A0A087WSF4_MOUSE Loading...

Zinc finger protein 976

May be involved in transcriptional regulation.

AlphaFold DB , UniProt , Accession A0A087WSF4, Species MOUSE (Mus musculus, Mouse), Gene Zfp976, Length 635 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	D	43.8	Very low	51.3	Low	216 Å²	216	99.8 Å²	99.8	100%	1.155	54%	0.539	S	S	*	.				0	125.1	0	-55.9	-21.9	0	0	0	109.9
2	A	49.8	Very low	51.6	Low	69 Å²	69	98.3 Å²	98.3	57%	0.57	52%	0.524	S	S	*	.	P	Polyproline II helix	trans	-86.1	124.4	-178	0	0	0	0	0	109.3	T4	A2-T4 PolarHBondContact O-N 3.39Å
3	L	47.6	Very low	51.5	Low	117 Å²	117	96.2 Å²	96.2	61%	0.613	52%	0.516	S	S	*	.	P	Polyproline II helix	trans	-62.8	119.9	174	-93	143.2	0	0	0	110	D7 V8	L3-D7 HydrophobicContact CD2-CB 4.01Å; L3-V8 HydrophobicContact CD2-CG1 4.12Å
4	T	53	Low	50.7	Low	70 Å²	70	105.1 Å²	105.1	43%	0.429	54%	0.539	S	S	.	.	P	Polyproline II helix	trans	-96.4	165.5	175.7	67.8	0	0	0	0	110.9	A2 D6 D7	A2-T4 PolarHBondContact O-N 3.39Å; T4-D6 PolarHBondContact O-N 3.14Å; T4-D7 WeakPolarHBondContact CB-OD2 3.46Å; T4-D7 PolarHBondContact N-OD2 3.28Å; T4-D7 WeakPolarHBondContact O-CB 3.43Å; T4-D7 PolarHBondContact O-N 2.83Å; T4-D7 VanDerWaalsContact O-N 3.16Å; T4-D7 VanDerWaalsContact OG1-CG 3.29Å; T4-D7 PolarHBondContact OG1-OD2 2.58Å
5	F	50.8	Low	50.3	Low	80 Å²	80	107.1 Å²	107.1	35%	0.351	55%	0.545	S	S	.	.	G	3₁₀ helix	trans	-61.8	-33.9	175.8	-177.6	-99.5	0	0	0	111.5	D7 V8 H9 L39	F5-D7 PolarHBondContact O-N 3.23Å; F5-V8 CarbonylContact O-C 3.55Å; F5-V8 WeakPolarHBondContact O-CG2 3.5Å; F5-V8 PolarHBondContact O-N 3.39Å; F5-V8 VanDerWaalsContact O-N 3.09Å; F5-H9 HydrophobicContact CD1-CB 4.01Å; F5-H9 HydrophobicContact CE1-CB 3.79Å; F5-H9 AromaticContact CE1-CD2 3.52Å; F5-H9 AromaticContact CE1-CG 3.82Å; F5-H9 HydrophobicContact CZ-CB 4.32Å; F5-H9 AromaticContact CZ-CD2 3.83Å; F5-H9 VanDerWaalsContact O-CB 3.23Å; F5-H9 WeakPolarHBondContact O-CB 3.33Å; F5-H9 PolarHBondContact O-N 2.99Å; F5-L39 HydrophobicContact CB-CD1 4.28Å; F5-L39 HydrophobicContact CD2-CD1 3.65Å; F5-L39 HydrophobicContact CG-CD1 4.45Å
6	D	52.8	Low	50.1	Low	118 Å²	118	106.3 Å²	106.3	63%	0.631	54%	0.539	S	S	*	.	G	3₁₀ helix	trans	-64.5	-24.5	177.8	-65.7	-26.3	0	0	0	112.4	T4 V8	T4-D6 PolarHBondContact O-N 3.14Å; D6-V8 VanDerWaalsContact C-N 3.33Å; D6-V8 PolarHBondContact O-N 3.18Å
7	D	53.8	Low	50.6	Low	103 Å²	103	104.9 Å²	104.9	55%	0.551	53%	0.526	S	S	*	.	G	3₁₀ helix	trans	-75.8	-19.2	175.6	-60.6	-52.1	0	0	0	113.6	L3 T4 F5	L3-D7 HydrophobicContact CD2-CB 4.01Å; T4-D7 WeakPolarHBondContact CB-OD2 3.46Å; T4-D7 PolarHBondContact N-OD2 3.28Å; T4-D7 WeakPolarHBondContact O-CB 3.43Å; T4-D7 PolarHBondContact O-N 2.83Å; T4-D7 VanDerWaalsContact O-N 3.16Å; T4-D7 VanDerWaalsContact OG1-CG 3.29Å; T4-D7 PolarHBondContact OG1-OD2 2.58Å; F5-D7 PolarHBondContact O-N 3.23Å
8	V	56	Low	50.6	Low	50 Å²	50	103.8 Å²	103.8	30%	0.303	53%	0.529	S	S	.	.	T	Hydrogen-bonded Turn	trans	-120	0	-178	-67	0	0	0	0	113.5	L3 F5 D6 N35 L39	L3-V8 HydrophobicContact CD2-CG1 4.12Å; F5-V8 CarbonylContact O-C 3.55Å; F5-V8 WeakPolarHBondContact O-CG2 3.5Å; F5-V8 PolarHBondContact O-N 3.39Å; F5-V8 VanDerWaalsContact O-N 3.09Å; D6-V8 VanDerWaalsContact C-N 3.33Å; D6-V8 PolarHBondContact O-N 3.18Å; V8-N35 PolarHBondContact O-ND2 3.11Å; V8-L39 HydrophobicContact CG2-CD1 3.74Å
9	H	53	Low	50.8	Low	43 Å²	43	106 Å²	106	20%	0.199	54%	0.541	C	S	.	.			trans	-86.1	131.8	176.3	178.6	-100.6	0	0	0	110.5	F5 H11 Y28	F5-H9 HydrophobicContact CD1-CB 4.01Å; F5-H9 HydrophobicContact CE1-CB 3.79Å; F5-H9 AromaticContact CE1-CD2 3.52Å; F5-H9 AromaticContact CE1-CG 3.82Å; F5-H9 HydrophobicContact CZ-CB 4.32Å; F5-H9 AromaticContact CZ-CD2 3.83Å; F5-H9 VanDerWaalsContact O-CB 3.23Å; F5-H9 WeakPolarHBondContact O-CB 3.33Å; F5-H9 PolarHBondContact O-N 2.99Å; H9-H11 AromaticContact CE1-CD2 3.92Å; H9-H11 AromaticContact CE1-CE1 3.39Å; H9-H11 PolarHBondContact CE1-CE1 3.12Å; H9-H11 AromaticContact CE1-CG 3.79Å; H9-H11 AromaticContact CE1-ND1 3.45Å; H9-H11 PolarHBondContact CE1-ND1 3.48Å; H9-H11 AromaticContact CE1-NE2 3.65Å; H9-H11 AromaticContact ND1-CD2 3.27Å; H9-H11 PolarHBondContact ND1-CD2 3.04Å; H9-H11 VanDerWaalsContact ND1-CD2 3.27Å; H9-H11 AromaticContact ND1-CE1 3.21Å; H9-H11 PolarHBondContact ND1-CE1 3.4Å; H9-H11 AromaticContact ND1-CG 3.61Å; H9-H11 AromaticContact ND1-ND1 3.57Å; H9-H11 AromaticContact ND1-NE2 2.98Å; H9-H11 PolarHBondContact ND1-NE2 2.78Å; H9-Y28 PolarHBondContact NE2-OH 3.08Å
10	I	53.9	Low	51.2	Low	97 Å²	97	102.5 Å²	102.5	50%	0.497	52%	0.524	S	S	.	.			trans	-96.5	114.9	176.6	-61.5	174.8	0	0	0	108	F12 Y28 M32	I10-F12 HydrophobicContact CG2-CE2 4.42Å; I10-Y28 HydrophobicContact CB-CE2 4.29Å; I10-Y28 VanDerWaalsContact O-CE2 3.28Å; I10-Y28 WeakPolarHBondContact O-CE2 3.41Å; I10-Y28 PolarHBondContact O-OH 2.82Å; I10-M32 HydrophobicContact CB-CE 4.34Å; I10-M32 HydrophobicContact CD1-CE 4.45Å; I10-M32 HydrophobicContact CG1-CE 4.33Å
11	H	50.2	Low	51.6	Low	135 Å²	135	100.8 Å²	100.8	63%	0.625	52%	0.516	S	S	*	.			trans	-84.1	135.1	175.5	-73.7	-84.9	0	0	0	111.5	H9	H9-H11 AromaticContact CE1-CD2 3.92Å; H9-H11 AromaticContact CE1-CE1 3.39Å; H9-H11 PolarHBondContact CE1-CE1 3.12Å; H9-H11 AromaticContact CE1-CG 3.79Å; H9-H11 AromaticContact CE1-ND1 3.45Å; H9-H11 PolarHBondContact CE1-ND1 3.48Å; H9-H11 AromaticContact CE1-NE2 3.65Å; H9-H11 AromaticContact ND1-CD2 3.27Å; H9-H11 PolarHBondContact ND1-CD2 3.04Å; H9-H11 VanDerWaalsContact ND1-CD2 3.27Å; H9-H11 AromaticContact ND1-CE1 3.21Å; H9-H11 PolarHBondContact ND1-CE1 3.4Å; H9-H11 AromaticContact ND1-CG 3.61Å; H9-H11 AromaticContact ND1-ND1 3.57Å; H9-H11 AromaticContact ND1-NE2 2.98Å; H9-H11 PolarHBondContact ND1-NE2 2.78Å
12	F	54.6	Low	52.2	Low	82 Å²	82	95.6 Å²	95.6	36%	0.36	49%	0.494	S	S	.	.			trans	-110.1	138.9	165.5	-75.9	-71.9	0	0	0	109.6	I10 E16 W17 L20 Y28	I10-F12 HydrophobicContact CG2-CE2 4.42Å; F12-E16 HydrophobicContact CD1-CB 3.99Å; F12-W17 HydrophobicContact CB-CB 4.37Å; F12-W17 HydrophobicContact CB-CE3 4.04Å; F12-W17 AromaticContact CD2-CE3 3.71Å; F12-W17 HydrophobicContact CD2-CE3 3.71Å; F12-W17 AromaticContact CD2-CZ3 3.84Å; F12-W17 HydrophobicContact CD2-CZ3 3.84Å; F12-W17 HydrophobicContact CE2-CE3 4.49Å; F12-W17 HydrophobicContact CE2-CZ3 4.33Å; F12-W17 HydrophobicContact CG-CE3 4.07Å; F12-L20 HydrophobicContact CD1-CD1 4.41Å; F12-L20 HydrophobicContact CD2-CD1 4.29Å; F12-L20 HydrophobicContact CE1-CD1 4.16Å; F12-L20 HydrophobicContact CE2-CD1 4.02Å; F12-L20 HydrophobicContact CG-CD1 4.46Å; F12-L20 HydrophobicContact CZ-CD1 3.96Å; F12-Y28 AromaticContact CD2-CD2 3.99Å; F12-Y28 HydrophobicContact CD2-CD2 3.99Å; F12-Y28 AromaticContact CD2-CE2 3.7Å; F12-Y28 HydrophobicContact CD2-CE2 3.7Å; F12-Y28 AromaticContact CE2-CD2 3.47Å; F12-Y28 HydrophobicContact CE2-CD2 3.47Å; F12-Y28 VanDerWaalsContact CE2-CD2 3.47Å; F12-Y28 AromaticContact CE2-CE2 3.58Å; F12-Y28 HydrophobicContact CE2-CE2 3.58Å; F12-Y28 HydrophobicContact CE2-CG 4.22Å
13	T	50.4	Low	52.3	Low	70 Å²	70	96.1 Å²	96.1	43%	0.429	49%	0.493	S	S	.	.			trans	-71	164.1	167	63.7	0	0	0	0	110.6	E15 E16 W17	T13-E15 VanDerWaalsContact C-N 3.29Å; T13-E15 PolarHBondContact O-N 3.44Å; T13-E16 WeakPolarHBondContact CB-OE2 3.36Å; T13-E16 WeakPolarHBondContact CG2-OE2 3.39Å; T13-E16 PolarHBondContact N-OE2 3.2Å; T13-E16 PolarHBondContact O-N 3.06Å; T13-E16 WeakPolarHBondContact OG1-CB 3.43Å; T13-E16 WeakPolarHBondContact OG1-CG 3.38Å; T13-E16 PolarHBondContact OG1-N 3.01Å; T13-E16 PolarHBondContact OG1-OE2 2.88Å; T13-W17 WeakPolarHBondContact O-CB 3.37Å; T13-W17 PolarHBondContact O-N 2.76Å
14	R	39.8	Very low	52.5	Low	222 Å²	222	94.7 Å²	94.7	84%	0.838	48%	0.484	S	S	*	.	H	α-helix	trans	-65.8	-35.5	-176.7	-170.3	175.3	179.7	178	-1.8	111.6	S18	R14-S18 PolarHBondContact O-N 2.93Å
15	E	45.7	Very low	52.9	Low	134 Å²	134	93.9 Å²	93.9	63%	0.626	47%	0.474	S	S	*	.	H	α-helix	trans	-65.2	-47	173.9	-64.5	76.9	-160	0	0	110.8	T13 W17 S18 L19	T13-E15 VanDerWaalsContact C-N 3.29Å; T13-E15 PolarHBondContact O-N 3.44Å; E15-W17 PolarHBondContact O-N 3.28Å; E15-S18 WeakPolarHBondContact O-CB 3.35Å; E15-S18 PolarHBondContact O-N 3.36Å; E15-S18 PolarHBondContact O-OG 2.83Å; E15-L19 PolarHBondContact O-N 3.32Å
16	E	47.2	Very low	53	Low	94 Å²	94	98 Å²	98	44%	0.439	49%	0.487	S	S	.	.	H	α-helix	trans	-65.1	-41.6	179.4	-70.4	165.3	149.9	0	0	112.6	F12 T13 S18 L19	F12-E16 HydrophobicContact CD1-CB 3.99Å; T13-E16 WeakPolarHBondContact CB-OE2 3.36Å; T13-E16 WeakPolarHBondContact CG2-OE2 3.39Å; T13-E16 PolarHBondContact N-OE2 3.2Å; T13-E16 PolarHBondContact O-N 3.06Å; T13-E16 WeakPolarHBondContact OG1-CB 3.43Å; T13-E16 WeakPolarHBondContact OG1-CG 3.38Å; T13-E16 PolarHBondContact OG1-N 3.01Å; T13-E16 PolarHBondContact OG1-OE2 2.88Å; E16-S18 PolarHBondContact O-N 3.29Å; E16-L19 PolarHBondContact O-N 3.25Å; E16-L19 VanDerWaalsContact O-N 3.13Å
17	W	58.4	Low	53	Low	84 Å²	84	97.8 Å²	97.8	32%	0.318	49%	0.485	S	S	.	.	H	α-helix	trans	-63.6	-30.6	177	-170.2	-99.9	0	0	0	112.2	F12 T13 E15 L19 L20 K25 Y28	F12-W17 HydrophobicContact CB-CB 4.37Å; F12-W17 HydrophobicContact CB-CE3 4.04Å; F12-W17 AromaticContact CD2-CE3 3.71Å; F12-W17 HydrophobicContact CD2-CE3 3.71Å; F12-W17 AromaticContact CD2-CZ3 3.84Å; F12-W17 HydrophobicContact CD2-CZ3 3.84Å; F12-W17 HydrophobicContact CE2-CE3 4.49Å; F12-W17 HydrophobicContact CE2-CZ3 4.33Å; F12-W17 HydrophobicContact CG-CE3 4.07Å; T13-W17 WeakPolarHBondContact O-CB 3.37Å; T13-W17 PolarHBondContact O-N 2.76Å; E15-W17 PolarHBondContact O-N 3.28Å; W17-L19 VanDerWaalsContact C-N 3.27Å; W17-L19 PolarHBondContact O-N 3.42Å; W17-L20 HydrophobicContact CE3-CD1 3.87Å; W17-L20 HydrophobicContact CZ3-CD1 4.14Å; W17-L20 PolarHBondContact O-N 2.9Å; W17-K25 HydrophobicContact CH2-CB 4.29Å; W17-K25 HydrophobicContact CH2-CG 4.12Å; W17-K25 HydrophobicContact CZ2-CB 4.1Å; W17-K25 HydrophobicContact CZ2-CD 4.25Å; W17-K25 HydrophobicContact CZ2-CG 3.78Å; W17-K25 WeakPolarHBondContact O-CE 3.31Å; W17-K25 PolarHBondContact O-NZ 3.37Å; W17-Y28 AromaticContact CH2-CD1 3.35Å; W17-Y28 HydrophobicContact CH2-CD1 3.35Å; W17-Y28 AromaticContact CH2-CE1 3.84Å; W17-Y28 HydrophobicContact CH2-CE1 3.84Å; W17-Y28 AromaticContact CH2-CG 3.99Å; W17-Y28 HydrophobicContact CH2-CG 3.99Å; W17-Y28 AromaticContact CZ3-CD1 3.37Å; W17-Y28 HydrophobicContact CZ3-CD1 3.37Å; W17-Y28 HydrophobicContact CZ3-CD2 4.38Å; W17-Y28 AromaticContact CZ3-CE1 3.64Å; W17-Y28 HydrophobicContact CZ3-CE1 3.64Å; W17-Y28 AromaticContact CZ3-CG 3.73Å; W17-Y28 HydrophobicContact CZ3-CG 3.73Å
18	S	50.3	Low	53.6	Low	84 Å²	84	95 Å²	95	59%	0.587	47%	0.467	S	S	*	.	H	α-helix	trans	-69	-26.9	177.7	79.3	0	0	0	0	113	R14 E15 E16	R14-S18 PolarHBondContact O-N 2.93Å; E15-S18 WeakPolarHBondContact O-CB 3.35Å; E15-S18 PolarHBondContact O-N 3.36Å; E15-S18 PolarHBondContact O-OG 2.83Å; E16-S18 PolarHBondContact O-N 3.29Å
19	L	54.3	Low	53.7	Low	146 Å²	146	98.3 Å²	98.3	76%	0.764	48%	0.48	S	S	*	.	H	α-helix	trans	-84	-14.8	-178.7	-63.2	172.5	0	0	0	113.7	E15 E16 W17	E15-L19 PolarHBondContact O-N 3.32Å; E16-L19 PolarHBondContact O-N 3.25Å; E16-L19 VanDerWaalsContact O-N 3.13Å; W17-L19 VanDerWaalsContact C-N 3.27Å; W17-L19 PolarHBondContact O-N 3.42Å
20	L	58.4	Low	53.8	Low	36 Å²	36	100.9 Å²	100.9	19%	0.188	50%	0.495	C	S	.	.	S	Bend	trans	-77	133.7	178.3	-63	176.6	0	0	0	111.9	F12 W17 Q24 K25	F12-L20 HydrophobicContact CD1-CD1 4.41Å; F12-L20 HydrophobicContact CD2-CD1 4.29Å; F12-L20 HydrophobicContact CE1-CD1 4.16Å; F12-L20 HydrophobicContact CE2-CD1 4.02Å; F12-L20 HydrophobicContact CG-CD1 4.46Å; F12-L20 HydrophobicContact CZ-CD1 3.96Å; W17-L20 HydrophobicContact CE3-CD1 3.87Å; W17-L20 HydrophobicContact CZ3-CD1 4.14Å; W17-L20 PolarHBondContact O-N 2.9Å; L20-Q24 HydrophobicContact CB-CB 4.24Å; L20-Q24 HydrophobicContact CD2-CB 4.23Å; L20-K25 HydrophobicContact CB-CD 4.49Å; L20-K25 HydrophobicContact CB-CG 3.87Å; L20-K25 VanDerWaalsContact O-CE 3.29Å; L20-K25 WeakPolarHBondContact O-CE 3.46Å; L20-K25 PolarHBondContact O-NZ 3.43Å
21	D	60.7	Low	53.8	Low	66 Å²	66	98.8 Å²	98.8	35%	0.353	49%	0.487	S	S	.	.			trans	-74.6	164.8	175.2	81	61.7	0	0	0	111.7	S23 Q24 K25	D21-S23 PolarHBondContact O-N 3.28Å; D21-S23 VanDerWaalsContact O-N 3.16Å; D21-S23 WeakPolarHBondContact OD1-CA 3.37Å; D21-S23 VanDerWaalsContact OD1-CB 3.32Å; D21-S23 WeakPolarHBondContact OD1-CB 3.29Å; D21-S23 PolarHBondContact OD1-N 3.13Å; D21-S23 PolarHBondContact OD1-OG 3.29Å; D21-Q24 VanDerWaalsContact N-OE1 3.14Å; D21-Q24 PolarHBondContact O-N 2.77Å; D21-Q24 VanDerWaalsContact O-N 3.15Å; D21-Q24 PolarHBondContact OD1-N 3.34Å; D21-Q24 WeakPolarHBondContact OD2-CG 3.42Å; D21-Q24 PolarHBondContact OD2-OE1 2.91Å; D21-K25 PolarHBondContact O-N 2.98Å
22	P	56.4	Low	54.8	Low	108 Å²	108	93.4 Å²	93.4	70%	0.701	46%	0.462	S	S	*	.	H	α-helix	trans	-59.1	-28.4	-175.5	-25.3	35.2	0	0	0	115.2	R26	P22-R26 WeakPolarHBondContact O-CB 3.16Å; P22-R26 PolarHBondContact O-N 3.27Å
23	S	50.5	Low	55	Low	79 Å²	79	93.5 Å²	93.5	55%	0.552	47%	0.466	S	S	*	.	H	α-helix	trans	-76.8	-37	178.4	70.9	0	0	0	0	111.8	D21 R26 L27	D21-S23 PolarHBondContact O-N 3.28Å; D21-S23 VanDerWaalsContact O-N 3.16Å; D21-S23 WeakPolarHBondContact OD1-CA 3.37Å; D21-S23 VanDerWaalsContact OD1-CB 3.32Å; D21-S23 WeakPolarHBondContact OD1-CB 3.29Å; D21-S23 PolarHBondContact OD1-N 3.13Å; D21-S23 PolarHBondContact OD1-OG 3.29Å; S23-R26 PolarHBondContact O-N 3.41Å; S23-L27 WeakPolarHBondContact O-CB 3.29Å; S23-L27 PolarHBondContact O-N 2.96Å
24	Q	51.5	Low	55.3	Low	88 Å²	88	95.6 Å²	95.6	41%	0.411	47%	0.471	S	S	.	.	H	α-helix	trans	-68.8	-40	174.4	-66.3	174.3	-28.3	0	0	112	L20 D21 R26 L27 Y28	L20-Q24 HydrophobicContact CB-CB 4.24Å; L20-Q24 HydrophobicContact CD2-CB 4.23Å; D21-Q24 VanDerWaalsContact N-OE1 3.14Å; D21-Q24 PolarHBondContact O-N 2.77Å; D21-Q24 VanDerWaalsContact O-N 3.15Å; D21-Q24 PolarHBondContact OD1-N 3.34Å; D21-Q24 WeakPolarHBondContact OD2-CG 3.42Å; D21-Q24 PolarHBondContact OD2-OE1 2.91Å; Q24-R26 VanDerWaalsContact C-N 3.31Å; Q24-R26 PolarHBondContact O-N 3.46Å; Q24-L27 PolarHBondContact O-N 3.44Å; Q24-Y28 PolarHBondContact O-N 3.34Å
25	K	62.4	Low	56	Low	53 Å²	53	87.1 Å²	87.1	23%	0.23	44%	0.442	C	S	.	.	H	α-helix	trans	-62.6	-38.3	173.8	-73.4	173.5	166.9	140.3	0	112.3	W17 L20 D21 Q29	W17-K25 HydrophobicContact CH2-CB 4.29Å; W17-K25 HydrophobicContact CH2-CG 4.12Å; W17-K25 HydrophobicContact CZ2-CB 4.1Å; W17-K25 HydrophobicContact CZ2-CD 4.25Å; W17-K25 HydrophobicContact CZ2-CG 3.78Å; W17-K25 WeakPolarHBondContact O-CE 3.31Å; W17-K25 PolarHBondContact O-NZ 3.37Å; L20-K25 HydrophobicContact CB-CD 4.49Å; L20-K25 HydrophobicContact CB-CG 3.87Å; L20-K25 VanDerWaalsContact O-CE 3.29Å; L20-K25 WeakPolarHBondContact O-CE 3.46Å; L20-K25 PolarHBondContact O-NZ 3.43Å; D21-K25 PolarHBondContact O-N 2.98Å; K25-Q29 WeakPolarHBondContact O-CG 3.41Å; K25-Q29 PolarHBondContact O-N 3.36Å; K25-Q29 VanDerWaalsContact O-N 3.12Å
26	R	52	Low	56.5	Low	167 Å²	167	87.4 Å²	87.4	63%	0.63	44%	0.438	S	S	*	.	H	α-helix	trans	-70.6	-40.6	176.5	-173.1	170	-80.7	154	-5.6	111.6	P22 S23 Q24 Y28 Q29 D30	P22-R26 WeakPolarHBondContact O-CB 3.16Å; P22-R26 PolarHBondContact O-N 3.27Å; S23-R26 PolarHBondContact O-N 3.41Å; Q24-R26 VanDerWaalsContact C-N 3.31Å; Q24-R26 PolarHBondContact O-N 3.46Å; R26-Y28 VanDerWaalsContact C-N 3.34Å; R26-Y28 PolarHBondContact O-N 3.08Å; R26-Q29 PolarHBondContact O-N 3.1Å; R26-D30 PolarHBondContact O-N 2.99Å
27	L	54.2	Low	56.9	Low	112 Å²	112	90.1 Å²	90.1	59%	0.586	44%	0.444	S	S	*	.	H	α-helix	trans	-60.9	-42.8	173.5	-177.3	63.6	0	0	0	111.6	S23 Q24 Q29 D30 V31	S23-L27 WeakPolarHBondContact O-CB 3.29Å; S23-L27 PolarHBondContact O-N 2.96Å; Q24-L27 PolarHBondContact O-N 3.44Å; L27-Q29 VanDerWaalsContact C-N 3.35Å; L27-Q29 PolarHBondContact O-N 3.35Å; L27-D30 PolarHBondContact O-N 3.25Å; L27-V31 HydrophobicContact CD1-CG2 4.19Å; L27-V31 HydrophobicContact CG-CG2 4.41Å; L27-V31 WeakPolarHBondContact O-CB 3.42Å; L27-V31 VanDerWaalsContact O-CG2 3.25Å; L27-V31 WeakPolarHBondContact O-CG2 3.44Å; L27-V31 PolarHBondContact O-N 3.45Å
28	Y	64.9	Low	56.7	Low	44 Å²	44	89.9 Å²	89.9	17%	0.173	45%	0.449	C	S	.	.	H	α-helix	trans	-59.6	-44.6	174.6	175.9	-95.5	0	0	0	112.2	H9 I10 F12 W17 Q24 R26 D30 V31 M32	H9-Y28 PolarHBondContact NE2-OH 3.08Å; I10-Y28 HydrophobicContact CB-CE2 4.29Å; I10-Y28 VanDerWaalsContact O-CE2 3.28Å; I10-Y28 WeakPolarHBondContact O-CE2 3.41Å; I10-Y28 PolarHBondContact O-OH 2.82Å; F12-Y28 AromaticContact CD2-CD2 3.99Å; F12-Y28 HydrophobicContact CD2-CD2 3.99Å; F12-Y28 AromaticContact CD2-CE2 3.7Å; F12-Y28 HydrophobicContact CD2-CE2 3.7Å; F12-Y28 AromaticContact CE2-CD2 3.47Å; F12-Y28 HydrophobicContact CE2-CD2 3.47Å; F12-Y28 VanDerWaalsContact CE2-CD2 3.47Å; F12-Y28 AromaticContact CE2-CE2 3.58Å; F12-Y28 HydrophobicContact CE2-CE2 3.58Å; F12-Y28 HydrophobicContact CE2-CG 4.22Å; W17-Y28 AromaticContact CH2-CD1 3.35Å; W17-Y28 HydrophobicContact CH2-CD1 3.35Å; W17-Y28 AromaticContact CH2-CE1 3.84Å; W17-Y28 HydrophobicContact CH2-CE1 3.84Å; W17-Y28 AromaticContact CH2-CG 3.99Å; W17-Y28 HydrophobicContact CH2-CG 3.99Å; W17-Y28 AromaticContact CZ3-CD1 3.37Å; W17-Y28 HydrophobicContact CZ3-CD1 3.37Å; W17-Y28 HydrophobicContact CZ3-CD2 4.38Å; W17-Y28 AromaticContact CZ3-CE1 3.64Å; W17-Y28 HydrophobicContact CZ3-CE1 3.64Å; W17-Y28 AromaticContact CZ3-CG 3.73Å; W17-Y28 HydrophobicContact CZ3-CG 3.73Å; Q24-Y28 PolarHBondContact O-N 3.34Å; R26-Y28 VanDerWaalsContact C-N 3.34Å; R26-Y28 PolarHBondContact O-N 3.08Å; Y28-D30 PolarHBondContact O-N 3.31Å; Y28-V31 PolarHBondContact O-N 3Å; Y28-M32 HydrophobicContact CD1-CG 4.2Å; Y28-M32 HydrophobicContact CD2-CG 4.19Å; Y28-M32 HydrophobicContact CE1-CG 3.89Å; Y28-M32 HydrophobicContact CE2-CE 4.26Å; Y28-M32 HydrophobicContact CE2-CG 3.88Å; Y28-M32 HydrophobicContact CE2-SD 4.23Å; Y28-M32 HydrophobicContact CG-CG 4.4Å; Y28-M32 WeakPolarHBondContact O-CB 3.44Å; Y28-M32 VanDerWaalsContact O-CG 3.32Å; Y28-M32 WeakPolarHBondContact O-CG 3.25Å; Y28-M32 PolarHBondContact O-N 2.88Å
