1Å; W338-A341 PolarHBondContact O-N 3.33Å; W338-Q342 PolarHBondContact O-N 2.96Å; W338-A350 HydrophobicContact CD2-CB 4.09Å; W338-A350 HydrophobicContact CE3-CB 4.05Å; W338-A350 HydrophobicContact CH2-CB 3.41Å; W338-A350 VanDerWaalsContact CH2-CB 3.41Å; W338-A350 HydrophobicContact CZ2-CB 3.45Å; W338-A350 VanDerWaalsContact CZ2-CB 3.45Å; W338-A350 HydrophobicContact CZ3-CB 3.68Å; W338-L394 HydrophobicContact CE3-CD1 4.42Å; W338-L394 HydrophobicContact CE3-CD2 4.06Å; W338-L394 HydrophobicContact CZ3-CD2 4.31Å
339	Y	92.4	Very high	91.9	Very high	129 Å²	129	53.9 Å²	53.9	51%	0.506	28%	0.276	S	S	.	.	H	α-helix	trans	-71.1	-35.4	178.9	-58	-65.2	0	0	0	111.6	D336 Q342 A343	D336-Y339 CarbonylContact O-C 3.49Å; D336-Y339 WeakPolarHBondContact O-CA 3.46Å; D336-Y339 PolarHBondContact O-N 3.42Å; Y339-Q342 PolarHBondContact O-N 2.99Å; Y339-A343 WeakPolarHBondContact O-CB 3.23Å; Y339-A343 PolarHBondContact O-N 3.25Å
340	A	94.6	Very high	91.7	Very high	1 Å²	1	48.4 Å²	48.4	1%	0.008	26%	0.257	C	S	.	.	H	α-helix	trans	-62.4	-45.5	174.1	0	0	0	0	0	111.5	A273 F277 D336 A337 A343 L344	A273-A340 HydrophobicContact CB-CB 4.14Å; F277-A340 HydrophobicContact CB-CB 3.63Å; F277-A340 HydrophobicContact CD1-CB 4.18Å; F277-A340 HydrophobicContact CG-CB 3.89Å; D336-A340 PolarHBondContact O-N 3.21Å; A337-A340 PolarHBondContact O-N 3.27Å; A340-A343 PolarHBondContact O-N 2.91Å; A340-L344 PolarHBondContact O-N 3.39Å
341	A	94.5	Very high	91.7	Very high	0 Å²	0	50.1 Å²	50.1	0%	0	26%	0.263	C	S	.	.	H	α-helix	trans	-59.9	-50	174.2	0	0	0	0	0	110.8	A337 W338 A343 L344 P381 L394 V396	A337-A341 WeakPolarHBondContact O-CB 3.24Å; A337-A341 PolarHBondContact O-N 2.73Å; W338-A341 PolarHBondContact O-N 3.33Å; A341-A343 VanDerWaalsContact C-N 3.25Å; A341-A343 PolarHBondContact O-N 3.17Å; A341-L344 VanDerWaalsContact O-CB 3.23Å; A341-L344 WeakPolarHBondContact O-CB 2.98Å; A341-L344 WeakPolarHBondContact O-CG 3.29Å; A341-L344 PolarHBondContact O-N 3.46Å; A341-P381 HydrophobicContact CB-CG 4.15Å; A341-L394 HydrophobicContact CB-CB 3.75Å; A341-L394 HydrophobicContact CB-CD1 4.21Å; A341-V396 WeakPolarHBondContact O-CG2 3.1Å
342	Q	93.1	Very high	91.7	Very high	71 Å²	71	50.2 Å²	50.2	33%	0.332	27%	0.266	S	S	.	.	H	α-helix	trans	-56.6	-38.5	176.9	-176.5	169.7	94.1	0	0	112.9	W338 Y339 L344 R345 A350	W338-Q342 PolarHBondContact O-N 2.96Å; Y339-Q342 PolarHBondContact O-N 2.99Å; Q342-L344 PolarHBondContact O-N 3.13Å; Q342-R345 PolarHBondContact O-N 3.14Å; Q342-A350 HydrophobicContact CB-CB 4.15Å
343	A	94.2	Very high	91.8	Very high	51 Å²	51	44.4 Å²	44.4	42%	0.421	24%	0.241	S	C	.	.	H	α-helix	trans	-67.4	-15.1	-179.7	0	0	0	0	0	114	F277 Y339 A340 A341 R345	F277-A343 HydrophobicContact CD2-CB 3.78Å; F277-A343 HydrophobicContact CE2-CB 4.22Å; Y339-A343 WeakPolarHBondContact O-CB 3.23Å; Y339-A343 PolarHBondContact O-N 3.25Å; A340-A343 PolarHBondContact O-N 2.91Å; A341-A343 VanDerWaalsContact C-N 3.25Å; A341-A343 PolarHBondContact O-N 3.17Å; A343-R345 PolarHBondContact O-N 3.42Å
344	L	93.4	Very high	92	Very high	54 Å²	54	44.4 Å²	44.4	28%	0.283	24%	0.241	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.4	-28.2	174.7	-67.1	175	0	0	0	112.7	V269 A273 A340 A341 Q342 T379 P381	V269-L344 HydrophobicContact CG1-CD1 4.31Å; A273-L344 HydrophobicContact CB-CD1 4.07Å; A273-L344 HydrophobicContact CB-CD2 3.8Å; A273-L344 HydrophobicContact CB-CG 4Å; A340-L344 PolarHBondContact O-N 3.39Å; A341-L344 VanDerWaalsContact O-CB 3.23Å; A341-L344 WeakPolarHBondContact O-CB 2.98Å; A341-L344 WeakPolarHBondContact O-CG 3.29Å; A341-L344 PolarHBondContact O-N 3.46Å; Q342-L344 PolarHBondContact O-N 3.13Å; L344-T379 HydrophobicContact CD1-CG2 4.06Å; L344-P381 HydrophobicContact CD1-CG 3.36Å
345	R	92.7	Very high	92.2	Very high	70 Å²	70	43.2 Å²	43.2	26%	0.264	24%	0.236	S	C	.	.	S	Bend	trans	-137.3	89	179	-153.6	170.7	72.8	179	17.2	111.2	Q342 A343 G347 C348 V396 V397 E404	Q342-R345 PolarHBondContact O-N 3.14Å; A343-R345 PolarHBondContact O-N 3.42Å; R345-G347 PolarHBondContact O-N 3.28Å; R345-C348 HydrophobicContact CB-CB 4.31Å; R345-C348 HydrophobicContact CG-CB 4.5Å; R345-C348 PolarHBondContact NE-SG 3.44Å; R345-C348 PolarHBondContact NH2-SG 3.03Å; R345-C348 WeakPolarHBondContact O-CB 3.06Å; R345-C348 PolarHBondContact O-N 3.13Å; R345-V396 HydrophobicContact CB-CB 4.47Å; R345-V396 HydrophobicContact CB-CG1 3.74Å; R345-V396 VanDerWaalsContact CZ-O 3.27Å; R345-V396 PolarHBondContact NH1-O 2.55Å; R345-V396 PolarHBondContact NH2-O 3.32Å; R345-V397 VanDerWaalsContact NH2-CA 3.29Å; R345-E404 IonicContact CZ-OE1 3.38Å; R345-E404 IonicContact CZ-OE2 3.68Å; R345-E404 IonicContact NH1-OE1 3.22Å; R345-E404 PolarHBondContact NH1-OE1 2.98Å; R345-E404 IonicContact NH1-OE2 2.76Å; R345-E404 IonicContact NH2-OE1 2.73Å; R345-E404 PolarHBondContact NH2-OE1 3.27Å; R345-E404 IonicContact NH2-OE2 3.68Å; R345-E404 PolarHBondContact NH2-OE2 2.79Å
346	P	90.3	Very high	92.6	Very high	118 Å²	118	42 Å²	42	77%	0.766	23%	0.234	S	C	*	.	T	Hydrogen-bonded Turn	trans	-54.5	137.6	179.8	-27.3	35.4	0	0	0	113	C348	P346-C348 VanDerWaalsContact C-N 3.31Å
347	G	88.1	Confident	92.8	Very high	80 Å²	80	41 Å²	41	83%	0.825	23%	0.228	S	C	*	.	T	Hydrogen-bonded Turn	trans	87.9	-10.3	-178.6	0	0	0	0	0	114.9	R345	R345-G347 PolarHBondContact O-N 3.28Å
348	C	91.1	Very high	92.9	Very high	19 Å²	19	43.4 Å²	43.4	13%	0.128	24%	0.243	C	C	.	.			trans	-94.4	170.8	175	-66.2	0	0	0	0	111.8	R345 P346 V396 V397	R345-C348 HydrophobicContact CB-CB 4.31Å; R345-C348 HydrophobicContact CG-CB 4.5Å; R345-C348 PolarHBondContact NE-SG 3.44Å; R345-C348 PolarHBondContact NH2-SG 3.03Å; R345-C348 WeakPolarHBondContact O-CB 3.06Å; R345-C348 PolarHBondContact O-N 3.13Å; P346-C348 VanDerWaalsContact C-N 3.31Å; C348-V396 HydrophobicContact CB-CG1 3.59Å; C348-V397 VanDerWaalsContact CB-O 3.29Å; C348-V397 WeakPolarHBondContact CB-O 3.43Å
349	K	88.1	Confident	92.9	Very high	122 Å²	122	43.5 Å²	43.5	53%	0.53	25%	0.247	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	149.5	176.7	-69.1	-169.2	177.6	-177.7	0	110.5	V396 V397 P399	K349-V396 CarbonylContact O-C 3.35Å; K349-V396 WeakPolarHBondContact O-CA 3.48Å; K349-V397 PolarHBondContact N-O 3.23Å; K349-V397 PolarHBondContact O-N 3.25Å; K349-P399 HydrophobicContact CD-CB 4.1Å; K349-P399 HydrophobicContact CD-CG 3.98Å; K349-P399 HydrophobicContact CG-CG 4.05Å
350	A	87.9	Confident	92.8	Very high	5 Å²	5	41.8 Å²	41.8	4%	0.041	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.9	144.5	172.2	0	0	0	0	0	109.9	W338 Q342 M395	W338-A350 HydrophobicContact CD2-CB 4.09Å; W338-A350 HydrophobicContact CE3-CB 4.05Å; W338-A350 HydrophobicContact CH2-CB 3.41Å; W338-A350 VanDerWaalsContact CH2-CB 3.41Å; W338-A350 HydrophobicContact CZ2-CB 3.45Å; W338-A350 VanDerWaalsContact CZ2-CB 3.45Å; W338-A350 HydrophobicContact CZ3-CB 3.68Å; Q342-A350 HydrophobicContact CB-CB 4.15Å; A350-M395 CarbonylContact C-O 3.42Å; A350-M395 VanDerWaalsContact CA-O 3.31Å; A350-M395 WeakPolarHBondContact CA-O 3.33Å
351	Y	91.5	Very high	92.8	Very high	41 Å²	41	44.1 Å²	44.1	16%	0.161	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	121.1	172.7	-177.9	-61.3	0	0	0	106.4	V47 L394 M395 V408 T412	V47-Y351 HydrophobicContact CB-CD2 4.11Å; V47-Y351 HydrophobicContact CB-CE2 4.45Å; V47-Y351 HydrophobicContact CG1-CD2 3.57Å; V47-Y351 HydrophobicContact CG1-CE2 4.35Å; V47-Y351 HydrophobicContact CG1-CG 4.17Å; V47-Y351 HydrophobicContact CG2-CD2 3.44Å; V47-Y351 VanDerWaalsContact CG2-CD2 3.44Å; V47-Y351 HydrophobicContact CG2-CE2 3.33Å; Y351-L394 CarbonylContact O-C 3.57Å; Y351-M395 HydrophobicContact CD1-CE 3.41Å; Y351-M395 VanDerWaalsContact CD1-CE 3.41Å; Y351-M395 HydrophobicContact CE1-CE 3.86Å; Y351-M395 HydrophobicContact CG-CE 4.24Å; Y351-M395 PolarHBondContact N-O 2.92Å; Y351-M395 PolarHBondContact O-N 3.5Å; Y351-V408 HydrophobicContact CD1-CG1 4.01Å; Y351-V408 HydrophobicContact CD2-CG1 3.65Å; Y351-V408 HydrophobicContact CE1-CG1 4.2Å; Y351-V408 HydrophobicContact CE2-CG1 3.82Å; Y351-V408 HydrophobicContact CG-CG1 3.79Å; Y351-T412 HydrophobicContact CD1-CG2 4.29Å; Y351-T412 HydrophobicContact CE1-CG2 3.45Å; Y351-T412 VanDerWaalsContact CE1-CG2 3.45Å
352	S	91.9	Very high	92.7	Very high	13 Å²	13	44.1 Å²	44.1	9%	0.091	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98	138.6	173.6	-150.7	0	0	0	0	110.4	L394 H430	S352-L394 WeakPolarHBondContact OG-CD2 3.45Å; S352-H430 PolarHBondContact OG-CE1 3.2Å; S352-H430 VanDerWaalsContact OG-CE1 3.29Å
353	T	93.4	Very high	92.6	Very high	4 Å²	4	41 Å²	41	3%	0.025	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135	153	157.1	-171.8	0	0	0	0	108.7	H392 C393 M395 T412 L415	T353-H392 CarbonylContact O-C 3.52Å; T353-H392 VanDerWaalsContact O-CA 3.27Å; T353-H392 WeakPolarHBondContact O-CA 3.26Å; T353-C393 HydrophobicContact CG2-CB 3.97Å; T353-C393 PolarHBondContact N-O 2.99Å; T353-C393 PolarHBondContact O-N 2.87Å; T353-M395 HydrophobicContact CG2-CE 3.8Å; T353-T412 HydrophobicContact CG2-CG2 3.97Å; T353-L415 HydrophobicContact CG2-CD2 3.65Å
354	D	95.6	Very high	92.6	Very high	0 Å²	0	43.1 Å²	43.1	0%	0	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.8	144	-175.4	67.2	-50.7	0	0	0	110.1	F391 C426 T427 G428 E429 H430 K436	D354-F391 WeakPolarHBondContact CA-O 3.41Å; D354-C426 VanDerWaalsContact O-O 3.07Å; D354-T427 PolarHBondContact OD1-OG1 2.85Å; D354-T427 PolarHBondContact OD2-OG1 3.43Å; D354-G428 WeakPolarHBondContact OD2-CA 3.39Å; D354-G428 PolarHBondContact OD2-N 3Å; D354-E429 PolarHBondContact OD2-N 3.43Å; D354-H430 VanDerWaalsContact CG-ND1 3.29Å; D354-H430 IonicContact OD1-CE1 3.43Å; D354-H430 IonicContact OD1-CG 2.89Å; D354-H430 IonicContact OD1-ND1 3.94Å; D354-H430 PolarHBondContact OD1-ND1 3.44Å; D354-H430 IonicContact OD2-CG 2.85Å; D354-H430 PolarHBondContact OD2-N 3.15Å; D354-H430 IonicContact OD2-ND1 3.81Å; D354-K436 PolarHBondContact O-NZ 3.34Å; D354-K436 IonicContact OD1-NZ 3.74Å; D354-K436 PolarHBondContact OD1-NZ 3.15Å
355	V	97.6	Very high	92.8	Very high	0 Å²	0	40.6 Å²	40.6	0%	0	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139	159.5	170.4	-64.5	0	0	0	0	108.7	I365 N390 F391 L415 A419	V355-I365 HydrophobicContact CG2-CD1 4.15Å; V355-N390 WeakPolarHBondContact O-CA 3.4Å; V355-N390 PolarHBondContact O-ND2 3.31Å; V355-F391 HydrophobicContact CG2-CD1 4.01Å; V355-F391 HydrophobicContact CG2-CE1 3.33Å; V355-F391 HydrophobicContact CG2-CE2 4.31Å; V355-F391 HydrophobicContact CG2-CZ 3.52Å; V355-F391 PolarHBondContact N-O 3.21Å; V355-F391 PolarHBondContact O-N 3.49Å; V355-F391 VanDerWaalsContact O-N 3.14Å; V355-L415 HydrophobicContact CG1-CG 4.05Å; V355-L415 HydrophobicContact CG2-CD1 4.05Å; V355-L415 HydrophobicContact CG2-CG 4.31Å; V355-A419 HydrophobicContact CB-CB 3.67Å; V355-A419 HydrophobicContact CG1-CB 3.86Å; V355-A419 HydrophobicContact CG2-CB 4.03Å
356	C	97.6	Very high	92.9	Very high	27 Å²	27	37.2 Å²	37.2	18%	0.182	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.1	139.5	172.5	179.6	0	0	0	0	109.3	D388 G389 N390 G424 T425	C356-D388 PolarHBondContact SG-O 3.23Å; C356-G389 WeakPolarHBondContact CA-O 3.33Å; C356-G389 VanDerWaalsContact SG-C 3.51Å; C356-N390 HydrophobicContact CB-CB 4.12Å; C356-G424 CarbonylContact O-C 3.3Å; C356-G424 WeakPolarHBondContact O-CA 3.16Å; C356-T425 HydrophobicContact CB-CG2 3.68Å; C356-T425 PolarHBondContact N-O 2.83Å; C356-T425 PolarHBondContact O-N 2.89Å
357	V	97.4	Very high	93.2	Very high	5 Å²	5	35.3 Å²	35.3	3%	0.03	21%	0.212	C	C	.	.			trans	-132.8	160	-179.5	-66	0	0	0	0	110.1	L359 Q361 L362 I365 G389 A419 M422	V357-L359 PolarHBondContact O-N 3.04Å; V357-Q361 HydrophobicContact CB-CB 4.14Å; V357-Q361 HydrophobicContact CG2-CB 4.13Å; V357-L362 HydrophobicContact CG2-CB 4.13Å; V357-L362 HydrophobicContact CG2-CD1 4.06Å; V357-I365 HydrophobicContact CG1-CD1 3.67Å; V357-I365 HydrophobicContact CG1-CG2 4.47Å; V357-I365 HydrophobicContact CG2-CG2 3.88Å; V357-G389 PolarHBondContact N-O 2.78Å; V357-G389 WeakPolarHBondContact O-CA 3.48Å; V357-A419 HydrophobicContact CG1-CB 3.92Å; V357-M422 HydrophobicContact CG1-CB 4.36Å