29	Q	57.9	Low	57	Low	121 Å²	121	87.6 Å²	87.6	57%	0.565	43%	0.431	S	S	*	.	H	α-helix	trans	-61.4	-43.4	176.2	-73.7	175.3	-19.1	0	0	112.2	K25 R26 L27 L33	K25-Q29 WeakPolarHBondContact O-CG 3.41Å; K25-Q29 PolarHBondContact O-N 3.36Å; K25-Q29 VanDerWaalsContact O-N 3.12Å; R26-Q29 PolarHBondContact O-N 3.1Å; L27-Q29 VanDerWaalsContact C-N 3.35Å; L27-Q29 PolarHBondContact O-N 3.35Å; Q29-L33 VanDerWaalsContact O-CB 3.29Å; Q29-L33 WeakPolarHBondContact O-CB 3.48Å; Q29-L33 PolarHBondContact O-N 3.31Å
30	D	55.3	Low	56.9	Low	97 Å²	97	83.7 Å²	83.7	52%	0.519	41%	0.413	S	S	.	.	H	α-helix	trans	-64.7	-42.7	179.5	-71.3	-23.6	0	0	0	111.4	R26 L27 Y28 L33 E34	R26-D30 PolarHBondContact O-N 2.99Å; L27-D30 PolarHBondContact O-N 3.25Å; Y28-D30 PolarHBondContact O-N 3.31Å; D30-L33 PolarHBondContact O-N 3.44Å; D30-E34 WeakPolarHBondContact O-CB 3.46Å; D30-E34 PolarHBondContact O-N 3.17Å
31	V	53.8	Low	56.6	Low	53 Å²	53	87.5 Å²	87.5	32%	0.321	44%	0.438	S	S	.	.	H	α-helix	trans	-69.4	-41.8	179.5	175.6	0	0	0	0	111.8	L27 Y28 L33 E34 N35	L27-V31 HydrophobicContact CD1-CG2 4.19Å; L27-V31 HydrophobicContact CG-CG2 4.41Å; L27-V31 WeakPolarHBondContact O-CB 3.42Å; L27-V31 VanDerWaalsContact O-CG2 3.25Å; L27-V31 WeakPolarHBondContact O-CG2 3.44Å; L27-V31 PolarHBondContact O-N 3.45Å; Y28-V31 PolarHBondContact O-N 3Å; V31-L33 VanDerWaalsContact C-N 3.32Å; V31-L33 PolarHBondContact O-N 3.02Å; V31-E34 PolarHBondContact O-N 2.85Å; V31-N35 PolarHBondContact O-N 3.22Å
32	M	72.4	Confident	56	Low	21 Å²	21	90.3 Å²	90.3	10%	0.103	45%	0.452	C	S	.	.	H	α-helix	trans	-66.6	-35.8	176.7	-68.6	-59.5	109.7	0	0	111.8	I10 Y28 E34 N35 Y36	I10-M32 HydrophobicContact CB-CE 4.34Å; I10-M32 HydrophobicContact CD1-CE 4.45Å; I10-M32 HydrophobicContact CG1-CE 4.33Å; Y28-M32 HydrophobicContact CD1-CG 4.2Å; Y28-M32 HydrophobicContact CD2-CG 4.19Å; Y28-M32 HydrophobicContact CE1-CG 3.89Å; Y28-M32 HydrophobicContact CE2-CE 4.26Å; Y28-M32 HydrophobicContact CE2-CG 3.88Å; Y28-M32 HydrophobicContact CE2-SD 4.23Å; Y28-M32 HydrophobicContact CG-CG 4.4Å; Y28-M32 WeakPolarHBondContact O-CB 3.44Å; Y28-M32 VanDerWaalsContact O-CG 3.32Å; Y28-M32 WeakPolarHBondContact O-CG 3.25Å; Y28-M32 PolarHBondContact O-N 2.88Å; M32-E34 VanDerWaalsContact C-N 3.34Å; M32-N35 PolarHBondContact O-N 3.28Å; M32-Y36 WeakPolarHBondContact O-CB 3.3Å; M32-Y36 PolarHBondContact O-N 2.59Å
33	L	58.8	Low	55.4	Low	85 Å²	85	88.2 Å²	88.2	45%	0.445	45%	0.45	S	S	.	.	H	α-helix	trans	-68.4	-34.8	174.5	-155.8	85.9	0	0	0	111.9	Q29 D30 V31 R37	Q29-L33 VanDerWaalsContact O-CB 3.29Å; Q29-L33 WeakPolarHBondContact O-CB 3.48Å; Q29-L33 PolarHBondContact O-N 3.31Å; D30-L33 PolarHBondContact O-N 3.44Å; V31-L33 VanDerWaalsContact C-N 3.32Å; V31-L33 PolarHBondContact O-N 3.02Å; L33-R37 VanDerWaalsContact O-CG 3.27Å; L33-R37 WeakPolarHBondContact O-CG 3.45Å; L33-R37 PolarHBondContact O-N 3.45Å
34	E	56.5	Low	54.9	Low	113 Å²	113	91.4 Å²	91.4	53%	0.528	45%	0.45	S	S	.	.	H	α-helix	trans	-69.3	-42.8	174.4	-171.5	168	-169.8	0	0	111.5	D30 V31 M32 Y36 R37 N38	D30-E34 WeakPolarHBondContact O-CB 3.46Å; D30-E34 PolarHBondContact O-N 3.17Å; V31-E34 PolarHBondContact O-N 2.85Å; M32-E34 VanDerWaalsContact C-N 3.34Å; E34-Y36 VanDerWaalsContact C-N 3.34Å; E34-Y36 PolarHBondContact O-N 3.07Å; E34-R37 PolarHBondContact O-N 3.48Å; E34-N38 WeakPolarHBondContact O-CB 3.35Å; E34-N38 PolarHBondContact O-N 3.05Å; E34-N38 PolarHBondContact O-ND2 2.87Å
35	N	53.9	Low	54.2	Low	44 Å²	44	94.3 Å²	94.3	24%	0.235	47%	0.469	C	S	.	.	H	α-helix	trans	-60.3	-42.9	173.4	-74.4	-6.5	0	0	0	111.7	V8 V31 M32 R37 N38 L39	V8-N35 PolarHBondContact O-ND2 3.11Å; V31-N35 PolarHBondContact O-N 3.22Å; M32-N35 PolarHBondContact O-N 3.28Å; N35-R37 PolarHBondContact O-N 3.47Å; N35-N38 PolarHBondContact O-N 3.45Å; N35-L39 WeakPolarHBondContact O-CG 3.38Å; N35-L39 PolarHBondContact O-N 3.25Å
36	Y	55.8	Low	52.8	Low	140 Å²	140	102.3 Å²	102.3	55%	0.549	50%	0.498	S	S	.	.	H	α-helix	trans	-60.1	-44.4	173.6	174.5	-98	0	0	0	112.6	M32 E34 N38 L39 T40	M32-Y36 WeakPolarHBondContact O-CB 3.3Å; M32-Y36 PolarHBondContact O-N 2.59Å; E34-Y36 VanDerWaalsContact C-N 3.34Å; E34-Y36 PolarHBondContact O-N 3.07Å; Y36-N38 VanDerWaalsContact C-N 3.33Å; Y36-N38 PolarHBondContact O-N 3Å; Y36-L39 PolarHBondContact O-N 3.41Å; Y36-T40 HydrophobicContact CE1-CG2 4.28Å; Y36-T40 HydrophobicContact CE2-CG2 4.24Å; Y36-T40 PolarHBondContact O-N 2.6Å; Y36-T40 PolarHBondContact O-OG1 2.83Å
37	R	56.5	Low	51.7	Low	151 Å²	151	102.2 Å²	102.2	57%	0.57	50%	0.502	S	S	*	.	H	α-helix	trans	-64.9	-37.9	176.8	-75.2	171.8	179.6	173.8	2.8	112.1	L33 E34 N35 T40 T41	L33-R37 VanDerWaalsContact O-CG 3.27Å; L33-R37 WeakPolarHBondContact O-CG 3.45Å; L33-R37 PolarHBondContact O-N 3.45Å; E34-R37 PolarHBondContact O-N 3.48Å; N35-R37 PolarHBondContact O-N 3.47Å; R37-T40 VanDerWaalsContact CA-OG1 3.3Å; R37-T40 WeakPolarHBondContact CA-OG1 3.27Å; R37-T40 PolarHBondContact O-OG1 3.16Å; R37-T41 WeakPolarHBondContact O-CB 3.44Å; R37-T41 PolarHBondContact O-N 3.13Å; R37-T41 PolarHBondContact O-OG1 3.2Å
38	N	54.5	Low	50.5	Low	79 Å²	79	103.6 Å²	103.6	42%	0.422	51%	0.51	S	S	.	.	H	α-helix	trans	-68.5	-42.3	178.8	-69.5	-24.6	0	0	0	111.3	E34 N35 Y36 T41 I42	E34-N38 WeakPolarHBondContact O-CB 3.35Å; E34-N38 PolarHBondContact O-N 3.05Å; E34-N38 PolarHBondContact O-ND2 2.87Å; N35-N38 PolarHBondContact O-N 3.45Å; Y36-N38 VanDerWaalsContact C-N 3.33Å; Y36-N38 PolarHBondContact O-N 3Å; N38-T41 PolarHBondContact O-N 2.77Å; N38-I42 WeakPolarHBondContact O-CD1 3.48Å; N38-I42 VanDerWaalsContact O-CG1 3.3Å; N38-I42 WeakPolarHBondContact O-CG1 3.23Å; N38-I42 PolarHBondContact O-N 3.39Å
39	L	55.1	Low	48.6	Very low	37 Å²	37	108.7 Å²	108.7	19%	0.194	54%	0.535	C	S	.	.	H	α-helix	trans	-65.1	-39.7	176.5	-73.9	169.4	0	0	0	113	F5 V8 N35 Y36 T41 I42	F5-L39 HydrophobicContact CB-CD1 4.28Å; F5-L39 HydrophobicContact CD2-CD1 3.65Å; F5-L39 HydrophobicContact CG-CD1 4.45Å; V8-L39 HydrophobicContact CG2-CD1 3.74Å; N35-L39 WeakPolarHBondContact O-CG 3.38Å; N35-L39 PolarHBondContact O-N 3.25Å; Y36-L39 PolarHBondContact O-N 3.41Å; L39-T41 VanDerWaalsContact C-N 3.3Å; L39-T41 PolarHBondContact O-N 3.36Å; L39-I42 PolarHBondContact O-N 3.01Å
40	T	52.8	Low	47.3	Very low	64 Å²	64	110.2 Å²	110.2	39%	0.393	55%	0.547	S	S	.	.	H	α-helix	trans	-68.9	-27.4	174.5	45.8	0	0	0	0	113	Y36 R37 I42 G43	Y36-T40 HydrophobicContact CE1-CG2 4.28Å; Y36-T40 HydrophobicContact CE2-CG2 4.24Å; Y36-T40 PolarHBondContact O-N 2.6Å; Y36-T40 PolarHBondContact O-OG1 2.83Å; R37-T40 VanDerWaalsContact CA-OG1 3.3Å; R37-T40 WeakPolarHBondContact CA-OG1 3.27Å; R37-T40 PolarHBondContact O-OG1 3.16Å; T40-I42 VanDerWaalsContact C-N 3.34Å; T40-G43 PolarHBondContact O-N 3.39Å
41	T	52.2	Low	45.9	Very low	116 Å²	116	111.4 Å²	111.4	71%	0.712	55%	0.552	S	S	*	*	H	α-helix	trans	-74.4	-22.6	175.8	-55.6	0	0	0	0	112.8	R37 N38 L39 G43	R37-T41 WeakPolarHBondContact O-CB 3.44Å; R37-T41 PolarHBondContact O-N 3.13Å; R37-T41 PolarHBondContact O-OG1 3.2Å; N38-T41 PolarHBondContact O-N 2.77Å; L39-T41 VanDerWaalsContact C-N 3.3Å; L39-T41 PolarHBondContact O-N 3.36Å; T41-G43 PolarHBondContact O-N 3.12Å
42	I	48.6	Very low	44.6	Very low	125 Å²	125	117.9 Å²	117.9	64%	0.641	58%	0.579	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.6	6.3	178.9	-59.1	159.7	0	0	0	111.8	N38 L39 T40 Y44	N38-I42 WeakPolarHBondContact O-CD1 3.48Å; N38-I42 VanDerWaalsContact O-CG1 3.3Å; N38-I42 WeakPolarHBondContact O-CG1 3.23Å; N38-I42 PolarHBondContact O-N 3.39Å; L39-I42 PolarHBondContact O-N 3.01Å; T40-I42 VanDerWaalsContact C-N 3.34Å; I42-Y44 HydrophobicContact CG2-CE2 4.5Å
43	G	43.5	Very low	42.3	Very low	64 Å²	64	124.9 Å²	124.9	66%	0.66	61%	0.611	S	S	*	*	T	Hydrogen-bonded Turn	trans	92.2	14.4	167.1	0	0	0	0	0	115.5	T40 T41 N45	T40-G43 PolarHBondContact O-N 3.39Å; T41-G43 PolarHBondContact O-N 3.12Å; G43-N45 PolarHBondContact O-N 2.94Å
44	Y	41.2	Very low	40.6	Very low	145 Å²	145	129.5 Å²	129.5	57%	0.569	63%	0.63	S	S	*	*			trans	-77.1	103.8	168.6	-72.7	-81.7	0	0	0	109.8	I42	I42-Y44 HydrophobicContact CG2-CE2 4.5Å
45	N	35.2	Very low	39.1	Very low	149 Å²	149	127.4 Å²	127.4	80%	0.797	63%	0.628	S	S	*	*			trans	-90.4	120.7	170.5	-155.5	0.7	0	0	0	107.7	G43 K47	G43-N45 PolarHBondContact O-N 2.94Å; N45-K47 PolarHBondContact O-N 3.17Å
46	W	34.2	Very low	37.9	Very low	221 Å²	221	133 Å²	133	84%	0.837	65%	0.653	S	S	*	*			trans	-64.7	106.5	171.2	-175	-95.1	0	0	0	107.3	D48	W46-D48 PolarHBondContact O-N 3.42Å
47	K	28	Very low	36.3	Very low	165 Å²	165	133.4 Å²	133.4	72%	0.717	66%	0.664	S	S	*	*			trans	-68.7	116.1	168.5	-74.9	-177.2	177.7	179.3	0	106.5	N45 H49	N45-K47 PolarHBondContact O-N 3.17Å; K47-H49 PolarHBondContact O-N 3.2Å
48	D	28.5	Very low	34.8	Very low	141 Å²	141	132.6 Å²	132.6	75%	0.754	67%	0.672	S	S	*	*			trans	-53	94	159.1	-80.1	-35.5	0	0	0	108.4	W46 N50	W46-D48 PolarHBondContact O-N 3.42Å; D48-N50 VanDerWaalsContact C-N 3.35Å; D48-N50 PolarHBondContact O-N 2.97Å
49	H	26.8	Very low	33.4	Very low	152 Å²	152	140.7 Å²	140.7	70%	0.704	70%	0.696	S	S	*	*			trans	-87.1	89.4	150.8	-79.9	-65.7	0	0	0	106.4	K47 I51	K47-H49 PolarHBondContact O-N 3.2Å; H49-I51 HydrophobicContact CB-CG1 4.45Å; H49-I51 PolarHBondContact O-N 2.95Å
50	N	30.2	Very low	32	Very low	152 Å²	152	148.4 Å²	148.4	81%	0.813	72%	0.723	S	S	*	*			trans	-55	119.2	147.1	-93.1	-28.8	0	0	0	107.1	D48	D48-N50 VanDerWaalsContact C-N 3.35Å; D48-N50 PolarHBondContact O-N 2.97Å
51	I	25.4	Very low	30.7	Very low	123 Å²	123	155.7 Å²	155.7	63%	0.631	75%	0.745	S	S	*	*			trans	-136.5	73.4	157.1	-52.3	179.3	0	0	0	106.4	H49 E53	H49-I51 HydrophobicContact CB-CG1 4.45Å; H49-I51 PolarHBondContact O-N 2.95Å; I51-E53 WeakPolarHBondContact CG2-O 3.46Å
52	E	25.8	Very low	29.4	Very low	188 Å²	188	153.5 Å²	153.5	88%	0.879	75%	0.745	S	S	*	*				-70	134.5	128.7	-93.9	-178.9	163.9	0	0	105.9
53	E	24.6	Very low	28.2	Very low	168 Å²	168	158.2 Å²	158.2	79%	0.785	76%	0.755	S	S	*	*			trans	85.7	74.3	-173.1	-59	-166.4	146.5	0	0	117.1	I51	I51-E53 WeakPolarHBondContact CG2-O 3.46Å
54	H	22.8	Very low	27.4	Very low	182 Å²	182	162.1 Å²	162.1	84%	0.843	76%	0.756	S	S	*	*				-134.7	92.9	104	-122.8	-39.4	0	0	0	109.4
55	S	26.2	Very low	26.5	Very low	70 Å²	70	161.8 Å²	161.8	49%	0.49	76%	0.759	S	S	.	*			trans	-63	154.5	151.6	54.7	0	0	0	0	108.9
56	Q	28.5	Very low	26	Very low	162 Å²	162	164.3 Å²	164.3	76%	0.757	76%	0.757	S	S	*	*			trans	78.7	96	163.4	-57.6	163.2	-3.7	0	0	116.1
57	N	22.7	Very low	25.5	Very low	147 Å²	147	159.1 Å²	159.1	79%	0.786	76%	0.755	S	S	*	*				-166.8	129.4	108.9	-90.9	-28.7	0	0	0	112.7
58	D	23.5	Very low	25.8	Very low	135 Å²	135	156.8 Å²	156.8	72%	0.722	76%	0.757	S	S	*	*			trans	62.9	87.5	147	-67.7	-41.4	0	0	0	121	R60	D58-R60 PolarHBondContact O-N 3.41Å
59	R	25.7	Very low	25.9	Very low	248 Å²	248	155.7 Å²	155.7	94%	0.936	76%	0.76	S	S	*	*				-63.1	107.4	123.4	-79.6	178.7	175.2	162.6	-0.8	109.7
60	R	25.9	Very low	25.8	Very low	199 Å²	199	152.7 Å²	152.7	75%	0.751	76%	0.762	S	S	*	*			trans	-167.1	132.5	143.2	-116	178.3	-158.5	-159.8	7.1	112.9	D58	D58-R60 PolarHBondContact O-N 3.41Å
61	Y	25.5	Very low	25.9	Very low	218 Å²	218	153.9 Å²	153.9	86%	0.855	76%	0.762	S	S	*	*			trans	70.3	132.9	175.5	-57.5	-83.7	0	0	0	115.7
62	G	23.9	Very low	25.9	Very low	70 Å²	70	157.7 Å²	157.7	72%	0.722	77%	0.774	S	S	*	*			cis	139.2	92.2	8.2	0	0	0	0	0	110.4
63	R	24.4	Very low	25.9	Very low	223 Å²	223	153.3 Å²	153.3	84%	0.842	76%	0.762	S	S	*	*			trans	66.6	140.9	145.5	-133.5	176.8	-150.2	-157.3	13.7	122.6
64	H	25.9	Very low	26.2	Very low	147 Å²	147	154.1 Å²	154.1	68%	0.681	76%	0.76	S	S	*	*			trans	79.1	135.4	163.4	-65.2	-68.9	0	0	0	117
65	E	23.1	Very low	26.8	Very low	137 Å²	137	153.4 Å²	153.4	64%	0.64	76%	0.756	S	S	*	*			cis	-161.6	151.5	11.2	-120.9	-171.3	141.4	0	0	111
66	R	24.5	Very low	27.1	Very low	202 Å²	202	159.3 Å²	159.3	76%	0.762	77%	0.77	S	S	*	*			trans	63.6	103.4	155.3	-68.7	177	-146.1	-156.5	5.5	122.9
67	S	24	Very low	27.5	Very low	113 Å²	113	154.9 Å²	154.9	79%	0.79	75%	0.753	S	S	*	*				37.2	152.1	128.1	-48.5	0	0	0	0	122.9
68	P	34.4	Very low	28.1	Very low	115 Å²	115	155.8 Å²	155.8	75%	0.747	75%	0.753	S	S	*	*			cis	-134.8	174.6	-37	37.2	-19.5	0	0	0	113.8
69	S	30.3	Very low	28.5	Very low	118 Å²	118	158 Å²	158	83%	0.825	75%	0.751	S	S	*	*			trans	75.2	85.2	158.4	73.3	0	0	0	0	118.8
70	A	25.5	Very low	28.9	Very low	90 Å²	90	150.9 Å²	150.9	74%	0.744	73%	0.732	S	S	*	*			trans	-156.1	125.3	143.1	0	0	0	0	0	110.6
71	E	31.1	Very low	29.4	Very low	176 Å²	176	150.1 Å²	150.1	82%	0.822	73%	0.734	S	S	*	*			trans	61.1	129.6	146.1	-61.6	179.9	173.5	0	0	121.3
72	K	24.8	Very low	29.7	Very low	203 Å²	203	142.7 Å²	142.7	88%	0.883	72%	0.718	S	S	*	*				-150.9	142.4	110	-102.9	170.9	-166.5	-173.1	0	112.1
73	P	27.2	Very low	30.2	Very low	97 Å²	97	145 Å²	145	63%	0.63	71%	0.708	S	S	*	*			trans	-85.6	138.8	-164.8	-8.6	28.8	0	0	0	112.6	E75	P73-E75 PolarHBondContact O-N 3.27Å
74	Y	30.1	Very low	30.7	Very low	185 Å²	185	142.3 Å²	142.3	73%	0.725	70%	0.703	S	S	*	*			trans	-73.9	66.2	165.4	177.4	-97.7	0	0	0	109.2	T77	Y74-T77 WeakPolarHBondContact CD2-OG1 3.49Å; Y74-T77 VanDerWaalsContact CE1-OG1 3.31Å; Y74-T77 WeakPolarHBondContact CE1-OG1 3.45Å; Y74-T77 HydrophobicContact CE2-CG2 4.21Å; Y74-T77 WeakPolarHBondContact CE2-OG1 3.2Å; Y74-T77 PolarHBondContact OH-OG1 3.47Å
75	E	35.4	Very low	31.1	Very low	166 Å²	166	143.7 Å²	143.7	78%	0.776	70%	0.703	S	S	*	*			trans	-94.6	1.1	171.1	-109.7	-173.6	158.5	0	0	112.8	P73	P73-E75 PolarHBondContact O-N 3.27Å
76	Y	32.3	Very low	31.8	Very low	195 Å²	195	142.9 Å²	142.9	77%	0.765	70%	0.699	S	S	*	*	S	Bend	trans	-102.6	6.1	-165.6	-157.5	-106.5	0	0	0	116.7
77	T	36.7	Very low	32.1	Very low	68 Å²	68	136.7 Å²	136.7	42%	0.417	69%	0.687	S	S	.	*	S	Bend	trans	-136.2	-6.9	-172.7	46.2	0	0	0	0	115.3	Y74	Y74-T77 WeakPolarHBondContact CD2-OG1 3.49Å; Y74-T77 VanDerWaalsContact CE1-OG1 3.31Å; Y74-T77 WeakPolarHBondContact CE1-OG1 3.45Å; Y74-T77 HydrophobicContact CE2-CG2 4.21Å; Y74-T77 WeakPolarHBondContact CE2-OG1 3.2Å; Y74-T77 PolarHBondContact OH-OG1 3.47Å
78	Q	35.3	Very low	32.7	Very low	167 Å²	167	137.5 Å²	137.5	78%	0.78	68%	0.678	S	S	*	*	S	Bend	trans	-91	-20.3	171.9	-147.9	166.6	0.7	0	0	112.8
79	W	32.8	Very low	32.7	Very low	180 Å²	180	135.9 Å²	135.9	68%	0.682	66%	0.662	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80	-22	179.5	-125.8	78.7	0	0	0	114.4	K81 A82 F83	W79-K81 VanDerWaalsContact C-N 3.33Å; W79-K81 PolarHBondContact O-N 3.03Å; W79-A82 PolarHBondContact O-N 3.04Å; W79-F83 AromaticContact CE3-CD2 3.6Å; W79-F83 HydrophobicContact CE3-CD2 3.6Å; W79-F83 AromaticContact CE3-CE2 3.71Å; W79-F83 HydrophobicContact CE3-CE2 3.71Å; W79-F83 HydrophobicContact CH2-CD2 4.14Å; W79-F83 AromaticContact CH2-CE2 3.4Å; W79-F83 HydrophobicContact CH2-CE2 3.4Å; W79-F83 HydrophobicContact CH2-CZ 4.22Å; W79-F83 HydrophobicContact CZ2-CE2 4.45Å; W79-F83 AromaticContact CZ3-CD2 3.38Å; W79-F83 HydrophobicContact CZ3-CD2 3.38Å; W79-F83 AromaticContact CZ3-CE2 2.95Å; W79-F83 HydrophobicContact CZ3-CE2 2.95Å; W79-F83 AromaticContact CZ3-CZ 3.81Å; W79-F83 HydrophobicContact CZ3-CZ 3.81Å; W79-F83 PolarHBondContact O-N 3.5Å
80	N	34	Very low	32.9	Very low	100 Å²	100	136.8 Å²	136.8	54%	0.535	65%	0.654	S	S	.	*	H	α-helix	trans	-76.3	-10.4	-179.8	-90.5	-43.9	0	0	0	115.1
81	K	35.8	Very low	33.4	Very low	182 Å²	182	140.4 Å²	140.4	79%	0.791	65%	0.653	S	S	*	*	H	α-helix	trans	-88.8	-24.8	172	-80.7	-177.9	178.2	176.2	0	113.2	W79	W79-K81 VanDerWaalsContact C-N 3.33Å; W79-K81 PolarHBondContact O-N 3.03Å
82	A	32.9	Very low	33.6	Very low	63 Å²	63	136.7 Å²	136.7	52%	0.521	64%	0.638	S	S	.	*	H	α-helix	trans	-76.7	-35.8	174.8	0	0	0	0	0	111.9	W79 Y85 H86	W79-A82 PolarHBondContact O-N 3.04Å; A82-Y85 PolarHBondContact O-N 3.3Å; A82-H86 PolarHBondContact O-N 3.47Å
83	F	33.4	Very low	33.9	Very low	117 Å²	117	134.4 Å²	134.4	51%	0.513	63%	0.63	S	S	.	*	H	α-helix	trans	-72.8	-29.8	178.7	-103.5	-100.6	0	0	0	114.8	W79 Y85 H86 S87	W79-F83 AromaticContact CE3-CD2 3.6Å; W79-F83 HydrophobicContact CE3-CD2 3.6Å; W79-F83 AromaticContact CE3-CE2 3.71Å; W79-F83 HydrophobicContact CE3-CE2 3.71Å; W79-F83 HydrophobicContact CH2-CD2 4.14Å; W79-F83 AromaticContact CH2-CE2 3.4Å; W79-F83 HydrophobicContact CH2-CE2 3.4Å; W79-F83 HydrophobicContact CH2-CZ 4.22Å; W79-F83 HydrophobicContact CZ2-CE2 4.45Å; W79-F83 AromaticContact CZ3-CD2 3.38Å; W79-F83 HydrophobicContact CZ3-CD2 3.38Å; W79-F83 AromaticContact CZ3-CE2 2.95Å; W79-F83 HydrophobicContact CZ3-CE2 2.95Å; W79-F83 AromaticContact CZ3-CZ 3.81Å; W79-F83 HydrophobicContact CZ3-CZ 3.81Å; W79-F83 PolarHBondContact O-N 3.5Å; F83-Y85 VanDerWaalsContact C-N 3.27Å; F83-Y85 PolarHBondContact O-N 3.37Å; F83-H86 PolarHBondContact O-N 3.24Å; F83-S87 PolarHBondContact O-N 2.89Å; F83-S87 VanDerWaalsContact O-N 3.1Å
84	K	35.9	Very low	34.1	Very low	168 Å²	168	140.1 Å²	140.1	73%	0.73	64%	0.639	S	S	*	*	H	α-helix	trans	-67.9	-24.4	172.4	-99.7	-176.5	177.3	178.8	0	113.6	S87	K84-S87 PolarHBondContact O-OG 3.08Å
85	Y	32.8	Very low	34.4	Very low	175 Å²	175	137.5 Å²	137.5	69%	0.686	64%	0.638	S	S	*	*	H	α-helix	trans	-80	-31.6	174.9	-148.3	-99.4	0	0	0	111.3	A82 F83 L89	A82-Y85 PolarHBondContact O-N 3.3Å; F83-Y85 VanDerWaalsContact C-N 3.27Å; F83-Y85 PolarHBondContact O-N 3.37Å; Y85-L89 HydrophobicContact CD1-CD1 3.7Å; Y85-L89 HydrophobicContact CE1-CD1 3.87Å; Y85-L89 PolarHBondContact O-N 2.8Å
86	H	37.6	Very low	34.3	Very low	121 Å²	121	137.8 Å²	137.8	56%	0.56	64%	0.639	S	S	*	*	H	α-helix	trans	-78.4	-34.1	179.1	-130.6	-11.5	0	0	0	113.6	A82 F83 H88 L89 Q90	A82-H86 PolarHBondContact O-N 3.47Å; F83-H86 PolarHBondContact O-N 3.24Å; H86-H88 VanDerWaalsContact C-N 3.29Å; H86-H88 PolarHBondContact O-N 3.46Å; H86-L89 PolarHBondContact O-N 3.12Å; H86-Q90 PolarHBondContact O-N 3.05Å
87	S	31.4	Very low	34.7	Very low	72 Å²	72	134.8 Å²	134.8	50%	0.503	64%	0.641	S	S	.	*	H	α-helix	trans	-69.8	-24.6	172.1	71.9	0	0	0	0	113.4	F83 K84 K91	F83-S87 PolarHBondContact O-N 2.89Å; F83-S87 VanDerWaalsContact O-N 3.1Å; K84-S87 PolarHBondContact O-OG 3.08Å; S87-K91 PolarHBondContact O-N 3.32Å
88	H	36.8	Very low	34.7	Very low	129 Å²	129	142.1 Å²	142.1	60%	0.597	66%	0.661	S	S	*	*	H	α-helix	trans	-77.4	-33.4	173.7	-161.3	-87	0	0	0	111.7	H86 L92	H86-H88 VanDerWaalsContact C-N 3.29Å; H86-H88 PolarHBondContact O-N 3.46Å; H88-L92 PolarHBondContact O-N 3.4Å
89	L	35.2	Very low	34.3	Very low	81 Å²	81	141.5 Å²	141.5	42%	0.424	66%	0.664	S	S	.	*	H	α-helix	trans	-75.9	-33.5	175.9	-77.5	163.9	0	0	0	113.2	Y85 H86 K91 L92 E93	Y85-L89 HydrophobicContact CD1-CD1 3.7Å; Y85-L89 HydrophobicContact CE1-CD1 3.87Å; Y85-L89 PolarHBondContact O-N 2.8Å; H86-L89 PolarHBondContact O-N 3.12Å; L89-K91 PolarHBondContact O-N 3.23Å; L89-L92 PolarHBondContact O-N 3.18Å; L89-E93 PolarHBondContact O-N 3.26Å
90	Q	34.9	Very low	34.7	Very low	138 Å²	138	143.8 Å²	143.8	65%	0.645	67%	0.672	S	S	*	*	H	α-helix	trans	-72.6	-23.4	172.8	-104	179.4	7.5	0	0	114	H86	H86-Q90 PolarHBondContact O-N 3.05Å
91	K	34.2	Very low	34.8	Very low	166 Å²	166	147.5 Å²	147.5	72%	0.722	69%	0.686	S	S	*	*	H	α-helix	trans	-77.5	-20.7	168.9	-93.4	-179.2	175	178.3	0	113.2	S87 L89	S87-K91 PolarHBondContact O-N 3.32Å; L89-K91 PolarHBondContact O-N 3.23Å
92	L	35.3	Very low	34.7	Very low	98 Å²	98	144 Å²	144	51%	0.513	68%	0.684	S	S	.	*	H	α-helix	trans	-80.6	-22.5	173.1	-92.8	152.9	0	0	0	113.1	H88 L89	H88-L92 PolarHBondContact O-N 3.4Å; L89-L92 PolarHBondContact O-N 3.18Å
93	E	32.1	Very low	34.6	Very low	154 Å²	154	148.9 Å²	148.9	72%	0.72	70%	0.696	S	S	*	*	S	Bend	trans	-84.3	-13.7	174.5	-75.6	-178.7	156.9	0	0	114.2	L89	L89-E93 PolarHBondContact O-N 3.26Å
94	R	31.9	Very low	34.6	Very low	217 Å²	217	148.8 Å²	148.8	82%	0.819	71%	0.705	S	S	*	*	S	Bend	trans	-95	-8.6	173.3	-86.1	-177.4	177.8	167.9	0.9	115.4
95	N	35	Very low	34.5	Very low	130 Å²	130	149.6 Å²	149.6	70%	0.695	71%	0.709	S	S	*	*	S	Bend	trans	-98.7	8.3	175.1	-76	-14	0	0	0	113.9	T97	N95-T97 VanDerWaalsContact C-N 3.28Å; N95-T97 PolarHBondContact O-N 3.42Å
96	Q	34.9	Very low	34.6	Very low	173 Å²	173	149.8 Å²	149.8	81%	0.808	72%	0.716	S	S	*	*	T	Hydrogen-bonded Turn	trans	-91.4	33.3	169.4	-78.7	-170.9	-6.1	0	0	113.9
97	T	39.1	Very low	34.4	Very low	131 Å²	131	151.2 Å²	151.2	80%	0.804	72%	0.722	S	S	*	*	T	Hydrogen-bonded Turn	trans	-132	41.3	157.4	56.6	0	0	0	0	111.5	N95	N95-T97 VanDerWaalsContact C-N 3.28Å; N95-T97 PolarHBondContact O-N 3.42Å
98	R	37.4	Very low	34.4	Very low	223 Å²	223	151.6 Å²	151.6	84%	0.842	73%	0.725	S	S	*	*	S	Bend	trans	-169.7	83	157.1	-126.4	173.3	163.9	171.8	-5.8	109.3
99	D	27.2	Very low	34.2	Very low	154 Å²	154	153.9 Å²	153.9	82%	0.824	73%	0.734	S	S	*	*			trans	-175.4	69	141.5	-89.6	-18.9	0	0	0	108.6
100	R	41.6	Very low	34.2	Very low	228 Å²	228	154.5 Å²	154.5	86%	0.86	74%	0.741	S	S	*	*			trans	-57.4	129.8	138.9	-91	177	166.2	177.9	-3.7	105.9
101	H	36.2	Very low	34.3	Very low	178 Å²	178	154.2 Å²	154.2	82%	0.824	74%	0.739	S	S	*	*	S	Bend	trans	105.1	63.9	174.3	-61.4	-85.4	0	0	0	117
102	S	33.5	Very low	34.1	Very low	109 Å²	109	149.1 Å²	149.1	76%	0.762	73%	0.727	S	S	*	*	S	Bend	trans	-165	-5.4	141	66.8	0	0	0	0	116.8	V104	S102-V104 PolarHBondContact O-N 3.29Å
103	E	29.3	Very low	34	Very low	165 Å²	165	146.8 Å²	146.8	77%	0.771	72%	0.719	S	S	*	*	T	Hydrogen-bonded Turn	trans	-97.2	33	177.3	-73.1	-165	152.8	0	0	115.5
104	V	35.2	Very low	34.1	Very low	115 Å²	115	143.4 Å²	143.4	70%	0.697	70%	0.703	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.1	-6.5	176	174.9	0	0	0	0	113.2	S102	S102-V104 PolarHBondContact O-N 3.29Å
105	F	33.3	Very low	34.2	Very low	185 Å²	185	136 Å²	136	81%	0.811	68%	0.684	S	S	*	*	S	Bend	trans	-106.1	-1.1	-166.4	-112.6	-93.9	0	0	0	118.7
106	Q	33.6	Very low	34.1	Very low	178 Å²	178	132.8 Å²	132.8	83%	0.832	67%	0.669	S	S	*	*	S	Bend	trans	-128.7	-15.4	174.6	-71.9	-171.9	-9.7	0	0	115.8	S108	Q106-S108 VanDerWaalsContact C-N 3.29Å; Q106-S108 PolarHBondContact O-N 3Å
107	H	35	Very low	34.2	Very low	151 Å²	151	129.9 Å²	129.9	70%	0.699	66%	0.659	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76	-10.7	174.3	-100.8	112.5	0	0	0	114.4
108	S	30.6	Very low	34.1	Very low	80 Å²	80	131.9 Å²	131.9	56%	0.559	66%	0.659	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.9	-15.9	-175.8	62.7	0	0	0	0	115.3	Q106	Q106-S108 VanDerWaalsContact C-N 3.29Å; Q106-S108 PolarHBondContact O-N 3Å
109	K	32.2	Very low	34	Very low	178 Å²	178	126.4 Å²	126.4	77%	0.774	65%	0.646	S	S	*	*	T	Hydrogen-bonded Turn	trans	-96.6	-20.5	-177.6	-75.6	-179.1	-179.6	172.6	0	115.2
110	V	36.8	Very low	34.3	Very low	94 Å²	94	124.8 Å²	124.8	57%	0.57	64%	0.637	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.4	-34	-179.4	-178.4	0	0	0	0	111.8	A112 C113	V110-A112 VanDerWaalsContact C-N 3.29Å; V110-A112 PolarHBondContact O-N 3.45Å; V110-C113 PolarHBondContact O-N 2.82Å
111	H	35.5	Very low	34.1	Very low	132 Å²	132	123.2 Å²	123.2	61%	0.611	64%	0.636	S	S	*	*	H	α-helix	trans	-66.9	-31.5	175.4	-132.8	-93.1	0	0	0	112.1	C113 S115	H111-C113 PolarHBondContact O-N 3.21Å; H111-S115 PolarHBondContact O-N 2.98Å; H111-S115 PolarHBondContact O-OG 3.49Å
112	A	31	Very low	34	Very low	58 Å²	58	126 Å²	126	48%	0.479	64%	0.639	S	S	.	*	H	α-helix	trans	-65.4	-21.1	178.5	0	0	0	0	0	114.3	V110 T116	V110-A112 VanDerWaalsContact C-N 3.29Å; V110-A112 PolarHBondContact O-N 3.45Å; A112-T116 PolarHBondContact O-OG1 3.17Å
113	C	32.5	Very low	33.9	Very low	49 Å²	49	127.4 Å²	127.4	33%	0.331	64%	0.644	S	S	.	*	H	α-helix	trans	-92.3	-27.8	-176	-163	0	0	0	0	113.4	V110 H111 T116	V110-C113 PolarHBondContact O-N 2.82Å; H111-C113 PolarHBondContact O-N 3.21Å; C113-T116 VanDerWaalsContact C-OG1 3.3Å; C113-T116 WeakPolarHBondContact CA-OG1 3.45Å; C113-T116 PolarHBondContact O-OG1 3.12Å
114	Q	35.3	Very low	34.6	Very low	84 Å²	84	127 Å²	127	39%	0.393	65%	0.647	S	S	.	*	H	α-helix	trans	-79.1	-31.3	173.4	-70.5	-174.7	-8.3	0	0	111.8	T116 L117 Y186	Q114-T116 VanDerWaalsContact C-N 3.26Å; Q114-T116 PolarHBondContact O-N 3.33Å; Q114-L117 PolarHBondContact O-N 3.41Å; Q114-Y186 PolarHBondContact NE2-OH 3.29Å
115	S	32.5	Very low	35	Very low	61 Å²	61	128.4 Å²	128.4	43%	0.427	66%	0.656	S	S	.	*	H	α-helix	trans	-63.7	-28.8	172.4	-47.6	0	0	0	0	113.1	H111 L117 Q118	H111-S115 PolarHBondContact O-N 2.98Å; H111-S115 PolarHBondContact O-OG 3.49Å; S115-L117 VanDerWaalsContact C-N 3.25Å; S115-L117 PolarHBondContact O-N 2.98Å; S115-Q118 PolarHBondContact O-N 2.95Å
116	T	32.8	Very low	35.8	Very low	62 Å²	62	123 Å²	123	38%	0.38	65%	0.645	S	S	.	*	T	Hydrogen-bonded Turn	trans	-74	-9	176.5	34.3	0	0	0	0	114.8	A112 C113 Q114 Y144	A112-T116 PolarHBondContact O-OG1 3.17Å; C113-T116 VanDerWaalsContact C-OG1 3.3Å; C113-T116 WeakPolarHBondContact CA-OG1 3.45Å; C113-T116 PolarHBondContact O-OG1 3.12Å; Q114-T116 VanDerWaalsContact C-N 3.26Å; Q114-T116 PolarHBondContact O-N 3.33Å; T116-Y144 HydrophobicContact CG2-CE1 3.71Å; T116-Y144 WeakPolarHBondContact CG2-OH 3.37Å
117	L	37.4	Very low	36.7	Very low	113 Å²	113	123.4 Å²	123.4	59%	0.592	65%	0.647	S	S	*	*	T	Hydrogen-bonded Turn	trans	-104.3	-2.5	177.8	-88.1	157.9	0	0	0	113.8	Q114 S115	Q114-L117 PolarHBondContact O-N 3.41Å; S115-L117 VanDerWaalsContact C-N 3.25Å; S115-L117 PolarHBondContact O-N 2.98Å
118	Q	36.3	Very low	37.9	Very low	172 Å²	172	119.8 Å²	119.8	80%	0.804	63%	0.63	S	S	*	*	S	Bend	trans	-120.2	20.9	-179.2	-102.1	179.1	-13.5	0	0	114.8	S115	S115-Q118 PolarHBondContact O-N 2.95Å
119	I	35.6	Very low	39.3	Very low	109 Å²	109	120.1 Å²	120.1	56%	0.559	63%	0.63	S	S	*	*	T	Hydrogen-bonded Turn	trans	-101.2	81	169.3	-53.8	171.1	0	0	0	108.9	L140	I119-L140 HydrophobicContact CG2-CD1 4.23Å
120	N	35	Very low	40.7	Very low	120 Å²	120	116.2 Å²	116.2	64%	0.642	61%	0.611	S	S	*	*	T	Hydrogen-bonded Turn	trans	-172	36.5	149.6	-96.3	-20.2	0	0	0	112.4	K128	N120-K128 PolarHBondContact OD1-NZ 3.41Å
121	K	37.4	Very low	42.1	Very low	194 Å²	194	119.1 Å²	119.1	84%	0.843	62%	0.616	S	S	*	*	S	Bend	trans	-148.4	85.9	159.4	-72.6	-164.9	178.8	-177	0	110.2
122	R	34	Very low	43.4	Very low	236 Å²	236	113.3 Å²	113.3	89%	0.891	59%	0.59	S	S	*	*	S	Bend		172.8	125	129.9	-91.6	162.6	-175.6	-164.5	0.1	110.2
123	T	30.8	Very low	44.8	Very low	139 Å²	139	117.9 Å²	117.9	85%	0.853	61%	0.606	S	S	*	*			trans	58.9	126.4	157.2	53.4	0	0	0	0	120.8
124	N	43.3	Very low	45.8	Very low	157 Å²	157	122 Å²	122	84%	0.84	62%	0.621	S	S	*	*			trans	-31.7	159.5	171.9	-86.5	-35.9	0	0	0	118.7
125	T	44.1	Very low	47.2	Very low	144 Å²	144	119.8 Å²	119.8	88%	0.883	61%	0.614	S	S	*	*			trans	93.5	43.7	169.1	77.9	0	0	0	0	119.2
126	A	49.2	Very low	48.3	Very low	71 Å²	71	125.5 Å²	125.5	59%	0.587	64%	0.64	S	S	*	*			trans	-133.1	116.1	155.1	0	0	0	0	0	109.8	K128 L140	A126-K128 PolarHBondContact O-N 2.83Å; A126-L140 HydrophobicContact CB-CD2 4Å
127	Q	52.7	Low	49.4	Very low	188 Å²	188	128.3 Å²	128.3	88%	0.879	65%	0.647	S	S	*	*			trans	-59.7	123.7	171.9	-80.9	-178.5	-1.6	0	0	108.6	P129	Q127-P129 WeakPolarHBondContact O-CD 3.28Å
128	K	61.5	Low	50.3	Low	75 Å²	75	124.3 Å²	124.3	33%	0.326	63%	0.63	S	S	.	*			trans	-92.1	97.7	176.2	-67.4	179.2	175	-175.7	0	107.9	N120 A126 Y130 A138 L140	N120-K128 PolarHBondContact OD1-NZ 3.41Å; A126-K128 PolarHBondContact O-N 2.83Å; K128-Y130 VanDerWaalsContact C-N 3.32Å; K128-Y130 PolarHBondContact O-N 3.48Å; K128-A138 HydrophobicContact CB-CB 3.56Å; K128-A138 HydrophobicContact CD-CB 4.07Å; K128-A138 WeakPolarHBondContact CD-O 3.27Å; K128-A138 HydrophobicContact CG-CB 4.47Å; K128-L140 HydrophobicContact CG-CD2 3.74Å; K128-L140 HydrophobicContact CG-CG 4.12Å
129	P	58.9	Low	51.8	Low	87 Å²	87	118 Å²	118	57%	0.565	60%	0.6	S	S	*	*			trans	-77.3	-20.8	-166.1	-9.3	26.8	0	0	0	112.8	Q127	Q127-P129 WeakPolarHBondContact O-CD 3.28Å
130	Y	63.2	Low	52.8	Low	96 Å²	96	116.3 Å²	116.3	38%	0.376	59%	0.591	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-103.3	98.5	-172.4	-56	-75.9	0	0	0	110.1	K128 A138 F139 L142	K128-Y130 VanDerWaalsContact C-N 3.32Å; K128-Y130 PolarHBondContact O-N 3.48Å; Y130-A138 CarbonylContact O-C 3.56Å; Y130-A138 WeakPolarHBondContact O-CA 3.44Å; Y130-F139 PolarHBondContact N-O 3.39Å; Y130-F139 PolarHBondContact O-N 3.45Å; Y130-L142 HydrophobicContact CD1-CB 3.94Å; Y130-L142 HydrophobicContact CD1-CD1 3.83Å; Y130-L142 HydrophobicContact CD1-CG 4.43Å; Y130-L142 HydrophobicContact CE1-CB 3.83Å; Y130-L142 HydrophobicContact CE1-CD1 4.23Å; Y130-L142 HydrophobicContact CE1-CG 4.45Å; Y130-L142 HydrophobicContact CE2-CB 4.49Å; Y130-L142 HydrophobicContact CG-CB 4.32Å
131	K	64.6	Low	54.1	Low	154 Å²	154	116.1 Å²	116.1	67%	0.67	59%	0.585	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-91.5	142.1	177.9	-60.7	-176.6	-177.6	177.8	0	110.4	A138 L145	K131-A138 HydrophobicContact CG-CB 4.13Å; K131-L145 WeakPolarHBondContact O-CD2 3.44Å
132	C	62.6	Low	54.9	Low	11 Å²	11	110 Å²	110	7%	0.074	56%	0.561	C	S	.	*			trans	-78.5	135	171.3	-176.6	0	0	0	0	109.9	E134 C135 K137 F139 L145 H152	C132-E134 VanDerWaalsContact C-N 3.29Å; C132-C135 WeakPolarHBondContact CB-O 3.29Å; C132-K137 WeakPolarHBondContact CB-O 3.47Å; C132-K137 PolarHBondContact N-O 2.61Å; C132-F139 HydrophobicContact CB-CE2 4.36Å; C132-L145 VanDerWaalsContact CA-CD1 3.49Å; C132-L145 HydrophobicContact CB-CD1 3.56Å; C132-H152 PolarHBondContact SG-NE2 3.11Å; C132-H152 VanDerWaalsContact SG-NE2 3.35Å
133	N	60.3	Low	55.8	Low	153 Å²	153	104.6 Å²	104.6	82%	0.818	54%	0.544	S	S	*	.	S	Bend	trans	-80.1	-13.4	-178.9	-64.9	-14.6	0	0	0	112.9
134	E	55	Low	56.9	Low	137 Å²	137	102 Å²	102	64%	0.64	52%	0.519	S	S	*	.	S	Bend	trans	-108.1	-7.1	-177.4	-63.6	-177.7	-160.3	0	0	113.2	C132 H152	C132-E134 VanDerWaalsContact C-N 3.29Å; E134-H152 WeakPolarHBondContact OE2-CB 3.41Å; E134-H152 IonicContact OE2-CD2 3.05Å; E134-H152 PolarHBondContact OE2-CD2 3.12Å; E134-H152 IonicContact OE2-CG 3.12Å
135	C	64	Low	57.5	Low	37 Å²	37	95 Å²	95	25%	0.25	48%	0.482	C	S	.	.	S	Bend	trans	-159.7	162.4	171.4	74.9	0	0	0	0	112.3	C132 K137 H148	C132-C135 WeakPolarHBondContact CB-O 3.29Å; C135-K137 PolarHBondContact O-N 3.45Å; C135-H148 PolarHBondContact SG-NE2 3.4Å
136	D	54.9	Low	58.3	Low	180 Å²	180	95.3 Å²	95.3	96%	0.963	47%	0.467	S	S	*	.	S	Bend	trans	-70.4	23	-175	-62.4	-38.2	0	0	0	115.9
137	K	57.1	Low	58.7	Low	122 Å²	122	93 Å²	93	53%	0.53	45%	0.448	S	S	.	.			trans	-93.1	123.6	-179.4	-67.9	178	-175.6	166	0	111.2	C132 C135 F139	C132-K137 WeakPolarHBondContact CB-O 3.47Å; C132-K137 PolarHBondContact N-O 2.61Å; C135-K137 PolarHBondContact O-N 3.45Å; K137-F139 HydrophobicContact CB-CE2 3.67Å; K137-F139 HydrophobicContact CB-CZ 3.78Å; K137-F139 HydrophobicContact CD-CZ 4.4Å; K137-F139 WeakPolarHBondContact O-CE2 3.22Å
138	A	56	Low	58.9	Low	28 Å²	28	85.1 Å²	85.1	23%	0.231	41%	0.411	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	145.2	170.8	0	0	0	0	0	111.3	K128 Y130 K131	K128-A138 HydrophobicContact CB-CB 3.56Å; K128-A138 HydrophobicContact CD-CB 4.07Å; K128-A138 WeakPolarHBondContact CD-O 3.27Å; K128-A138 HydrophobicContact CG-CB 4.47Å; Y130-A138 CarbonylContact O-C 3.56Å; Y130-A138 WeakPolarHBondContact O-CA 3.44Å; K131-A138 HydrophobicContact CG-CB 4.13Å
139	F	66.9	Low	58.7	Low	40 Å²	40	84.8 Å²	84.8	18%	0.175	41%	0.411	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	149.9	-175.4	-60.1	-89.4	0	0	0	110.9	Y130 C132 K137 L145 H148	Y130-F139 PolarHBondContact N-O 3.39Å; Y130-F139 PolarHBondContact O-N 3.45Å; C132-F139 HydrophobicContact CB-CE2 4.36Å; K137-F139 HydrophobicContact CB-CE2 3.67Å; K137-F139 HydrophobicContact CB-CZ 3.78Å; K137-F139 HydrophobicContact CD-CZ 4.4Å; K137-F139 WeakPolarHBondContact O-CE2 3.22Å; F139-L145 HydrophobicContact CB-CB 4.26Å; F139-L145 HydrophobicContact CD2-CB 3.95Å; F139-L145 HydrophobicContact CD2-CD1 3.75Å; F139-L145 HydrophobicContact CD2-CG 4.46Å; F139-L145 HydrophobicContact CE2-CD1 3.97Å; F139-L145 HydrophobicContact CG-CB 4.28Å; F139-H148 HydrophobicContact CE1-CB 3.94Å; F139-H148 HydrophobicContact CE2-CB 3.92Å; F139-H148 AromaticContact CE2-CD2 3.27Å; F139-H148 WeakPolarHBondContact CE2-CD2 3.26Å; F139-H148 AromaticContact CE2-CG 3.69Å; F139-H148 HydrophobicContact CZ-CB 3.45Å; F139-H148 VanDerWaalsContact CZ-CB 3.45Å; F139-H148 AromaticContact CZ-CD2 3.28Å; F139-H148 WeakPolarHBondContact CZ-CD2 3.45Å; F139-H148 AromaticContact CZ-CG 3.24Å; F139-H148 AromaticContact CZ-ND1 3.97Å; F139-H148 AromaticContact CZ-NE2 3.99Å
140	L	57	Low	58.8	Low	73 Å²	73	85.9 Å²	85.9	38%	0.382	40%	0.403	S	S	.	.	S	Bend	trans	-76.9	-22.3	-178.9	-69.2	166.1	0	0	0	113.1	I119 A126 K128	I119-L140 HydrophobicContact CG2-CD1 4.23Å; A126-L140 HydrophobicContact CB-CD2 4Å; K128-L140 HydrophobicContact CG-CD2 3.74Å; K128-L140 HydrophobicContact CG-CG 4.12Å
141	K	62.7	Low	58.2	Low	117 Å²	117	84.7 Å²	84.7	51%	0.509	41%	0.406	S	S	.	.	S	Bend	trans	-142.1	143.3	179.5	-56	-173.6	178.1	-175.2	0	111	K143 Y144 L145	K141-K143 VanDerWaalsContact C-N 3.26Å; K141-K143 HydrophobicContact CB-CG 4.23Å; K141-K143 PolarHBondContact O-N 3.4Å; K141-Y144 HydrophobicContact CB-CD2 3.71Å; K141-Y144 HydrophobicContact CB-CE2 4.02Å; K141-Y144 HydrophobicContact CD-CE2 4.02Å; K141-Y144 HydrophobicContact CG-CD2 4.26Å; K141-Y144 HydrophobicContact CG-CE2 4.16Å; K141-Y144 PolarHBondContact O-N 3.12Å; K141-L145 PolarHBondContact O-N 3.23Å
142	L	53.5	Low	57.7	Low	64 Å²	64	80.6 Å²	80.6	34%	0.335	39%	0.389	S	S	.	.	H	α-helix	trans	-55.7	-34.6	-179.5	-173.4	60.6	0	0	0	113.7	Y130 Y144 L145 R146	Y130-L142 HydrophobicContact CD1-CB 3.94Å; Y130-L142 HydrophobicContact CD1-CD1 3.83Å; Y130-L142 HydrophobicContact CD1-CG 4.43Å; Y130-L142 HydrophobicContact CE1-CB 3.83Å; Y130-L142 HydrophobicContact CE1-CD1 4.23Å; Y130-L142 HydrophobicContact CE1-CG 4.45Å; Y130-L142 HydrophobicContact CE2-CB 4.49Å; Y130-L142 HydrophobicContact CG-CB 4.32Å; L142-Y144 PolarHBondContact O-N 2.83Å; L142-L145 HydrophobicContact CD1-CD2 4.23Å; L142-L145 PolarHBondContact O-N 2.83Å; L142-R146 HydrophobicContact CD1-CG 4.5Å; L142-R146 HydrophobicContact CG-CG 4.43Å; L142-R146 WeakPolarHBondContact O-CG 3.48Å; L142-R146 PolarHBondContact O-N 3.22Å