358	P	95.3	Very high	93.6	Very high	50 Å²	50	34.6 Å²	34.6	33%	0.325	19%	0.188	S	C	.	.			trans	-50.9	138.9	164.9	-24.6	34.4	0	0	0	110.6	S360 Q361 L362 M422 D423	P358-S360 PolarHBondContact O-N 3.34Å; P358-Q361 HydrophobicContact CB-CG 4.42Å; P358-Q361 WeakPolarHBondContact O-CB 3.31Å; P358-Q361 PolarHBondContact O-N 2.7Å; P358-L362 PolarHBondContact O-N 3.34Å; P358-M422 VanDerWaalsContact CD-O 3.25Å; P358-M422 WeakPolarHBondContact CD-O 3.15Å; P358-D423 HydrophobicContact CG-CB 4.08Å
359	L	90.6	Very high	93.9	Very high	53 Å²	53	33.7 Å²	33.7	28%	0.277	18%	0.181	S	C	.	.	G	3₁₀ helix	trans	-52	-32.9	-175.2	-67.1	172.5	0	0	0	113.4	V251 L254 V357 Q361 L362 V386	V251-L359 HydrophobicContact CG2-CB 4.18Å; L254-L359 HydrophobicContact CD1-CD1 3.55Å; L254-L359 HydrophobicContact CD1-CD2 4.42Å; V357-L359 PolarHBondContact O-N 3.04Å; L359-Q361 PolarHBondContact O-N 2.66Å; L359-L362 WeakPolarHBondContact O-CB 3.37Å; L359-L362 PolarHBondContact O-N 3.08Å; L359-V386 WeakPolarHBondContact CD2-O 3.43Å
360	S	89.3	Confident	94.2	Very high	93 Å²	93	29.9 Å²	29.9	65%	0.65	17%	0.165	S	C	*	.	G	3₁₀ helix	trans	-64.6	-23	177.3	56	0	0	0	0	114.3	P358	P358-S360 PolarHBondContact O-N 3.34Å
361	Q	94.8	Very high	94.5	Very high	51 Å²	51	35.6 Å²	35.6	24%	0.238	19%	0.189	C	C	.	.	G	3₁₀ helix	trans	-96.1	-14.4	-179.2	-57.8	-66.4	7.7	0	0	112.9	V357 P358 L359 Q364 I365 M422	V357-Q361 HydrophobicContact CB-CB 4.14Å; V357-Q361 HydrophobicContact CG2-CB 4.13Å; P358-Q361 HydrophobicContact CB-CG 4.42Å; P358-Q361 WeakPolarHBondContact O-CB 3.31Å; P358-Q361 PolarHBondContact O-N 2.7Å; L359-Q361 PolarHBondContact O-N 2.66Å; Q361-Q364 PolarHBondContact O-N 2.87Å; Q361-I365 PolarHBondContact O-N 3.4Å; Q361-M422 HydrophobicContact CB-CB 4.07Å; Q361-M422 HydrophobicContact CB-SD 4.46Å; Q361-M422 HydrophobicContact CG-CB 4.03Å
362	L	92.9	Very high	94.8	Very high	0 Å²	0	34.1 Å²	34.1	0%	0	18%	0.184	C	C	.	.	H	α-helix	trans	-56.8	-41.1	-175.3	-171.4	63.6	0	0	0	114.6	V247 V357 P358 L359 I365 I366 V386 F391	V247-L362 HydrophobicContact CG1-CB 4.02Å; V247-L362 HydrophobicContact CG1-CD2 4.07Å; V247-L362 HydrophobicContact CG1-CG 4.24Å; V247-L362 HydrophobicContact CG2-CD2 4.36Å; V247-L362 HydrophobicContact CG2-CG 4.29Å; V357-L362 HydrophobicContact CG2-CB 4.13Å; V357-L362 HydrophobicContact CG2-CD1 4.06Å; P358-L362 PolarHBondContact O-N 3.34Å; L359-L362 WeakPolarHBondContact O-CB 3.37Å; L359-L362 PolarHBondContact O-N 3.08Å; L362-I365 HydrophobicContact CD1-CG2 4.41Å; L362-I365 WeakPolarHBondContact O-CG2 3.45Å; L362-I366 HydrophobicContact CD1-CD1 3.83Å; L362-I366 HydrophobicContact CD1-CG1 4.26Å; L362-I366 HydrophobicContact CG-CD1 3.94Å; L362-I366 VanDerWaalsContact O-CG1 3.3Å; L362-I366 WeakPolarHBondContact O-CG1 3.35Å; L362-I366 PolarHBondContact O-N 2.95Å; L362-V386 HydrophobicContact CD2-CB 3.56Å; L362-V386 HydrophobicContact CD2-CG1 3.69Å; L362-V386 HydrophobicContact CG-CG1 4.49Å; L362-F391 HydrophobicContact CD1-CD1 3.82Å; L362-F391 HydrophobicContact CD1-CE1 4.45Å
363	P	91.5	Very high	95	Very high	6 Å²	6	33.9 Å²	33.9	4%	0.039	18%	0.181	C	C	.	.	H	α-helix	trans	-62.8	-47.4	176.7	-11.4	21.9	0	0	0	111.7	V247 I366 V367	V247-P363 HydrophobicContact CB-CB 4.23Å; V247-P363 HydrophobicContact CB-CG 3.79Å; V247-P363 HydrophobicContact CG1-CB 4.39Å; V247-P363 HydrophobicContact CG1-CG 3.5Å; V247-P363 VanDerWaalsContact CG1-CG 3.5Å; V247-P363 HydrophobicContact CG2-CG 4.45Å; P363-I366 PolarHBondContact O-N 3.27Å; P363-V367 WeakPolarHBondContact O-CG2 3.26Å; P363-V367 PolarHBondContact O-N 3.34Å; P363-V367 VanDerWaalsContact O-N 3.09Å
364	Q	95	Very high	95	Very high	95 Å²	95	40.4 Å²	40.4	44%	0.444	22%	0.215	S	C	.	.	H	α-helix	trans	-63.8	-48.6	-175.5	-175.6	179.9	-16.7	0	0	110.8	Q361 I366 V367 E368 M422	Q361-Q364 PolarHBondContact O-N 2.87Å; Q364-I366 VanDerWaalsContact C-N 3.34Å; Q364-I366 PolarHBondContact O-N 3.08Å; Q364-V367 PolarHBondContact O-N 3.46Å; Q364-E368 HydrophobicContact CG-CG 4.42Å; Q364-E368 WeakPolarHBondContact CG-OE1 3.5Å; Q364-E368 PolarHBondContact NE2-OE1 3.25Å; Q364-E368 WeakPolarHBondContact O-CG 3.41Å; Q364-E368 PolarHBondContact O-N 3.45Å; Q364-M422 HydrophobicContact CG-CE 3.91Å
365	I	96.8	Very high	95	Very high	0 Å²	0	46.7 Å²	46.7	0%	0	25%	0.245	C	C	.	.	H	α-helix	trans	-63.6	-39.1	-178.3	-165	169.2	0	0	0	111.9	V355 V357 Q361 L362 T369 F391 L415 R418 A419 M422	V355-I365 HydrophobicContact CG2-CD1 4.15Å; V357-I365 HydrophobicContact CG1-CD1 3.67Å; V357-I365 HydrophobicContact CG1-CG2 4.47Å; V357-I365 HydrophobicContact CG2-CG2 3.88Å; Q361-I365 PolarHBondContact O-N 3.4Å; L362-I365 HydrophobicContact CD1-CG2 4.41Å; L362-I365 WeakPolarHBondContact O-CG2 3.45Å; I365-T369 WeakPolarHBondContact O-CB 3.4Å; I365-T369 PolarHBondContact O-N 3.37Å; I365-T369 PolarHBondContact O-OG1 2.86Å; I365-F391 HydrophobicContact CB-CE1 4.42Å; I365-F391 HydrophobicContact CD1-CE1 4.07Å; I365-F391 HydrophobicContact CD1-CZ 4.2Å; I365-F391 HydrophobicContact CG1-CE1 4.13Å; I365-F391 HydrophobicContact CG1-CZ 4Å; I365-F391 HydrophobicContact CG2-CD1 4.38Å; I365-F391 HydrophobicContact CG2-CE1 3.49Å; I365-F391 VanDerWaalsContact CG2-CE1 3.49Å; I365-F391 HydrophobicContact CG2-CZ 4.03Å; I365-L415 HydrophobicContact CD1-CD1 4.44Å; I365-L415 HydrophobicContact CG1-CD1 4.5Å; I365-R418 HydrophobicContact CD1-CG 4.34Å; I365-R418 HydrophobicContact CG1-CG 4.1Å; I365-A419 HydrophobicContact CD1-CB 3.72Å; I365-M422 HydrophobicContact CB-CE 4.49Å; I365-M422 HydrophobicContact CB-SD 3.65Å; I365-M422 HydrophobicContact CD1-SD 4.12Å; I365-M422 HydrophobicContact CG1-SD 4Å
366	I	95.6	Very high	94.9	Very high	0 Å²	0	47.7 Å²	47.7	0%	0	25%	0.252	C	S	.	.	H	α-helix	trans	-65.7	-45.8	178.5	-68.9	171.5	0	0	0	109.9	V243 F265 L362 P363 Q364 E368 T369 K370 I382 F391	V243-I366 HydrophobicContact CB-CG2 4.5Å; V243-I366 HydrophobicContact CG1-CB 3.83Å; V243-I366 HydrophobicContact CG1-CD1 4.32Å; V243-I366 HydrophobicContact CG1-CG2 3.55Å; V243-I366 HydrophobicContact CG2-CG2 4.14Å; F265-I366 HydrophobicContact CD1-CD1 4.22Å; F265-I366 HydrophobicContact CE1-CD1 4.27Å; F265-I366 HydrophobicContact CE1-CG2 4.08Å; F265-I366 HydrophobicContact CZ-CG2 4.47Å; L362-I366 HydrophobicContact CD1-CD1 3.83Å; L362-I366 HydrophobicContact CD1-CG1 4.26Å; L362-I366 HydrophobicContact CG-CD1 3.94Å; L362-I366 VanDerWaalsContact O-CG1 3.3Å; L362-I366 WeakPolarHBondContact O-CG1 3.35Å; L362-I366 PolarHBondContact O-N 2.95Å; P363-I366 PolarHBondContact O-N 3.27Å; Q364-I366 VanDerWaalsContact C-N 3.34Å; Q364-I366 PolarHBondContact O-N 3.08Å; I366-E368 PolarHBondContact O-N 2.81Å; I366-T369 PolarHBondContact O-N 3.34Å; I366-K370 HydrophobicContact CG2-CD 4.25Å; I366-K370 HydrophobicContact CG2-CG 4.48Å; I366-K370 WeakPolarHBondContact O-CG 3.41Å; I366-K370 PolarHBondContact O-N 3.25Å; I366-I382 HydrophobicContact CG2-CD1 4.16Å; I366-F391 HydrophobicContact CG1-CD1 4.15Å; I366-F391 HydrophobicContact CG1-CD2 4.31Å; I366-F391 HydrophobicContact CG1-CE1 4.27Å; I366-F391 HydrophobicContact CG1-CE2 4.42Å; I366-F391 HydrophobicContact CG1-CG 4.16Å; I366-F391 HydrophobicContact CG1-CZ 4.38Å
367	V	94.6	Very high	94.6	Very high	78 Å²	78	57.3 Å²	57.3	47%	0.473	28%	0.284	S	S	.	.	H	α-helix	trans	-60.1	-47.5	178	170.6	0	0	0	0	111.4	V243 P363 Q364 T369 K370 K371	V243-V367 HydrophobicContact CB-CG2 4.05Å; V243-V367 HydrophobicContact CG1-CG2 4.33Å; V243-V367 HydrophobicContact CG2-CG2 4.36Å; P363-V367 WeakPolarHBondContact O-CG2 3.26Å; P363-V367 PolarHBondContact O-N 3.34Å; P363-V367 VanDerWaalsContact O-N 3.09Å; Q364-V367 PolarHBondContact O-N 3.46Å; V367-T369 VanDerWaalsContact C-N 3.3Å; V367-T369 PolarHBondContact O-N 2.97Å; V367-K370 PolarHBondContact O-N 3.1Å; V367-K371 PolarHBondContact O-N 3.43Å
368	E	96.9	Very high	94.4	Very high	65 Å²	65	57.9 Å²	57.9	30%	0.304	29%	0.287	S	S	.	.	H	α-helix	trans	-63.4	-37.1	177.1	-71.8	-178.2	-165.7	0	0	112.2	Q364 I366 K371 D372 R418	Q364-E368 HydrophobicContact CG-CG 4.42Å; Q364-E368 WeakPolarHBondContact CG-OE1 3.5Å; Q364-E368 PolarHBondContact NE2-OE1 3.25Å; Q364-E368 WeakPolarHBondContact O-CG 3.41Å; Q364-E368 PolarHBondContact O-N 3.45Å; I366-E368 PolarHBondContact O-N 2.81Å; E368-K371 PolarHBondContact O-N 2.99Å; E368-D372 WeakPolarHBondContact O-CB 3.47Å; E368-D372 PolarHBondContact O-N 3.37Å; E368-R418 WeakPolarHBondContact OE2-CD 3.42Å; E368-R418 IonicContact OE2-NE 3.33Å; E368-R418 PolarHBondContact OE2-NE 2.81Å
369	T	96.9	Very high	94.2	Very high	0 Å²	0	58.3 Å²	58.3	0%	0	29%	0.289	C	S	.	.	H	α-helix	trans	-67.7	-41.4	178.2	-58.3	0	0	0	0	112	I365 I366 V367 K371 D372 L373 I382 F391 C393 F411 L415 R418	I365-T369 WeakPolarHBondContact O-CB 3.4Å; I365-T369 PolarHBondContact O-N 3.37Å; I365-T369 PolarHBondContact O-OG1 2.86Å; I366-T369 PolarHBondContact O-N 3.34Å; V367-T369 VanDerWaalsContact C-N 3.3Å; V367-T369 PolarHBondContact O-N 2.97Å; T369-K371 VanDerWaalsContact C-N 3.33Å; T369-K371 PolarHBondContact O-N 3.09Å; T369-D372 PolarHBondContact O-N 3.5Å; T369-L373 WeakPolarHBondContact O-CG 3.4Å; T369-L373 PolarHBondContact O-N 2.98Å; T369-I382 HydrophobicContact CG2-CD1 4.23Å; T369-F391 HydrophobicContact CG2-CE2 4.26Å; T369-C393 VanDerWaalsContact CG2-SG 3.54Å; T369-F411 HydrophobicContact CG2-CE2 4.23Å; T369-F411 HydrophobicContact CG2-CZ 3.67Å; T369-L415 HydrophobicContact CG2-CD1 3.87Å; T369-L415 HydrophobicContact CG2-CD2 4.33Å; T369-L415 VanDerWaalsContact OG1-CD1 3.28Å; T369-L415 WeakPolarHBondContact OG1-CD1 3.45Å; T369-R418 PolarHBondContact OG1-NH1 3.01Å
370	K	94.7	Very high	94.4	Very high	41 Å²	41	56 Å²	56	18%	0.178	28%	0.278	C	S	.	.	H	α-helix	trans	-63.3	-40.1	173.9	-68.7	-175.8	82	-179.2	0	112.1	V243 D267 D268 I366 V367 L373 L374 I382	V243-K370 HydrophobicContact CG2-CD 4.43Å; D267-K370 HydrophobicContact CB-CD 4.37Å; D267-K370 WeakPolarHBondContact OD2-CE 3.37Å; D267-K370 IonicContact OD2-NZ 2.73Å; D268-K370 IonicContact OD1-NZ 2.88Å; D268-K370 PolarHBondContact OD1-NZ 2.83Å; I366-K370 HydrophobicContact CG2-CD 4.25Å; I366-K370 HydrophobicContact CG2-CG 4.48Å; I366-K370 WeakPolarHBondContact O-CG 3.41Å; I366-K370 PolarHBondContact O-N 3.25Å; V367-K370 PolarHBondContact O-N 3.1Å; K370-L373 PolarHBondContact O-N 3.41Å; K370-L374 WeakPolarHBondContact O-CG 3.38Å; K370-L374 PolarHBondContact O-N 3.26Å; K370-L374 VanDerWaalsContact O-N 3.16Å; K370-I382 HydrophobicContact CD-CD1 4.26Å; K370-I382 HydrophobicContact CG-CD1 3.52Å
371	K	95.9	Very high	94.7	Very high	125 Å²	125	51.6 Å²	51.6	54%	0.543	25%	0.247	S	C	.	.	H	α-helix	trans	-60.9	-46.5	174	-179.1	179.9	169.9	-176.5	0	111.4	V367 E368 T369 L373 L374 E375	V367-K371 PolarHBondContact O-N 3.43Å; E368-K371 PolarHBondContact O-N 2.99Å; T369-K371 VanDerWaalsContact C-N 3.33Å; T369-K371 PolarHBondContact O-N 3.09Å; K371-L373 PolarHBondContact O-N 2.83Å; K371-L374 PolarHBondContact O-N 3.16Å; K371-E375 WeakPolarHBondContact CE-OE1 3.15Å; K371-E375 HydrophobicContact CG-CG 4.48Å; K371-E375 IonicContact NZ-OE1 2.77Å; K371-E375 WeakPolarHBondContact O-CG 3.42Å; K371-E375 PolarHBondContact O-N 3.08Å
372	D	97.1	Very high	94.8	Very high	10 Å²	10	49.2 Å²	49.2	5%	0.053	24%	0.236	C	C	.	.	H	α-helix	trans	-63.9	-38.5	179.2	-167.4	-7.9	0	0	0	112.2	E368 T369 L374 E375 S376 F411 R414 R418	E368-D372 WeakPolarHBondContact O-CB 3.47Å; E368-D372 PolarHBondContact O-N 3.37Å; T369-D372 PolarHBondContact O-N 3.5Å; D372-L374 PolarHBondContact O-N 2.87Å; D372-E375 PolarHBondContact O-N 2.85Å; D372-S376 WeakPolarHBondContact O-CB 3.36Å; D372-S376 PolarHBondContact O-N 3.22Å; D372-S376 PolarHBondContact O-OG 3.11Å; D372-S376 PolarHBondContact OD1-OG 3.01Å; D372-S376 VanDerWaalsContact OD1-OG 3.11Å; D372-F411 HydrophobicContact CB-CD2 4.32Å; D372-F411 HydrophobicContact CB-CE2 3.99Å; D372-R414 IonicContact OD1-CZ 3.8Å; D372-R414 IonicContact OD1-NE 3.93Å; D372-R414 PolarHBondContact OD1-NE 2.87Å; D372-R414 IonicContact OD1-NH2 2.79Å; D372-R414 PolarHBondContact OD1-NH2 2.68Å; D372-R414 IonicContact OD2-CZ 3.22Å; D372-R414 IonicContact OD2-NE 2.69Å; D372-R414 PolarHBondContact OD2-NE 3.33Å; D372-R414 IonicContact OD2-NH2 2.85Å; D372-R418 IonicContact OD2-CZ 2.73Å; D372-R418 IonicContact OD2-NH1 3.17Å; D372-R418 IonicContact OD2-NH2 3.15Å; D372-R418 PolarHBondContact OD2-NH2 2.82Å
373	L	95.6	Very high	94.9	Very high	9 Å²	9	49.2 Å²	49.2	5%	0.047	24%	0.236	C	C	.	.	H	α-helix	trans	-58.2	-46.5	172.3	-77.2	165.5	0	0	0	111.9	T369 K370 K371 S376 R377 L378 G380 I382 M395 F411	T369-L373 WeakPolarHBondContact O-CG 3.4Å; T369-L373 PolarHBondContact O-N 2.98Å; K370-L373 PolarHBondContact O-N 3.41Å; K371-L373 PolarHBondContact O-N 2.83Å; L373-S376 CarbonylContact O-C 3.46Å; L373-S376 PolarHBondContact O-N 2.82Å; L373-R377 PolarHBondContact O-N 2.72Å; L373-L378 HydrophobicContact CD2-CB 3.91Å; L373-L378 PolarHBondContact O-N 3.18Å; L373-G380 WeakPolarHBondContact CD1-O 3.5Å; L373-I382 HydrophobicContact CD1-CD1 4.38Å; L373-I382 HydrophobicContact CD1-CG1 4.47Å; L373-M395 HydrophobicContact CD2-CG 4.29Å; L373-F411 HydrophobicContact CB-CE2 4.47Å; L373-F411 HydrophobicContact CD1-CZ 4.28Å; L373-F411 HydrophobicContact CD2-CD2 4.37Å; L373-F411 HydrophobicContact CD2-CE1 3.91Å; L373-F411 HydrophobicContact CD2-CE2 3.7Å; L373-F411 HydrophobicContact CD2-CZ 3.43Å; L373-F411 VanDerWaalsContact CD2-CZ 3.43Å; L373-F411 HydrophobicContact CG-CE1 4.47Å; L373-F411 HydrophobicContact CG-CE2 3.62Å; L373-F411 HydrophobicContact CG-CZ 3.53Å
374	L	93.9	Very high	95	Very high	141 Å²	141	49 Å²	49	74%	0.738	23%	0.234	S	C	*	.	H	α-helix	trans	-65	-45.7	178.3	-68.5	171.4	0	0	0	111.9	K370 K371 D372 S376 R377	K370-L374 WeakPolarHBondContact O-CG 3.38Å; K370-L374 PolarHBondContact O-N 3.26Å; K370-L374 VanDerWaalsContact O-N 3.16Å; K371-L374 PolarHBondContact O-N 3.16Å; D372-L374 PolarHBondContact O-N 2.87Å; L374-S376 VanDerWaalsContact C-N 3.3Å; L374-S376 PolarHBondContact O-N 3.5Å; L374-R377 PolarHBondContact O-N 2.86Å; L374-R377 VanDerWaalsContact O-N 3.13Å
375	E	95.6	Very high	94.9	Very high	131 Å²	131	45 Å²	45	61%	0.612	22%	0.216	S	C	*	.	H	α-helix	trans	-63.9	-36.4	178.1	-72.1	176.9	171.2	0	0	112	K371 D372 R377	K371-E375 WeakPolarHBondContact CE-OE1 3.15Å; K371-E375 HydrophobicContact CG-CG 4.48Å; K371-E375 IonicContact NZ-OE1 2.77Å; K371-E375 WeakPolarHBondContact O-CG 3.42Å; K371-E375 PolarHBondContact O-N 3.08Å; D372-E375 PolarHBondContact O-N 2.85Å; E375-R377 VanDerWaalsContact C-N 3.28Å; E375-R377 PolarHBondContact O-N 3.24Å
376	S	94.3	Very high	94.7	Very high	21 Å²	21	45 Å²	45	15%	0.147	22%	0.216	C	C	.	.	T	Hydrogen-bonded Turn	trans	-80.3	-6.4	176.2	-57.2	0	0	0	0	113.5	D372 L373 L374 L378 R414	D372-S376 WeakPolarHBondContact O-CB 3.36Å; D372-S376 PolarHBondContact O-N 3.22Å; D372-S376 PolarHBondContact O-OG 3.11Å; D372-S376 PolarHBondContact OD1-OG 3.01Å; D372-S376 VanDerWaalsContact OD1-OG 3.11Å; L373-S376 CarbonylContact O-C 3.46Å; L373-S376 PolarHBondContact O-N 2.82Å; L374-S376 VanDerWaalsContact C-N 3.3Å; L374-S376 PolarHBondContact O-N 3.5Å; S376-L378 PolarHBondContact O-N 3.08Å; S376-R414 PolarHBondContact OG-NH2 3.31Å
377	R	92.3	Very high	94.6	Very high	230 Å²	230	45.4 Å²	45.4	87%	0.868	22%	0.22	S	C	*	.	T	Hydrogen-bonded Turn	trans	55.9	35.7	-175.3	-53	179.3	-179.1	-174.3	-0.6	113.3	L373 L374 E375	L373-R377 PolarHBondContact O-N 2.72Å; L374-R377 PolarHBondContact O-N 2.86Å; L374-R377 VanDerWaalsContact O-N 3.13Å; E375-R377 VanDerWaalsContact C-N 3.28Å; E375-R377 PolarHBondContact O-N 3.24Å
378	L	93.1	Very high	94.4	Very high	17 Å²	17	44 Å²	44	9%	0.089	21%	0.21	C	C	.	.			trans	-100.1	134.5	178.8	-65.1	176.5	0	0	0	110.4	L373 S376 G380 M395 Q407 V408 F411	L373-L378 HydrophobicContact CD2-CB 3.91Å; L373-L378 PolarHBondContact O-N 3.18Å; S376-L378 PolarHBondContact O-N 3.08Å; L378-G380 PolarHBondContact O-N 3.24Å; L378-M395 HydrophobicContact CD1-SD 4.31Å; L378-Q407 HydrophobicContact CD2-CB 4.43Å; L378-V408 HydrophobicContact CD1-CG2 4.03Å; L378-V408 HydrophobicContact CD2-CG2 3.73Å; L378-F411 HydrophobicContact CD1-CB 3.71Å; L378-F411 HydrophobicContact CD1-CD1 4.42Å; L378-F411 HydrophobicContact CD1-CD2 4.37Å; L378-F411 HydrophobicContact CD1-CG 3.92Å
379	T	90.6	Very high	94.3	Very high	59 Å²	59	41 Å²	41	36%	0.362	20%	0.196	S	C	.	.			trans	-84	107	168.2	-57.6	0	0	0	0	108.5	L344 M395 V396	L344-T379 HydrophobicContact CD1-CG2 4.06Å; T379-M395 VanDerWaalsContact O-CA 3.29Å; T379-M395 WeakPolarHBondContact O-CA 3.32Å; T379-V396 PolarHBondContact O-N 2.83Å; T379-V396 VanDerWaalsContact O-N 3.09Å
380	G	94.3	Very high	94.3	Very high	5 Å²	5	41.1 Å²	41.1	5%	0.052	20%	0.196	C	C	.	.			trans	-141.1	83.2	179.5	0	0	0	0	0	112.7	L373 L378	L373-G380 WeakPolarHBondContact CD1-O 3.5Å; L378-G380 PolarHBondContact O-N 3.24Å
381	P	96	Very high	94.4	Very high	0 Å²	0	39.1 Å²	39.1	0%	0	19%	0.188	C	C	.	.			trans	-51.9	142.4	170.3	-24.6	31.4	0	0	0	112.3	V269 M270 A341 L344 L394	V269-P381 HydrophobicContact CB-CB 4.36Å; V269-P381 HydrophobicContact CB-CG 4.41Å; V269-P381 HydrophobicContact CG1-CB 4.27Å; V269-P381 HydrophobicContact CG1-CG 3.79Å; M270-P381 HydrophobicContact CB-CB 3.88Å; M270-P381 HydrophobicContact CE-CB 3.46Å; M270-P381 VanDerWaalsContact CE-CB 3.46Å; M270-P381 HydrophobicContact CG-CB 4.45Å; M270-P381 HydrophobicContact SD-CB 3.82Å; A341-P381 HydrophobicContact CB-CG 4.15Å; L344-P381 HydrophobicContact CD1-CG 3.36Å; P381-L394 WeakPolarHBondContact CD-O 3.44Å; P381-L394 PolarHBondContact O-N 2.94Å
382	I	96.7	Very high	94.4	Very high	0 Å²	0	33.6 Å²	33.6	0%	0	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	128.2	179.9	-62.1	-179.9	0	0	0	109.8	F265 D267 M270 I366 T369 K370 L373 F391 H392	F265-I382 HydrophobicContact CD1-CG2 4.29Å; F265-I382 HydrophobicContact CE1-CG2 4.2Å; D267-I382 HydrophobicContact CB-CB 4.17Å; D267-I382 PolarHBondContact N-O 3.46Å; D267-I382 PolarHBondContact OD1-N 3.28Å; M270-I382 WeakPolarHBondContact CB-O 3.43Å; I366-I382 HydrophobicContact CG2-CD1 4.16Å; T369-I382 HydrophobicContact CG2-CD1 4.23Å; K370-I382 HydrophobicContact CD-CD1 4.26Å; K370-I382 HydrophobicContact CG-CD1 3.52Å; L373-I382 HydrophobicContact CD1-CD1 4.38Å; L373-I382 HydrophobicContact CD1-CG1 4.47Å; I382-F391 HydrophobicContact CG2-CB 4.41Å; I382-F391 HydrophobicContact CG2-CD2 3.85Å; I382-H392 WeakPolarHBondContact CA-O 3.41Å
383	A	95.4	Very high	94.3	Very high	1 Å²	1	33.1 Å²	33.1	1%	0.008	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	148.2	165.4	0	0	0	0	0	109	F265 M270 H392	F265-A383 CarbonylContact O-C 3.59Å; F265-A383 WeakPolarHBondContact O-CA 3.28Å; M270-A383 HydrophobicContact CE-CB 3.76Å; M270-A383 HydrophobicContact CG-CB 4.24Å; A383-H392 PolarHBondContact N-O 3.42Å; A383-H392 PolarHBondContact O-CD2 2.99Å; A383-H392 PolarHBondContact O-N 3.18Å
384	G	92.8	Very high	94.3	Very high	0 Å²	0	33.2 Å²	33.2	0%	0	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-155.6	147.5	179.6	0	0	0	0	0	115.4	E264 F265 V386 N390	E264-G384 CarbonylContact C-O 3.47Å; E264-G384 VanDerWaalsContact CA-O 3.26Å; E264-G384 WeakPolarHBondContact CA-O 3.4Å; F265-G384 PolarHBondContact N-O 2.81Å; F265-G384 PolarHBondContact O-N 3.11Å; G384-V386 PolarHBondContact O-N 2.85Å; G384-N390 CarbonylContact C-O 3.55Å; G384-N390 WeakPolarHBondContact CA-O 3.36Å
385	H	93.8	Very high	94.3	Very high	12 Å²	12	26.6 Å²	26.6	6%	0.056	13%	0.127	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77	68.7	166.6	-54.4	-48.8	0	0	0	108.5	E264 R334 G387 D388 G389 N390 H392	E264-H385 IonicContact OE1-CE1 2.92Å; E264-H385 IonicContact OE1-CG 3.47Å; E264-H385 IonicContact OE1-ND1 3.26Å; E264-H385 PolarHBondContact OE1-ND1 2.87Å; E264-H385 IonicContact OE2-CE1 3.35Å; E264-H385 PolarHBondContact OE2-CE1 3.13Å; E264-H385 IonicContact OE2-CG 3.25Å; E264-H385 IonicContact OE2-ND1 3.63Å; E264-H385 PolarHBondContact OE2-ND1 3.48Å; R334-H385 PolarHBondContact NH2-CE1 2.73Å; R334-H385 VanDerWaalsContact NH2-CE1 3.27Å; H385-G387 PolarHBondContact O-N 3.41Å; H385-D388 PolarHBondContact O-N 3.48Å; H385-D388 VanDerWaalsContact O-N 3.11Å; H385-G389 PolarHBondContact O-N 3.12Å; H385-N390 CarbonylContact C-O 3.58Å; H385-N390 HydrophobicContact CB-CB 4.41Å; H385-N390 PolarHBondContact N-O 3.02Å; H385-N390 PolarHBondContact O-N 3.11Å; H385-H392 AromaticContact CD2-NE2 3.52Å; H385-H392 AromaticContact NE2-NE2 3.55Å
386	V	93.1	Very high	94.2	Very high	0 Å²	0	20.4 Å²	20.4	0%	0	10%	0.098	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.6	-11.9	-167.7	-65.2	0	0	0	0	113.7	T250 I263 F265 L288 L359 L362 G384 D388	T250-V386 HydrophobicContact CG2-CB 4.19Å; T250-V386 HydrophobicContact CG2-CG2 3.83Å; T250-V386 WeakPolarHBondContact CG2-O 3.47Å; I263-V386 HydrophobicContact CG1-CG2 4.03Å; I263-V386 WeakPolarHBondContact O-CG2 3.49Å; I263-V386 PolarHBondContact O-N 3.33Å; F265-V386 HydrophobicContact CB-CB 4.24Å; F265-V386 HydrophobicContact CB-CG1 3.25Å; F265-V386 HydrophobicContact CB-CG2 3.94Å; F265-V386 HydrophobicContact CG-CG1 4.12Å; L288-V386 HydrophobicContact CD2-CG2 4.08Å; L359-V386 WeakPolarHBondContact CD2-O 3.43Å; L362-V386 HydrophobicContact CD2-CB 3.56Å; L362-V386 HydrophobicContact CD2-CG1 3.69Å; L362-V386 HydrophobicContact CG-CG1 4.49Å; G384-V386 PolarHBondContact O-N 2.85Å; V386-D388 VanDerWaalsContact C-N 3.28Å; V386-D388 PolarHBondContact O-N 2.95Å
387	G	92.2	Very high	94	Very high	9 Å²	9	19.4 Å²	19.4	9%	0.093	9%	0.091	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68.6	-22.4	174.5	0	0	0	0	0	114.6	L254 H385	L254-G387 WeakPolarHBondContact CD1-O 3.47Å; H385-G387 PolarHBondContact O-N 3.41Å
388	D	92	Very high	93.9	Very high	49 Å²	49	11 Å²	11	26%	0.262	6%	0.064	S	C	.	.	T	Hydrogen-bonded Turn	trans	-118	6.4	176.8	61.8	26.9	0	0	0	113.2	C356 H385 V386 N390	C356-D388 PolarHBondContact SG-O 3.23Å; H385-D388 PolarHBondContact O-N 3.48Å; H385-D388 VanDerWaalsContact O-N 3.11Å; V386-D388 VanDerWaalsContact C-N 3.28Å; V386-D388 PolarHBondContact O-N 2.95Å; D388-N390 VanDerWaalsContact OD1-CB 3.23Å; D388-N390 WeakPolarHBondContact OD1-CB 3.23Å; D388-N390 PolarHBondContact OD1-N 2.96Å
389	G	94.3	Very high	93.6	Very high	0 Å²	0	12.5 Å²	12.5	0%	0	8%	0.075	C	C	.	.	T	Hydrogen-bonded Turn	trans	85.9	5.7	176.7	0	0	0	0	0	114.6	C356 V357 H385	C356-G389 WeakPolarHBondContact CA-O 3.33Å; C356-G389 VanDerWaalsContact SG-C 3.51Å; V357-G389 PolarHBondContact N-O 2.78Å; V357-G389 WeakPolarHBondContact O-CA 3.48Å; H385-G389 PolarHBondContact O-N 3.12Å
390	N	96.9	Very high	93.4	Very high	3 Å²	3	16.2 Å²	16.2	2%	0.016	9%	0.092	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.2	140.1	179.8	177.8	-129.5	0	0	0	112.9	V355 C356 G384 H385 D388 H392	V355-N390 WeakPolarHBondContact O-CA 3.4Å; V355-N390 PolarHBondContact O-ND2 3.31Å; C356-N390 HydrophobicContact CB-CB 4.12Å; G384-N390 CarbonylContact C-O 3.55Å; G384-N390 WeakPolarHBondContact CA-O 3.36Å; H385-N390 CarbonylContact C-O 3.58Å; H385-N390 HydrophobicContact CB-CB 4.41Å; H385-N390 PolarHBondContact N-O 3.02Å; H385-N390 PolarHBondContact O-N 3.11Å; D388-N390 VanDerWaalsContact OD1-CB 3.23Å; D388-N390 WeakPolarHBondContact OD1-CB 3.23Å; D388-N390 PolarHBondContact OD1-N 2.96Å; N390-H392 PolarHBondContact OD1-CE1 3.41Å; N390-H392 PolarHBondContact OD1-NE2 3.01Å