143	K	53.9	Low	57.5	Low	123 Å²	123	83.4 Å²	83.4	54%	0.535	41%	0.409	S	S	.	.	H	α-helix	trans	-61.7	-29.8	176.1	68.7	180	-177.6	178.6	0	113.9	K141 A147	K141-K143 VanDerWaalsContact C-N 3.26Å; K141-K143 HydrophobicContact CB-CG 4.23Å; K141-K143 PolarHBondContact O-N 3.4Å; K143-A147 WeakPolarHBondContact O-CB 3.41Å; K143-A147 PolarHBondContact O-N 3.06Å; K143-A147 VanDerWaalsContact O-N 3.14Å
144	Y	53.3	Low	57.2	Low	85 Å²	85	78.5 Å²	78.5	33%	0.333	40%	0.395	S	S	.	.	H	α-helix	trans	-83.1	-34.5	177.9	-60.5	-55.6	0	0	0	111.6	T116 K141 L142 A147 H148	T116-Y144 HydrophobicContact CG2-CE1 3.71Å; T116-Y144 WeakPolarHBondContact CG2-OH 3.37Å; K141-Y144 HydrophobicContact CB-CD2 3.71Å; K141-Y144 HydrophobicContact CB-CE2 4.02Å; K141-Y144 HydrophobicContact CD-CE2 4.02Å; K141-Y144 HydrophobicContact CG-CD2 4.26Å; K141-Y144 HydrophobicContact CG-CE2 4.16Å; K141-Y144 PolarHBondContact O-N 3.12Å; L142-Y144 PolarHBondContact O-N 2.83Å; Y144-A147 PolarHBondContact O-N 2.82Å; Y144-H148 WeakPolarHBondContact O-CB 3.48Å; Y144-H148 PolarHBondContact O-N 3.01Å
145	L	56.8	Low	57.2	Low	10 Å²	10	79.5 Å²	79.5	5%	0.052	40%	0.397	C	S	.	.	H	α-helix	trans	-61.5	-49.9	169	173.9	60.1	0	0	0	110.5	K131 C132 F139 K141 L142 A147 H148 E149	K131-L145 WeakPolarHBondContact O-CD2 3.44Å; C132-L145 VanDerWaalsContact CA-CD1 3.49Å; C132-L145 HydrophobicContact CB-CD1 3.56Å; F139-L145 HydrophobicContact CB-CB 4.26Å; F139-L145 HydrophobicContact CD2-CB 3.95Å; F139-L145 HydrophobicContact CD2-CD1 3.75Å; F139-L145 HydrophobicContact CD2-CG 4.46Å; F139-L145 HydrophobicContact CE2-CD1 3.97Å; F139-L145 HydrophobicContact CG-CB 4.28Å; K141-L145 PolarHBondContact O-N 3.23Å; L142-L145 HydrophobicContact CD1-CD2 4.23Å; L142-L145 PolarHBondContact O-N 2.83Å; L145-A147 VanDerWaalsContact C-N 3.28Å; L145-A147 PolarHBondContact O-N 2.9Å; L145-H148 CarbonylContact O-C 3.49Å; L145-H148 WeakPolarHBondContact O-CA 3.24Å; L145-H148 WeakPolarHBondContact O-CB 3.4Å; L145-H148 PolarHBondContact O-N 3.12Å; L145-E149 HydrophobicContact CD1-CG 4Å; L145-E149 HydrophobicContact CG-CG 4.33Å; L145-E149 WeakPolarHBondContact CG-OE1 3.36Å; L145-E149 WeakPolarHBondContact O-CG 3.5Å; L145-E149 PolarHBondContact O-N 3.26Å
146	R	60	Low	57.2	Low	150 Å²	150	83.3 Å²	83.3	57%	0.566	41%	0.409	S	S	*	.	H	α-helix	trans	-59.6	-34.4	175.9	-71.3	178	179.6	173.1	-0.5	113.5	L142 E149 R150	L142-R146 HydrophobicContact CD1-CG 4.5Å; L142-R146 HydrophobicContact CG-CG 4.43Å; L142-R146 WeakPolarHBondContact O-CG 3.48Å; L142-R146 PolarHBondContact O-N 3.22Å; R146-E149 WeakPolarHBondContact CA-OE2 3.12Å; R146-R150 WeakPolarHBondContact O-CG 3.4Å
147	A	57	Low	57.4	Low	24 Å²	24	78.5 Å²	78.5	20%	0.198	39%	0.388	C	S	.	.	H	α-helix	trans	-72	-31.9	173.6	0	0	0	0	0	112.3	K143 Y144 L145	K143-A147 WeakPolarHBondContact O-CB 3.41Å; K143-A147 PolarHBondContact O-N 3.06Å; K143-A147 VanDerWaalsContact O-N 3.14Å; Y144-A147 PolarHBondContact O-N 2.82Å; L145-A147 VanDerWaalsContact C-N 3.28Å; L145-A147 PolarHBondContact O-N 2.9Å
148	H	57.2	Low	57.8	Low	22 Å²	22	76.5 Å²	76.5	10%	0.102	38%	0.378	C	S	.	.	H	α-helix	trans	-76	-37.5	175.1	171.9	56.8	0	0	0	112.8	C135 F139 Y144 L145 R150 T151 H152	C135-H148 PolarHBondContact SG-NE2 3.4Å; F139-H148 HydrophobicContact CE1-CB 3.94Å; F139-H148 HydrophobicContact CE2-CB 3.92Å; F139-H148 AromaticContact CE2-CD2 3.27Å; F139-H148 WeakPolarHBondContact CE2-CD2 3.26Å; F139-H148 AromaticContact CE2-CG 3.69Å; F139-H148 HydrophobicContact CZ-CB 3.45Å; F139-H148 VanDerWaalsContact CZ-CB 3.45Å; F139-H148 AromaticContact CZ-CD2 3.28Å; F139-H148 WeakPolarHBondContact CZ-CD2 3.45Å; F139-H148 AromaticContact CZ-CG 3.24Å; F139-H148 AromaticContact CZ-ND1 3.97Å; F139-H148 AromaticContact CZ-NE2 3.99Å; Y144-H148 WeakPolarHBondContact O-CB 3.48Å; Y144-H148 PolarHBondContact O-N 3.01Å; L145-H148 CarbonylContact O-C 3.49Å; L145-H148 WeakPolarHBondContact O-CA 3.24Å; L145-H148 WeakPolarHBondContact O-CB 3.4Å; L145-H148 PolarHBondContact O-N 3.12Å; H148-R150 PolarHBondContact O-N 3.49Å; H148-T151 PolarHBondContact ND1-OG1 3.31Å; H148-T151 WeakPolarHBondContact O-CA 3.49Å; H148-T151 VanDerWaalsContact O-CB 3.25Å; H148-T151 WeakPolarHBondContact O-CB 3.22Å; H148-T151 WeakPolarHBondContact O-CG2 3.39Å; H148-T151 PolarHBondContact O-N 3.19Å; H148-T151 PolarHBondContact O-OG1 2.77Å; H148-H152 AromaticContact CE1-NE2 3.8Å; H148-H152 AromaticContact NE2-NE2 3.43Å; H148-H152 PolarHBondContact NE2-NE2 3.01Å
149	E	57.1	Low	58	Low	68 Å²	68	81.3 Å²	81.3	32%	0.318	40%	0.396	S	S	.	.	H	α-helix	trans	-62.5	-25.8	175.4	-71	166.2	161.4	0	0	112.2	L145 R146 T151 H152 S153	L145-E149 HydrophobicContact CD1-CG 4Å; L145-E149 HydrophobicContact CG-CG 4.33Å; L145-E149 WeakPolarHBondContact CG-OE1 3.36Å; L145-E149 WeakPolarHBondContact O-CG 3.5Å; L145-E149 PolarHBondContact O-N 3.26Å; R146-E149 WeakPolarHBondContact CA-OE2 3.12Å; E149-T151 PolarHBondContact O-N 2.85Å; E149-H152 PolarHBondContact O-N 2.8Å; E149-H152 VanDerWaalsContact O-N 3.13Å; E149-S153 PolarHBondContact O-N 3.28Å; E149-S153 PolarHBondContact O-OG 3.06Å
150	R	61.5	Low	57.9	Low	109 Å²	109	79.5 Å²	79.5	41%	0.411	39%	0.388	S	S	.	.	H	α-helix	trans	-63.7	-19.2	169.2	-67	173.9	-166.5	-167.8	-0.5	113.6	R146 H148 S153 G154 L168	R146-R150 WeakPolarHBondContact O-CG 3.4Å; H148-R150 PolarHBondContact O-N 3.49Å; R150-S153 WeakPolarHBondContact CA-OG 3.41Å; R150-G154 PolarHBondContact O-N 3.46Å; R150-L168 HydrophobicContact CB-CD2 4.27Å; R150-L168 WeakPolarHBondContact O-CD2 3.26Å
151	T	51.2	Low	58.3	Low	71 Å²	71	81.4 Å²	81.4	44%	0.436	41%	0.407	S	S	.	.	H	α-helix	trans	-77	-24.6	175.1	69.5	0	0	0	0	112.7	H148 E149 L168	H148-T151 PolarHBondContact ND1-OG1 3.31Å; H148-T151 WeakPolarHBondContact O-CA 3.49Å; H148-T151 VanDerWaalsContact O-CB 3.25Å; H148-T151 WeakPolarHBondContact O-CB 3.22Å; H148-T151 WeakPolarHBondContact O-CG2 3.39Å; H148-T151 PolarHBondContact O-N 3.19Å; H148-T151 PolarHBondContact O-OG1 2.77Å; E149-T151 PolarHBondContact O-N 2.85Å; T151-L168 HydrophobicContact CG2-CD1 4.15Å; T151-L168 HydrophobicContact CG2-CD2 4.33Å
152	H	53	Low	58	Low	68 Å²	68	82.6 Å²	82.6	32%	0.315	42%	0.415	S	S	.	.	H	α-helix	trans	-86.6	-38.5	175.3	-55.4	-56.2	0	0	0	112.5	C132 E134 H148 E149 G154	C132-H152 PolarHBondContact SG-NE2 3.11Å; C132-H152 VanDerWaalsContact SG-NE2 3.35Å; E134-H152 WeakPolarHBondContact OE2-CB 3.41Å; E134-H152 IonicContact OE2-CD2 3.05Å; E134-H152 PolarHBondContact OE2-CD2 3.12Å; E134-H152 IonicContact OE2-CG 3.12Å; H148-H152 AromaticContact CE1-NE2 3.8Å; H148-H152 AromaticContact NE2-NE2 3.43Å; H148-H152 PolarHBondContact NE2-NE2 3.01Å; E149-H152 PolarHBondContact O-N 2.8Å; E149-H152 VanDerWaalsContact O-N 3.13Å; H152-G154 PolarHBondContact O-N 2.8Å
153	S	58.1	Low	58.4	Low	70 Å²	70	82.1 Å²	82.1	49%	0.49	42%	0.416	S	S	.	.	S	Bend	trans	-73.8	-3.2	176.2	54.1	0	0	0	0	114.8	E149 R150 K155	E149-S153 PolarHBondContact O-N 3.28Å; E149-S153 PolarHBondContact O-OG 3.06Å; R150-S153 WeakPolarHBondContact CA-OG 3.41Å; S153-K155 PolarHBondContact O-N 3.22Å
154	G	54.5	Low	58.6	Low	51 Å²	51	78.2 Å²	78.2	53%	0.526	41%	0.41	S	S	.	.			trans	66	-2.4	174.8	0	0	0	0	0	116.2	R150 H152 K156	R150-G154 PolarHBondContact O-N 3.46Å; H152-G154 PolarHBondContact O-N 2.8Å; G154-K156 PolarHBondContact O-N 2.77Å
155	K	56.3	Low	58.9	Low	157 Å²	157	80 Å²	80	68%	0.683	42%	0.42	S	S	*	.			trans	-69.9	117.7	-178.1	-69.8	-174.5	178.9	-178.8	0	110.5	S153 P157	S153-K155 PolarHBondContact O-N 3.22Å; K155-P157 WeakPolarHBondContact O-CD 3.44Å
156	K	63.7	Low	58.9	Low	117 Å²	117	81.3 Å²	81.3	51%	0.509	43%	0.432	S	S	.	.			trans	-114	88.8	176.9	-60.1	-167.5	-167.5	166.3	0	109.5	G154 Y158 A166 F167 L168	G154-K156 PolarHBondContact O-N 2.77Å; K156-Y158 VanDerWaalsContact C-N 3.26Å; K156-Y158 PolarHBondContact O-N 2.89Å; K156-A166 HydrophobicContact CB-CB 3.52Å; K156-A166 HydrophobicContact CD-CB 4.26Å; K156-A166 WeakPolarHBondContact CD-O 3.46Å; K156-F167 CarbonylContact C-O 3.37Å; K156-L168 HydrophobicContact CG-CD2 4.47Å; K156-L168 HydrophobicContact CG-CG 4.19Å
157	P	59.7	Low	59	Low	79 Å²	79	76 Å²	76	51%	0.513	41%	0.413	S	S	.	.			trans	-76.8	-7	-168.4	6.4	3	0	0	0	114.9	K155	K155-P157 WeakPolarHBondContact O-CD 3.44Å
158	Y	64.4	Low	58.7	Low	81 Å²	81	77.2 Å²	77.2	32%	0.318	42%	0.416	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	98.6	-173.3	-56.6	-75.1	0	0	0	110.4	K156 A166 F167 P170	K156-Y158 VanDerWaalsContact C-N 3.26Å; K156-Y158 PolarHBondContact O-N 2.89Å; Y158-A166 CarbonylContact O-C 3.53Å; Y158-A166 WeakPolarHBondContact O-CA 3.39Å; Y158-F167 PolarHBondContact N-O 2.84Å; Y158-F167 PolarHBondContact O-N 3.1Å; Y158-P170 HydrophobicContact CD1-CB 4.45Å; Y158-P170 HydrophobicContact CD1-CG 3.84Å; Y158-P170 HydrophobicContact CD2-CG 4.26Å; Y158-P170 HydrophobicContact CE1-CG 3.54Å; Y158-P170 VanDerWaalsContact CE2-CD 3.5Å; Y158-P170 HydrophobicContact CE2-CG 3.96Å; Y158-P170 HydrophobicContact CG-CG 4.19Å
159	E	60.1	Low	58.6	Low	129 Å²	129	79.6 Å²	79.6	60%	0.603	43%	0.427	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-93.9	138.5	-177.6	-169	175.2	169.1	0	0	112.3	S161 G164	E159-S161 PolarHBondContact O-N 3.07Å; E159-G164 VanDerWaalsContact OE1-CA 3.29Å; E159-G164 WeakPolarHBondContact OE1-CA 3.48Å
160	C	65.4	Low	58.3	Low	1 Å²	1	78.9 Å²	78.9	1%	0.007	43%	0.428	C	S	.	.			trans	-77.9	115.1	173.2	-177.2	0	0	0	0	110.4	Q162 C163 G164 K165 F167 L173 H180	C160-Q162 PolarHBondContact O-N 2.97Å; C160-Q162 VanDerWaalsContact O-N 3.09Å; C160-C163 PolarHBondContact O-N 3.44Å; C160-G164 WeakPolarHBondContact O-CA 3.5Å; C160-G164 PolarHBondContact O-N 3.24Å; C160-K165 PolarHBondContact N-O 2.86Å; C160-F167 HydrophobicContact CB-CE2 4.26Å; C160-L173 VanDerWaalsContact CA-CD1 3.48Å; C160-L173 HydrophobicContact CB-CD1 3.5Å; C160-H180 PolarHBondContact SG-NE2 3.42Å; C160-H180 VanDerWaalsContact SG-NE2 3.44Å
161	S	65.5	Low	57.9	Low	113 Å²	113	75.4 Å²	75.4	79%	0.79	42%	0.42	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59	-21.6	178.8	54.2	0	0	0	0	114.3	E159	E159-S161 PolarHBondContact O-N 3.07Å
162	Q	56.8	Low	57.9	Low	143 Å²	143	76.4 Å²	76.4	67%	0.668	42%	0.417	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.5	-20.7	-178.8	-62.9	-145.9	-2.3	0	0	114.9	C160	C160-Q162 PolarHBondContact O-N 2.97Å; C160-Q162 VanDerWaalsContact O-N 3.09Å
163	C	60.8	Low	58.4	Low	54 Å²	54	74.2 Å²	74.2	37%	0.365	41%	0.407	S	S	.	.	T	Hydrogen-bonded Turn	trans	-145.9	11.7	-177.9	80.2	0	0	0	0	115.3	C160 K165 H176	C160-C163 PolarHBondContact O-N 3.44Å; C163-K165 PolarHBondContact O-N 3.39Å; C163-H176 PolarHBondContact SG-NE2 3.29Å
164	G	57.3	Low	58.4	Low	40 Å²	40	78.4 Å²	78.4	41%	0.412	41%	0.412	S	S	.	.			trans	64.8	11.7	176.3	0	0	0	0	0	115.4	E159 C160 A166	E159-G164 VanDerWaalsContact OE1-CA 3.29Å; E159-G164 WeakPolarHBondContact OE1-CA 3.48Å; C160-G164 WeakPolarHBondContact O-CA 3.5Å; C160-G164 PolarHBondContact O-N 3.24Å; G164-A166 PolarHBondContact O-N 3.28Å
165	K	60	Low	58.6	Low	122 Å²	122	78.6 Å²	78.6	53%	0.53	40%	0.401	S	S	.	.			trans	-79.5	123.8	-179.3	-77.2	-179.6	-174.4	167.8	0	110.2	C160 C163 F167	C160-K165 PolarHBondContact N-O 2.86Å; C163-K165 PolarHBondContact O-N 3.39Å; K165-F167 HydrophobicContact CB-CE2 3.72Å; K165-F167 HydrophobicContact CB-CZ 3.88Å; K165-F167 VanDerWaalsContact O-CD2 3.23Å; K165-F167 WeakPolarHBondContact O-CD2 3.39Å; K165-F167 WeakPolarHBondContact O-CE2 3.39Å
166	A	58	Low	58.8	Low	38 Å²	38	72.1 Å²	72.1	31%	0.314	37%	0.373	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.7	139.6	179	0	0	0	0	0	112.5	K156 Y158 G164	K156-A166 HydrophobicContact CB-CB 3.52Å; K156-A166 HydrophobicContact CD-CB 4.26Å; K156-A166 WeakPolarHBondContact CD-O 3.46Å; Y158-A166 CarbonylContact O-C 3.53Å; Y158-A166 WeakPolarHBondContact O-CA 3.39Å; G164-A166 PolarHBondContact O-N 3.28Å
167	F	62.3	Low	58.8	Low	39 Å²	39	69.9 Å²	69.9	17%	0.171	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126	152.1	-177.3	-61.6	-86.2	0	0	0	111.6	K156 Y158 C160 K165 L173 H176	K156-F167 CarbonylContact C-O 3.37Å; Y158-F167 PolarHBondContact N-O 2.84Å; Y158-F167 PolarHBondContact O-N 3.1Å; C160-F167 HydrophobicContact CB-CE2 4.26Å; K165-F167 HydrophobicContact CB-CE2 3.72Å; K165-F167 HydrophobicContact CB-CZ 3.88Å; K165-F167 VanDerWaalsContact O-CD2 3.23Å; K165-F167 WeakPolarHBondContact O-CD2 3.39Å; K165-F167 WeakPolarHBondContact O-CE2 3.39Å; F167-L173 HydrophobicContact CB-CB 4.24Å; F167-L173 HydrophobicContact CD2-CB 3.92Å; F167-L173 HydrophobicContact CD2-CD1 3.75Å; F167-L173 HydrophobicContact CD2-CG 4.43Å; F167-L173 HydrophobicContact CE2-CD1 3.97Å; F167-L173 HydrophobicContact CG-CB 4.24Å; F167-H176 HydrophobicContact CE1-CB 3.8Å; F167-H176 HydrophobicContact CE2-CB 3.82Å; F167-H176 AromaticContact CE2-CD2 3.28Å; F167-H176 WeakPolarHBondContact CE2-CD2 3.44Å; F167-H176 AromaticContact CE2-CG 3.61Å; F167-H176 HydrophobicContact CZ-CB 3.34Å; F167-H176 AromaticContact CZ-CD2 3.29Å; F167-H176 WeakPolarHBondContact CZ-CD2 3.46Å; F167-H176 AromaticContact CZ-CG 3.14Å; F167-H176 AromaticContact CZ-ND1 3.81Å; F167-H176 AromaticContact CZ-NE2 3.97Å
168	L	49.3	Very low	59.3	Low	49 Å²	49	68.4 Å²	68.4	26%	0.257	35%	0.349	S	S	.	.	S	Bend	trans	-74.5	-26.2	-180	-75.9	149.4	0	0	0	112.9	R150 T151 K156	R150-L168 HydrophobicContact CB-CD2 4.27Å; R150-L168 WeakPolarHBondContact O-CD2 3.26Å; T151-L168 HydrophobicContact CG2-CD1 4.15Å; T151-L168 HydrophobicContact CG2-CD2 4.33Å; K156-L168 HydrophobicContact CG-CD2 4.47Å; K156-L168 HydrophobicContact CG-CG 4.19Å
169	H	56.4	Low	58.9	Low	72 Å²	72	68.7 Å²	68.7	33%	0.333	36%	0.359	S	S	.	.	S	Bend	trans	-140.1	151	179.6	-90.5	-75.4	0	0	0	112.2	C171 Y172 L173	H169-C171 PolarHBondContact O-N 3.48Å; H169-Y172 HydrophobicContact CB-CD2 3.75Å; H169-Y172 HydrophobicContact CB-CE2 4.17Å; H169-Y172 PolarHBondContact O-N 3.19Å; H169-Y172 VanDerWaalsContact O-N 3.1Å; H169-L173 PolarHBondContact O-N 2.95Å
170	P	49.9	Very low	58.9	Low	53 Å²	53	66 Å²	66	34%	0.344	35%	0.346	S	S	.	.	H	α-helix	trans	-59.9	-29.8	176.3	-19.6	30.5	0	0	0	113.1	Y158 L173 R174	Y158-P170 HydrophobicContact CD1-CB 4.45Å; Y158-P170 HydrophobicContact CD1-CG 3.84Å; Y158-P170 HydrophobicContact CD2-CG 4.26Å; Y158-P170 HydrophobicContact CE1-CG 3.54Å; Y158-P170 VanDerWaalsContact CE2-CD 3.5Å; Y158-P170 HydrophobicContact CE2-CG 3.96Å; Y158-P170 HydrophobicContact CG-CG 4.19Å; P170-L173 PolarHBondContact O-N 2.79Å; P170-R174 WeakPolarHBondContact O-CB 3.44Å; P170-R174 PolarHBondContact O-N 3.37Å
171	C	53	Low	58.9	Low	36 Å²	36	70.6 Å²	70.6	24%	0.243	37%	0.374	C	S	.	.	H	α-helix	trans	-67.9	-35.1	178.1	61.9	0	0	0	0	112.4	H169 I175	H169-C171 PolarHBondContact O-N 3.48Å; C171-I175 WeakPolarHBondContact O-CD1 3.49Å; C171-I175 VanDerWaalsContact O-CG1 3.24Å; C171-I175 WeakPolarHBondContact O-CG1 3.18Å; C171-I175 PolarHBondContact O-N 3.01Å
172	Y	52.6	Low	58.8	Low	92 Å²	92	67.5 Å²	67.5	36%	0.361	36%	0.36	S	S	.	.	H	α-helix	trans	-74.3	-36.4	175.1	-64.6	-55.5	0	0	0	111.9	H169 I175 H176	H169-Y172 HydrophobicContact CB-CD2 3.75Å; H169-Y172 HydrophobicContact CB-CE2 4.17Å; H169-Y172 PolarHBondContact O-N 3.19Å; H169-Y172 VanDerWaalsContact O-N 3.1Å; Y172-I175 HydrophobicContact CD1-CD1 4.47Å; Y172-I175 PolarHBondContact O-N 3.27Å; Y172-H176 WeakPolarHBondContact O-CB 3.17Å; Y172-H176 PolarHBondContact O-N 2.86Å
173	L	61.9	Low	59.2	Low	22 Å²	22	65.2 Å²	65.2	12%	0.115	35%	0.35	C	S	.	.	H	α-helix	trans	-59.2	-48.8	170.1	173.6	58.1	0	0	0	110.5	C160 F167 H169 P170 I175 H176 E177	C160-L173 VanDerWaalsContact CA-CD1 3.48Å; C160-L173 HydrophobicContact CB-CD1 3.5Å; F167-L173 HydrophobicContact CB-CB 4.24Å; F167-L173 HydrophobicContact CD2-CB 3.92Å; F167-L173 HydrophobicContact CD2-CD1 3.75Å; F167-L173 HydrophobicContact CD2-CG 4.43Å; F167-L173 HydrophobicContact CE2-CD1 3.97Å; F167-L173 HydrophobicContact CG-CB 4.24Å; H169-L173 PolarHBondContact O-N 2.95Å; P170-L173 PolarHBondContact O-N 2.79Å; L173-I175 PolarHBondContact O-N 3Å; L173-H176 CarbonylContact O-C 3.41Å; L173-H176 WeakPolarHBondContact O-CA 3.17Å; L173-H176 WeakPolarHBondContact O-CB 3.35Å; L173-H176 PolarHBondContact O-N 3.21Å; L173-E177 HydrophobicContact CD1-CG 4.13Å; L173-E177 HydrophobicContact CG-CG 4.46Å; L173-E177 WeakPolarHBondContact O-CG 3.32Å; L173-E177 PolarHBondContact O-N 3.46Å
174	R	59.4	Low	59.7	Low	159 Å²	159	68.3 Å²	68.3	60%	0.6	36%	0.357	S	S	*	.	H	α-helix	trans	-61.2	-39	177.6	-166.5	-179.7	-62.7	-178.5	-1.4	113.5	P170 H176 E177	P170-R174 WeakPolarHBondContact O-CB 3.44Å; P170-R174 PolarHBondContact O-N 3.37Å; R174-H176 VanDerWaalsContact C-N 3.31Å; R174-E177 WeakPolarHBondContact CA-OE2 3.46Å
175	I	57.4	Low	60.4	Low	54 Å²	54	69.2 Å²	69.2	28%	0.277	36%	0.356	S	S	.	.	H	α-helix	trans	-66	-37.3	173.1	-71.2	162	0	0	0	110.8	C171 Y172 L173 R178 L197	C171-I175 WeakPolarHBondContact O-CD1 3.49Å; C171-I175 VanDerWaalsContact O-CG1 3.24Å; C171-I175 WeakPolarHBondContact O-CG1 3.18Å; C171-I175 PolarHBondContact O-N 3.01Å; Y172-I175 HydrophobicContact CD1-CD1 4.47Å; Y172-I175 PolarHBondContact O-N 3.27Å; L173-I175 PolarHBondContact O-N 3Å; I175-R178 WeakPolarHBondContact O-CB 3.37Å; I175-L197 HydrophobicContact CD1-CD2 3.91Å; I175-L197 HydrophobicContact CG1-CD2 4.08Å; I175-L197 HydrophobicContact CG2-CD2 3.77Å; I175-L197 HydrophobicContact CG2-CG 4.31Å
176	H	61	Low	61	Low	22 Å²	22	65.8 Å²	65.8	10%	0.102	34%	0.34	C	S	.	.	H	α-helix	trans	-70.8	-37.6	177.2	171.5	61.2	0	0	0	112.4	C163 F167 Y172 L173 R174 R178 T179 H180	C163-H176 PolarHBondContact SG-NE2 3.29Å; F167-H176 HydrophobicContact CE1-CB 3.8Å; F167-H176 HydrophobicContact CE2-CB 3.82Å; F167-H176 AromaticContact CE2-CD2 3.28Å; F167-H176 WeakPolarHBondContact CE2-CD2 3.44Å; F167-H176 AromaticContact CE2-CG 3.61Å; F167-H176 HydrophobicContact CZ-CB 3.34Å; F167-H176 AromaticContact CZ-CD2 3.29Å; F167-H176 WeakPolarHBondContact CZ-CD2 3.46Å; F167-H176 AromaticContact CZ-CG 3.14Å; F167-H176 AromaticContact CZ-ND1 3.81Å; F167-H176 AromaticContact CZ-NE2 3.97Å; Y172-H176 WeakPolarHBondContact O-CB 3.17Å; Y172-H176 PolarHBondContact O-N 2.86Å; L173-H176 CarbonylContact O-C 3.41Å; L173-H176 WeakPolarHBondContact O-CA 3.17Å; L173-H176 WeakPolarHBondContact O-CB 3.35Å; L173-H176 PolarHBondContact O-N 3.21Å; R174-H176 VanDerWaalsContact C-N 3.31Å; H176-R178 PolarHBondContact O-N 3.33Å; H176-R178 VanDerWaalsContact O-N 3.16Å; H176-T179 PolarHBondContact CE1-OG1 2.97Å; H176-T179 PolarHBondContact ND1-OG1 3.47Å; H176-T179 WeakPolarHBondContact O-CA 3.35Å; H176-T179 VanDerWaalsContact O-CB 3.27Å; H176-T179 WeakPolarHBondContact O-CB 3.19Å; H176-T179 WeakPolarHBondContact O-CG2 3.46Å; H176-T179 PolarHBondContact O-N 3.07Å; H176-T179 PolarHBondContact O-OG1 2.95Å; H176-H180 AromaticContact CE1-NE2 3.82Å; H176-H180 AromaticContact NE2-NE2 3.34Å; H176-H180 PolarHBondContact NE2-NE2 3.39Å
177	E	62.8	Low	61.6	Low	70 Å²	70	71.1 Å²	71.1	33%	0.327	36%	0.358	S	S	.	.	H	α-helix	trans	-58.4	-28.9	176.1	-74	168.4	161.8	0	0	112.3	L173 R174 T179 H180 T181	L173-E177 HydrophobicContact CD1-CG 4.13Å; L173-E177 HydrophobicContact CG-CG 4.46Å; L173-E177 WeakPolarHBondContact O-CG 3.32Å; L173-E177 PolarHBondContact O-N 3.46Å; R174-E177 WeakPolarHBondContact CA-OE2 3.46Å; E177-T179 PolarHBondContact O-N 3.2Å; E177-T179 VanDerWaalsContact O-N 3.12Å; E177-H180 WeakPolarHBondContact O-CB 3.36Å; E177-H180 PolarHBondContact O-N 3.46Å; E177-T181 PolarHBondContact O-N 2.9Å; E177-T181 VanDerWaalsContact O-N 3.08Å
178	R	71.5	Confident	62.3	Low	48 Å²	48	69.9 Å²	69.9	18%	0.181	35%	0.354	C	S	.	.	H	α-helix	trans	-61	-19	170.8	-62	-175.7	168.8	157.9	1.4	114.4	I175 H176 H180 T181 G182 E183 T196	I175-R178 WeakPolarHBondContact O-CB 3.37Å; H176-R178 PolarHBondContact O-N 3.33Å; H176-R178 VanDerWaalsContact O-N 3.16Å; R178-H180 VanDerWaalsContact C-N 3.32Å; R178-T181 WeakPolarHBondContact CA-OG1 3.15Å; R178-G182 WeakPolarHBondContact O-CA 3.24Å; R178-G182 PolarHBondContact O-N 3.34Å; R178-E183 HydrophobicContact CB-CB 4.38Å; R178-E183 HydrophobicContact CG-CB 4.16Å; R178-E183 WeakPolarHBondContact CG-OE2 3.45Å; R178-E183 IonicContact CZ-OE2 3.37Å; R178-E183 IonicContact NE-OE1 3.87Å; R178-E183 IonicContact NE-OE2 3.93Å; R178-E183 PolarHBondContact NE-OE2 2.76Å; R178-E183 IonicContact NH2-OE1 2.98Å; R178-E183 IonicContact NH2-OE2 3.16Å; R178-E183 PolarHBondContact O-N 3.07Å; R178-T196 HydrophobicContact CB-CG2 4.48Å; R178-T196 PolarHBondContact NH1-O 3.25Å
179	T	55.5	Low	63.5	Low	87 Å²	87	73.5 Å²	73.5	53%	0.534	37%	0.374	S	S	.	.	H	α-helix	trans	-75.2	-23.7	173.5	67.5	0	0	0	0	112.6	H176 E177	H176-T179 PolarHBondContact CE1-OG1 2.97Å; H176-T179 PolarHBondContact ND1-OG1 3.47Å; H176-T179 WeakPolarHBondContact O-CA 3.35Å; H176-T179 VanDerWaalsContact O-CB 3.27Å; H176-T179 WeakPolarHBondContact O-CB 3.19Å; H176-T179 WeakPolarHBondContact O-CG2 3.46Å; H176-T179 PolarHBondContact O-N 3.07Å; H176-T179 PolarHBondContact O-OG1 2.95Å; E177-T179 PolarHBondContact O-N 3.2Å; E177-T179 VanDerWaalsContact O-N 3.12Å
180	H	61.1	Low	64.1	Low	72 Å²	72	75.2 Å²	75.2	33%	0.333	38%	0.382	S	S	.	.	H	α-helix	trans	-88.5	-41.5	174.3	-57.1	-53.1	0	0	0	111.4	C160 H176 E177 R178	C160-H180 PolarHBondContact SG-NE2 3.42Å; C160-H180 VanDerWaalsContact SG-NE2 3.44Å; H176-H180 AromaticContact CE1-NE2 3.82Å; H176-H180 AromaticContact NE2-NE2 3.34Å; H176-H180 PolarHBondContact NE2-NE2 3.39Å; E177-H180 WeakPolarHBondContact O-CB 3.36Å; E177-H180 PolarHBondContact O-N 3.46Å; R178-H180 VanDerWaalsContact C-N 3.32Å
181	T	65.1	Low	65.4	Low	98 Å²	98	74.7 Å²	74.7	60%	0.601	38%	0.379	S	S	*	.	H	α-helix	trans	-81.4	-14.6	-179.5	64.8	0	0	0	0	113.8	E177 R178 E183	E177-T181 PolarHBondContact O-N 2.9Å; E177-T181 VanDerWaalsContact O-N 3.08Å; R178-T181 WeakPolarHBondContact CA-OG1 3.15Å; T181-E183 PolarHBondContact O-N 3.3Å
182	G	62.2	Low	66.6	Low	48 Å²	48	78.5 Å²	78.5	50%	0.495	41%	0.413	S	S	.	.			trans	72.3	5.8	-176.8	0	0	0	0	0	114.6	R178 K184	R178-G182 WeakPolarHBondContact O-CA 3.24Å; R178-G182 PolarHBondContact O-N 3.34Å; G182-K184 PolarHBondContact O-N 3.15Å
183	E	65.3	Low	67.2	Low	95 Å²	95	80 Å²	80	44%	0.444	42%	0.421	S	S	.	.			trans	-61.7	121	-177	-167.1	-158.9	171.5	0	0	111.3	R178 T181 P185	R178-E183 HydrophobicContact CB-CB 4.38Å; R178-E183 HydrophobicContact CG-CB 4.16Å; R178-E183 WeakPolarHBondContact CG-OE2 3.45Å; R178-E183 IonicContact CZ-OE2 3.37Å; R178-E183 IonicContact NE-OE1 3.87Å; R178-E183 IonicContact NE-OE2 3.93Å; R178-E183 PolarHBondContact NE-OE2 2.76Å; R178-E183 IonicContact NH2-OE1 2.98Å; R178-E183 IonicContact NH2-OE2 3.16Å; R178-E183 PolarHBondContact O-N 3.07Å; T181-E183 PolarHBondContact O-N 3.3Å; E183-P185 HydrophobicContact CG-CG 4.07Å; E183-P185 WeakPolarHBondContact O-CD 3.39Å
184	K	72.4	Confident	67.5	Low	118 Å²	118	80.2 Å²	80.2	51%	0.513	43%	0.426	S	S	.	.			trans	-124.8	79.6	-179.9	-72.3	165.4	176.4	-179.4	0	110.7	G182 Y186 A194 F195 T196	G182-K184 PolarHBondContact O-N 3.15Å; K184-Y186 PolarHBondContact O-N 3.45Å; K184-Y186 VanDerWaalsContact O-N 3.14Å; K184-A194 HydrophobicContact CB-CB 3.55Å; K184-A194 HydrophobicContact CD-CB 4.18Å; K184-A194 WeakPolarHBondContact CD-O 3.44Å; K184-A194 HydrophobicContact CG-CB 4.45Å; K184-F195 CarbonylContact C-O 3.5Å; K184-F195 VanDerWaalsContact C-O 3.29Å; K184-F195 WeakPolarHBondContact CA-O 3.38Å; K184-T196 HydrophobicContact CG-CG2 4.02Å
185	P	71.1	Confident	68.1	Low	60 Å²	60	74.4 Å²	74.4	39%	0.39	41%	0.405	S	S	.	.			trans	-66.8	-18.1	-171.1	-21.9	34.1	0	0	0	114.7	E183	E183-P185 HydrophobicContact CG-CG 4.07Å; E183-P185 WeakPolarHBondContact O-CD 3.39Å
186	Y	72.9	Confident	68.1	Low	50 Å²	50	73.1 Å²	73.1	20%	0.196	40%	0.4	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	93.6	-172.8	-58.7	-80.1	0	0	0	110.2	Q114 K184 A194 F195 T196 L197 R198	Q114-Y186 PolarHBondContact NE2-OH 3.29Å; K184-Y186 PolarHBondContact O-N 3.45Å; K184-Y186 VanDerWaalsContact O-N 3.14Å; Y186-A194 CarbonylContact O-C 3.55Å; Y186-A194 WeakPolarHBondContact O-CA 3.37Å; Y186-F195 PolarHBondContact N-O 3.04Å; Y186-F195 VanDerWaalsContact N-O 3.08Å; Y186-F195 PolarHBondContact O-N 3.34Å; Y186-T196 WeakPolarHBondContact CE2-O 3.49Å; Y186-L197 VanDerWaalsContact CD2-C 3.41Å; Y186-R198 HydrophobicContact CD1-CB 3.82Å; Y186-R198 HydrophobicContact CD1-CG 4.13Å; Y186-R198 HydrophobicContact CE1-CB 3.57Å; Y186-R198 HydrophobicContact CE1-CG 4.04Å; Y186-R198 HydrophobicContact CE2-CB 4.42Å; Y186-R198 HydrophobicContact CG-CB 4.33Å
187	Q	70.6	Confident	68.3	Low	150 Å²	150	74.4 Å²	74.4	70%	0.701	41%	0.407	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-85.2	142.4	179.9	-63.4	-178.8	-14.4	0	0	111.8	A194 L201	Q187-A194 HydrophobicContact CG-CB 3.99Å; Q187-L201 WeakPolarHBondContact O-CD2 3.33Å
188	C	77.5	Confident	68.1	Low	12 Å²	12	78.2 Å²	78.2	8%	0.081	42%	0.419	C	S	.	.			trans	-78.1	131.9	169.2	-170.6	0	0	0	0	109.7	Q190 K193 L201 H208	C188-Q190 PolarHBondContact O-N 3.38Å; C188-Q190 PolarHBondContact SG-N 3.27Å; C188-Q190 VanDerWaalsContact SG-N 3.41Å; C188-K193 VanDerWaalsContact CB-O 3.23Å; C188-K193 WeakPolarHBondContact CB-O 3.48Å; C188-K193 PolarHBondContact N-O 3.36Å; C188-L201 HydrophobicContact CB-CD1 3.79Å; C188-H208 PolarHBondContact SG-NE2 3.21Å
189	N	73.8	Confident	67.4	Low	126 Å²	126	79.5 Å²	79.5	67%	0.674	44%	0.435	S	S	*	.	S	Bend	trans	-81	-3	175.1	62.3	-29.3	0	0	0	113.1
190	Q	69.1	Low	67.7	Low	107 Å²	107	79.1 Å²	79.1	50%	0.5	43%	0.427	S	S	.	.	S	Bend	trans	-117.4	-5.9	-177.3	-67.3	174.5	-19.9	0	0	113	C188 H208	C188-Q190 PolarHBondContact O-N 3.38Å; C188-Q190 PolarHBondContact SG-N 3.27Å; C188-Q190 VanDerWaalsContact SG-N 3.41Å; Q190-H208 HydrophobicContact CB-CB 4.47Å; Q190-H208 PolarHBondContact O-CE1 3.1Å; Q190-H208 PolarHBondContact OE1-CD2 2.98Å
191	C	78.1	Confident	68	Low	43 Å²	43	76.5 Å²	76.5	29%	0.291	42%	0.416	S	S	.	.	S	Bend	trans	-160.5	169.8	168.4	67.3	0	0	0	0	111.7	K193 H204 H208	C191-K193 PolarHBondContact O-N 3.09Å; C191-K193 VanDerWaalsContact SG-CB 3.58Å; C191-H204 PolarHBondContact SG-NE2 3.28Å; C191-H208 PolarHBondContact SG-NE2 3.27Å
192	A	77	Confident	68.1	Low	115 Å²	115	77.4 Å²	77.4	95%	0.95	41%	0.413	S	S	*	.	S	Bend	trans	-67.8	10.8	178.7	0	0	0	0	0	115.4
193	K	65.2	Low	68.1	Low	123 Å²	123	77.3 Å²	77.3	54%	0.535	41%	0.405	S	S	.	.			trans	-85	129.1	-178.7	-68.3	179.3	178.8	173.7	0	111.5	C188 C191 F195	C188-K193 VanDerWaalsContact CB-O 3.23Å; C188-K193 WeakPolarHBondContact CB-O 3.48Å; C188-K193 PolarHBondContact N-O 3.36Å; C191-K193 PolarHBondContact O-N 3.09Å; C191-K193 VanDerWaalsContact SG-CB 3.58Å; K193-F195 HydrophobicContact CB-CE2 3.84Å; K193-F195 HydrophobicContact CB-CZ 3.81Å; K193-F195 HydrophobicContact CD-CZ 4.49Å
194	A	68.3	Low	68.5	Low	27 Å²	27	73.5 Å²	73.5	22%	0.223	39%	0.387	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	149.1	174.2	0	0	0	0	0	111.4	K184 Y186 Q187	K184-A194 HydrophobicContact CB-CB 3.55Å; K184-A194 HydrophobicContact CD-CB 4.18Å; K184-A194 WeakPolarHBondContact CD-O 3.44Å; K184-A194 HydrophobicContact CG-CB 4.45Å; Y186-A194 CarbonylContact O-C 3.55Å; Y186-A194 WeakPolarHBondContact O-CA 3.37Å; Q187-A194 HydrophobicContact CG-CB 3.99Å
195	F	73.2	Confident	68.4	Low	38 Å²	38	71.2 Å²	71.2	17%	0.167	38%	0.377	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	152.1	-172	-58.3	-87	0	0	0	111.7	K184 Y186 K193 Q200 L201 H204	K184-F195 CarbonylContact C-O 3.5Å; K184-F195 VanDerWaalsContact C-O 3.29Å; K184-F195 WeakPolarHBondContact CA-O 3.38Å; Y186-F195 PolarHBondContact N-O 3.04Å; Y186-F195 VanDerWaalsContact N-O 3.08Å; Y186-F195 PolarHBondContact O-N 3.34Å; K193-F195 HydrophobicContact CB-CE2 3.84Å; K193-F195 HydrophobicContact CB-CZ 3.81Å; K193-F195 HydrophobicContact CD-CZ 4.49Å; F195-Q200 HydrophobicContact CB-CB 3.95Å; F195-Q200 HydrophobicContact CD1-CB 3.77Å; F195-Q200 HydrophobicContact CG-CB 4.09Å; F195-L201 HydrophobicContact CB-CB 4.3Å; F195-L201 HydrophobicContact CD2-CB 3.8Å; F195-L201 HydrophobicContact CD2-CD1 3.8Å; F195-L201 HydrophobicContact CD2-CG 4.4Å; F195-L201 HydrophobicContact CE2-CD1 3.96Å; F195-L201 HydrophobicContact CG-CB 4.24Å; F195-H204 HydrophobicContact CE1-CB 3.91Å; F195-H204 HydrophobicContact CE2-CB 3.78Å; F195-H204 AromaticContact CE2-CD2 3.25Å; F195-H204 WeakPolarHBondContact CE2-CD2 3.33Å; F195-H204 AromaticContact CE2-CG 3.59Å; F195-H204 HydrophobicContact CZ-CB 3.36Å; F195-H204 AromaticContact CZ-CD2 3.28Å; F195-H204 WeakPolarHBondContact CZ-CD2 3.41Å; F195-H204 AromaticContact CZ-CG 3.15Å; F195-H204 AromaticContact CZ-ND1 3.82Å; F195-H204 AromaticContact CZ-NE2 3.95Å
196	T	56.8	Low	68.2	Low	26 Å²	26	70.2 Å²	70.2	16%	0.16	37%	0.37	C	S	.	.	S	Bend	trans	-80.6	-22.4	179	59.7	0	0	0	0	112.1	R178 K184 Y186 Q200	R178-T196 HydrophobicContact CB-CG2 4.48Å; R178-T196 PolarHBondContact NH1-O 3.25Å; K184-T196 HydrophobicContact CG-CG2 4.02Å; Y186-T196 WeakPolarHBondContact CE2-O 3.49Å; T196-Q200 PolarHBondContact OG1-OE1 3.33Å
197	L	64.1	Low	67.8	Low	49 Å²	49	71.9 Å²	71.9	26%	0.257	39%	0.385	S	S	.	.	S	Bend	trans	-128.1	142.6	-180	-64.6	175	0	0	0	112.5	I175 Y186 S199 Q200 L201	I175-L197 HydrophobicContact CD1-CD2 3.91Å; I175-L197 HydrophobicContact CG1-CD2 4.08Å; I175-L197 HydrophobicContact CG2-CD2 3.77Å; I175-L197 HydrophobicContact CG2-CG 4.31Å; Y186-L197 VanDerWaalsContact CD2-C 3.41Å; L197-S199 VanDerWaalsContact C-N 3.27Å; L197-S199 PolarHBondContact O-N 3.25Å; L197-Q200 HydrophobicContact CB-CB 4.43Å; L197-Q200 HydrophobicContact CB-CG 4.01Å; L197-Q200 WeakPolarHBondContact O-CB 3.45Å; L197-Q200 PolarHBondContact O-N 2.9Å; L197-Q200 VanDerWaalsContact O-N 3.11Å; L197-L201 PolarHBondContact O-N 3.04Å
198	R	59.6	Low	67.7	Low	151 Å²	151	68.1 Å²	68.1	57%	0.57	37%	0.367	S	S	*	.	H	α-helix	trans	-58.9	-36.7	174.5	-167.2	173.1	179.4	149.7	0.6	112.9	Y186 Q200 L201 Q202	Y186-R198 HydrophobicContact CD1-CB 3.82Å; Y186-R198 HydrophobicContact CD1-CG 4.13Å; Y186-R198 HydrophobicContact CE1-CB 3.57Å; Y186-R198 HydrophobicContact CE1-CG 4.04Å; Y186-R198 HydrophobicContact CE2-CB 4.42Å; Y186-R198 HydrophobicContact CG-CB 4.33Å; R198-Q200 VanDerWaalsContact C-N 3.32Å; R198-Q200 PolarHBondContact O-N 2.84Å; R198-L201 PolarHBondContact O-N 3.28Å; R198-Q202 WeakPolarHBondContact O-CB 3.18Å; R198-Q202 PolarHBondContact O-N 2.74Å
199	S	57.6	Low	67.2	Low	75 Å²	75	71.7 Å²	71.7	52%	0.524	39%	0.389	S	S	.	.	H	α-helix	trans	-63.3	-36.6	176.7	54.1	0	0	0	0	112.5	L197 Q202 S203	L197-S199 VanDerWaalsContact C-N 3.27Å; L197-S199 PolarHBondContact O-N 3.25Å; S199-Q202 PolarHBondContact O-N 3.32Å; S199-S203 WeakPolarHBondContact O-CB 3.37Å; S199-S203 PolarHBondContact O-N 3.29Å; S199-S203 PolarHBondContact O-OG 3.05Å; S199-S203 VanDerWaalsContact O-OG 3.09Å
200	Q	60.2	Low	66.6	Low	79 Å²	79	68.2 Å²	68.2	37%	0.369	38%	0.383	S	S	.	.	H	α-helix	trans	-69.2	-42.3	176.5	-66.8	171.2	-9.7	0	0	111.6	F195 T196 L197 R198 Q202 S203 H204	F195-Q200 HydrophobicContact CB-CB 3.95Å; F195-Q200 HydrophobicContact CD1-CB 3.77Å; F195-Q200 HydrophobicContact CG-CB 4.09Å; T196-Q200 PolarHBondContact OG1-OE1 3.33Å; L197-Q200 HydrophobicContact CB-CB 4.43Å; L197-Q200 HydrophobicContact CB-CG 4.01Å; L197-Q200 WeakPolarHBondContact O-CB 3.45Å; L197-Q200 PolarHBondContact O-N 2.9Å; L197-Q200 VanDerWaalsContact O-N 3.11Å; R198-Q200 VanDerWaalsContact C-N 3.32Å; R198-Q200 PolarHBondContact O-N 2.84Å; Q200-Q202 VanDerWaalsContact C-N 3.33Å; Q200-S203 PolarHBondContact O-N 3.1Å; Q200-H204 VanDerWaalsContact O-CB 3.28Å; Q200-H204 WeakPolarHBondContact O-CB 3.29Å; Q200-H204 PolarHBondContact O-N 3.27Å
201	L	68.6	Low	66.4	Low	17 Å²	17	67.1 Å²	67.1	9%	0.089	38%	0.383	C	S	.	.	H	α-helix	trans	-60.2	-44.7	172.1	173.7	61.1	0	0	0	110.9	Q187 C188 F195 L197 R198 S203 H204 K205	Q187-L201 WeakPolarHBondContact O-CD2 3.33Å; C188-L201 HydrophobicContact CB-CD1 3.79Å; F195-L201 HydrophobicContact CB-CB 4.3Å; F195-L201 HydrophobicContact CD2-CB 3.8Å; F195-L201 HydrophobicContact CD2-CD1 3.8Å; F195-L201 HydrophobicContact CD2-CG 4.4Å; F195-L201 HydrophobicContact CE2-CD1 3.96Å; F195-L201 HydrophobicContact CG-CB 4.24Å; L197-L201 PolarHBondContact O-N 3.04Å; R198-L201 PolarHBondContact O-N 3.28Å; L201-S203 VanDerWaalsContact C-N 3.35Å; L201-S203 PolarHBondContact O-N 2.81Å; L201-H204 WeakPolarHBondContact O-CB 3.46Å; L201-H204 PolarHBondContact O-N 2.76Å; L201-H204 VanDerWaalsContact O-N 3.12Å; L201-K205 HydrophobicContact CD1-CG 4.45Å; L201-K205 WeakPolarHBondContact O-CG 3.19Å; L201-K205 PolarHBondContact O-N 3.16Å
202	Q	66.8	Low	66.1	Low	117 Å²	117	72.3 Å²	72.3	55%	0.547	40%	0.397	S	S	.	.	H	α-helix	trans	-62	-41.9	178.3	-168.6	63.7	22.2	0	0	112.1	R198 S199 Q200 H204	R198-Q202 WeakPolarHBondContact O-CB 3.18Å; R198-Q202 PolarHBondContact O-N 2.74Å; S199-Q202 PolarHBondContact O-N 3.32Å; Q200-Q202 VanDerWaalsContact C-N 3.33Å; Q202-H204 VanDerWaalsContact C-N 3.31Å
203	S	62.3	Low	65.8	Low	46 Å²	46	70.4 Å²	70.4	32%	0.322	38%	0.375	S	S	.	.	H	α-helix	trans	-71	-25	174.7	-61.1	0	0	0	0	113.5	S199 Q200 L201 Q225	S199-S203 WeakPolarHBondContact O-CB 3.37Å; S199-S203 PolarHBondContact O-N 3.29Å; S199-S203 PolarHBondContact O-OG 3.05Å; S199-S203 VanDerWaalsContact O-OG 3.09Å; Q200-S203 PolarHBondContact O-N 3.1Å; L201-S203 VanDerWaalsContact C-N 3.35Å; L201-S203 PolarHBondContact O-N 2.81Å; S203-Q225 VanDerWaalsContact CB-NE2 3.27Å
204	H	72.9	Confident	66.4	Low	15 Å²	15	68.5 Å²	68.5	7%	0.069	37%	0.365	C	S	.	.	H	α-helix	trans	-77.1	-34.9	175.4	171.9	57.8	0	0	0	112.8	C191 F195 Q200 L201 Q202 V206 V207 H208	C191-H204 PolarHBondContact SG-NE2 3.28Å; F195-H204 HydrophobicContact CE1-CB 3.91Å; F195-H204 HydrophobicContact CE2-CB 3.78Å; F195-H204 AromaticContact CE2-CD2 3.25Å; F195-H204 WeakPolarHBondContact CE2-CD2 3.33Å; F195-H204 AromaticContact CE2-CG 3.59Å; F195-H204 HydrophobicContact CZ-CB 3.36Å; F195-H204 AromaticContact CZ-CD2 3.28Å; F195-H204 WeakPolarHBondContact CZ-CD2 3.41Å; F195-H204 AromaticContact CZ-CG 3.15Å; F195-H204 AromaticContact CZ-ND1 3.82Å; F195-H204 AromaticContact CZ-NE2 3.95Å; Q200-H204 VanDerWaalsContact O-CB 3.28Å; Q200-H204 WeakPolarHBondContact O-CB 3.29Å; Q200-H204 PolarHBondContact O-N 3.27Å; L201-H204 WeakPolarHBondContact O-CB 3.46Å; L201-H204 PolarHBondContact O-N 2.76Å; L201-H204 VanDerWaalsContact O-N 3.12Å; Q202-H204 VanDerWaalsContact C-N 3.31Å; H204-V206 PolarHBondContact O-N 3.37Å; H204-V206 VanDerWaalsContact O-N 3.09Å; H204-V207 WeakPolarHBondContact O-CB 3.39Å; H204-V207 WeakPolarHBondContact O-CG2 3.44Å; H204-V207 PolarHBondContact O-N 2.91Å; H204-H208 AromaticContact CE1-NE2 3.71Å; H204-H208 AromaticContact NE2-CD2 3.94Å; H204-H208 AromaticContact NE2-NE2 3.29Å; H204-H208 PolarHBondContact NE2-NE2 2.83Å