391	F	96.1	Very high	93.2	Very high	0 Å²	0	19 Å²	19	0%	0	11%	0.106	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.2	160.6	166.5	74.6	-81.5	0	0	0	112.3	D354 V355 L362 I365 I366 T369 I382 L415	D354-F391 WeakPolarHBondContact CA-O 3.41Å; V355-F391 HydrophobicContact CG2-CD1 4.01Å; V355-F391 HydrophobicContact CG2-CE1 3.33Å; V355-F391 HydrophobicContact CG2-CE2 4.31Å; V355-F391 HydrophobicContact CG2-CZ 3.52Å; V355-F391 PolarHBondContact N-O 3.21Å; V355-F391 PolarHBondContact O-N 3.49Å; V355-F391 VanDerWaalsContact O-N 3.14Å; L362-F391 HydrophobicContact CD1-CD1 3.82Å; L362-F391 HydrophobicContact CD1-CE1 4.45Å; I365-F391 HydrophobicContact CB-CE1 4.42Å; I365-F391 HydrophobicContact CD1-CE1 4.07Å; I365-F391 HydrophobicContact CD1-CZ 4.2Å; I365-F391 HydrophobicContact CG1-CE1 4.13Å; I365-F391 HydrophobicContact CG1-CZ 4Å; I365-F391 HydrophobicContact CG2-CD1 4.38Å; I365-F391 HydrophobicContact CG2-CE1 3.49Å; I365-F391 VanDerWaalsContact CG2-CE1 3.49Å; I365-F391 HydrophobicContact CG2-CZ 4.03Å; I366-F391 HydrophobicContact CG1-CD1 4.15Å; I366-F391 HydrophobicContact CG1-CD2 4.31Å; I366-F391 HydrophobicContact CG1-CE1 4.27Å; I366-F391 HydrophobicContact CG1-CE2 4.42Å; I366-F391 HydrophobicContact CG1-CG 4.16Å; I366-F391 HydrophobicContact CG1-CZ 4.38Å; T369-F391 HydrophobicContact CG2-CE2 4.26Å; I382-F391 HydrophobicContact CG2-CB 4.41Å; I382-F391 HydrophobicContact CG2-CD2 3.85Å; F391-L415 HydrophobicContact CE2-CD1 4.24Å; F391-L415 HydrophobicContact CZ-CD1 3.81Å
392	H	95.9	Very high	93	Very high	9 Å²	9	23.2 Å²	23.2	4%	0.042	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	142.8	-177.5	-47.3	-94.4	0	0	0	110.3	T353 I382 A383 H385 N390 L394 E429 H430	T353-H392 CarbonylContact O-C 3.52Å; T353-H392 VanDerWaalsContact O-CA 3.27Å; T353-H392 WeakPolarHBondContact O-CA 3.26Å; I382-H392 WeakPolarHBondContact CA-O 3.41Å; A383-H392 PolarHBondContact N-O 3.42Å; A383-H392 PolarHBondContact O-CD2 2.99Å; A383-H392 PolarHBondContact O-N 3.18Å; H385-H392 AromaticContact CD2-NE2 3.52Å; H385-H392 AromaticContact NE2-NE2 3.55Å; N390-H392 PolarHBondContact OD1-CE1 3.41Å; N390-H392 PolarHBondContact OD1-NE2 3.01Å; H392-L394 HydrophobicContact CB-CD2 3.85Å; H392-E429 IonicContact CE1-OE1 3.84Å; H392-E429 PolarHBondContact CE1-OE1 2.94Å; H392-E429 VanDerWaalsContact CE1-OE1 3.25Å; H392-E429 IonicContact NE2-OE1 3.93Å; H392-H430 AromaticContact CE1-NE2 3.77Å; H392-H430 AromaticContact ND1-CE1 3.64Å; H392-H430 AromaticContact ND1-NE2 3.57Å
393	C	96	Very high	92.8	Very high	0 Å²	0	29 Å²	29	0%	0	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	113.8	164.1	-67.1	0	0	0	0	108.6	T353 T369 M395 F411 L415	T353-C393 HydrophobicContact CG2-CB 3.97Å; T353-C393 PolarHBondContact N-O 2.99Å; T353-C393 PolarHBondContact O-N 2.87Å; T369-C393 VanDerWaalsContact CG2-SG 3.54Å; C393-M395 PolarHBondContact O-N 3.37Å; C393-F411 HydrophobicContact CB-CE1 4.32Å; C393-L415 HydrophobicContact CB-CD2 4.45Å
394	L	95.2	Very high	92.6	Very high	11 Å²	11	30.3 Å²	30.3	6%	0.058	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.2	71.7	-177.6	-52.1	-168.2	0	0	0	110.1	M270 W338 A341 Y351 S352 P381 H392	M270-L394 HydrophobicContact CE-CB 4.17Å; M270-L394 HydrophobicContact CE-CD1 3.38Å; M270-L394 HydrophobicContact CE-CG 3.76Å; W338-L394 HydrophobicContact CE3-CD1 4.42Å; W338-L394 HydrophobicContact CE3-CD2 4.06Å; W338-L394 HydrophobicContact CZ3-CD2 4.31Å; A341-L394 HydrophobicContact CB-CB 3.75Å; A341-L394 HydrophobicContact CB-CD1 4.21Å; Y351-L394 CarbonylContact O-C 3.57Å; S352-L394 WeakPolarHBondContact OG-CD2 3.45Å; P381-L394 WeakPolarHBondContact CD-O 3.44Å; P381-L394 PolarHBondContact O-N 2.94Å; H392-L394 HydrophobicContact CB-CD2 3.85Å
395	M	94.3	Very high	92.5	Very high	1 Å²	1	33.2 Å²	33.2	1%	0.005	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-66.8	152.9	-177.8	-65.7	164.2	-76.3	0	0	112.3	A350 Y351 T353 L373 L378 T379 C393 V408 F411 T412	A350-M395 CarbonylContact C-O 3.42Å; A350-M395 VanDerWaalsContact CA-O 3.31Å; A350-M395 WeakPolarHBondContact CA-O 3.33Å; Y351-M395 HydrophobicContact CD1-CE 3.41Å; Y351-M395 VanDerWaalsContact CD1-CE 3.41Å; Y351-M395 HydrophobicContact CE1-CE 3.86Å; Y351-M395 HydrophobicContact CG-CE 4.24Å; Y351-M395 PolarHBondContact N-O 2.92Å; Y351-M395 PolarHBondContact O-N 3.5Å; T353-M395 HydrophobicContact CG2-CE 3.8Å; L373-M395 HydrophobicContact CD2-CG 4.29Å; L378-M395 HydrophobicContact CD1-SD 4.31Å; T379-M395 VanDerWaalsContact O-CA 3.29Å; T379-M395 WeakPolarHBondContact O-CA 3.32Å; C393-M395 PolarHBondContact O-N 3.37Å; M395-V408 HydrophobicContact CE-CG1 3.88Å; M395-V408 HydrophobicContact SD-CB 4.41Å; M395-V408 HydrophobicContact SD-CG1 3.8Å; M395-V408 HydrophobicContact SD-CG2 4.14Å; M395-F411 HydrophobicContact CE-CD1 4.03Å; M395-F411 HydrophobicContact CE-CE1 4.12Å; M395-F411 HydrophobicContact SD-CD1 3.4Å; M395-F411 WeakPolarHBondContact SD-CD1 3.33Å; M395-F411 HydrophobicContact SD-CE1 3.64Å; M395-F411 HydrophobicContact SD-CG 4.37Å; M395-T412 HydrophobicContact CE-CG2 3.61Å
396	V	92.5	Very high	92.4	Very high	1 Å²	1	37.2 Å²	37.2	1%	0.006	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	119.6	176.9	-168	0	0	0	0	109.3	A341 R345 C348 K349 T379	A341-V396 WeakPolarHBondContact O-CG2 3.1Å; R345-V396 HydrophobicContact CB-CB 4.47Å; R345-V396 HydrophobicContact CB-CG1 3.74Å; R345-V396 VanDerWaalsContact CZ-O 3.27Å; R345-V396 PolarHBondContact NH1-O 2.55Å; R345-V396 PolarHBondContact NH2-O 3.32Å; C348-V396 HydrophobicContact CB-CG1 3.59Å; K349-V396 CarbonylContact O-C 3.35Å; K349-V396 WeakPolarHBondContact O-CA 3.48Å; T379-V396 PolarHBondContact O-N 2.83Å; T379-V396 VanDerWaalsContact O-N 3.09Å
397	V	91.3	Very high	92.4	Very high	1 Å²	1	41 Å²	41	1%	0.006	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130	143.8	-168.5	-59.1	0	0	0	0	112.1	R345 C348 K349 P399 E404 L405 V408	R345-V397 VanDerWaalsContact NH2-CA 3.29Å; C348-V397 VanDerWaalsContact CB-O 3.29Å; C348-V397 WeakPolarHBondContact CB-O 3.43Å; K349-V397 PolarHBondContact N-O 3.23Å; K349-V397 PolarHBondContact O-N 3.25Å; V397-P399 WeakPolarHBondContact O-CD 3.33Å; V397-E404 HydrophobicContact CG1-CG 4.49Å; V397-L405 HydrophobicContact CB-CD2 4.35Å; V397-L405 HydrophobicContact CG2-CD2 4Å; V397-V408 HydrophobicContact CG1-CB 4.18Å; V397-V408 HydrophobicContact CG1-CG1 4.34Å; V397-V408 HydrophobicContact CG1-CG2 3.26Å
398	D	90.4	Very high	92.5	Very high	53 Å²	53	40.5 Å²	40.5	28%	0.283	22%	0.217	S	C	.	.			trans	-80.2	114.7	168.8	-174.2	-16.5	0	0	0	107.7	N400 D401 E404	D398-N400 PolarHBondContact O-N 3.48Å; D398-N400 WeakPolarHBondContact OD1-CB 3.43Å; D398-N400 PolarHBondContact OD1-N 3.45Å; D398-N400 PolarHBondContact OD1-ND2 3.01Å; D398-D401 HydrophobicContact CB-CB 4.06Å; D398-D401 PolarHBondContact O-N 3.13Å; D398-D401 VanDerWaalsContact O-N 3.14Å; D398-E404 WeakPolarHBondContact CB-OE2 3.16Å; D398-E404 PolarHBondContact N-OE2 3.4Å
399	P	85	Confident	92.5	Very high	49 Å²	49	42.2 Å²	42.2	32%	0.318	22%	0.223	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.8	-10.1	-179.6	30.1	-37.8	0	0	0	113.8	K349 V397	K349-P399 HydrophobicContact CD-CB 4.1Å; K349-P399 HydrophobicContact CD-CG 3.98Å; K349-P399 HydrophobicContact CG-CG 4.05Å; V397-P399 WeakPolarHBondContact O-CD 3.33Å
400	N	87.3	Confident	92.5	Very high	136 Å²	136	44.9 Å²	44.9	73%	0.727	24%	0.237	S	C	*	.	T	Hydrogen-bonded Turn	trans	-98.6	-5.9	178.5	-50.3	-69.8	0	0	0	113.1	D398 P402	D398-N400 PolarHBondContact O-N 3.48Å; D398-N400 WeakPolarHBondContact OD1-CB 3.43Å; D398-N400 PolarHBondContact OD1-N 3.45Å; D398-N400 PolarHBondContact OD1-ND2 3.01Å; N400-P402 VanDerWaalsContact O-CD 3.28Å; N400-P402 WeakPolarHBondContact O-CD 3.46Å
401	D	91.1	Very high	92.5	Very high	63 Å²	63	44.8 Å²	44.8	34%	0.337	24%	0.236	S	C	.	.			trans	-97.1	101.8	175.8	-171.2	-25.9	0	0	0	109.9	D398 D403 E404 L405	D398-D401 HydrophobicContact CB-CB 4.06Å; D398-D401 PolarHBondContact O-N 3.13Å; D398-D401 VanDerWaalsContact O-N 3.14Å; D401-D403 VanDerWaalsContact C-N 3.27Å; D401-D403 PolarHBondContact O-N 3.43Å; D401-D403 WeakPolarHBondContact OD1-CB 3.08Å; D401-D403 PolarHBondContact OD1-N 2.94Å; D401-E404 HydrophobicContact CB-CB 3.9Å; D401-E404 PolarHBondContact O-N 3.38Å; D401-E404 PolarHBondContact OD1-N 2.83Å; D401-L405 WeakPolarHBondContact O-CG 3.4Å; D401-L405 PolarHBondContact O-N 3.09Å; D401-L405 VanDerWaalsContact O-N 3.11Å
402	P	90	Very high	92.4	Very high	90 Å²	90	45.2 Å²	45.2	58%	0.584	24%	0.239	S	C	*	.	H	α-helix	trans	-67.2	-27.2	-178.8	29	-35.2	0	0	0	113.1	N400 H406	N400-P402 VanDerWaalsContact O-CD 3.28Å; N400-P402 WeakPolarHBondContact O-CD 3.46Å; P402-H406 WeakPolarHBondContact O-CB 3.41Å; P402-H406 PolarHBondContact O-N 3.37Å
403	D	92.4	Very high	92.4	Very high	122 Å²	122	47.2 Å²	47.2	65%	0.652	25%	0.248	S	C	*	.	H	α-helix	trans	-74.7	-41.8	-180	-70.3	-24	0	0	0	109.9	D401 H406 Q407	D401-D403 VanDerWaalsContact C-N 3.27Å; D401-D403 PolarHBondContact O-N 3.43Å; D401-D403 WeakPolarHBondContact OD1-CB 3.08Å; D401-D403 PolarHBondContact OD1-N 2.94Å; D403-H406 WeakPolarHBondContact O-CB 3.16Å; D403-H406 PolarHBondContact O-N 2.83Å; D403-Q407 WeakPolarHBondContact O-CG 3.41Å; D403-Q407 PolarHBondContact O-N 2.98Å
404	E	91.9	Very high	92.5	Very high	28 Å²	28	51.4 Å²	51.4	13%	0.131	26%	0.264	C	S	.	.	H	α-helix	trans	-62.6	-45.3	174	-172.6	174.7	-149.9	0	0	111.7	R345 V397 D398 D401 H406 Q407 V408	R345-E404 IonicContact CZ-OE1 3.38Å; R345-E404 IonicContact CZ-OE2 3.68Å; R345-E404 IonicContact NH1-OE1 3.22Å; R345-E404 PolarHBondContact NH1-OE1 2.98Å; R345-E404 IonicContact NH1-OE2 2.76Å; R345-E404 IonicContact NH2-OE1 2.73Å; R345-E404 PolarHBondContact NH2-OE1 3.27Å; R345-E404 IonicContact NH2-OE2 3.68Å; R345-E404 PolarHBondContact NH2-OE2 2.79Å; V397-E404 HydrophobicContact CG1-CG 4.49Å; D398-E404 WeakPolarHBondContact CB-OE2 3.16Å; D398-E404 PolarHBondContact N-OE2 3.4Å; D401-E404 HydrophobicContact CB-CB 3.9Å; D401-E404 PolarHBondContact O-N 3.38Å; D401-E404 PolarHBondContact OD1-N 2.83Å; E404-H406 PolarHBondContact O-N 3.43Å; E404-Q407 PolarHBondContact O-N 3.11Å; E404-Q407 VanDerWaalsContact O-N 3.16Å; E404-V408 WeakPolarHBondContact O-CG2 2.86Å; E404-V408 PolarHBondContact O-N 3.02Å
405	L	90.4	Very high	92.6	Very high	61 Å²	61	50.9 Å²	50.9	32%	0.319	26%	0.262	S	S	.	.	H	α-helix	trans	-59.6	-37.5	175	-71	174.6	0	0	0	112	V397 D401 H409	V397-L405 HydrophobicContact CB-CD2 4.35Å; V397-L405 HydrophobicContact CG2-CD2 4Å; D401-L405 WeakPolarHBondContact O-CG 3.4Å; D401-L405 PolarHBondContact O-N 3.09Å; D401-L405 VanDerWaalsContact O-N 3.11Å; L405-H409 WeakPolarHBondContact O-CB 3.42Å; L405-H409 PolarHBondContact O-N 2.8Å
406	H	91.4	Very high	92.8	Very high	96 Å²	96	51 Å²	51	44%	0.444	26%	0.262	S	S	.	.	H	α-helix	trans	-66.9	-42.7	175.3	-175.9	52.2	0	0	0	112	P402 D403 E404 V408 H409 L410	P402-H406 WeakPolarHBondContact O-CB 3.41Å; P402-H406 PolarHBondContact O-N 3.37Å; D403-H406 WeakPolarHBondContact O-CB 3.16Å; D403-H406 PolarHBondContact O-N 2.83Å; E404-H406 PolarHBondContact O-N 3.43Å; H406-V408 PolarHBondContact O-N 3.4Å; H406-H409 PolarHBondContact O-N 2.85Å; H406-L410 WeakPolarHBondContact O-CG 3.47Å; H406-L410 PolarHBondContact O-N 3.3Å
407	Q	93.8	Very high	93	Very high	78 Å²	78	55.4 Å²	55.4	36%	0.364	28%	0.279	S	S	.	.	H	α-helix	trans	-62.2	-42.8	176	-69.8	-53.1	-46.9	0	0	112.2	L378 D403 E404 H409 L410 F411	L378-Q407 HydrophobicContact CD2-CB 4.43Å; D403-Q407 WeakPolarHBondContact O-CG 3.41Å; D403-Q407 PolarHBondContact O-N 2.98Å; E404-Q407 PolarHBondContact O-N 3.11Å; E404-Q407 VanDerWaalsContact O-N 3.16Å; Q407-H409 VanDerWaalsContact C-N 3.35Å; Q407-H409 PolarHBondContact O-N 2.69Å; Q407-L410 PolarHBondContact O-N 3.35Å; Q407-F411 WeakPolarHBondContact O-CB 3.42Å; Q407-F411 PolarHBondContact O-N 2.96Å
408	V	93.6	Very high	93.4	Very high	0 Å²	0	57.4 Å²	57.4	0%	0	29%	0.286	C	S	.	.	H	α-helix	trans	-61.3	-44.3	174.9	167.4	0	0	0	0	111.3	Y351 L378 M395 V397 E404 H406 L410 F411 T412	Y351-V408 HydrophobicContact CD1-CG1 4.01Å; Y351-V408 HydrophobicContact CD2-CG1 3.65Å; Y351-V408 HydrophobicContact CE1-CG1 4.2Å; Y351-V408 HydrophobicContact CE2-CG1 3.82Å; Y351-V408 HydrophobicContact CG-CG1 3.79Å; L378-V408 HydrophobicContact CD1-CG2 4.03Å; L378-V408 HydrophobicContact CD2-CG2 3.73Å; M395-V408 HydrophobicContact CE-CG1 3.88Å; M395-V408 HydrophobicContact SD-CB 4.41Å; M395-V408 HydrophobicContact SD-CG1 3.8Å; M395-V408 HydrophobicContact SD-CG2 4.14Å; V397-V408 HydrophobicContact CG1-CB 4.18Å; V397-V408 HydrophobicContact CG1-CG1 4.34Å; V397-V408 HydrophobicContact CG1-CG2 3.26Å; E404-V408 WeakPolarHBondContact O-CG2 2.86Å; E404-V408 PolarHBondContact O-N 3.02Å; H406-V408 PolarHBondContact O-N 3.4Å; V408-L410 PolarHBondContact O-N 3.11Å; V408-F411 PolarHBondContact O-N 3.42Å; V408-T412 HydrophobicContact CG1-CG2 4.15Å; V408-T412 WeakPolarHBondContact O-CG2 3.43Å; V408-T412 PolarHBondContact O-N 3.25Å; V408-T412 PolarHBondContact O-OG1 3.29Å
409	H	91.9	Very high	93.8	Very high	85 Å²	85	54.9 Å²	54.9	39%	0.394	27%	0.273	S	S	.	.	H	α-helix	trans	-58.6	-48.6	175.8	177.7	48.2	0	0	0	111.9	L405 H406 Q407 F411 T412 E413	L405-H409 WeakPolarHBondContact O-CB 3.42Å; L405-H409 PolarHBondContact O-N 2.8Å; H406-H409 PolarHBondContact O-N 2.85Å; Q407-H409 VanDerWaalsContact C-N 3.35Å; Q407-H409 PolarHBondContact O-N 2.69Å; H409-F411 VanDerWaalsContact C-N 3.32Å; H409-F411 PolarHBondContact O-N 3.3Å; H409-T412 PolarHBondContact O-N 2.79Å; H409-T412 PolarHBondContact O-OG1 3.04Å; H409-E413 IonicContact CE1-OE1 2.83Å; H409-E413 PolarHBondContact CE1-OE1 3.28Å; H409-E413 IonicContact NE2-OE1 3.15Å; H409-E413 PolarHBondContact NE2-OE1 2.87Å; H409-E413 PolarHBondContact O-N 2.79Å; H409-E413 VanDerWaalsContact O-N 3.08Å
410	L	94.6	Very high	94.4	Very high	56 Å²	56	54.3 Å²	54.3	29%	0.293	27%	0.267	S	S	.	.	H	α-helix	trans	-60.4	-40.6	176.7	-67.9	176.6	0	0	0	112.4	H406 Q407 V408 R414	H406-L410 WeakPolarHBondContact O-CG 3.47Å; H406-L410 PolarHBondContact O-N 3.3Å; Q407-L410 PolarHBondContact O-N 3.35Å; V408-L410 PolarHBondContact O-N 3.11Å; L410-R414 WeakPolarHBondContact O-CG 3.42Å; L410-R414 PolarHBondContact O-N 3.41Å; L410-R414 VanDerWaalsContact O-N 3.09Å; L410-R414 PolarHBondContact O-NH1 3.3Å
411	F	96.6	Very high	94.9	Very high	0 Å²	0	51.9 Å²	51.9	0%	0	27%	0.266	C	S	.	.	H	α-helix	trans	-62.5	-47.1	175.8	170.2	-92.7	0	0	0	111.6	T369 D372 L373 L378 C393 M395 Q407 V408 H409 E413 R414 L415	T369-F411 HydrophobicContact CG2-CE2 4.23Å; T369-F411 HydrophobicContact CG2-CZ 3.67Å; D372-F411 HydrophobicContact CB-CD2 4.32Å; D372-F411 HydrophobicContact CB-CE2 3.99Å; L373-F411 HydrophobicContact CB-CE2 4.47Å; L373-F411 HydrophobicContact CD1-CZ 4.28Å; L373-F411 HydrophobicContact CD2-CD2 4.37Å; L373-F411 HydrophobicContact CD2-CE1 3.91Å; L373-F411 HydrophobicContact CD2-CE2 3.7Å; L373-F411 HydrophobicContact CD2-CZ 3.43Å; L373-F411 VanDerWaalsContact CD2-CZ 3.43Å; L373-F411 HydrophobicContact CG-CE1 4.47Å; L373-F411 HydrophobicContact CG-CE2 3.62Å; L373-F411 HydrophobicContact CG-CZ 3.53Å; L378-F411 HydrophobicContact CD1-CB 3.71Å; L378-F411 HydrophobicContact CD1-CD1 4.42Å; L378-F411 HydrophobicContact CD1-CD2 4.37Å; L378-F411 HydrophobicContact CD1-CG 3.92Å; C393-F411 HydrophobicContact CB-CE1 4.32Å; M395-F411 HydrophobicContact CE-CD1 4.03Å; M395-F411 HydrophobicContact CE-CE1 4.12Å; M395-F411 HydrophobicContact SD-CD1 3.4Å; M395-F411 WeakPolarHBondContact SD-CD1 3.33Å; M395-F411 HydrophobicContact SD-CE1 3.64Å; M395-F411 HydrophobicContact SD-CG 4.37Å; Q407-F411 WeakPolarHBondContact O-CB 3.42Å; Q407-F411 PolarHBondContact O-N 2.96Å; V408-F411 PolarHBondContact O-N 3.42Å; H409-F411 VanDerWaalsContact C-N 3.32Å; H409-F411 PolarHBondContact O-N 3.3Å; F411-E413 VanDerWaalsContact C-N 3.31Å; F411-E413 PolarHBondContact O-N 3.45Å; F411-R414 PolarHBondContact O-N 3.11Å; F411-R414 VanDerWaalsContact O-N 3.16Å; F411-L415 HydrophobicContact CE1-CD2 4.22Å; F411-L415 HydrophobicContact CZ-CD2 4.49Å; F411-L415 WeakPolarHBondContact O-CB 3.49Å; F411-L415 PolarHBondContact O-N 3.4Å
412	T	95.3	Very high	95.2	Very high	10 Å²	10	49.7 Å²	49.7	6%	0.061	25%	0.254	C	S	.	.	H	α-helix	trans	-61.8	-38.8	-179.2	59.9	0	0	0	0	112.1	Y351 T353 M395 V408 H409 L415 A416	Y351-T412 HydrophobicContact CD1-CG2 4.29Å; Y351-T412 HydrophobicContact CE1-CG2 3.45Å; Y351-T412 VanDerWaalsContact CE1-CG2 3.45Å; T353-T412 HydrophobicContact CG2-CG2 3.97Å; M395-T412 HydrophobicContact CE-CG2 3.61Å; V408-T412 HydrophobicContact CG1-CG2 4.15Å; V408-T412 WeakPolarHBondContact O-CG2 3.43Å; V408-T412 PolarHBondContact O-N 3.25Å; V408-T412 PolarHBondContact O-OG1 3.29Å; H409-T412 PolarHBondContact O-N 2.79Å; H409-T412 PolarHBondContact O-OG1 3.04Å; T412-L415 PolarHBondContact O-N 2.76Å; T412-A416 WeakPolarHBondContact O-CB 3.09Å; T412-A416 PolarHBondContact O-N 3.34Å
413	E	95.5	Very high	95.6	Very high	50 Å²	50	51.9 Å²	51.9	23%	0.234	26%	0.261	C	S	.	.	H	α-helix	trans	-66.4	-42.7	174.4	-73.3	-164.1	176.1	0	0	112.5	H409 F411 A416 R417	H409-E413 IonicContact CE1-OE1 2.83Å; H409-E413 PolarHBondContact CE1-OE1 3.28Å; H409-E413 IonicContact NE2-OE1 3.15Å; H409-E413 PolarHBondContact NE2-OE1 2.87Å; H409-E413 PolarHBondContact O-N 2.79Å; H409-E413 VanDerWaalsContact O-N 3.08Å; F411-E413 VanDerWaalsContact C-N 3.31Å; F411-E413 PolarHBondContact O-N 3.45Å; E413-A416 PolarHBondContact O-N 2.95Å; E413-R417 WeakPolarHBondContact O-CB 3.5Å; E413-R417 WeakPolarHBondContact O-CG 3.47Å; E413-R417 PolarHBondContact O-N 2.93Å; E413-R417 IonicContact OE2-CZ 2.76Å; E413-R417 IonicContact OE2-NH1 3.45Å; E413-R417 PolarHBondContact OE2-NH1 2.94Å; E413-R417 IonicContact OE2-NH2 2.76Å
414	R	97.4	Very high	95.9	Very high	88 Å²	88	46.8 Å²	46.8	33%	0.332	24%	0.237	S	C	.	.	H	α-helix	trans	-62.5	-43.5	176.2	-74.1	-167.6	-54.2	-89.2	8.5	111.5	D372 S376 L410 F411 R417 R418	D372-R414 IonicContact OD1-CZ 3.8Å; D372-R414 IonicContact OD1-NE 3.93Å; D372-R414 PolarHBondContact OD1-NE 2.87Å; D372-R414 IonicContact OD1-NH2 2.79Å; D372-R414 PolarHBondContact OD1-NH2 2.68Å; D372-R414 IonicContact OD2-CZ 3.22Å; D372-R414 IonicContact OD2-NE 2.69Å; D372-R414 PolarHBondContact OD2-NE 3.33Å; D372-R414 IonicContact OD2-NH2 2.85Å; S376-R414 PolarHBondContact OG-NH2 3.31Å; L410-R414 WeakPolarHBondContact O-CG 3.42Å; L410-R414 PolarHBondContact O-N 3.41Å; L410-R414 VanDerWaalsContact O-N 3.09Å; L410-R414 PolarHBondContact O-NH1 3.3Å; F411-R414 PolarHBondContact O-N 3.11Å; F411-R414 VanDerWaalsContact O-N 3.16Å; R414-R417 PolarHBondContact O-N 3.07Å; R414-R418 VanDerWaalsContact O-CB 3.3Å; R414-R418 WeakPolarHBondContact O-CB 3.43Å; R414-R418 PolarHBondContact O-N 2.73Å
415	L	98	Very high	96.2	Very high	1 Å²	1	47 Å²	47	1%	0.005	24%	0.241	C	C	.	.	H	α-helix	trans	-59.5	-49.4	176.4	173	57.8	0	0	0	111.3	T353 V355 I365 T369 F391 C393 F411 T412 R418 A419	T353-L415 HydrophobicContact CG2-CD2 3.65Å; V355-L415 HydrophobicContact CG1-CG 4.05Å; V355-L415 HydrophobicContact CG2-CD1 4.05Å; V355-L415 HydrophobicContact CG2-CG 4.31Å; I365-L415 HydrophobicContact CD1-CD1 4.44Å; I365-L415 HydrophobicContact CG1-CD1 4.5Å; T369-L415 HydrophobicContact CG2-CD1 3.87Å; T369-L415 HydrophobicContact CG2-CD2 4.33Å; T369-L415 VanDerWaalsContact OG1-CD1 3.28Å; T369-L415 WeakPolarHBondContact OG1-CD1 3.45Å; F391-L415 HydrophobicContact CE2-CD1 4.24Å; F391-L415 HydrophobicContact CZ-CD1 3.81Å; C393-L415 HydrophobicContact CB-CD2 4.45Å; F411-L415 HydrophobicContact CE1-CD2 4.22Å; F411-L415 HydrophobicContact CZ-CD2 4.49Å; F411-L415 WeakPolarHBondContact O-CB 3.49Å; F411-L415 PolarHBondContact O-N 3.4Å; T412-L415 PolarHBondContact O-N 2.76Å; L415-R418 WeakPolarHBondContact O-CB 3.38Å; L415-R418 PolarHBondContact O-N 3.22Å; L415-A419 PolarHBondContact O-N 2.84Å
416	A	97.9	Very high	96.5	Very high	2 Å²	2	44.1 Å²	44.1	2%	0.017	23%	0.226	C	C	.	.	H	α-helix	trans	-60.6	-47.9	178.2	0	0	0	0	0	111.9	T412 E413 R418 A419 L420 C426 L439	T412-A416 WeakPolarHBondContact O-CB 3.09Å; T412-A416 PolarHBondContact O-N 3.34Å; E413-A416 PolarHBondContact O-N 2.95Å; A416-R418 VanDerWaalsContact C-N 3.3Å; A416-R418 PolarHBondContact O-N 3.27Å; A416-A419 WeakPolarHBondContact O-CB 3.29Å; A416-A419 PolarHBondContact O-N 3.39Å; A416-A419 VanDerWaalsContact O-N 3.11Å; A416-L420 WeakPolarHBondContact O-CG 3.29Å; A416-L420 PolarHBondContact O-N 3.14Å; A416-C426 HydrophobicContact CB-CB 4.07Å; A416-L439 HydrophobicContact CB-CD1 3.42Å; A416-L439 VanDerWaalsContact CB-CD1 3.42Å; A416-L439 HydrophobicContact CB-CD2 3.76Å; A416-L439 HydrophobicContact CB-CG 4.15Å
417	R	98.1	Very high	96.7	Very high	94 Å²	94	40.5 Å²	40.5	36%	0.355	21%	0.21	S	C	.	.	H	α-helix	trans	-64	-33.5	177.4	-70.9	-177.2	-178.9	113.1	5.1	113.1	E413 R414 L420 A421 L439 E442	E413-R417 WeakPolarHBondContact O-CB 3.5Å; E413-R417 WeakPolarHBondContact O-CG 3.47Å; E413-R417 PolarHBondContact O-N 2.93Å; E413-R417 IonicContact OE2-CZ 2.76Å; E413-R417 IonicContact OE2-NH1 3.45Å; E413-R417 PolarHBondContact OE2-NH1 2.94Å; E413-R417 IonicContact OE2-NH2 2.76Å; R414-R417 PolarHBondContact O-N 3.07Å; R417-L420 PolarHBondContact O-N 3.2Å; R417-A421 WeakPolarHBondContact O-CB 3.42Å; R417-A421 PolarHBondContact O-N 3.05Å; R417-L439 HydrophobicContact CG-CD2 3.87Å; R417-E442 IonicContact CZ-OE1 3.97Å; R417-E442 IonicContact CZ-OE2 3.66Å; R417-E442 IonicContact NE-OE1 3.68Å; R417-E442 PolarHBondContact NE-OE1 3.2Å; R417-E442 IonicContact NE-OE2 3.34Å; R417-E442 PolarHBondContact NE-OE2 3.42Å; R417-E442 IonicContact NH2-OE1 3Å; R417-E442 PolarHBondContact NH2-OE1 3.21Å
418	R	98.3	Very high	96.6	Very high	43 Å²	43	38.3 Å²	38.3	16%	0.162	21%	0.209	C	C	.	.	H	α-helix	trans	-62	-44.7	171.6	-175.2	-171	-67.2	125.1	10.5	110.6	I365 E368 T369 D372 R414 L415 A416 A421 M422	I365-R418 HydrophobicContact CD1-CG 4.34Å; I365-R418 HydrophobicContact CG1-CG 4.1Å; E368-R418 WeakPolarHBondContact OE2-CD 3.42Å; E368-R418 IonicContact OE2-NE 3.33Å; E368-R418 PolarHBondContact OE2-NE 2.81Å; T369-R418 PolarHBondContact OG1-NH1 3.01Å; D372-R418 IonicContact OD2-CZ 2.73Å; D372-R418 IonicContact OD2-NH1 3.17Å; D372-R418 IonicContact OD2-NH2 3.15Å; D372-R418 PolarHBondContact OD2-NH2 2.82Å; R414-R418 VanDerWaalsContact O-CB 3.3Å; R414-R418 WeakPolarHBondContact O-CB 3.43Å; R414-R418 PolarHBondContact O-N 2.73Å; L415-R418 WeakPolarHBondContact O-CB 3.38Å; L415-R418 PolarHBondContact O-N 3.22Å; A416-R418 VanDerWaalsContact C-N 3.3Å; A416-R418 PolarHBondContact O-N 3.27Å; R418-A421 PolarHBondContact O-N 3.2Å; R418-M422 HydrophobicContact CG-CE 3.95Å; R418-M422 HydrophobicContact CG-SD 4.17Å; R418-M422 WeakPolarHBondContact O-CG 3.39Å; R418-M422 PolarHBondContact O-N 3.1Å
419	A	98.4	Very high	96.6	Very high	0 Å²	0	39.7 Å²	39.7	0%	0	22%	0.215	C	C	.	.	H	α-helix	trans	-61.4	-45.3	175	0	0	0	0	0	112.1	V355 V357 I365 L415 A416 A421 M422 G424	V355-A419 HydrophobicContact CB-CB 3.67Å; V355-A419 HydrophobicContact CG1-CB 3.86Å; V355-A419 HydrophobicContact CG2-CB 4.03Å; V357-A419 HydrophobicContact CG1-CB 3.92Å; I365-A419 HydrophobicContact CD1-CB 3.72Å; L415-A419 PolarHBondContact O-N 2.84Å; A416-A419 WeakPolarHBondContact O-CB 3.29Å; A416-A419 PolarHBondContact O-N 3.39Å; A416-A419 VanDerWaalsContact O-N 3.11Å; A419-A421 VanDerWaalsContact C-N 3.32Å; A419-A421 PolarHBondContact O-N 3.31Å; A419-M422 CarbonylContact O-C 3.49Å; A419-M422 WeakPolarHBondContact O-CA 3.3Å; A419-M422 PolarHBondContact O-N 3.38Å; A419-G424 VanDerWaalsContact O-CA 3.31Å; A419-G424 WeakPolarHBondContact O-CA 3.37Å; A419-G424 PolarHBondContact O-N 2.68Å
420	L	98.4	Very high	96.7	Very high	38 Å²	38	36.8 Å²	36.8	20%	0.199	20%	0.202	C	C	.	.	H	α-helix	trans	-60.1	-40.4	176.2	-62.9	-176	0	0	0	112.4	A416 R417 M422 D423 C426 E442 E443	A416-L420 WeakPolarHBondContact O-CG 3.29Å; A416-L420 PolarHBondContact O-N 3.14Å; R417-L420 PolarHBondContact O-N 3.2Å; L420-M422 PolarHBondContact O-N 3.45Å; L420-D423 PolarHBondContact O-N 3.4Å; L420-C426 HydrophobicContact CD2-CB 4.36Å; L420-E442 HydrophobicContact CD1-CB 4.11Å; L420-E443 HydrophobicContact CD1-CB 4.2Å; L420-E443 HydrophobicContact CD2-CB 3.64Å; L420-E443 HydrophobicContact CD2-CG 3.62Å; L420-E443 WeakPolarHBondContact CD2-OE2 3.38Å