205	K	70.1	Confident	66.6	Low	69 Å²	69	71.3 Å²	71.3	30%	0.3	38%	0.375	S	S	.	.	H	α-helix	trans	-54.8	-29.2	175.8	-75.2	179.9	175.4	-171.2	0	113.2	L201 V207 H208 T209	L201-K205 HydrophobicContact CD1-CG 4.45Å; L201-K205 WeakPolarHBondContact O-CG 3.19Å; L201-K205 PolarHBondContact O-N 3.16Å; K205-V207 PolarHBondContact O-N 3.5Å; K205-H208 PolarHBondContact O-N 3.09Å; K205-H208 VanDerWaalsContact O-N 3.1Å; K205-T209 PolarHBondContact O-N 3.21Å
206	V	68.1	Low	66.9	Low	40 Å²	40	69.6 Å²	69.6	24%	0.242	37%	0.367	C	S	.	.	H	α-helix	trans	-62.6	-21.7	174.5	-173.6	0	0	0	0	112.7	H204 T209 V211 P224	H204-V206 PolarHBondContact O-N 3.37Å; H204-V206 VanDerWaalsContact O-N 3.09Å; V206-T209 PolarHBondContact O-OG1 3.39Å; V206-V211 WeakPolarHBondContact CG1-O 3.16Å; V206-P224 HydrophobicContact CG1-CB 4.18Å
207	V	63.6	Low	67.8	Low	84 Å²	84	78 Å²	78	51%	0.509	40%	0.402	S	S	.	.	H	α-helix	trans	-69.9	-36.9	174.2	-179.9	0	0	0	0	111.3	H204 K205	H204-V207 WeakPolarHBondContact O-CB 3.39Å; H204-V207 WeakPolarHBondContact O-CG2 3.44Å; H204-V207 PolarHBondContact O-N 2.91Å; K205-V207 PolarHBondContact O-N 3.5Å
208	H	69.8	Low	68.3	Low	72 Å²	72	81.8 Å²	81.8	33%	0.333	42%	0.418	S	S	.	.	H	α-helix	trans	-77.4	-31.7	-179.2	-68.9	-68.4	0	0	0	113	C188 Q190 C191 H204 K205 G210	C188-H208 PolarHBondContact SG-NE2 3.21Å; Q190-H208 HydrophobicContact CB-CB 4.47Å; Q190-H208 PolarHBondContact O-CE1 3.1Å; Q190-H208 PolarHBondContact OE1-CD2 2.98Å; C191-H208 PolarHBondContact SG-NE2 3.27Å; H204-H208 AromaticContact CE1-NE2 3.71Å; H204-H208 AromaticContact NE2-CD2 3.94Å; H204-H208 AromaticContact NE2-NE2 3.29Å; H204-H208 PolarHBondContact NE2-NE2 2.83Å; K205-H208 PolarHBondContact O-N 3.09Å; K205-H208 VanDerWaalsContact O-N 3.1Å; H208-G210 PolarHBondContact O-N 3.45Å
209	T	66.8	Low	69.3	Low	87 Å²	87	76.8 Å²	76.8	53%	0.534	41%	0.406	S	S	.	.	S	Bend	trans	-76.1	-10.1	176.2	62.4	0	0	0	0	112.6	K205 V206 V211	K205-T209 PolarHBondContact O-N 3.21Å; V206-T209 PolarHBondContact O-OG1 3.39Å; T209-V211 PolarHBondContact O-N 3.4Å
210	G	60.1	Low	70.1	Confident	53 Å²	53	79.3 Å²	79.3	55%	0.546	41%	0.414	S	S	.	.			trans	67.1	-6.7	-177.6	0	0	0	0	0	114.6	H208 R212	H208-G210 PolarHBondContact O-N 3.45Å; G210-R212 PolarHBondContact O-N 3.25Å
211	V	64.4	Low	70.7	Confident	84 Å²	84	81.3 Å²	81.3	51%	0.509	42%	0.421	S	S	.	.			trans	-68.1	118.6	-178.6	-174	0	0	0	0	108.5	V206 T209 P213	V206-V211 WeakPolarHBondContact CG1-O 3.16Å; T209-V211 PolarHBondContact O-N 3.4Å; V211-P213 VanDerWaalsContact C-CD 3.46Å; V211-P213 HydrophobicContact CG1-CB 4.42Å; V211-P213 HydrophobicContact CG1-CG 4.49Å; V211-P213 WeakPolarHBondContact O-CD 3.37Å
212	R	73.1	Confident	71	Confident	152 Å²	152	81.9 Å²	81.9	57%	0.574	43%	0.428	S	S	*	.			trans	-113.6	76.1	176.9	-69.5	174.8	174.4	-160.7	10.5	109.2	G210 Y214 A222 Y223	G210-R212 PolarHBondContact O-N 3.25Å; R212-Y214 PolarHBondContact O-N 3.39Å; R212-Y214 VanDerWaalsContact O-N 3.09Å; R212-A222 HydrophobicContact CB-CB 3.47Å; R212-A222 VanDerWaalsContact CB-CB 3.47Å; R212-A222 WeakPolarHBondContact CD-O 3.31Å; R212-A222 HydrophobicContact CG-CB 4.38Å; R212-A222 PolarHBondContact NH1-O 3.4Å; R212-Y223 CarbonylContact C-O 3.25Å; R212-Y223 WeakPolarHBondContact CA-O 3.4Å
213	P	71.3	Confident	71.3	Confident	75 Å²	75	78.4 Å²	78.4	49%	0.487	41%	0.41	S	S	.	.			trans	-72.2	-7.8	-166.4	27.9	-31.8	0	0	0	113.6	V211	V211-P213 VanDerWaalsContact C-CD 3.46Å; V211-P213 HydrophobicContact CG1-CB 4.42Å; V211-P213 HydrophobicContact CG1-CG 4.49Å; V211-P213 WeakPolarHBondContact O-CD 3.37Å
214	Y	77.5	Confident	71.4	Confident	83 Å²	83	77.7 Å²	77.7	33%	0.325	41%	0.405	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	98.3	-177.5	-57.3	-76.5	0	0	0	110.6	R212 A222 Y223 Q225 Q226	R212-Y214 PolarHBondContact O-N 3.39Å; R212-Y214 VanDerWaalsContact O-N 3.09Å; Y214-A222 CarbonylContact O-C 3.56Å; Y214-Y223 PolarHBondContact N-O 3.03Å; Y214-Y223 PolarHBondContact O-N 3.48Å; Y214-Q225 VanDerWaalsContact CD2-CA 3.48Å; Y214-Q226 HydrophobicContact CD1-CB 3.69Å; Y214-Q226 HydrophobicContact CD1-CG 3.93Å; Y214-Q226 HydrophobicContact CD2-CB 4.44Å; Y214-Q226 VanDerWaalsContact CD2-N 3.27Å; Y214-Q226 HydrophobicContact CE1-CB 3.57Å; Y214-Q226 HydrophobicContact CE1-CG 4.02Å; Y214-Q226 HydrophobicContact CE2-CB 4.33Å; Y214-Q226 HydrophobicContact CG-CB 4.12Å
215	I	71.4	Confident	71.3	Confident	86 Å²	86	79.3 Å²	79.3	44%	0.441	41%	0.412	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.6	133.4	-177	-56.4	173	0	0	0	110.2	K217 N220 A222	I215-K217 PolarHBondContact O-N 2.69Å; I215-N220 VanDerWaalsContact CG2-OD1 3.25Å; I215-N220 WeakPolarHBondContact CG2-OD1 3.45Å; I215-A222 HydrophobicContact CG1-CB 4.03Å
216	C	79.2	Confident	71.4	Confident	1 Å²	1	80.6 Å²	80.6	1%	0.007	42%	0.419	C	S	.	.			trans	-73.7	116.2	172.6	-178.3	0	0	0	0	110.2	Q218 C219 N220 K221 Y223 L229	C216-Q218 PolarHBondContact O-N 3.46Å; C216-Q218 VanDerWaalsContact O-N 3.13Å; C216-C219 PolarHBondContact O-N 3.39Å; C216-N220 WeakPolarHBondContact O-CA 3.44Å; C216-N220 PolarHBondContact O-N 3.27Å; C216-K221 WeakPolarHBondContact CB-O 3.39Å; C216-K221 PolarHBondContact N-O 3.26Å; C216-Y223 HydrophobicContact CB-CE2 4.34Å; C216-L229 VanDerWaalsContact CA-CD1 3.44Å; C216-L229 HydrophobicContact CB-CD1 3.51Å
217	K	76.6	Confident	71.4	Confident	203 Å²	203	81.3 Å²	81.3	88%	0.883	43%	0.426	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.3	-19.3	-179.2	-62	-174	177.8	-173.7	0	114.2	I215	I215-K217 PolarHBondContact O-N 2.69Å
218	Q	75.2	Confident	71.6	Confident	128 Å²	128	82.4 Å²	82.4	60%	0.598	42%	0.422	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.9	-29	-175.4	-64.7	-179.1	7.3	0	0	114.3	C216 H236	C216-Q218 PolarHBondContact O-N 3.46Å; C216-Q218 VanDerWaalsContact O-N 3.13Å; Q218-H236 VanDerWaalsContact OE1-CG 3.26Å
219	C	79.5	Confident	71.8	Confident	46 Å²	46	79.7 Å²	79.7	31%	0.311	41%	0.41	S	S	.	.	T	Hydrogen-bonded Turn	trans	-135.2	10.7	-179.5	73	0	0	0	0	113.8	C216 K221 H232 H236	C216-C219 PolarHBondContact O-N 3.39Å; C219-K221 PolarHBondContact O-N 2.92Å; C219-H232 PolarHBondContact SG-NE2 2.92Å; C219-H236 PolarHBondContact SG-NE2 3.41Å
220	N	74.4	Confident	72	Confident	129 Å²	129	83.1 Å²	83.1	69%	0.69	41%	0.413	S	S	*	.			trans	56.7	15.3	178.6	-139	22.9	0	0	0	116.1	I215 C216 A222	I215-N220 VanDerWaalsContact CG2-OD1 3.25Å; I215-N220 WeakPolarHBondContact CG2-OD1 3.45Å; C216-N220 WeakPolarHBondContact O-CA 3.44Å; C216-N220 PolarHBondContact O-N 3.27Å; N220-A222 PolarHBondContact O-N 2.91Å
221	K	73.9	Confident	72.3	Confident	121 Å²	121	85.3 Å²	85.3	53%	0.526	41%	0.407	S	S	.	.			trans	-72.9	127.5	176.6	-72.4	-177.7	-177.1	179.4	0	111	C216 C219 Y223	C216-K221 WeakPolarHBondContact CB-O 3.39Å; C216-K221 PolarHBondContact N-O 3.26Å; C219-K221 PolarHBondContact O-N 2.92Å; K221-Y223 HydrophobicContact CB-CE2 3.67Å; K221-Y223 WeakPolarHBondContact CB-OH 3.2Å; K221-Y223 VanDerWaalsContact O-CD2 3.3Å; K221-Y223 WeakPolarHBondContact O-CD2 3.49Å; K221-Y223 WeakPolarHBondContact O-CE2 3.44Å
222	A	73	Confident	72.7	Confident	29 Å²	29	82.4 Å²	82.4	24%	0.24	39%	0.388	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.1	138.2	-179.5	0	0	0	0	0	111.9	R212 Y214 I215 N220	R212-A222 HydrophobicContact CB-CB 3.47Å; R212-A222 VanDerWaalsContact CB-CB 3.47Å; R212-A222 WeakPolarHBondContact CD-O 3.31Å; R212-A222 HydrophobicContact CG-CB 4.38Å; R212-A222 PolarHBondContact NH1-O 3.4Å; Y214-A222 CarbonylContact O-C 3.56Å; I215-A222 HydrophobicContact CG1-CB 4.03Å; N220-A222 PolarHBondContact O-N 2.91Å
223	Y	75.1	Confident	72.6	Confident	43 Å²	43	78.4 Å²	78.4	17%	0.169	38%	0.376	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	145.8	-177.2	-63.8	-86.9	0	0	0	111.7	R212 Y214 C216 K221 Q225 L229 H232	R212-Y223 CarbonylContact C-O 3.25Å; R212-Y223 WeakPolarHBondContact CA-O 3.4Å; Y214-Y223 PolarHBondContact N-O 3.03Å; Y214-Y223 PolarHBondContact O-N 3.48Å; C216-Y223 HydrophobicContact CB-CE2 4.34Å; K221-Y223 HydrophobicContact CB-CE2 3.67Å; K221-Y223 WeakPolarHBondContact CB-OH 3.2Å; K221-Y223 VanDerWaalsContact O-CD2 3.3Å; K221-Y223 WeakPolarHBondContact O-CD2 3.49Å; K221-Y223 WeakPolarHBondContact O-CE2 3.44Å; Y223-Q225 VanDerWaalsContact C-N 3.32Å; Y223-Q225 PolarHBondContact O-N 3.13Å; Y223-L229 HydrophobicContact CD2-CB 4Å; Y223-L229 HydrophobicContact CD2-CD1 3.77Å; Y223-L229 HydrophobicContact CD2-CG 4.49Å; Y223-L229 HydrophobicContact CE2-CD1 4.09Å; Y223-L229 HydrophobicContact CG-CB 4.25Å; Y223-H232 HydrophobicContact CE1-CB 3.98Å; Y223-H232 HydrophobicContact CE2-CB 3.91Å; Y223-H232 AromaticContact CE2-CD2 3.36Å; Y223-H232 WeakPolarHBondContact CE2-CD2 3.32Å; Y223-H232 AromaticContact CE2-CG 3.69Å; Y223-H232 AromaticContact CZ-CD2 3.49Å; Y223-H232 VanDerWaalsContact CZ-CD2 3.49Å; Y223-H232 AromaticContact CZ-CG 3.35Å; Y223-H232 AromaticContact CZ-ND1 3.98Å; Y223-H232 PolarHBondContact OH-CD2 3.21Å; Y223-H232 PolarHBondContact OH-CE1 2.65Å; Y223-H232 PolarHBondContact OH-ND1 3.5Å; Y223-H232 VanDerWaalsContact OH-ND1 3.09Å; Y223-H232 PolarHBondContact OH-NE2 3.21Å
224	P	64.5	Low	72.8	Confident	32 Å²	32	78.5 Å²	78.5	21%	0.208	37%	0.366	C	S	.	.	S	Bend	trans	-75.5	-18	179.7	28.5	-33.8	0	0	0	113.5	V206 Y228	V206-P224 HydrophobicContact CG1-CB 4.18Å; P224-Y228 HydrophobicContact CG-CD2 4.31Å
225	Q	70.1	Confident	72.2	Confident	48 Å²	48	79.2 Å²	79.2	22%	0.224	38%	0.38	C	S	.	.	S	Bend	trans	-140	147.4	177.6	-54.2	172.5	9.5	0	0	111.3	S203 Y214 Y223 S227 Y228 L229	S203-Q225 VanDerWaalsContact CB-NE2 3.27Å; Y214-Q225 VanDerWaalsContact CD2-CA 3.48Å; Y223-Q225 VanDerWaalsContact C-N 3.32Å; Y223-Q225 PolarHBondContact O-N 3.13Å; Q225-S227 PolarHBondContact O-N 3.45Å; Q225-S227 PolarHBondContact OE1-OG 3.3Å; Q225-Y228 HydrophobicContact CB-CD2 3.66Å; Q225-Y228 HydrophobicContact CB-CE2 4.16Å; Q225-Y228 VanDerWaalsContact CD-CE2 3.44Å; Q225-Y228 HydrophobicContact CG-CD2 3.95Å; Q225-Y228 HydrophobicContact CG-CE2 4Å; Q225-Y228 PolarHBondContact O-N 3.04Å; Q225-Y228 VanDerWaalsContact O-N 3.1Å; Q225-L229 PolarHBondContact O-N 3.49Å
226	Q	71.1	Confident	71.9	Confident	97 Å²	97	78.6 Å²	78.6	45%	0.453	38%	0.375	S	S	.	.	H	α-helix	trans	-63	-29.6	178	-161.8	162	2.8	0	0	113.2	Y214 Y228 L229 R230	Y214-Q226 HydrophobicContact CD1-CB 3.69Å; Y214-Q226 HydrophobicContact CD1-CG 3.93Å; Y214-Q226 HydrophobicContact CD2-CB 4.44Å; Y214-Q226 VanDerWaalsContact CD2-N 3.27Å; Y214-Q226 HydrophobicContact CE1-CB 3.57Å; Y214-Q226 HydrophobicContact CE1-CG 4.02Å; Y214-Q226 HydrophobicContact CE2-CB 4.33Å; Y214-Q226 HydrophobicContact CG-CB 4.12Å; Q226-Y228 VanDerWaalsContact C-N 3.31Å; Q226-Y228 PolarHBondContact O-N 3.28Å; Q226-L229 PolarHBondContact O-N 3.2Å; Q226-R230 WeakPolarHBondContact O-CB 3.38Å; Q226-R230 WeakPolarHBondContact O-CG 3.41Å; Q226-R230 PolarHBondContact O-N 3.06Å
227	S	67.9	Low	71.2	Confident	54 Å²	54	83.2 Å²	83.2	38%	0.378	40%	0.403	S	S	.	.	H	α-helix	trans	-63.8	-35.1	175	58.8	0	0	0	0	112.4	Q225 K231	Q225-S227 PolarHBondContact O-N 3.45Å; Q225-S227 PolarHBondContact OE1-OG 3.3Å; S227-K231 VanDerWaalsContact O-CG 3.3Å; S227-K231 WeakPolarHBondContact O-CG 3.48Å; S227-K231 PolarHBondContact O-N 2.59Å
228	Y	68.2	Low	70.6	Confident	108 Å²	108	76 Å²	76	42%	0.424	39%	0.386	S	S	.	.	H	α-helix	trans	-75.9	-41.1	175.6	-66.8	-58.4	0	0	0	111.6	P224 Q225 Q226 K231 H232	P224-Y228 HydrophobicContact CG-CD2 4.31Å; Q225-Y228 HydrophobicContact CB-CD2 3.66Å; Q225-Y228 HydrophobicContact CB-CE2 4.16Å; Q225-Y228 VanDerWaalsContact CD-CE2 3.44Å; Q225-Y228 HydrophobicContact CG-CD2 3.95Å; Q225-Y228 HydrophobicContact CG-CE2 4Å; Q225-Y228 PolarHBondContact O-N 3.04Å; Q225-Y228 VanDerWaalsContact O-N 3.1Å; Q226-Y228 VanDerWaalsContact C-N 3.31Å; Q226-Y228 PolarHBondContact O-N 3.28Å; Y228-K231 PolarHBondContact O-N 2.83Å; Y228-H232 WeakPolarHBondContact O-CB 3.18Å; Y228-H232 PolarHBondContact O-N 3.17Å
229	L	74.5	Confident	70.1	Confident	15 Å²	15	71.1 Å²	71.1	8%	0.079	37%	0.371	C	S	.	.	H	α-helix	trans	-57.8	-49.6	172.2	173.5	59.9	0	0	0	111	C216 Y223 Q225 Q226 K231 H232 E233	C216-L229 VanDerWaalsContact CA-CD1 3.44Å; C216-L229 HydrophobicContact CB-CD1 3.51Å; Y223-L229 HydrophobicContact CD2-CB 4Å; Y223-L229 HydrophobicContact CD2-CD1 3.77Å; Y223-L229 HydrophobicContact CD2-CG 4.49Å; Y223-L229 HydrophobicContact CE2-CD1 4.09Å; Y223-L229 HydrophobicContact CG-CB 4.25Å; Q225-L229 PolarHBondContact O-N 3.49Å; Q226-L229 PolarHBondContact O-N 3.2Å; L229-K231 VanDerWaalsContact C-N 3.26Å; L229-K231 PolarHBondContact O-N 3.02Å; L229-H232 CarbonylContact O-C 3.54Å; L229-H232 WeakPolarHBondContact O-CA 3.49Å; L229-H232 WeakPolarHBondContact O-CB 3.39Å; L229-H232 PolarHBondContact O-N 2.78Å; L229-E233 HydrophobicContact CD1-CG 3.92Å; L229-E233 HydrophobicContact CG-CG 4.29Å; L229-E233 WeakPolarHBondContact O-CG 3.47Å; L229-E233 PolarHBondContact O-N 3.36Å
230	R	70.8	Confident	69.6	Low	158 Å²	158	74.8 Å²	74.8	60%	0.596	38%	0.381	S	S	*	.	H	α-helix	trans	-60	-31.9	177.1	-76.3	-174.7	-180	-140.2	1.1	113.7	Q226 R234	Q226-R230 WeakPolarHBondContact O-CB 3.38Å; Q226-R230 WeakPolarHBondContact O-CG 3.41Å; Q226-R230 PolarHBondContact O-N 3.06Å; R230-R234 WeakPolarHBondContact O-CG 3.31Å
231	K	67.4	Low	69.5	Low	100 Å²	100	72.2 Å²	72.2	44%	0.435	37%	0.372	S	S	.	.	H	α-helix	trans	-72.2	-39.7	173.6	-76.2	173.1	-175	-179.9	0	111.2	S227 Y228 L229 R234	S227-K231 VanDerWaalsContact O-CG 3.3Å; S227-K231 WeakPolarHBondContact O-CG 3.48Å; S227-K231 PolarHBondContact O-N 2.59Å; Y228-K231 PolarHBondContact O-N 2.83Å; L229-K231 VanDerWaalsContact C-N 3.26Å; L229-K231 PolarHBondContact O-N 3.02Å; K231-R234 WeakPolarHBondContact O-CB 3.38Å; K231-R234 PolarHBondContact O-N 3.22Å
232	H	72.8	Confident	69.4	Low	23 Å²	23	69.8 Å²	69.8	11%	0.106	36%	0.36	C	S	.	.	H	α-helix	trans	-69	-39.7	177.2	170.3	62.1	0	0	0	112.5	C219 Y223 Y228 L229 R234 T235 H236	C219-H232 PolarHBondContact SG-NE2 2.92Å; Y223-H232 HydrophobicContact CE1-CB 3.98Å; Y223-H232 HydrophobicContact CE2-CB 3.91Å; Y223-H232 AromaticContact CE2-CD2 3.36Å; Y223-H232 WeakPolarHBondContact CE2-CD2 3.32Å; Y223-H232 AromaticContact CE2-CG 3.69Å; Y223-H232 AromaticContact CZ-CD2 3.49Å; Y223-H232 VanDerWaalsContact CZ-CD2 3.49Å; Y223-H232 AromaticContact CZ-CG 3.35Å; Y223-H232 AromaticContact CZ-ND1 3.98Å; Y223-H232 PolarHBondContact OH-CD2 3.21Å; Y223-H232 PolarHBondContact OH-CE1 2.65Å; Y223-H232 PolarHBondContact OH-ND1 3.5Å; Y223-H232 VanDerWaalsContact OH-ND1 3.09Å; Y223-H232 PolarHBondContact OH-NE2 3.21Å; Y228-H232 WeakPolarHBondContact O-CB 3.18Å; Y228-H232 PolarHBondContact O-N 3.17Å; L229-H232 CarbonylContact O-C 3.54Å; L229-H232 WeakPolarHBondContact O-CA 3.49Å; L229-H232 WeakPolarHBondContact O-CB 3.39Å; L229-H232 PolarHBondContact O-N 2.78Å; H232-R234 PolarHBondContact O-N 2.85Å; H232-T235 PolarHBondContact ND1-OG1 3.3Å; H232-T235 WeakPolarHBondContact O-CB 3.47Å; H232-T235 PolarHBondContact O-N 3.31Å; H232-T235 PolarHBondContact O-OG1 3.23Å; H232-H236 AromaticContact CD2-NE2 3.91Å; H232-H236 AromaticContact CE1-CE1 3.91Å; H232-H236 AromaticContact CE1-NE2 3.36Å; H232-H236 PolarHBondContact CE1-NE2 3.04Å; H232-H236 AromaticContact NE2-CD2 3.89Å; H232-H236 AromaticContact NE2-CE1 3.9Å; H232-H236 AromaticContact NE2-NE2 3.01Å; H232-H236 PolarHBondContact NE2-NE2 3.19Å
233	E	71.1	Confident	69.1	Low	68 Å²	68	72.6 Å²	72.6	32%	0.318	37%	0.37	S	S	.	.	H	α-helix	trans	-58	-25.6	177.6	-72.9	170.3	154.2	0	0	112.8	L229 T235 H236 T237	L229-E233 HydrophobicContact CD1-CG 3.92Å; L229-E233 HydrophobicContact CG-CG 4.29Å; L229-E233 WeakPolarHBondContact O-CG 3.47Å; L229-E233 PolarHBondContact O-N 3.36Å; E233-T235 PolarHBondContact O-N 3.47Å; E233-H236 PolarHBondContact O-N 3.19Å; E233-T237 PolarHBondContact O-N 3.01Å; E233-T237 PolarHBondContact O-OG1 3.12Å
234	R	74.5	Confident	68.8	Low	76 Å²	76	70.6 Å²	70.6	29%	0.287	36%	0.362	S	S	.	.	H	α-helix	trans	-66	-21.4	172.8	-60.7	172.4	-172	-171.4	-4.6	113.7	R230 K231 H232 H236 G238 G239	R230-R234 WeakPolarHBondContact O-CG 3.31Å; K231-R234 WeakPolarHBondContact O-CB 3.38Å; K231-R234 PolarHBondContact O-N 3.22Å; H232-R234 PolarHBondContact O-N 2.85Å; R234-H236 VanDerWaalsContact C-N 3.27Å; R234-G238 WeakPolarHBondContact O-CA 3.46Å; R234-G238 PolarHBondContact O-N 2.9Å; R234-G238 VanDerWaalsContact O-N 3.08Å; R234-G239 PolarHBondContact O-N 3.01Å
235	T	64.5	Low	69.1	Low	98 Å²	98	75.9 Å²	75.9	60%	0.601	39%	0.388	S	S	*	.	H	α-helix	trans	-72.6	-25.1	175.5	67.4	0	0	0	0	112	H232 E233	H232-T235 PolarHBondContact ND1-OG1 3.3Å; H232-T235 WeakPolarHBondContact O-CB 3.47Å; H232-T235 PolarHBondContact O-N 3.31Å; H232-T235 PolarHBondContact O-OG1 3.23Å; E233-T235 PolarHBondContact O-N 3.47Å