421	A	98.3	Very high	96.7	Very high	85 Å²	85	34.6 Å²	34.6	70%	0.702	19%	0.193	S	C	*	.	H	α-helix	trans	-67	-13.1	175.8	0	0	0	0	0	113.7	R417 R418 A419	R417-A421 WeakPolarHBondContact O-CB 3.42Å; R417-A421 PolarHBondContact O-N 3.05Å; R418-A421 PolarHBondContact O-N 3.2Å; A419-A421 VanDerWaalsContact C-N 3.32Å; A419-A421 PolarHBondContact O-N 3.31Å
422	M	98	Very high	96.7	Very high	16 Å²	16	35.1 Å²	35.1	8%	0.079	20%	0.196	C	C	.	.	T	Hydrogen-bonded Turn	trans	-109.1	28.2	178.4	-67.5	174.1	174.3	0	0	111.8	V357 P358 Q361 Q364 I365 R418 A419 L420 G424	V357-M422 HydrophobicContact CG1-CB 4.36Å; P358-M422 VanDerWaalsContact CD-O 3.25Å; P358-M422 WeakPolarHBondContact CD-O 3.15Å; Q361-M422 HydrophobicContact CB-CB 4.07Å; Q361-M422 HydrophobicContact CB-SD 4.46Å; Q361-M422 HydrophobicContact CG-CB 4.03Å; Q364-M422 HydrophobicContact CG-CE 3.91Å; I365-M422 HydrophobicContact CB-CE 4.49Å; I365-M422 HydrophobicContact CB-SD 3.65Å; I365-M422 HydrophobicContact CD1-SD 4.12Å; I365-M422 HydrophobicContact CG1-SD 4Å; R418-M422 HydrophobicContact CG-CE 3.95Å; R418-M422 HydrophobicContact CG-SD 4.17Å; R418-M422 WeakPolarHBondContact O-CG 3.39Å; R418-M422 PolarHBondContact O-N 3.1Å; A419-M422 CarbonylContact O-C 3.49Å; A419-M422 WeakPolarHBondContact O-CA 3.3Å; A419-M422 PolarHBondContact O-N 3.38Å; L420-M422 PolarHBondContact O-N 3.45Å; M422-G424 PolarHBondContact O-N 2.81Å; M422-G424 VanDerWaalsContact O-N 3.13Å
423	D	97.7	Very high	96.7	Very high	136 Å²	136	34.7 Å²	34.7	73%	0.727	19%	0.193	S	C	*	.	T	Hydrogen-bonded Turn	trans	59	21.3	-178.6	-54.2	-47.9	0	0	0	114.1	P358 L420	P358-D423 HydrophobicContact CG-CB 4.08Å; L420-D423 PolarHBondContact O-N 3.4Å
424	G	98	Very high	96.6	Very high	16 Å²	16	33.6 Å²	33.6	17%	0.165	19%	0.189	C	C	.	.			trans	-93	-165.5	176.9	0	0	0	0	0	113.8	C356 A419 M422	C356-G424 CarbonylContact O-C 3.3Å; C356-G424 WeakPolarHBondContact O-CA 3.16Å; A419-G424 VanDerWaalsContact O-CA 3.31Å; A419-G424 WeakPolarHBondContact O-CA 3.37Å; A419-G424 PolarHBondContact O-N 2.68Å; M422-G424 PolarHBondContact O-N 2.81Å; M422-G424 VanDerWaalsContact O-N 3.13Å
425	T	98	Very high	96.1	Very high	33 Å²	33	31.4 Å²	31.4	20%	0.202	19%	0.193	C	C	.	.	B	Isolated β-bridge	trans	-124.6	149.1	179	179.6	0	0	0	0	111.3	C356 T427 E443	C356-T425 HydrophobicContact CB-CG2 3.68Å; C356-T425 PolarHBondContact N-O 2.83Å; C356-T425 PolarHBondContact O-N 2.89Å; T425-T427 WeakPolarHBondContact CG2-O 3.38Å; T425-T427 PolarHBondContact O-N 2.75Å; T425-T427 PolarHBondContact OG1-N 2.7Å; T425-T427 PolarHBondContact OG1-O 2.7Å; T425-E443 WeakPolarHBondContact CA-OE2 3.39Å; T425-E443 WeakPolarHBondContact CB-OE1 3.45Å; T425-E443 PolarHBondContact OG1-OE1 2.76Å; T425-E443 PolarHBondContact OG1-OE2 2.87Å
426	C	96.8	Very high	95.9	Very high	0 Å²	0	31.9 Å²	31.9	0%	0	20%	0.195	C	C	.	.	S	Bend	trans	-69.3	-11.5	177.9	69.5	0	0	0	0	113.9	D354 A416 L420 K436 L439 E443	D354-C426 VanDerWaalsContact O-O 3.07Å; A416-C426 HydrophobicContact CB-CB 4.07Å; L420-C426 HydrophobicContact CD2-CB 4.36Å; C426-K436 WeakPolarHBondContact O-CD 3.44Å; C426-K436 PolarHBondContact O-NZ 2.83Å; C426-K436 VanDerWaalsContact O-NZ 3.11Å; C426-L439 HydrophobicContact CB-CB 3.72Å; C426-L439 HydrophobicContact CB-CD1 4.35Å; C426-E443 PolarHBondContact N-OE2 3.3Å; C426-E443 PolarHBondContact SG-OE2 3.47Å
427	T	95.8	Very high	95.7	Very high	20 Å²	20	33 Å²	33	12%	0.123	20%	0.199	C	C	.	.			trans	-150.5	128.9	174	-174.4	0	0	0	0	110.5	D354 T425 H430 G431 V432 K436	D354-T427 PolarHBondContact OD1-OG1 2.85Å; D354-T427 PolarHBondContact OD2-OG1 3.43Å; T425-T427 WeakPolarHBondContact CG2-O 3.38Å; T425-T427 PolarHBondContact O-N 2.75Å; T425-T427 PolarHBondContact OG1-N 2.7Å; T425-T427 PolarHBondContact OG1-O 2.7Å; T427-H430 PolarHBondContact OG1-N 3.28Å; T427-G431 WeakPolarHBondContact CB-O 3.32Å; T427-G431 WeakPolarHBondContact CG2-O 3.19Å; T427-G431 PolarHBondContact OG1-N 3.46Å; T427-G431 VanDerWaalsContact OG1-N 3.11Å; T427-G431 PolarHBondContact OG1-O 3.12Å; T427-V432 HydrophobicContact CG2-CG2 4.35Å; T427-K436 VanDerWaalsContact CB-NZ 3.33Å; T427-K436 PolarHBondContact OG1-NZ 3.27Å
428	G	92.9	Very high	95.5	Very high	32 Å²	32	31.3 Å²	31.3	33%	0.33	21%	0.205	S	C	.	.	S	Bend	trans	-84	-40.3	175.1	0	0	0	0	0	112.7	D354	D354-G428 WeakPolarHBondContact OD2-CA 3.39Å; D354-G428 PolarHBondContact OD2-N 3Å
429	E	92.2	Very high	95.4	Very high	29 Å²	29	29.8 Å²	29.8	14%	0.136	20%	0.2	C	C	.	.	S	Bend	trans	-148	-21.3	-172.7	60.7	160.4	-141.3	0	0	116.8	S160 D354 H392	S160-E429 WeakPolarHBondContact CB-OE2 3.28Å; D354-E429 PolarHBondContact OD2-N 3.43Å; H392-E429 IonicContact CE1-OE1 3.84Å; H392-E429 PolarHBondContact CE1-OE1 2.94Å; H392-E429 VanDerWaalsContact CE1-OE1 3.25Å; H392-E429 IonicContact NE2-OE1 3.93Å
430	H	93.9	Very high	95.3	Very high	24 Å²	24	30.5 Å²	30.5	11%	0.111	20%	0.204	C	C	.	.	S	Bend	trans	-79.4	-21.5	-174.4	-59.4	158	0	0	0	113.9	L88 E89 S352 D354 H392 T427	L88-H430 HydrophobicContact CB-CB 4.35Å; L88-H430 WeakPolarHBondContact CD1-NE2 3.5Å; E89-H430 HydrophobicContact CG-CB 3.82Å; S352-H430 PolarHBondContact OG-CE1 3.2Å; S352-H430 VanDerWaalsContact OG-CE1 3.29Å; D354-H430 VanDerWaalsContact CG-ND1 3.29Å; D354-H430 IonicContact OD1-CE1 3.43Å; D354-H430 IonicContact OD1-CG 2.89Å; D354-H430 IonicContact OD1-ND1 3.94Å; D354-H430 PolarHBondContact OD1-ND1 3.44Å; D354-H430 IonicContact OD2-CG 2.85Å; D354-H430 PolarHBondContact OD2-N 3.15Å; D354-H430 IonicContact OD2-ND1 3.81Å; H392-H430 AromaticContact CE1-NE2 3.77Å; H392-H430 AromaticContact ND1-CE1 3.64Å; H392-H430 AromaticContact ND1-NE2 3.57Å; T427-H430 PolarHBondContact OG1-N 3.28Å
431	G	94.8	Very high	95.2	Very high	10 Å²	10	30.8 Å²	30.8	10%	0.103	21%	0.209	C	C	.	.			trans	96	-168.7	-178.5	0	0	0	0	0	113.2	E89 T427	E89-G431 WeakPolarHBondContact CG-O 3.45Å; T427-G431 WeakPolarHBondContact CB-O 3.32Å; T427-G431 WeakPolarHBondContact CG2-O 3.19Å; T427-G431 PolarHBondContact OG1-N 3.46Å; T427-G431 VanDerWaalsContact OG1-N 3.11Å; T427-G431 PolarHBondContact OG1-O 3.12Å
432	V	96.7	Very high	95.1	Very high	11 Å²	11	31.2 Å²	31.2	7%	0.067	20%	0.196	C	C	.	.			trans	-101.7	-41.8	-175.3	177.8	0	0	0	0	111.2	E213 T427 L434 G435 K436 R437 L440 I470	E213-V432 PolarHBondContact OE1-N 3.19Å; T427-V432 HydrophobicContact CG2-CG2 4.35Å; V432-L434 PolarHBondContact O-N 2.86Å; V432-G435 PolarHBondContact O-N 2.95Å; V432-K436 HydrophobicContact CG1-CB 4.19Å; V432-K436 PolarHBondContact O-N 2.95Å; V432-K436 VanDerWaalsContact O-N 3.1Å; V432-R437 HydrophobicContact CG1-CB 4.34Å; V432-R437 HydrophobicContact CG1-CG 3.76Å; V432-L440 HydrophobicContact CG1-CB 4.09Å; V432-L440 HydrophobicContact CG1-CD2 4.16Å; V432-L440 HydrophobicContact CG2-CB 4.27Å; V432-L440 HydrophobicContact CG2-CD1 4.26Å; V432-L440 HydrophobicContact CG2-CD2 4.18Å; V432-L440 HydrophobicContact CG2-CG 4.46Å; V432-I470 HydrophobicContact CB-CG1 4.36Å
433	G	94.8	Very high	95.1	Very high	0 Å²	0	33.8 Å²	33.8	0%	0	21%	0.208	C	C	.	.	T	Hydrogen-bonded Turn	trans	46.2	-123.9	178.3	0	0	0	0	0	113.5	E89 E213 R437 K469 I470	E89-G433 CarbonylContact O-C 3.57Å; E89-G433 WeakPolarHBondContact O-CA 3.15Å; E213-G433 PolarHBondContact OE1-N 3.29Å; E213-G433 WeakPolarHBondContact OE2-CA 3.37Å; E213-G433 PolarHBondContact OE2-N 2.83Å; G433-R437 WeakPolarHBondContact O-CD 3.31Å; G433-R437 WeakPolarHBondContact O-CG 3.4Å; G433-K469 VanDerWaalsContact O-CA 3.26Å; G433-K469 WeakPolarHBondContact O-CA 3.4Å; G433-I470 PolarHBondContact O-N 3.46Å
434	L	93.4	Very high	95	Very high	28 Å²	28	29.8 Å²	29.8	15%	0.147	19%	0.188	C	C	.	.	T	Hydrogen-bonded Turn	trans	-93.6	-37.8	176.5	-63.6	176.3	0	0	0	112.7	E89 G90 V95 V432 G468 K469	E89-L434 PolarHBondContact O-N 3.41Å; G90-L434 WeakPolarHBondContact O-CD1 3.14Å; V95-L434 HydrophobicContact CG2-CD1 4.28Å; V95-L434 HydrophobicContact CG2-CD2 3.61Å; V432-L434 PolarHBondContact O-N 2.86Å; L434-G468 WeakPolarHBondContact CD2-O 3.38Å; L434-K469 HydrophobicContact CD2-CD 4.35Å; L434-K469 HydrophobicContact CD2-CG 3.84Å; L434-K469 HydrophobicContact CG-CG 4.32Å
435	G	87.5	Confident	94.9	Very high	42 Å²	42	29.9 Å²	29.9	43%	0.433	19%	0.189	S	C	.	.	T	Hydrogen-bonded Turn	trans	-77.2	-37.4	-164.9	0	0	0	0	0	114.5	V432	V432-G435 PolarHBondContact O-N 2.95Å
436	K	94.5	Very high	94.7	Very high	11 Å²	11	32 Å²	32	5%	0.048	20%	0.203	C	C	.	.	S	Bend	trans	-104.9	12.8	-166.6	-58.3	-177.4	-178.6	177.4	0	114.6	E89 D354 C426 T427 V432 A438 L439 L440	E89-K436 WeakPolarHBondContact OE1-CE 3.29Å; E89-K436 IonicContact OE1-NZ 2.81Å; E89-K436 PolarHBondContact OE1-NZ 3.06Å; D354-K436 PolarHBondContact O-NZ 3.34Å; D354-K436 IonicContact OD1-NZ 3.74Å; D354-K436 PolarHBondContact OD1-NZ 3.15Å; C426-K436 WeakPolarHBondContact O-CD 3.44Å; C426-K436 PolarHBondContact O-NZ 2.83Å; C426-K436 VanDerWaalsContact O-NZ 3.11Å; T427-K436 VanDerWaalsContact CB-NZ 3.33Å; T427-K436 PolarHBondContact OG1-NZ 3.27Å; V432-K436 HydrophobicContact CG1-CB 4.19Å; V432-K436 PolarHBondContact O-N 2.95Å; V432-K436 VanDerWaalsContact O-N 3.1Å; K436-A438 VanDerWaalsContact C-N 3.35Å; K436-A438 PolarHBondContact O-N 2.76Å; K436-L439 HydrophobicContact CB-CD1 4.31Å; K436-L439 HydrophobicContact CG-CD1 4.32Å; K436-L439 WeakPolarHBondContact O-CB 3.39Å; K436-L439 PolarHBondContact O-N 3.41Å; K436-L439 VanDerWaalsContact O-N 3.08Å; K436-L440 PolarHBondContact O-N 2.82Å
437	R	94.2	Very high	94.7	Very high	25 Å²	25	38.1 Å²	38.1	9%	0.094	24%	0.236	C	C	.	.	H	α-helix	trans	-61	-39.9	-174.5	-65.8	176.5	38.3	-126.3	-43.6	113.6	V432 G433 L439 L440 C441 G468 I470 E475	V432-R437 HydrophobicContact CG1-CB 4.34Å; V432-R437 HydrophobicContact CG1-CG 3.76Å; G433-R437 WeakPolarHBondContact O-CD 3.31Å; G433-R437 WeakPolarHBondContact O-CG 3.4Å; R437-L439 VanDerWaalsContact C-N 3.34Å; R437-L440 PolarHBondContact O-N 2.73Å; R437-C441 PolarHBondContact O-N 2.88Å; R437-C441 VanDerWaalsContact O-N 3.14Å; R437-C441 PolarHBondContact O-SG 3.32Å; R437-C441 VanDerWaalsContact O-SG 3.39Å; R437-G468 PolarHBondContact NH1-O 3.17Å; R437-I470 WeakPolarHBondContact CG-O 3.43Å; R437-E475 IonicContact CZ-OE1 3.87Å; R437-E475 IonicContact CZ-OE2 3.77Å; R437-E475 IonicContact NH2-OE1 2.64Å; R437-E475 PolarHBondContact NH2-OE1 3.45Å; R437-E475 IonicContact NH2-OE2 2.63Å; R437-E475 PolarHBondContact NH2-OE2 3.14Å
438	A	93.4	Very high	94.7	Very high	58 Å²	58	38.9 Å²	38.9	48%	0.479	24%	0.244	S	C	.	.	H	α-helix	trans	-64.2	-41.2	174.8	0	0	0	0	0	111.6	K436 C441 E442	K436-A438 VanDerWaalsContact C-N 3.35Å; K436-A438 PolarHBondContact O-N 2.76Å; A438-C441 WeakPolarHBondContact O-CB 3.33Å; A438-C441 PolarHBondContact O-N 3.39Å; A438-E442 PolarHBondContact O-N 3.5Å
439	L	96.2	Very high	94.9	Very high	11 Å²	11	37.9 Å²	37.9	6%	0.058	23%	0.231	C	C	.	.	H	α-helix	trans	-66.6	-37.6	177.2	-65.3	162.7	0	0	0	111.9	A416 R417 C426 K436 R437 C441 E442 E443	A416-L439 HydrophobicContact CB-CD1 3.42Å; A416-L439 VanDerWaalsContact CB-CD1 3.42Å; A416-L439 HydrophobicContact CB-CD2 3.76Å; A416-L439 HydrophobicContact CB-CG 4.15Å; R417-L439 HydrophobicContact CG-CD2 3.87Å; C426-L439 HydrophobicContact CB-CB 3.72Å; C426-L439 HydrophobicContact CB-CD1 4.35Å; K436-L439 HydrophobicContact CB-CD1 4.31Å; K436-L439 HydrophobicContact CG-CD1 4.32Å; K436-L439 WeakPolarHBondContact O-CB 3.39Å; K436-L439 PolarHBondContact O-N 3.41Å; K436-L439 VanDerWaalsContact O-N 3.08Å; R437-L439 VanDerWaalsContact C-N 3.34Å; L439-C441 VanDerWaalsContact C-N 3.32Å; L439-C441 PolarHBondContact O-N 2.98Å; L439-E442 WeakPolarHBondContact O-CB 3.23Å; L439-E442 PolarHBondContact O-N 2.98Å; L439-E443 WeakPolarHBondContact O-CB 3.31Å; L439-E443 PolarHBondContact O-N 2.82Å
440	L	96.7	Very high	95.1	Very high	15 Å²	15	41.5 Å²	41.5	8%	0.079	25%	0.248	C	C	.	.	H	α-helix	trans	-58.2	-45.3	171.2	177.8	69.3	0	0	0	110.9	V432 K436 R437 E442 E443 V444 I449 M452 I470	V432-L440 HydrophobicContact CG1-CB 4.09Å; V432-L440 HydrophobicContact CG1-CD2 4.16Å; V432-L440 HydrophobicContact CG2-CB 4.27Å; V432-L440 HydrophobicContact CG2-CD1 4.26Å; V432-L440 HydrophobicContact CG2-CD2 4.18Å; V432-L440 HydrophobicContact CG2-CG 4.46Å; K436-L440 PolarHBondContact O-N 2.82Å; R437-L440 PolarHBondContact O-N 2.73Å; L440-E442 VanDerWaalsContact C-N 3.31Å; L440-E442 PolarHBondContact O-N 2.86Å; L440-E443 PolarHBondContact O-N 3.38Å; L440-V444 HydrophobicContact CD1-CG1 4.01Å; L440-V444 HydrophobicContact CD1-CG2 4.4Å; L440-V444 HydrophobicContact CG-CG2 4.49Å; L440-V444 WeakPolarHBondContact O-CG2 3.45Å; L440-V444 PolarHBondContact O-N 3.28Å; L440-I449 HydrophobicContact CD2-CD1 4.18Å; L440-I449 HydrophobicContact CG-CD1 4.09Å; L440-M452 HydrophobicContact CD2-SD 4.46Å; L440-I470 HydrophobicContact CD2-CG2 3.73Å
441	C	95.1	Very high	95.2	Very high	44 Å²	44	44.9 Å²	44.9	30%	0.297	27%	0.27	S	S	.	.	H	α-helix	trans	-61.2	-38.6	176.6	-68	0	0	0	0	112.6	R437 A438 L439 G445 I449	R437-C441 PolarHBondContact O-N 2.88Å; R437-C441 VanDerWaalsContact O-N 3.14Å; R437-C441 PolarHBondContact O-SG 3.32Å; R437-C441 VanDerWaalsContact O-SG 3.39Å; A438-C441 WeakPolarHBondContact O-CB 3.33Å; A438-C441 PolarHBondContact O-N 3.39Å; L439-C441 VanDerWaalsContact C-N 3.32Å; L439-C441 PolarHBondContact O-N 2.98Å; C441-G445 VanDerWaalsContact O-CA 3.3Å; C441-G445 WeakPolarHBondContact O-CA 3.33Å; C441-G445 PolarHBondContact O-N 3.02Å; C441-G445 VanDerWaalsContact O-N 3.13Å; C441-I449 HydrophobicContact CB-CG1 4.33Å
442	E	96.2	Very high	95.3	Very high	95 Å²	95	47.6 Å²	47.6	44%	0.444	28%	0.281	S	S	.	.	H	α-helix	trans	-65.5	-43.3	173.2	-68	177.2	-141	0	0	111.4	R417 L420 A438 L439 L440	R417-E442 IonicContact CZ-OE1 3.97Å; R417-E442 IonicContact CZ-OE2 3.66Å; R417-E442 IonicContact NE-OE1 3.68Å; R417-E442 PolarHBondContact NE-OE1 3.2Å; R417-E442 IonicContact NE-OE2 3.34Å; R417-E442 PolarHBondContact NE-OE2 3.42Å; R417-E442 IonicContact NH2-OE1 3Å; R417-E442 PolarHBondContact NH2-OE1 3.21Å; L420-E442 HydrophobicContact CD1-CB 4.11Å; A438-E442 PolarHBondContact O-N 3.5Å; L439-E442 WeakPolarHBondContact O-CB 3.23Å; L439-E442 PolarHBondContact O-N 2.98Å; L440-E442 VanDerWaalsContact C-N 3.31Å; L440-E442 PolarHBondContact O-N 2.86Å
443	E	97.4	Very high	95.3	Very high	69 Å²	69	48.8 Å²	48.8	32%	0.322	29%	0.285	S	S	.	.	H	α-helix	trans	-66.6	-54.2	-176.7	-179	172.5	154.2	0	0	113.3	L420 T425 C426 L439 L440	L420-E443 HydrophobicContact CD1-CB 4.2Å; L420-E443 HydrophobicContact CD2-CB 3.64Å; L420-E443 HydrophobicContact CD2-CG 3.62Å; L420-E443 WeakPolarHBondContact CD2-OE2 3.38Å; T425-E443 WeakPolarHBondContact CA-OE2 3.39Å; T425-E443 WeakPolarHBondContact CB-OE1 3.45Å; T425-E443 PolarHBondContact OG1-OE1 2.76Å; T425-E443 PolarHBondContact OG1-OE2 2.87Å; C426-E443 PolarHBondContact N-OE2 3.3Å; C426-E443 PolarHBondContact SG-OE2 3.47Å; L439-E443 WeakPolarHBondContact O-CB 3.31Å; L439-E443 PolarHBondContact O-N 2.82Å; L440-E443 PolarHBondContact O-N 3.38Å
444	V	96.6	Very high	95.4	Very high	52 Å²	52	50.4 Å²	50.4	32%	0.315	30%	0.302	S	S	.	.	H	α-helix	trans	-93.8	-15	-172.8	-53.1	0	0	0	0	113.2	L440 A448 I449 M452	L440-V444 HydrophobicContact CD1-CG1 4.01Å; L440-V444 HydrophobicContact CD1-CG2 4.4Å; L440-V444 HydrophobicContact CG-CG2 4.49Å; L440-V444 WeakPolarHBondContact O-CG2 3.45Å; L440-V444 PolarHBondContact O-N 3.28Å; V444-A448 HydrophobicContact CB-CB 3.77Å; V444-A448 HydrophobicContact CG2-CB 3.75Å; V444-A448 VanDerWaalsContact O-CB 3.26Å; V444-A448 WeakPolarHBondContact O-CB 3.47Å; V444-I449 HydrophobicContact CG2-CD1 3.63Å; V444-I449 HydrophobicContact CG2-CG1 3.86Å; V444-M452 HydrophobicContact CG1-CE 4.3Å; V444-M452 HydrophobicContact CG2-CE 4.08Å
445	G	95.8	Very high	95.6	Very high	18 Å²	18	52.3 Å²	52.3	19%	0.186	31%	0.312	C	S	.	.	H	α-helix	trans	75.5	167.1	-179.9	0	0	0	0	0	114.8	C441 L447 A448 I449	C441-G445 VanDerWaalsContact O-CA 3.3Å; C441-G445 WeakPolarHBondContact O-CA 3.33Å; C441-G445 PolarHBondContact O-N 3.02Å; C441-G445 VanDerWaalsContact O-N 3.13Å; G445-L447 VanDerWaalsContact C-N 3.35Å; G445-L447 PolarHBondContact O-N 3.49Å; G445-A448 PolarHBondContact O-N 3.5Å; G445-I449 WeakPolarHBondContact O-CG1 3.07Å; G445-I449 PolarHBondContact O-N 3.16Å; G445-I449 VanDerWaalsContact O-N 3.13Å
446	P	94.3	Very high	96.1	Very high	77 Å²	77	50.7 Å²	50.7	50%	0.5	29%	0.293	S	S	.	.	H	α-helix	trans	-64.5	-34.1	-167.9	24.6	-35.3	0	0	0	113.8	I449 Q450 L476	P446-I449 PolarHBondContact O-N 3.34Å; P446-Q450 VanDerWaalsContact O-CG 3.29Å; P446-Q450 WeakPolarHBondContact O-CG 3.23Å; P446-Q450 PolarHBondContact O-N 3.25Å; P446-L476 HydrophobicContact CB-CD2 3.79Å
447	L	96.4	Very high	96.2	Very high	130 Å²	130	52.8 Å²	52.8	68%	0.681	31%	0.305	S	S	*	.	H	α-helix	trans	-69.2	-40.8	-179.7	-66.8	177.1	0	0	0	111.8	G445 Q450 V451	G445-L447 VanDerWaalsContact C-N 3.35Å; G445-L447 PolarHBondContact O-N 3.49Å; L447-Q450 PolarHBondContact O-N 2.71Å; L447-V451 WeakPolarHBondContact O-CG2 3.14Å; L447-V451 PolarHBondContact O-N 3.28Å; L447-V451 VanDerWaalsContact O-N 3.11Å
448	A	96.6	Very high	96.3	Very high	36 Å²	36	56.3 Å²	56.3	30%	0.298	33%	0.333	S	S	.	.	H	α-helix	trans	-68	-39.6	175.9	0	0	0	0	0	111	V444 G445 Q450 V451 M452	V444-A448 HydrophobicContact CB-CB 3.77Å; V444-A448 HydrophobicContact CG2-CB 3.75Å; V444-A448 VanDerWaalsContact O-CB 3.26Å; V444-A448 WeakPolarHBondContact O-CB 3.47Å; G445-A448 PolarHBondContact O-N 3.5Å; A448-Q450 VanDerWaalsContact C-N 3.33Å; A448-Q450 PolarHBondContact O-N 2.94Å; A448-V451 WeakPolarHBondContact O-CB 3.49Å; A448-V451 PolarHBondContact O-N 2.93Å; A448-V451 VanDerWaalsContact O-N 3.14Å; A448-M452 WeakPolarHBondContact O-CG 3.49Å; A448-M452 PolarHBondContact O-N 3.38Å
449	I	96.3	Very high	96.5	Very high	10 Å²	10	55.7 Å²	55.7	5%	0.051	32%	0.322	C	S	.	.	H	α-helix	trans	-57.8	-43.8	172.1	-66.1	-61.9	0	0	0	111.5	L440 C441 V444 G445 P446 V451 M452 Q453 L471 L476	L440-I449 HydrophobicContact CD2-CD1 4.18Å; L440-I449 HydrophobicContact CG-CD1 4.09Å; C441-I449 HydrophobicContact CB-CG1 4.33Å; V444-I449 HydrophobicContact CG2-CD1 3.63Å; V444-I449 HydrophobicContact CG2-CG1 3.86Å; G445-I449 WeakPolarHBondContact O-CG1 3.07Å; G445-I449 PolarHBondContact O-N 3.16Å; G445-I449 VanDerWaalsContact O-N 3.13Å; P446-I449 PolarHBondContact O-N 3.34Å; I449-V451 VanDerWaalsContact C-N 3.31Å; I449-V451 PolarHBondContact O-N 3.11Å; I449-M452 HydrophobicContact CD1-SD 4.38Å; I449-M452 PolarHBondContact O-N 3.48Å; I449-Q453 WeakPolarHBondContact O-CB 3.45Å; I449-Q453 PolarHBondContact O-N 3.43Å; I449-L471 HydrophobicContact CD1-CD2 4.27Å; I449-L471 HydrophobicContact CG2-CD2 4.49Å; I449-L476 HydrophobicContact CG2-CD1 4.32Å
450	Q	95.6	Very high	96.6	Very high	106 Å²	106	55.1 Å²	55.1	50%	0.495	32%	0.319	S	S	.	.	H	α-helix	trans	-60.7	-39.7	175.9	-74.3	172.6	8.9	0	0	112.4	P446 L447 A448 Q453 G454 L476	P446-Q450 VanDerWaalsContact O-CG 3.29Å; P446-Q450 WeakPolarHBondContact O-CG 3.23Å; P446-Q450 PolarHBondContact O-N 3.25Å; L447-Q450 PolarHBondContact O-N 2.71Å; A448-Q450 VanDerWaalsContact C-N 3.33Å; A448-Q450 PolarHBondContact O-N 2.94Å; Q450-Q453 PolarHBondContact O-N 2.85Å; Q450-G454 PolarHBondContact O-N 2.87Å; Q450-L476 HydrophobicContact CG-CD1 3.52Å
451	V	97.1	Very high	96.5	Very high	95 Å²	95	58 Å²	58	58%	0.576	34%	0.339	S	S	*	.	H	α-helix	trans	-65.2	-46.2	175.2	173.2	0	0	0	0	111	L447 A448 I449 Q453 G454 L455	L447-V451 WeakPolarHBondContact O-CG2 3.14Å; L447-V451 PolarHBondContact O-N 3.28Å; L447-V451 VanDerWaalsContact O-N 3.11Å; A448-V451 WeakPolarHBondContact O-CB 3.49Å; A448-V451 PolarHBondContact O-N 2.93Å; A448-V451 VanDerWaalsContact O-N 3.14Å; I449-V451 VanDerWaalsContact C-N 3.31Å; I449-V451 PolarHBondContact O-N 3.11Å; V451-Q453 VanDerWaalsContact C-N 3.28Å; V451-Q453 PolarHBondContact O-N 3.46Å; V451-G454 PolarHBondContact O-N 3.07Å; V451-G454 VanDerWaalsContact O-N 3.17Å; V451-L455 HydrophobicContact CG1-CD1 4.28Å; V451-L455 WeakPolarHBondContact O-CG 3.35Å; V451-L455 PolarHBondContact O-N 3.04Å
452	M	97.1	Very high	96.5	Very high	66 Å²	66	61 Å²	61	33%	0.325	34%	0.343	S	S	.	.	H	α-helix	trans	-58.9	-41.7	175.5	-66.7	-178.9	-173.6	0	0	111.4	L440 V444 A448 I449 L455 K456 L471	L440-M452 HydrophobicContact CD2-SD 4.46Å; V444-M452 HydrophobicContact CG1-CE 4.3Å; V444-M452 HydrophobicContact CG2-CE 4.08Å; A448-M452 WeakPolarHBondContact O-CG 3.49Å; A448-M452 PolarHBondContact O-N 3.38Å; I449-M452 HydrophobicContact CD1-SD 4.38Å; I449-M452 PolarHBondContact O-N 3.48Å; M452-L455 PolarHBondContact O-N 3.14Å; M452-K456 WeakPolarHBondContact O-CB 3.24Å; M452-K456 PolarHBondContact O-N 3.27Å; M452-L471 HydrophobicContact CB-CD1 3.93Å; M452-L471 HydrophobicContact CB-CD2 4.07Å; M452-L471 HydrophobicContact SD-CD2 4.4Å
453	Q	96.4	Very high	96.6	Very high	36 Å²	36	58.3 Å²	58.3	17%	0.168	33%	0.332	C	S	.	.	H	α-helix	trans	-64.2	-42.2	175.7	-172.9	56.8	58.3	0	0	111.7	I449 Q450 V451 L455 K456 D457	I449-Q453 WeakPolarHBondContact O-CB 3.45Å; I449-Q453 PolarHBondContact O-N 3.43Å; Q450-Q453 PolarHBondContact O-N 2.85Å; V451-Q453 VanDerWaalsContact C-N 3.28Å; V451-Q453 PolarHBondContact O-N 3.46Å; Q453-L455 VanDerWaalsContact C-N 3.34Å; Q453-L455 PolarHBondContact O-N 2.8Å; Q453-K456 WeakPolarHBondContact O-CB 3.45Å; Q453-K456 PolarHBondContact O-N 3.05Å; Q453-D457 PolarHBondContact NE2-OD1 2.63Å; Q453-D457 PolarHBondContact NE2-OD2 2.64Å; Q453-D457 WeakPolarHBondContact O-CB 3.43Å; Q453-D457 PolarHBondContact O-N 2.71Å
454	G	97.1	Very high	96.6	Very high	34 Å²	34	55.3 Å²	55.3	35%	0.351	32%	0.319	S	S	.	.	H	α-helix	trans	-61.6	-39	174.7	0	0	0	0	0	113.1	Q450 V451 S458	Q450-G454 PolarHBondContact O-N 2.87Å; V451-G454 PolarHBondContact O-N 3.07Å; V451-G454 VanDerWaalsContact O-N 3.17Å; G454-S458 WeakPolarHBondContact O-CB 3.37Å; G454-S458 PolarHBondContact O-N 3.06Å; G454-S458 PolarHBondContact O-OG 3.16Å
455	L	97.3	Very high	96.6	Very high	69 Å²	69	52.9 Å²	52.9	36%	0.361	30%	0.304	S	S	.	.	H	α-helix	trans	-65	-46.2	173.5	-68.9	168	0	0	0	111.3	L208 V451 M452 Q453 D457 S458 L459	L208-L455 HydrophobicContact CD1-CD1 3.89Å; V451-L455 HydrophobicContact CG1-CD1 4.28Å; V451-L455 WeakPolarHBondContact O-CG 3.35Å; V451-L455 PolarHBondContact O-N 3.04Å; M452-L455 PolarHBondContact O-N 3.14Å; Q453-L455 VanDerWaalsContact C-N 3.34Å; Q453-L455 PolarHBondContact O-N 2.8Å; L455-D457 PolarHBondContact O-N 3.27Å; L455-S458 PolarHBondContact O-N 3.43Å; L455-L459 PolarHBondContact O-N 2.72Å
456	K	97.4	Very high	96.7	Very high	8 Å²	8	52.2 Å²	52.2	4%	0.035	30%	0.296	C	S	.	.	H	α-helix	trans	-58.8	-46.6	175.6	172.5	60.6	179.7	177.4	0	111.8	T215 L216 M452 Q453 S458 L459 D460 N463 M465 L471	T215-K456 WeakPolarHBondContact O-CD 3.35Å; T215-K456 PolarHBondContact O-NZ 2.81Å; L216-K456 HydrophobicContact CD2-CB 4.24Å; L216-K456 HydrophobicContact CD2-CD 4.05Å; M452-K456 WeakPolarHBondContact O-CB 3.24Å; M452-K456 PolarHBondContact O-N 3.27Å; Q453-K456 WeakPolarHBondContact O-CB 3.45Å; Q453-K456 PolarHBondContact O-N 3.05Å; K456-S458 VanDerWaalsContact C-N 3.3Å; K456-S458 PolarHBondContact O-N 3.36Å; K456-L459 PolarHBondContact O-N 2.95Å; K456-D460 HydrophobicContact CD-CB 4.26Å; K456-D460 WeakPolarHBondContact CE-OD2 3.35Å; K456-D460 IonicContact NZ-OD2 3.27Å; K456-D460 PolarHBondContact NZ-OD2 3.14Å; K456-D460 CarbonylContact O-C 3.5Å; K456-D460 WeakPolarHBondContact O-CA 3.31Å; K456-D460 PolarHBondContact O-N 3.1Å; K456-N463 WeakPolarHBondContact CE-OD1 3.43Å; K456-M465 PolarHBondContact NZ-O 3.42Å; K456-L471 HydrophobicContact CB-CD1 4.05Å; K456-L471 HydrophobicContact CG-CD1 4.48Å