236	H	66	Low	69	Low	74 Å²	74	79.4 Å²	79.4	34%	0.343	41%	0.408	S	S	.	.	H	α-helix	trans	-89.4	-39.9	176.9	-56.2	-58.2	0	0	0	112.1	Q218 C219 H232 E233 R234 G238	Q218-H236 VanDerWaalsContact OE1-CG 3.26Å; C219-H236 PolarHBondContact SG-NE2 3.41Å; H232-H236 AromaticContact CD2-NE2 3.91Å; H232-H236 AromaticContact CE1-CE1 3.91Å; H232-H236 AromaticContact CE1-NE2 3.36Å; H232-H236 PolarHBondContact CE1-NE2 3.04Å; H232-H236 AromaticContact NE2-CD2 3.89Å; H232-H236 AromaticContact NE2-CE1 3.9Å; H232-H236 AromaticContact NE2-NE2 3.01Å; H232-H236 PolarHBondContact NE2-NE2 3.19Å; E233-H236 PolarHBondContact O-N 3.19Å; R234-H236 VanDerWaalsContact C-N 3.27Å; H236-G238 VanDerWaalsContact C-N 3.29Å; H236-G238 PolarHBondContact O-N 2.9Å
237	T	63.9	Low	69.1	Low	98 Å²	98	76.9 Å²	76.9	60%	0.601	40%	0.4	S	S	*	.	H	α-helix	trans	-82.5	-5.4	179.8	59.3	0	0	0	0	113.8	E233 G239	E233-T237 PolarHBondContact O-N 3.01Å; E233-T237 PolarHBondContact O-OG1 3.12Å; T237-G239 PolarHBondContact O-N 3.14Å; T237-G239 VanDerWaalsContact O-N 3.12Å
238	G	63.8	Low	69.1	Low	51 Å²	51	80.5 Å²	80.5	53%	0.526	42%	0.416	S	S	.	.			trans	63.2	14.6	-173.7	0	0	0	0	0	113.7	R234 H236 K240	R234-G238 WeakPolarHBondContact O-CA 3.46Å; R234-G238 PolarHBondContact O-N 2.9Å; R234-G238 VanDerWaalsContact O-N 3.08Å; H236-G238 VanDerWaalsContact C-N 3.29Å; H236-G238 PolarHBondContact O-N 2.9Å; G238-K240 WeakPolarHBondContact O-CG 3.44Å; G238-K240 PolarHBondContact O-N 3.48Å; G238-K240 VanDerWaalsContact O-N 3.08Å
239	G	65	Low	69	Low	26 Å²	26	81 Å²	81	27%	0.268	42%	0.42	S	S	.	.			trans	-59.5	111.9	-174	0	0	0	0	0	112.1	R234 T237 P241	R234-G239 PolarHBondContact O-N 3.01Å; T237-G239 PolarHBondContact O-N 3.14Å; T237-G239 VanDerWaalsContact O-N 3.12Å; G239-P241 WeakPolarHBondContact O-CD 3.39Å
240	K	69.9	Low	68.8	Low	123 Å²	123	81.6 Å²	81.6	54%	0.535	43%	0.428	S	S	.	.			trans	-112.7	72.3	178.4	-73.8	163	166.4	-170.4	0	110.4	G238 Y242 A250 Y251	G238-K240 WeakPolarHBondContact O-CG 3.44Å; G238-K240 PolarHBondContact O-N 3.48Å; G238-K240 VanDerWaalsContact O-N 3.08Å; K240-Y242 PolarHBondContact O-N 3.05Å; K240-Y242 VanDerWaalsContact O-N 3.12Å; K240-A250 HydrophobicContact CB-CB 3.43Å; K240-A250 VanDerWaalsContact CB-CB 3.43Å; K240-A250 HydrophobicContact CD-CB 4.02Å; K240-A250 WeakPolarHBondContact CD-O 3.47Å; K240-A250 HydrophobicContact CG-CB 4.29Å; K240-Y251 CarbonylContact C-O 3.55Å; K240-Y251 VanDerWaalsContact C-O 3.25Å; K240-Y251 VanDerWaalsContact CA-O 3.27Å; K240-Y251 WeakPolarHBondContact CA-O 3.43Å
241	P	70.9	Confident	68.9	Low	75 Å²	75	76.5 Å²	76.5	49%	0.487	41%	0.408	S	S	.	.			trans	-71.8	-4.7	-171.7	28.5	-35	0	0	0	114.4	G239	G239-P241 WeakPolarHBondContact O-CD 3.39Å
242	Y	72.9	Confident	69	Low	70 Å²	70	73.7 Å²	73.7	28%	0.275	40%	0.402	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	97	-178.9	-56	-76.4	0	0	0	109.3	K240 A250 Y251 H253 Q254	K240-Y242 PolarHBondContact O-N 3.05Å; K240-Y242 VanDerWaalsContact O-N 3.12Å; Y242-A250 CarbonylContact O-C 3.52Å; Y242-A250 WeakPolarHBondContact O-CA 3.23Å; Y242-Y251 PolarHBondContact N-O 3.09Å; Y242-Y251 PolarHBondContact O-N 3.44Å; Y242-H253 VanDerWaalsContact CD2-C 3.42Å; Y242-Q254 HydrophobicContact CD1-CB 3.81Å; Y242-Q254 HydrophobicContact CD1-CG 4.12Å; Y242-Q254 HydrophobicContact CD2-CB 4.44Å; Y242-Q254 VanDerWaalsContact CD2-N 3.33Å; Y242-Q254 HydrophobicContact CE1-CB 3.69Å; Y242-Q254 HydrophobicContact CE1-CG 4.16Å; Y242-Q254 HydrophobicContact CE2-CB 4.32Å; Y242-Q254 HydrophobicContact CG-CB 4.2Å
243	I	65.3	Low	68.9	Low	88 Å²	88	76.2 Å²	76.2	45%	0.451	41%	0.413	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.2	137.3	-176.8	-54.6	174.1	0	0	0	109.2	N245 A250	I243-N245 PolarHBondContact O-N 3Å; I243-A250 HydrophobicContact CG1-CB 3.92Å
244	C	70.4	Confident	68.8	Low	0 Å²	0	79.2 Å²	79.2	0%	0	43%	0.427	C	S	.	.			trans	-79.5	115.2	171.6	-177.3	0	0	0	0	109.7	L246 C247 D248 K249 Y251 L257 H264	C244-L246 PolarHBondContact O-N 2.85Å; C244-C247 PolarHBondContact O-N 3.34Å; C244-D248 VanDerWaalsContact O-CA 3.3Å; C244-D248 WeakPolarHBondContact O-CA 3.49Å; C244-D248 PolarHBondContact O-N 3.44Å; C244-K249 HydrophobicContact CB-CB 4.49Å; C244-K249 WeakPolarHBondContact CB-O 3.4Å; C244-K249 PolarHBondContact N-O 2.61Å; C244-Y251 HydrophobicContact CB-CE2 4.39Å; C244-L257 VanDerWaalsContact CA-CD1 3.46Å; C244-L257 HydrophobicContact CB-CD1 3.5Å; C244-H264 PolarHBondContact SG-NE2 3.21Å
245	N	69.5	Low	68.5	Low	143 Å²	143	78.9 Å²	78.9	77%	0.765	44%	0.437	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.7	-4.7	-178.8	-57.9	-22.1	0	0	0	113.8	I243	I243-N245 PolarHBondContact O-N 3Å
246	L	69	Low	68.8	Low	122 Å²	122	77.4 Å²	77.4	64%	0.639	43%	0.425	S	S	*	.	T	Hydrogen-bonded Turn	trans	-101.5	-19.1	-179.6	-60.3	176.7	0	0	0	113.8	C244 H264	C244-L246 PolarHBondContact O-N 2.85Å; L246-H264 HydrophobicContact CD1-CB 3.79Å
247	C	73.3	Confident	69.2	Low	44 Å²	44	74.7 Å²	74.7	30%	0.297	41%	0.413	S	S	.	.	T	Hydrogen-bonded Turn	trans	-153.7	17.2	-178.5	71.2	0	0	0	0	114.2	C244 K249 H260 H264	C244-C247 PolarHBondContact O-N 3.34Å; C247-K249 PolarHBondContact O-N 2.84Å; C247-H260 PolarHBondContact SG-NE2 2.82Å; C247-H264 PolarHBondContact SG-CE1 3.17Å; C247-H264 PolarHBondContact SG-NE2 3.13Å
248	D	67.2	Low	69.6	Low	131 Å²	131	78.8 Å²	78.8	70%	0.701	42%	0.418	S	S	*	.			trans	54.1	14.2	178.2	-57.8	-38.9	0	0	0	116	C244 A250	C244-D248 VanDerWaalsContact O-CA 3.3Å; C244-D248 WeakPolarHBondContact O-CA 3.49Å; C244-D248 PolarHBondContact O-N 3.44Å; D248-A250 PolarHBondContact O-N 2.96Å
249	K	65.8	Low	69.7	Low	117 Å²	117	78.4 Å²	78.4	51%	0.509	40%	0.403	S	S	.	.			trans	-72.6	123	175.4	-72.9	-180	-174.2	170.7	0	110.3	C244 C247 Y251	C244-K249 HydrophobicContact CB-CB 4.49Å; C244-K249 WeakPolarHBondContact CB-O 3.4Å; C244-K249 PolarHBondContact N-O 2.61Å; C247-K249 PolarHBondContact O-N 2.84Å; K249-Y251 HydrophobicContact CB-CE2 3.81Å; K249-Y251 WeakPolarHBondContact O-CD2 2.99Å; K249-Y251 WeakPolarHBondContact O-CE2 3.2Å
250	A	69.9	Low	70	Confident	29 Å²	29	78 Å²	78	24%	0.24	39%	0.394	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.5	139.1	-177.4	0	0	0	0	0	112.3	K240 Y242 I243 D248	K240-A250 HydrophobicContact CB-CB 3.43Å; K240-A250 VanDerWaalsContact CB-CB 3.43Å; K240-A250 HydrophobicContact CD-CB 4.02Å; K240-A250 WeakPolarHBondContact CD-O 3.47Å; K240-A250 HydrophobicContact CG-CB 4.29Å; Y242-A250 CarbonylContact O-C 3.52Å; Y242-A250 WeakPolarHBondContact O-CA 3.23Å; I243-A250 HydrophobicContact CG1-CB 3.92Å; D248-A250 PolarHBondContact O-N 2.96Å
251	Y	74.1	Confident	70	Confident	50 Å²	50	75.6 Å²	75.6	20%	0.196	39%	0.385	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	146.5	-176	-60.6	-86.3	0	0	0	111.6	K240 Y242 C244 K249 H253 N256 L257 H260	K240-Y251 CarbonylContact C-O 3.55Å; K240-Y251 VanDerWaalsContact C-O 3.25Å; K240-Y251 VanDerWaalsContact CA-O 3.27Å; K240-Y251 WeakPolarHBondContact CA-O 3.43Å; Y242-Y251 PolarHBondContact N-O 3.09Å; Y242-Y251 PolarHBondContact O-N 3.44Å; C244-Y251 HydrophobicContact CB-CE2 4.39Å; K249-Y251 HydrophobicContact CB-CE2 3.81Å; K249-Y251 WeakPolarHBondContact O-CD2 2.99Å; K249-Y251 WeakPolarHBondContact O-CE2 3.2Å; Y251-H253 VanDerWaalsContact C-N 3.3Å; Y251-N256 HydrophobicContact CD1-CB 3.92Å; Y251-N256 HydrophobicContact CG-CB 4.32Å; Y251-L257 HydrophobicContact CD2-CB 3.85Å; Y251-L257 HydrophobicContact CD2-CD1 3.75Å; Y251-L257 HydrophobicContact CD2-CG 4.42Å; Y251-L257 HydrophobicContact CE2-CD1 4Å; Y251-L257 HydrophobicContact CG-CB 4.22Å; Y251-H260 HydrophobicContact CE1-CB 4.04Å; Y251-H260 HydrophobicContact CE2-CB 3.8Å; Y251-H260 AromaticContact CE2-CD2 3.33Å; Y251-H260 WeakPolarHBondContact CE2-CD2 2.85Å; Y251-H260 AromaticContact CE2-CG 3.65Å; Y251-H260 VanDerWaalsContact CZ-CB 3.46Å; Y251-H260 AromaticContact CZ-CD2 3.5Å; Y251-H260 VanDerWaalsContact CZ-CD2 3.5Å; Y251-H260 AromaticContact CZ-CG 3.34Å; Y251-H260 AromaticContact CZ-ND1 3.98Å; Y251-H260 WeakPolarHBondContact OH-CB 3.49Å; Y251-H260 PolarHBondContact OH-CD2 3.48Å; Y251-H260 PolarHBondContact OH-CE1 3.24Å; Y251-H260 PolarHBondContact OH-ND1 3.38Å; Y251-H260 PolarHBondContact OH-NE2 3.28Å
252	S	69.6	Low	70	Confident	42 Å²	42	73.2 Å²	73.2	29%	0.294	37%	0.367	S	S	.	.	S	Bend	trans	-74.2	-21.2	176.9	52.5	0	0	0	0	113.3
253	H	70.1	Confident	69.6	Low	75 Å²	75	74 Å²	74	35%	0.347	38%	0.38	S	S	.	.	S	Bend	trans	-133.8	139.7	-178.3	-61.8	-73.9	0	0	0	111.9	Y242 Y251 S255 N256 L257	Y242-H253 VanDerWaalsContact CD2-C 3.42Å; Y251-H253 VanDerWaalsContact C-N 3.3Å; H253-S255 VanDerWaalsContact C-N 3.28Å; H253-S255 PolarHBondContact O-N 3.32Å; H253-N256 WeakPolarHBondContact O-CB 3.46Å; H253-N256 PolarHBondContact O-N 3.39Å; H253-N256 VanDerWaalsContact O-N 3.09Å; H253-L257 PolarHBondContact O-N 3.2Å
254	Q	69.9	Low	69.8	Low	131 Å²	131	73.6 Å²	73.6	61%	0.612	38%	0.376	S	S	*	.	H	α-helix	trans	-61.2	-33.6	177.3	-168.7	176.9	2.2	0	0	113.1	Y242 N256 L257 R258	Y242-Q254 HydrophobicContact CD1-CB 3.81Å; Y242-Q254 HydrophobicContact CD1-CG 4.12Å; Y242-Q254 HydrophobicContact CD2-CB 4.44Å; Y242-Q254 VanDerWaalsContact CD2-N 3.33Å; Y242-Q254 HydrophobicContact CE1-CB 3.69Å; Y242-Q254 HydrophobicContact CE1-CG 4.16Å; Y242-Q254 HydrophobicContact CE2-CB 4.32Å; Y242-Q254 HydrophobicContact CG-CB 4.2Å; Q254-N256 VanDerWaalsContact C-N 3.28Å; Q254-N256 PolarHBondContact O-N 3.35Å; Q254-L257 PolarHBondContact O-N 3.49Å; Q254-R258 PolarHBondContact O-N 2.7Å
255	S	67.6	Low	69.7	Low	69 Å²	69	77.7 Å²	77.7	48%	0.483	40%	0.401	S	S	.	.	H	α-helix	trans	-60.3	-39.3	174.5	53.2	0	0	0	0	112	H253 R258 I259	H253-S255 VanDerWaalsContact C-N 3.28Å; H253-S255 PolarHBondContact O-N 3.32Å; S255-R258 PolarHBondContact O-N 3.03Å; S255-I259 VanDerWaalsContact O-CD1 3.31Å; S255-I259 WeakPolarHBondContact O-CD1 3.45Å; S255-I259 VanDerWaalsContact O-CG1 3.26Å; S255-I259 WeakPolarHBondContact O-CG1 3.25Å; S255-I259 PolarHBondContact O-N 3.47Å
256	N	71.1	Confident	69.5	Low	68 Å²	68	73.4 Å²	73.4	36%	0.364	39%	0.391	S	S	.	.	H	α-helix	trans	-73.7	-37	-178.6	-62.3	-4.4	0	0	0	111.1	Y251 H253 Q254 I259 H260	Y251-N256 HydrophobicContact CD1-CB 3.92Å; Y251-N256 HydrophobicContact CG-CB 4.32Å; H253-N256 WeakPolarHBondContact O-CB 3.46Å; H253-N256 PolarHBondContact O-N 3.39Å; H253-N256 VanDerWaalsContact O-N 3.09Å; Q254-N256 VanDerWaalsContact C-N 3.28Å; Q254-N256 PolarHBondContact O-N 3.35Å; N256-I259 PolarHBondContact O-N 3.29Å; N256-H260 WeakPolarHBondContact O-CB 3.3Å; N256-H260 PolarHBondContact O-N 2.87Å
257	L	74.6	Confident	69.6	Low	16 Å²	16	73.5 Å²	73.5	8%	0.084	39%	0.388	C	S	.	.	H	α-helix	trans	-59.8	-48.7	170.2	172.7	60.5	0	0	0	110.8	C244 Y251 H253 Q254 I259 H260 E261	C244-L257 VanDerWaalsContact CA-CD1 3.46Å; C244-L257 HydrophobicContact CB-CD1 3.5Å; Y251-L257 HydrophobicContact CD2-CB 3.85Å; Y251-L257 HydrophobicContact CD2-CD1 3.75Å; Y251-L257 HydrophobicContact CD2-CG 4.42Å; Y251-L257 HydrophobicContact CE2-CD1 4Å; Y251-L257 HydrophobicContact CG-CB 4.22Å; H253-L257 PolarHBondContact O-N 3.2Å; Q254-L257 PolarHBondContact O-N 3.49Å; L257-I259 VanDerWaalsContact C-N 3.35Å; L257-I259 PolarHBondContact O-N 3.24Å; L257-H260 CarbonylContact O-C 3.55Å; L257-H260 WeakPolarHBondContact O-CA 3.43Å; L257-H260 WeakPolarHBondContact O-CB 3.41Å; L257-H260 PolarHBondContact O-N 3.36Å; L257-E261 HydrophobicContact CD1-CG 4.05Å; L257-E261 HydrophobicContact CG-CG 4.37Å; L257-E261 WeakPolarHBondContact O-CG 3.39Å; L257-E261 PolarHBondContact O-N 3.44Å
258	R	70.9	Confident	69.6	Low	185 Å²	185	77.3 Å²	77.3	70%	0.698	40%	0.399	S	S	*	.	H	α-helix	trans	-59.1	-42.1	178.4	-177.4	-178.8	-101.7	-164.7	-9.8	112.9	Q254 S255 H260 E261 I262	Q254-R258 PolarHBondContact O-N 2.7Å; S255-R258 PolarHBondContact O-N 3.03Å; R258-H260 VanDerWaalsContact C-N 3.3Å; R258-H260 PolarHBondContact O-N 3.41Å; R258-E261 PolarHBondContact O-N 3.13Å; R258-I262 WeakPolarHBondContact O-CG1 3.49Å; R258-I262 PolarHBondContact O-N 3.4Å
259	I	66	Low	70	Confident	43 Å²	43	74.4 Å²	74.4	22%	0.221	39%	0.388	C	S	.	.	H	α-helix	trans	-65.9	-36.1	175.4	-66	156.4	0	0	0	111.2	S255 N256 L257 I262 H281	S255-I259 VanDerWaalsContact O-CD1 3.31Å; S255-I259 WeakPolarHBondContact O-CD1 3.45Å; S255-I259 VanDerWaalsContact O-CG1 3.26Å; S255-I259 WeakPolarHBondContact O-CG1 3.25Å; S255-I259 PolarHBondContact O-N 3.47Å; N256-I259 PolarHBondContact O-N 3.29Å; L257-I259 VanDerWaalsContact C-N 3.35Å; L257-I259 PolarHBondContact O-N 3.24Å; I259-I262 WeakPolarHBondContact O-CB 3.31Å; I259-H281 WeakPolarHBondContact CD1-CD2 3.15Å; I259-H281 WeakPolarHBondContact CD1-NE2 3.39Å
260	H	72.3	Confident	70.6	Confident	17 Å²	17	72.5 Å²	72.5	8%	0.079	38%	0.378	C	S	.	.	H	α-helix	trans	-70.3	-37.5	175.3	169.1	63.3	0	0	0	112.6	C247 Y251 N256 L257 R258 I262 T263 H264	C247-H260 PolarHBondContact SG-NE2 2.82Å; Y251-H260 HydrophobicContact CE1-CB 4.04Å; Y251-H260 HydrophobicContact CE2-CB 3.8Å; Y251-H260 AromaticContact CE2-CD2 3.33Å; Y251-H260 WeakPolarHBondContact CE2-CD2 2.85Å; Y251-H260 AromaticContact CE2-CG 3.65Å; Y251-H260 VanDerWaalsContact CZ-CB 3.46Å; Y251-H260 AromaticContact CZ-CD2 3.5Å; Y251-H260 VanDerWaalsContact CZ-CD2 3.5Å; Y251-H260 AromaticContact CZ-CG 3.34Å; Y251-H260 AromaticContact CZ-ND1 3.98Å; Y251-H260 WeakPolarHBondContact OH-CB 3.49Å; Y251-H260 PolarHBondContact OH-CD2 3.48Å; Y251-H260 PolarHBondContact OH-CE1 3.24Å; Y251-H260 PolarHBondContact OH-ND1 3.38Å; Y251-H260 PolarHBondContact OH-NE2 3.28Å; N256-H260 WeakPolarHBondContact O-CB 3.3Å; N256-H260 PolarHBondContact O-N 2.87Å; L257-H260 CarbonylContact O-C 3.55Å; L257-H260 WeakPolarHBondContact O-CA 3.43Å; L257-H260 WeakPolarHBondContact O-CB 3.41Å; L257-H260 PolarHBondContact O-N 3.36Å; R258-H260 VanDerWaalsContact C-N 3.3Å; R258-H260 PolarHBondContact O-N 3.41Å; H260-I262 PolarHBondContact O-N 2.95Å; H260-T263 PolarHBondContact ND1-OG1 2.82Å; H260-T263 WeakPolarHBondContact O-CA 3.49Å; H260-T263 VanDerWaalsContact O-CB 3.28Å; H260-T263 WeakPolarHBondContact O-CB 3.48Å; H260-T263 PolarHBondContact O-N 3.2Å; H260-T263 PolarHBondContact O-OG1 3.03Å; H260-H264 AromaticContact CD2-NE2 4Å; H260-H264 AromaticContact CE1-NE2 3.47Å; H260-H264 PolarHBondContact CE1-NE2 3.45Å; H260-H264 AromaticContact NE2-CD2 4Å; H260-H264 AromaticContact NE2-NE2 3.18Å; H260-H264 PolarHBondContact NE2-NE2 2.96Å; H260-H264 VanDerWaalsContact NE2-NE2 3.18Å
261	E	69.8	Low	70.7	Confident	72 Å²	72	76 Å²	76	34%	0.336	39%	0.391	S	S	.	.	H	α-helix	trans	-59.4	-34.6	175.9	-72.9	167.3	161.8	0	0	111.7	L257 R258 T263 H264 T265	L257-E261 HydrophobicContact CD1-CG 4.05Å; L257-E261 HydrophobicContact CG-CG 4.37Å; L257-E261 WeakPolarHBondContact O-CG 3.39Å; L257-E261 PolarHBondContact O-N 3.44Å; R258-E261 PolarHBondContact O-N 3.13Å; E261-T263 PolarHBondContact O-N 3.37Å; E261-T263 VanDerWaalsContact O-N 3.16Å; E261-H264 WeakPolarHBondContact O-CB 3.5Å; E261-H264 PolarHBondContact O-N 3.44Å; E261-T265 PolarHBondContact O-N 3.23Å
262	I	70.6	Confident	70.9	Confident	25 Å²	25	73.8 Å²	73.8	13%	0.128	38%	0.383	C	S	.	.	H	α-helix	trans	-60	-24.2	171.9	-66.9	163.7	0	0	0	112.3	R258 I259 H260 H264 T265 G266 E267 P269	R258-I262 WeakPolarHBondContact O-CG1 3.49Å; R258-I262 PolarHBondContact O-N 3.4Å; I259-I262 WeakPolarHBondContact O-CB 3.31Å; H260-I262 PolarHBondContact O-N 2.95Å; I262-H264 VanDerWaalsContact C-N 3.31Å; I262-H264 PolarHBondContact O-N 3.01Å; I262-T265 PolarHBondContact O-OG1 3.11Å; I262-G266 PolarHBondContact O-N 2.84Å; I262-E267 HydrophobicContact CG2-CB 4.3Å; I262-E267 WeakPolarHBondContact CG2-O 3.29Å; I262-P269 HydrophobicContact CD1-CG 4.01Å
263	T	65.6	Low	71.3	Confident	86 Å²	86	78.9 Å²	78.9	53%	0.528	41%	0.407	S	S	.	.	H	α-helix	trans	-72.8	-22.6	174.8	70.1	0	0	0	0	113.6	H260 E261	H260-T263 PolarHBondContact ND1-OG1 2.82Å; H260-T263 WeakPolarHBondContact O-CA 3.49Å; H260-T263 VanDerWaalsContact O-CB 3.28Å; H260-T263 WeakPolarHBondContact O-CB 3.48Å; H260-T263 PolarHBondContact O-N 3.2Å; H260-T263 PolarHBondContact O-OG1 3.03Å; E261-T263 PolarHBondContact O-N 3.37Å; E261-T263 VanDerWaalsContact O-N 3.16Å
264	H	68.7	Low	71.6	Confident	81 Å²	81	81.2 Å²	81.2	38%	0.375	42%	0.422	S	S	.	.	H	α-helix	trans	-82.4	-36.4	173.7	-64.1	-62.5	0	0	0	111.7	C244 L246 C247 H260 E261 I262	C244-H264 PolarHBondContact SG-NE2 3.21Å; L246-H264 HydrophobicContact CD1-CB 3.79Å; C247-H264 PolarHBondContact SG-CE1 3.17Å; C247-H264 PolarHBondContact SG-NE2 3.13Å; H260-H264 AromaticContact CD2-NE2 4Å; H260-H264 AromaticContact CE1-NE2 3.47Å; H260-H264 PolarHBondContact CE1-NE2 3.45Å; H260-H264 AromaticContact NE2-CD2 4Å; H260-H264 AromaticContact NE2-NE2 3.18Å; H260-H264 PolarHBondContact NE2-NE2 2.96Å; H260-H264 VanDerWaalsContact NE2-NE2 3.18Å; E261-H264 WeakPolarHBondContact O-CB 3.5Å; E261-H264 PolarHBondContact O-N 3.44Å; I262-H264 VanDerWaalsContact C-N 3.31Å; I262-H264 PolarHBondContact O-N 3.01Å
265	T	69	Low	72.1	Confident	85 Å²	85	76.5 Å²	76.5	52%	0.521	40%	0.403	S	S	.	.	H	α-helix	trans	-82.2	-19.6	179.4	64.6	0	0	0	0	113	E261 I262 E267	E261-T265 PolarHBondContact O-N 3.23Å; I262-T265 PolarHBondContact O-OG1 3.11Å; T265-E267 PolarHBondContact O-N 3.32Å
266	G	65.4	Low	72.5	Confident	54 Å²	54	81.4 Å²	81.4	56%	0.557	42%	0.424	S	S	*	.			trans	71.7	3.3	-177.4	0	0	0	0	0	114	I262	I262-G266 PolarHBondContact O-N 2.84Å