457	D	96.7	Very high	96.8	Very high	55 Å²	55	48.8 Å²	48.8	29%	0.294	27%	0.274	S	S	.	.	H	α-helix	trans	-70	-28.6	-179.9	-71	-33.8	0	0	0	112.5	Q453 L455 P461 R473	Q453-D457 PolarHBondContact NE2-OD1 2.63Å; Q453-D457 PolarHBondContact NE2-OD2 2.64Å; Q453-D457 WeakPolarHBondContact O-CB 3.43Å; Q453-D457 PolarHBondContact O-N 2.71Å; L455-D457 PolarHBondContact O-N 3.27Å; D457-P461 WeakPolarHBondContact O-CA 3.41Å; D457-P461 WeakPolarHBondContact O-CB 3.45Å; D457-R473 IonicContact OD1-CZ 2.68Å; D457-R473 IonicContact OD1-NE 2.85Å; D457-R473 PolarHBondContact OD1-NE 3.05Å; D457-R473 IonicContact OD1-NH2 3.51Å; D457-R473 PolarHBondContact OD1-NH2 3.23Å
458	S	96.8	Very high	96.7	Very high	98 Å²	98	43.2 Å²	43.2	69%	0.685	25%	0.247	S	C	*	.	H	α-helix	trans	-71.7	-42.9	175	-60.7	0	0	0	0	112.3	G454 L455 K456	G454-S458 WeakPolarHBondContact O-CB 3.37Å; G454-S458 PolarHBondContact O-N 3.06Å; G454-S458 PolarHBondContact O-OG 3.16Å; L455-S458 PolarHBondContact O-N 3.43Å; K456-S458 VanDerWaalsContact C-N 3.3Å; K456-S458 PolarHBondContact O-N 3.36Å
459	L	97.1	Very high	96.6	Very high	45 Å²	45	41.7 Å²	41.7	24%	0.236	23%	0.234	C	C	.	.	H	α-helix	trans	-85.3	-26.1	-178.2	-67.6	173.2	0	0	0	113.1	L181 L208 F209 L216 L455 K456	L181-L459 HydrophobicContact CD1-CD2 4.38Å; L181-L459 HydrophobicContact CD2-CD2 4.41Å; L208-L459 HydrophobicContact CD2-CD1 4.23Å; F209-L459 HydrophobicContact CZ-CD1 4.12Å; L216-L459 HydrophobicContact CB-CD1 4.15Å; L216-L459 HydrophobicContact CD1-CD1 4.17Å; L216-L459 HydrophobicContact CD2-CD1 4.21Å; L216-L459 HydrophobicContact CG-CD1 4.4Å; L455-L459 PolarHBondContact O-N 2.72Å; K456-L459 PolarHBondContact O-N 2.95Å
460	D	97.8	Very high	96.6	Very high	0 Å²	0	42.2 Å²	42.2	0%	0	24%	0.237	C	C	.	.			trans	-143	71.2	-178.1	-178.5	30	0	0	0	111.9	S182 K456 R462 N463 L464 M465	S182-D460 WeakPolarHBondContact CB-OD1 3.31Å; S182-D460 PolarHBondContact OG-OD1 3.25Å; K456-D460 HydrophobicContact CD-CB 4.26Å; K456-D460 WeakPolarHBondContact CE-OD2 3.35Å; K456-D460 IonicContact NZ-OD2 3.27Å; K456-D460 PolarHBondContact NZ-OD2 3.14Å; K456-D460 CarbonylContact O-C 3.5Å; K456-D460 WeakPolarHBondContact O-CA 3.31Å; K456-D460 PolarHBondContact O-N 3.1Å; D460-R462 PolarHBondContact O-N 3.45Å; D460-R462 VanDerWaalsContact O-N 3.07Å; D460-N463 PolarHBondContact O-N 2.96Å; D460-N463 PolarHBondContact OD1-N 3.05Å; D460-N463 WeakPolarHBondContact OD2-CA 3.46Å; D460-L464 VanDerWaalsContact CG-N 3.33Å; D460-L464 PolarHBondContact OD1-N 3.4Å; D460-L464 VanDerWaalsContact OD1-N 3.1Å; D460-L464 PolarHBondContact OD2-N 3.23Å; D460-M465 HydrophobicContact CB-CB 4.31Å; D460-M465 VanDerWaalsContact OD2-CB 3.31Å; D460-M465 WeakPolarHBondContact OD2-CB 3.43Å; D460-M465 PolarHBondContact OD2-N 3.01Å
461	P	95.7	Very high	96.3	Very high	76 Å²	76	38.4 Å²	38.4	49%	0.494	22%	0.22	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.2	-21.7	-173.9	23.6	-34.8	0	0	0	113.7	D457 R473	D457-P461 WeakPolarHBondContact O-CA 3.41Å; D457-P461 WeakPolarHBondContact O-CB 3.45Å; P461-R473 PolarHBondContact O-NH2 3.21Å
462	R	95.9	Very high	95.4	Very high	105 Å²	105	38 Å²	38	40%	0.396	21%	0.212	S	C	.	.	T	Hydrogen-bonded Turn	trans	-91.9	-2.1	177.8	-66	-178.4	-173.3	-160.5	5.3	113	H73 N76 D460 L464	H73-R462 PolarHBondContact NE2-NE 2.91Å; H73-R462 PolarHBondContact O-NH1 2.95Å; N76-R462 WeakPolarHBondContact OD1-CD 3.42Å; N76-R462 PolarHBondContact OD1-NH1 3.35Å; D460-R462 PolarHBondContact O-N 3.45Å; D460-R462 VanDerWaalsContact O-N 3.07Å; R462-L464 VanDerWaalsContact C-N 3.29Å; R462-L464 HydrophobicContact CB-CD1 3.96Å; R462-L464 HydrophobicContact CB-CD2 4.02Å; R462-L464 HydrophobicContact CB-CG 3.65Å; R462-L464 PolarHBondContact O-N 3.02Å
463	N	96.6	Very high	94.2	Very high	39 Å²	39	40.1 Å²	40.1	21%	0.209	22%	0.216	C	C	.	.			trans	51.2	46.4	-176.9	-169.1	42.7	0	0	0	112.9	K456 D460	K456-N463 WeakPolarHBondContact CE-OD1 3.43Å; D460-N463 PolarHBondContact O-N 2.96Å; D460-N463 PolarHBondContact OD1-N 3.05Å; D460-N463 WeakPolarHBondContact OD2-CA 3.46Å
464	L	97.4	Very high	92.5	Very high	7 Å²	7	42.3 Å²	42.3	4%	0.037	25%	0.248	C	C	.	.			trans	-88.2	-28.7	179.5	-55.7	-179.4	0	0	0	112.1	H73 N76 P78 I79 D460 R462 N466 P467	H73-L464 HydrophobicContact CB-CD1 4.38Å; N76-L464 HydrophobicContact CB-CD2 4.45Å; P78-L464 CarbonylContact C-O 3.55Å; P78-L464 VanDerWaalsContact CA-O 3.29Å; P78-L464 WeakPolarHBondContact CA-O 3.41Å; I79-L464 PolarHBondContact N-O 3.33Å; D460-L464 VanDerWaalsContact CG-N 3.33Å; D460-L464 PolarHBondContact OD1-N 3.4Å; D460-L464 VanDerWaalsContact OD1-N 3.1Å; D460-L464 PolarHBondContact OD2-N 3.23Å; R462-L464 VanDerWaalsContact C-N 3.29Å; R462-L464 HydrophobicContact CB-CD1 3.96Å; R462-L464 HydrophobicContact CB-CD2 4.02Å; R462-L464 HydrophobicContact CB-CG 3.65Å; R462-L464 PolarHBondContact O-N 3.02Å; L464-N466 PolarHBondContact O-N 3.06Å; L464-P467 WeakPolarHBondContact O-CD 3.44Å
465	M	98.3	Very high	90.4	Very high	0 Å²	0	44.1 Å²	44.1	0%	0	25%	0.247	C	C	.	.	B	Isolated β-bridge	trans	-85.9	107.6	-168.2	-160.9	54.8	69.6	0	0	110.6	I79 P81 G214 T215 I218 K456 D460	I79-M465 HydrophobicContact CB-CE 4.08Å; I79-M465 HydrophobicContact CB-SD 3.93Å; I79-M465 HydrophobicContact CD1-CE 3.66Å; I79-M465 HydrophobicContact CG1-CE 4.48Å; I79-M465 HydrophobicContact CG2-CE 3.88Å; I79-M465 HydrophobicContact CG2-SD 3.59Å; I79-M465 VanDerWaalsContact CG2-SD 3.59Å; P81-M465 HydrophobicContact CG-SD 4.27Å; G214-M465 VanDerWaalsContact O-CG 3.23Å; G214-M465 WeakPolarHBondContact O-CG 3.48Å; T215-M465 WeakPolarHBondContact O-CB 3.49Å; I218-M465 HydrophobicContact CG1-CE 4.12Å; I218-M465 HydrophobicContact CG1-SD 3.97Å; K456-M465 PolarHBondContact NZ-O 3.42Å; D460-M465 HydrophobicContact CB-CB 4.31Å; D460-M465 VanDerWaalsContact OD2-CB 3.31Å; D460-M465 WeakPolarHBondContact OD2-CB 3.43Å; D460-M465 PolarHBondContact OD2-N 3.01Å
466	N	97.8	Very high	88	Confident	4 Å²	4	48.7 Å²	48.7	2%	0.021	27%	0.271	C	S	.	.	S	Bend	trans	42.4	57	-176.8	-151.7	19.4	0	0	0	115.1	I79 G91 E213 G214 T215 L464 K469	I79-N466 WeakPolarHBondContact O-CA 3.38Å; I79-N466 PolarHBondContact O-N 2.96Å; G91-N466 PolarHBondContact O-ND2 3.41Å; G91-N466 PolarHBondContact O-OD1 3.41Å; E213-N466 PolarHBondContact O-ND2 3.5Å; G214-N466 WeakPolarHBondContact O-CB 3.5Å; T215-N466 HydrophobicContact CG2-CB 4.26Å; L464-N466 PolarHBondContact O-N 3.06Å; N466-K469 HydrophobicContact CB-CD 4.44Å; N466-K469 VanDerWaalsContact O-CD 3.23Å; N466-K469 WeakPolarHBondContact O-CD 3.49Å; N466-K469 VanDerWaalsContact OD1-CD 3.31Å; N466-K469 WeakPolarHBondContact OD1-CD 3.4Å; N466-K469 WeakPolarHBondContact OD1-CE 3.28Å; N466-K469 PolarHBondContact OD1-NZ 3.06Å
467	P	96.5	Very high	87.5	Confident	6 Å²	6	50.8 Å²	50.8	4%	0.039	28%	0.283	C	S	.	.	T	Hydrogen-bonded Turn	trans	-69.1	143.5	-168.9	27.2	-35.3	0	0	0	113.1	P78 K96 L464 K469	P78-P467 HydrophobicContact CB-CG 3.88Å; P78-P467 HydrophobicContact CG-CG 4.34Å; K96-P467 HydrophobicContact CB-CG 4.09Å; K96-P467 HydrophobicContact CG-CB 4.27Å; K96-P467 HydrophobicContact CG-CG 4Å; L464-P467 WeakPolarHBondContact O-CD 3.44Å; P467-K469 PolarHBondContact O-NZ 3.4Å
468	G	93.6	Very high	87	Confident	12 Å²	12	50.5 Å²	50.5	12%	0.124	28%	0.282	C	S	.	.	T	Hydrogen-bonded Turn	trans	88.6	7.3	175.7	0	0	0	0	0	115.3	L434 R437	L434-G468 WeakPolarHBondContact CD2-O 3.38Å; R437-G468 PolarHBondContact NH1-O 3.17Å
469	K	95.1	Very high	86.5	Confident	5 Å²	5	47.9 Å²	47.9	2%	0.022	26%	0.26	C	S	.	.	S	Bend	trans	-112.7	151.9	174.1	-61.5	84.9	172.9	-176.7	0	109.9	G91 G93 T215 G433 L434 N466 P467 L471	G91-K469 WeakPolarHBondContact O-CE 3.41Å; G93-K469 WeakPolarHBondContact O-CE 3.37Å; G93-K469 PolarHBondContact O-NZ 3.05Å; T215-K469 HydrophobicContact CG2-CB 4.35Å; G433-K469 VanDerWaalsContact O-CA 3.26Å; G433-K469 WeakPolarHBondContact O-CA 3.4Å; L434-K469 HydrophobicContact CD2-CD 4.35Å; L434-K469 HydrophobicContact CD2-CG 3.84Å; L434-K469 HydrophobicContact CG-CG 4.32Å; N466-K469 HydrophobicContact CB-CD 4.44Å; N466-K469 VanDerWaalsContact O-CD 3.23Å; N466-K469 WeakPolarHBondContact O-CD 3.49Å; N466-K469 VanDerWaalsContact OD1-CD 3.31Å; N466-K469 WeakPolarHBondContact OD1-CD 3.4Å; N466-K469 WeakPolarHBondContact OD1-CE 3.28Å; N466-K469 PolarHBondContact OD1-NZ 3.06Å; P467-K469 PolarHBondContact O-NZ 3.4Å; K469-L471 PolarHBondContact O-N 3.23Å
470	I	94.9	Very high	85.9	Confident	20 Å²	20	48.1 Å²	48.1	10%	0.103	26%	0.262	C	S	.	.	S	Bend	trans	58.8	-62	-171.8	-54.3	-170.2	0	0	0	112.2	S212 E213 T215 V432 G433 R437 L440	S212-I470 WeakPolarHBondContact O-CD1 3.42Å; E213-I470 HydrophobicContact CB-CD1 3.81Å; E213-I470 HydrophobicContact CB-CG1 4.26Å; E213-I470 HydrophobicContact CG-CD1 3.82Å; E213-I470 HydrophobicContact CG-CG1 4.32Å; T215-I470 HydrophobicContact CG2-CB 4.44Å; T215-I470 HydrophobicContact CG2-CD1 4.16Å; T215-I470 HydrophobicContact CG2-CG1 4.16Å; V432-I470 HydrophobicContact CB-CG1 4.36Å; G433-I470 PolarHBondContact O-N 3.46Å; R437-I470 WeakPolarHBondContact CG-O 3.43Å; L440-I470 HydrophobicContact CD2-CG2 3.73Å
471	L	90.9	Very high	85.1	Confident	26 Å²	26	51.1 Å²	51.1	14%	0.136	28%	0.278	C	S	.	.			trans	-115.6	151.1	179.5	-52.8	175	0	0	0	110.6	I449 M452 K456 K469	I449-L471 HydrophobicContact CD1-CD2 4.27Å; I449-L471 HydrophobicContact CG2-CD2 4.49Å; M452-L471 HydrophobicContact CB-CD1 3.93Å; M452-L471 HydrophobicContact CB-CD2 4.07Å; M452-L471 HydrophobicContact SD-CD2 4.4Å; K456-L471 HydrophobicContact CB-CD1 4.05Å; K456-L471 HydrophobicContact CG-CD1 4.48Å; K469-L471 PolarHBondContact O-N 3.23Å
472	Q	78.1	Confident	84.4	Confident	88 Å²	88	49.4 Å²	49.4	41%	0.411	26%	0.263	S	S	.	.			trans	-126.6	124.4	166.1	170.2	173.1	-37.3	0	0	109.8	G474 E475	Q472-G474 PolarHBondContact O-N 3.3Å; Q472-E475 HydrophobicContact CB-CB 4.48Å; Q472-E475 HydrophobicContact CB-CG 3.93Å; Q472-E475 HydrophobicContact CG-CG 3.88Å; Q472-E475 PolarHBondContact NE2-OE1 3.32Å; Q472-E475 WeakPolarHBondContact O-CB 3.46Å; Q472-E475 PolarHBondContact O-N 3.33Å; Q472-E475 PolarHBondContact OE1-OE1 3.44Å; Q472-E475 VanDerWaalsContact OE1-OE1 3.05Å
473	R	70	Confident	83.6	Confident	110 Å²	110	45.4 Å²	45.4	42%	0.415	25%	0.254	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.5	129.2	174.5	-84.9	-169	169.3	178	2	110.2	D457 P461	D457-R473 IonicContact OD1-CZ 2.68Å; D457-R473 IonicContact OD1-NE 2.85Å; D457-R473 PolarHBondContact OD1-NE 3.05Å; D457-R473 IonicContact OD1-NH2 3.51Å; D457-R473 PolarHBondContact OD1-NH2 3.23Å; P461-R473 PolarHBondContact O-NH2 3.21Å
474	G	61.3	Low	82.6	Confident	81 Å²	81	45.9 Å²	45.9	84%	0.835	26%	0.258	S	S	*	.	T	Hydrogen-bonded Turn	trans	82.5	7.3	-179.9	0	0	0	0	0	114.7	Q472 L476	Q472-G474 PolarHBondContact O-N 3.3Å; G474-L476 VanDerWaalsContact C-N 3.35Å; G474-L476 PolarHBondContact O-N 3.1Å
475	E	54.3	Low	81.4	Confident	73 Å²	73	49.2 Å²	49.2	34%	0.341	28%	0.276	S	S	.	.			trans	-83.6	86.1	160.6	-76.7	-177.7	179.7	0	0	109	R437 Q472	R437-E475 IonicContact CZ-OE1 3.87Å; R437-E475 IonicContact CZ-OE2 3.77Å; R437-E475 IonicContact NH2-OE1 2.64Å; R437-E475 PolarHBondContact NH2-OE1 3.45Å; R437-E475 IonicContact NH2-OE2 2.63Å; R437-E475 PolarHBondContact NH2-OE2 3.14Å; Q472-E475 HydrophobicContact CB-CB 4.48Å; Q472-E475 HydrophobicContact CB-CG 3.93Å; Q472-E475 HydrophobicContact CG-CG 3.88Å; Q472-E475 PolarHBondContact NE2-OE1 3.32Å; Q472-E475 WeakPolarHBondContact O-CB 3.46Å; Q472-E475 PolarHBondContact O-N 3.33Å; Q472-E475 PolarHBondContact OE1-OE1 3.44Å; Q472-E475 VanDerWaalsContact OE1-OE1 3.05Å
476	L	45.7	Very low	79.8	Confident	165 Å²	165	53.6 Å²	53.6	86%	0.864	30%	0.301	S	S	*	.			trans	-171	0	151.7	-97.1	167.3	0	0	0	108.3	P446 I449 Q450 G474	P446-L476 HydrophobicContact CB-CD2 3.79Å; I449-L476 HydrophobicContact CG2-CD1 4.32Å; Q450-L476 HydrophobicContact CG-CD1 3.52Å; G474-L476 VanDerWaalsContact C-N 3.35Å; G474-L476 PolarHBondContact O-N 3.1Å

Retrieved 476 of 476 residues in 863.2 ms (Link to these results)

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