267	E	70.2	Confident	72.4	Confident	123 Å²	123	83.7 Å²	83.7	58%	0.575	43%	0.431	S	S	*	.			trans	-62.3	147.4	178.6	-69.8	179.2	172.6	0	0	110.8	I262 T265	I262-E267 HydrophobicContact CG2-CB 4.3Å; I262-E267 WeakPolarHBondContact CG2-O 3.29Å; T265-E267 PolarHBondContact O-N 3.32Å
268	K	73.9	Confident	72.5	Confident	125 Å²	125	84.2 Å²	84.2	54%	0.543	44%	0.437	S	S	.	.			trans	-127.8	77.7	178.1	-71.9	168.1	173.7	-179.1	0	108.9	Y270 A278 Y279	K268-Y270 PolarHBondContact O-N 3.5Å; K268-Y270 VanDerWaalsContact O-N 3.07Å; K268-A278 HydrophobicContact CB-CB 3.43Å; K268-A278 VanDerWaalsContact CB-CB 3.43Å; K268-A278 HydrophobicContact CD-CB 4.05Å; K268-A278 WeakPolarHBondContact CD-O 3.35Å; K268-A278 HydrophobicContact CG-CB 4.36Å; K268-Y279 CarbonylContact C-O 3.55Å; K268-Y279 WeakPolarHBondContact CA-O 3.39Å
269	P	74.3	Confident	72.8	Confident	70 Å²	70	77.8 Å²	77.8	46%	0.455	41%	0.413	S	S	.	.			trans	-65.7	-16	-169.4	-22.1	34.4	0	0	0	114.3	I262	I262-P269 HydrophobicContact CD1-CG 4.01Å
270	Y	78.3	Confident	73.2	Confident	76 Å²	76	77.8 Å²	77.8	30%	0.298	42%	0.417	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	94.4	-175.8	-56.6	-78.8	0	0	0	110.1	K268 A278 Y279 Q282	K268-Y270 PolarHBondContact O-N 3.5Å; K268-Y270 VanDerWaalsContact O-N 3.07Å; Y270-A278 CarbonylContact O-C 3.55Å; Y270-A278 WeakPolarHBondContact O-CA 3.45Å; Y270-Y279 WeakPolarHBondContact CB-O 3.47Å; Y270-Y279 WeakPolarHBondContact CD2-O 3.43Å; Y270-Y279 PolarHBondContact N-O 3.32Å; Y270-Y279 VanDerWaalsContact N-O 3.12Å; Y270-Y279 PolarHBondContact O-N 3.28Å; Y270-Q282 HydrophobicContact CD1-CB 3.8Å; Y270-Q282 HydrophobicContact CD1-CG 4.07Å; Y270-Q282 HydrophobicContact CE1-CB 3.62Å; Y270-Q282 HydrophobicContact CE1-CG 4.07Å; Y270-Q282 HydrophobicContact CE2-CB 4.48Å; Y270-Q282 HydrophobicContact CG-CB 4.31Å
271	I	73	Confident	73.3	Confident	102 Å²	102	79.9 Å²	79.9	52%	0.523	43%	0.427	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.4	140.2	-177.9	-55.3	170.4	0	0	0	109.5	A278 L285	I271-A278 HydrophobicContact CG1-CB 3.96Å; I271-L285 WeakPolarHBondContact O-CD2 3.21Å
272	C	78.4	Confident	73.6	Confident	5 Å²	5	82.5 Å²	82.5	3%	0.034	44%	0.439	C	S	.	.			trans	-78.2	129.2	172.1	-174.8	0	0	0	0	110.5	L274 C275 K277 L285 H292	C272-L274 PolarHBondContact O-N 3.08Å; C272-C275 WeakPolarHBondContact CB-O 3.2Å; C272-K277 WeakPolarHBondContact CB-O 3.33Å; C272-K277 PolarHBondContact N-O 3.03Å; C272-L285 HydrophobicContact CB-CD1 3.62Å; C272-H292 PolarHBondContact SG-NE2 3.4Å; C272-H292 VanDerWaalsContact SG-NE2 3.36Å
273	N	77.7	Confident	73.8	Confident	149 Å²	149	83.9 Å²	83.9	80%	0.797	45%	0.451	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.1	-8.6	179.7	-61.2	-23.8	0	0	0	113.2
274	L	77.3	Confident	74.5	Confident	123 Å²	123	83.1 Å²	83.1	64%	0.644	44%	0.443	S	S	*	.	T	Hydrogen-bonded Turn	trans	-105.2	-10.6	-178.7	-59.4	176.6	0	0	0	113	C272 H292	C272-L274 PolarHBondContact O-N 3.08Å; L274-H292 HydrophobicContact CD1-CB 3.64Å
275	C	80.5	Confident	75.1	Confident	33 Å²	33	80 Å²	80	22%	0.223	43%	0.43	C	S	.	.	S	Bend	trans	-162.4	164.7	174	73.6	0	0	0	0	111.5	C272 K277 H288	C272-C275 WeakPolarHBondContact CB-O 3.2Å; C275-K277 PolarHBondContact O-N 3.46Å; C275-H288 PolarHBondContact SG-NE2 3.49Å
276	D	74.7	Confident	75.6	Confident	171 Å²	171	84.1 Å²	84.1	91%	0.914	44%	0.436	S	S	*	.	S	Bend	trans	-72.8	20.8	-174.9	-51.9	-44.1	0	0	0	115.3
277	K	69.5	Low	76.2	Confident	117 Å²	117	83 Å²	83	51%	0.509	42%	0.416	S	S	.	.			trans	-89.9	125.8	179.8	-67.9	179	-176.1	166.7	0	111.1	C272 C275 Y279	C272-K277 WeakPolarHBondContact CB-O 3.33Å; C272-K277 PolarHBondContact N-O 3.03Å; C275-K277 PolarHBondContact O-N 3.46Å; K277-Y279 HydrophobicContact CB-CE2 3.86Å
278	A	75.9	Confident	76.6	Confident	27 Å²	27	77.7 Å²	77.7	22%	0.223	39%	0.392	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115	150.1	177.6	0	0	0	0	0	112.2	K268 Y270 I271	K268-A278 HydrophobicContact CB-CB 3.43Å; K268-A278 VanDerWaalsContact CB-CB 3.43Å; K268-A278 HydrophobicContact CD-CB 4.05Å; K268-A278 WeakPolarHBondContact CD-O 3.35Å; K268-A278 HydrophobicContact CG-CB 4.36Å; Y270-A278 CarbonylContact O-C 3.55Å; Y270-A278 WeakPolarHBondContact O-CA 3.45Å; I271-A278 HydrophobicContact CG1-CB 3.96Å
279	Y	77.8	Confident	76.8	Confident	49 Å²	49	75 Å²	75	19%	0.192	38%	0.381	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.5	148.1	-172.5	-61	-88.8	0	0	0	111.4	K268 Y270 K277 H281 N284 L285 H288	K268-Y279 CarbonylContact C-O 3.55Å; K268-Y279 WeakPolarHBondContact CA-O 3.39Å; Y270-Y279 WeakPolarHBondContact CB-O 3.47Å; Y270-Y279 WeakPolarHBondContact CD2-O 3.43Å; Y270-Y279 PolarHBondContact N-O 3.32Å; Y270-Y279 VanDerWaalsContact N-O 3.12Å; Y270-Y279 PolarHBondContact O-N 3.28Å; K277-Y279 HydrophobicContact CB-CE2 3.86Å; Y279-H281 VanDerWaalsContact C-N 3.28Å; Y279-N284 HydrophobicContact CD1-CB 3.76Å; Y279-N284 HydrophobicContact CG-CB 4.22Å; Y279-L285 HydrophobicContact CD2-CB 3.9Å; Y279-L285 HydrophobicContact CD2-CD1 3.88Å; Y279-L285 HydrophobicContact CE2-CD1 4.14Å; Y279-L285 HydrophobicContact CG-CB 4.25Å; Y279-H288 HydrophobicContact CE1-CB 4.06Å; Y279-H288 HydrophobicContact CE2-CB 3.76Å; Y279-H288 AromaticContact CE2-CD2 3.4Å; Y279-H288 VanDerWaalsContact CE2-CD2 3.4Å; Y279-H288 WeakPolarHBondContact CE2-CD2 3.13Å; Y279-H288 AromaticContact CE2-CG 3.67Å; Y279-H288 VanDerWaalsContact CZ-CB 3.42Å; Y279-H288 AromaticContact CZ-CD2 3.64Å; Y279-H288 AromaticContact CZ-CG 3.42Å; Y279-H288 VanDerWaalsContact CZ-CG 3.42Å; Y279-H288 VanDerWaalsContact OH-CB 3.27Å; Y279-H288 WeakPolarHBondContact OH-CB 3.33Å; Y279-H288 PolarHBondContact OH-CD2 3.21Å; Y279-H288 VanDerWaalsContact OH-CD2 3.25Å; Y279-H288 PolarHBondContact OH-ND1 3.47Å
280	S	73.8	Confident	77.3	Confident	43 Å²	43	73.8 Å²	73.8	30%	0.301	37%	0.367	S	S	.	.	S	Bend	trans	-78.6	-11.6	174.9	53.8	0	0	0	0	113.4
281	H	75.3	Confident	77.2	Confident	62 Å²	62	74.4 Å²	74.4	29%	0.287	38%	0.379	S	S	.	.	S	Bend	trans	-141.9	137.6	-177.7	-163.2	-116.6	0	0	0	111.7	I259 Y279 S283 N284 L285	I259-H281 WeakPolarHBondContact CD1-CD2 3.15Å; I259-H281 WeakPolarHBondContact CD1-NE2 3.39Å; Y279-H281 VanDerWaalsContact C-N 3.28Å; H281-S283 VanDerWaalsContact C-N 3.28Å; H281-S283 PolarHBondContact CE1-OG 2.87Å; H281-S283 WeakPolarHBondContact ND1-CB 3.32Å; H281-S283 PolarHBondContact ND1-N 2.82Å; H281-S283 PolarHBondContact ND1-OG 3.29Å; H281-S283 PolarHBondContact O-N 3.07Å; H281-N284 WeakPolarHBondContact O-CB 3.49Å; H281-N284 PolarHBondContact O-N 3.48Å; H281-L285 PolarHBondContact O-N 3.45Å
282	Q	75.1	Confident	77.4	Confident	126 Å²	126	73.2 Å²	73.2	59%	0.589	37%	0.371	S	S	*	.	H	α-helix	trans	-59.8	-35.5	-179	-166.5	177.6	2	0	0	112.9	Y270 N284 L285 R286	Y270-Q282 HydrophobicContact CD1-CB 3.8Å; Y270-Q282 HydrophobicContact CD1-CG 4.07Å; Y270-Q282 HydrophobicContact CE1-CB 3.62Å; Y270-Q282 HydrophobicContact CE1-CG 4.07Å; Y270-Q282 HydrophobicContact CE2-CB 4.48Å; Y270-Q282 HydrophobicContact CG-CB 4.31Å; Q282-N284 PolarHBondContact O-N 3.22Å; Q282-L285 PolarHBondContact O-N 2.95Å; Q282-R286 PolarHBondContact O-N 3.27Å
283	S	76.4	Confident	77.4	Confident	54 Å²	54	77.1 Å²	77.1	38%	0.378	40%	0.395	S	S	.	.	H	α-helix	trans	-64.6	-32.1	177.2	75.5	0	0	0	0	112.3	H281 R286 I287	H281-S283 VanDerWaalsContact C-N 3.28Å; H281-S283 PolarHBondContact CE1-OG 2.87Å; H281-S283 WeakPolarHBondContact ND1-CB 3.32Å; H281-S283 PolarHBondContact ND1-N 2.82Å; H281-S283 PolarHBondContact ND1-OG 3.29Å; H281-S283 PolarHBondContact O-N 3.07Å; S283-R286 PolarHBondContact O-N 2.98Å; S283-I287 WeakPolarHBondContact O-CD1 3.48Å; S283-I287 WeakPolarHBondContact O-CG1 3.38Å; S283-I287 PolarHBondContact O-N 3.45Å
284	N	80	Confident	77.4	Confident	70 Å²	70	72.3 Å²	72.3	37%	0.374	38%	0.381	S	S	.	.	H	α-helix	trans	-74.4	-38.5	179.8	-66.1	-19.5	0	0	0	110.9	Y279 H281 Q282 I287 H288	Y279-N284 HydrophobicContact CD1-CB 3.76Å; Y279-N284 HydrophobicContact CG-CB 4.22Å; H281-N284 WeakPolarHBondContact O-CB 3.49Å; H281-N284 PolarHBondContact O-N 3.48Å; Q282-N284 PolarHBondContact O-N 3.22Å; N284-I287 PolarHBondContact O-N 2.84Å; N284-H288 WeakPolarHBondContact O-CB 3.17Å; N284-H288 PolarHBondContact O-N 2.95Å
285	L	80.8	Confident	77.5	Confident	17 Å²	17	71.6 Å²	71.6	9%	0.089	37%	0.374	C	S	.	.	H	α-helix	trans	-58.4	-48.5	169.3	172.8	60.1	0	0	0	110.5	I271 C272 Y279 H281 Q282 I287 H288 E289	I271-L285 WeakPolarHBondContact O-CD2 3.21Å; C272-L285 HydrophobicContact CB-CD1 3.62Å; Y279-L285 HydrophobicContact CD2-CB 3.9Å; Y279-L285 HydrophobicContact CD2-CD1 3.88Å; Y279-L285 HydrophobicContact CE2-CD1 4.14Å; Y279-L285 HydrophobicContact CG-CB 4.25Å; H281-L285 PolarHBondContact O-N 3.45Å; Q282-L285 PolarHBondContact O-N 2.95Å; L285-I287 VanDerWaalsContact C-N 3.32Å; L285-I287 PolarHBondContact O-N 2.95Å; L285-H288 CarbonylContact O-C 3.34Å; L285-H288 WeakPolarHBondContact O-CA 3.43Å; L285-H288 WeakPolarHBondContact O-CB 2.79Å; L285-H288 PolarHBondContact O-N 3.09Å; L285-E289 HydrophobicContact CD1-CG 4.08Å; L285-E289 HydrophobicContact CG-CG 4.38Å; L285-E289 WeakPolarHBondContact O-CG 3.44Å; L285-E289 PolarHBondContact O-N 3.2Å
286	R	78.9	Confident	77.6	Confident	171 Å²	171	76 Å²	76	65%	0.645	39%	0.389	S	S	*	.	H	α-helix	trans	-61.3	-37	179.4	-161.5	177.5	-169.8	-173.4	2.9	113.6	Q282 S283 H288	Q282-R286 PolarHBondContact O-N 3.27Å; S283-R286 PolarHBondContact O-N 2.98Å; R286-H288 VanDerWaalsContact C-N 3.34Å
287	I	78.3	Confident	78.1	Confident	29 Å²	29	71.3 Å²	71.3	15%	0.149	37%	0.368	C	S	.	.	H	α-helix	trans	-68.7	-36.8	173.6	-66.2	158.5	0	0	0	110.7	S283 N284 L285 R290 H309	S283-I287 WeakPolarHBondContact O-CD1 3.48Å; S283-I287 WeakPolarHBondContact O-CG1 3.38Å; S283-I287 PolarHBondContact O-N 3.45Å; N284-I287 PolarHBondContact O-N 2.84Å; L285-I287 VanDerWaalsContact C-N 3.32Å; L285-I287 PolarHBondContact O-N 2.95Å; I287-R290 WeakPolarHBondContact O-CB 3.32Å; I287-H309 WeakPolarHBondContact CD1-CD2 3.28Å; I287-H309 HydrophobicContact CG2-CB 4.19Å
288	H	79.4	Confident	78.8	Confident	13 Å²	13	69 Å²	69	6%	0.06	36%	0.357	C	S	.	.	H	α-helix	trans	-69.7	-38.3	176.2	168.7	56.7	0	0	0	112.6	C275 Y279 N284 L285 R286 R290 T291 H292	C275-H288 PolarHBondContact SG-NE2 3.49Å; Y279-H288 HydrophobicContact CE1-CB 4.06Å; Y279-H288 HydrophobicContact CE2-CB 3.76Å; Y279-H288 AromaticContact CE2-CD2 3.4Å; Y279-H288 VanDerWaalsContact CE2-CD2 3.4Å; Y279-H288 WeakPolarHBondContact CE2-CD2 3.13Å; Y279-H288 AromaticContact CE2-CG 3.67Å; Y279-H288 VanDerWaalsContact CZ-CB 3.42Å; Y279-H288 AromaticContact CZ-CD2 3.64Å; Y279-H288 AromaticContact CZ-CG 3.42Å; Y279-H288 VanDerWaalsContact CZ-CG 3.42Å; Y279-H288 VanDerWaalsContact OH-CB 3.27Å; Y279-H288 WeakPolarHBondContact OH-CB 3.33Å; Y279-H288 PolarHBondContact OH-CD2 3.21Å; Y279-H288 VanDerWaalsContact OH-CD2 3.25Å; Y279-H288 PolarHBondContact OH-ND1 3.47Å; N284-H288 WeakPolarHBondContact O-CB 3.17Å; N284-H288 PolarHBondContact O-N 2.95Å; L285-H288 CarbonylContact O-C 3.34Å; L285-H288 WeakPolarHBondContact O-CA 3.43Å; L285-H288 WeakPolarHBondContact O-CB 2.79Å; L285-H288 PolarHBondContact O-N 3.09Å; R286-H288 VanDerWaalsContact C-N 3.34Å; H288-R290 PolarHBondContact O-N 3.05Å; H288-R290 VanDerWaalsContact O-N 3.17Å; H288-T291 PolarHBondContact CE1-OG1 3.44Å; H288-T291 PolarHBondContact ND1-OG1 2.88Å; H288-T291 VanDerWaalsContact ND1-OG1 3.13Å; H288-T291 WeakPolarHBondContact O-CA 3.38Å; H288-T291 VanDerWaalsContact O-CB 3.27Å; H288-T291 WeakPolarHBondContact O-CB 3.44Å; H288-T291 WeakPolarHBondContact O-CG2 3.28Å; H288-T291 PolarHBondContact O-N 3.44Å; H288-T291 PolarHBondContact O-OG1 3.46Å; H288-H292 AromaticContact CE1-CE1 3.99Å; H288-H292 AromaticContact CE1-NE2 3.44Å; H288-H292 PolarHBondContact CE1-NE2 3.22Å; H288-H292 AromaticContact NE2-CD2 3.96Å; H288-H292 AromaticContact NE2-CE1 3.99Å; H288-H292 AromaticContact NE2-NE2 3.13Å; H288-H292 PolarHBondContact NE2-NE2 3.5Å; H288-H292 VanDerWaalsContact NE2-NE2 3.13Å
289	E	78.1	Confident	79.1	Confident	68 Å²	68	72.5 Å²	72.5	32%	0.318	37%	0.371	S	S	.	.	H	α-helix	trans	-57.2	-32.6	176.7	-73.5	169.2	158.1	0	0	111.9	L285 T291 H292 T293	L285-E289 HydrophobicContact CD1-CG 4.08Å; L285-E289 HydrophobicContact CG-CG 4.38Å; L285-E289 WeakPolarHBondContact O-CG 3.44Å; L285-E289 PolarHBondContact O-N 3.2Å; E289-T291 PolarHBondContact O-N 2.99Å; E289-T291 VanDerWaalsContact O-N 3.11Å; E289-H292 WeakPolarHBondContact O-CB 3.39Å; E289-H292 PolarHBondContact O-N 3.28Å; E289-T293 PolarHBondContact O-N 3.16Å
290	R	83.4	Confident	79.4	Confident	45 Å²	45	70.4 Å²	70.4	17%	0.17	36%	0.363	C	S	.	.	H	α-helix	trans	-61.7	-17.5	171.8	-64.1	177.6	178.6	160.4	1.3	114.6	I287 H288 H292 T293 G294 E295 S308	I287-R290 WeakPolarHBondContact O-CB 3.32Å; H288-R290 PolarHBondContact O-N 3.05Å; H288-R290 VanDerWaalsContact O-N 3.17Å; R290-H292 VanDerWaalsContact C-N 3.32Å; R290-T293 WeakPolarHBondContact CA-OG1 3.45Å; R290-G294 CarbonylContact O-C 3.55Å; R290-G294 WeakPolarHBondContact O-CA 2.86Å; R290-G294 PolarHBondContact O-N 3.49Å; R290-E295 HydrophobicContact CB-CB 4.34Å; R290-E295 HydrophobicContact CG-CB 4.19Å; R290-E295 PolarHBondContact O-N 3.06Å; R290-S308 WeakPolarHBondContact CD-O 3.5Å; R290-S308 PolarHBondContact NH1-O 3.47Å
291	T	77.4	Confident	79.7	Confident	88 Å²	88	75.5 Å²	75.5	54%	0.54	39%	0.387	S	S	.	.	H	α-helix	trans	-76	-23.5	173.3	67.9	0	0	0	0	112.6	H288 E289	H288-T291 PolarHBondContact CE1-OG1 3.44Å; H288-T291 PolarHBondContact ND1-OG1 2.88Å; H288-T291 VanDerWaalsContact ND1-OG1 3.13Å; H288-T291 WeakPolarHBondContact O-CA 3.38Å; H288-T291 VanDerWaalsContact O-CB 3.27Å; H288-T291 WeakPolarHBondContact O-CB 3.44Å; H288-T291 WeakPolarHBondContact O-CG2 3.28Å; H288-T291 PolarHBondContact O-N 3.44Å; H288-T291 PolarHBondContact O-OG1 3.46Å; E289-T291 PolarHBondContact O-N 2.99Å; E289-T291 VanDerWaalsContact O-N 3.11Å
292	H	77.2	Confident	79.8	Confident	78 Å²	78	78.4 Å²	78.4	36%	0.361	40%	0.404	S	S	.	.	H	α-helix	trans	-84.5	-40.4	173.6	-59.2	-61.4	0	0	0	111.3	C272 L274 H288 E289 R290	C272-H292 PolarHBondContact SG-NE2 3.4Å; C272-H292 VanDerWaalsContact SG-NE2 3.36Å; L274-H292 HydrophobicContact CD1-CB 3.64Å; H288-H292 AromaticContact CE1-CE1 3.99Å; H288-H292 AromaticContact CE1-NE2 3.44Å; H288-H292 PolarHBondContact CE1-NE2 3.22Å; H288-H292 AromaticContact NE2-CD2 3.96Å; H288-H292 AromaticContact NE2-CE1 3.99Å; H288-H292 AromaticContact NE2-NE2 3.13Å; H288-H292 PolarHBondContact NE2-NE2 3.5Å; H288-H292 VanDerWaalsContact NE2-NE2 3.13Å; E289-H292 WeakPolarHBondContact O-CB 3.39Å; E289-H292 PolarHBondContact O-N 3.28Å; R290-H292 VanDerWaalsContact C-N 3.32Å
293	T	78.1	Confident	80.2	Confident	87 Å²	87	74 Å²	74	53%	0.534	39%	0.387	S	S	.	.	H	α-helix	trans	-81.5	-15.6	179.2	65.1	0	0	0	0	113.6	E289 R290 E295	E289-T293 PolarHBondContact O-N 3.16Å; R290-T293 WeakPolarHBondContact CA-OG1 3.45Å; T293-E295 PolarHBondContact O-N 3.31Å; T293-E295 WeakPolarHBondContact OG1-CG 3.44Å; T293-E295 PolarHBondContact OG1-N 3.44Å
294	G	77.2	Confident	80.1	Confident	48 Å²	48	79.6 Å²	79.6	50%	0.495	41%	0.413	S	S	.	.			trans	74.1	2.1	-175.6	0	0	0	0	0	114.3	R290 K296	R290-G294 CarbonylContact O-C 3.55Å; R290-G294 WeakPolarHBondContact O-CA 2.86Å; R290-G294 PolarHBondContact O-N 3.49Å; G294-K296 PolarHBondContact O-N 3.14Å
295	E	78.9	Confident	80.1	Confident	108 Å²	108	82 Å²	82	51%	0.505	42%	0.419	S	S	.	.			trans	-60.9	125.3	-178.6	-76.7	177.5	-165.1	0	0	112.2	R290 T293	R290-E295 HydrophobicContact CB-CB 4.34Å; R290-E295 HydrophobicContact CG-CB 4.19Å; R290-E295 PolarHBondContact O-N 3.06Å; T293-E295 PolarHBondContact O-N 3.31Å; T293-E295 WeakPolarHBondContact OG1-CG 3.44Å; T293-E295 PolarHBondContact OG1-N 3.44Å
296	K	84.3	Confident	80.3	Confident	124 Å²	124	82.7 Å²	82.7	54%	0.539	43%	0.428	S	S	.	.			trans	-127.7	76.9	177.1	-68.5	170.8	-177.2	-179.1	0	110.5	G294 Y298 A306 Y307	G294-K296 PolarHBondContact O-N 3.14Å; K296-Y298 PolarHBondContact O-N 3.27Å; K296-Y298 VanDerWaalsContact O-N 3.09Å; K296-A306 HydrophobicContact CB-CB 3.49Å; K296-A306 VanDerWaalsContact CB-CB 3.49Å; K296-A306 HydrophobicContact CD-CB 4.07Å; K296-A306 WeakPolarHBondContact CD-O 3.41Å; K296-A306 HydrophobicContact CG-CB 4.42Å; K296-Y307 CarbonylContact C-O 3.41Å; K296-Y307 VanDerWaalsContact C-O 3.28Å; K296-Y307 WeakPolarHBondContact CA-O 3.44Å
297	P	83.8	Confident	80.5	Confident	73 Å²	73	76.9 Å²	76.9	47%	0.474	41%	0.406	S	S	.	.			trans	-67.3	-13	-171.4	-21.3	34	0	0	0	114.9
298	Y	84.8	Confident	80.7	Confident	68 Å²	68	76.8 Å²	76.8	27%	0.267	41%	0.408	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	96.4	-174.2	-58.4	-84.5	0	0	0	109.7	K296 A306 Y307 H309 Q310	K296-Y298 PolarHBondContact O-N 3.27Å; K296-Y298 VanDerWaalsContact O-N 3.09Å; Y298-A306 CarbonylContact O-C 3.42Å; Y298-A306 WeakPolarHBondContact O-CA 3.4Å; Y298-Y307 PolarHBondContact N-O 2.93Å; Y298-Y307 VanDerWaalsContact N-O 3.13Å; Y298-Y307 PolarHBondContact O-N 3.29Å; Y298-H309 VanDerWaalsContact CD2-C 3.47Å; Y298-H309 VanDerWaalsContact CD2-CA 3.48Å; Y298-Q310 HydrophobicContact CD1-CB 3.76Å; Y298-Q310 HydrophobicContact CD1-CG 4.13Å; Y298-Q310 HydrophobicContact CE1-CB 3.54Å; Y298-Q310 HydrophobicContact CE1-CG 4.08Å; Y298-Q310 HydrophobicContact CG-CB 4.35Å
299	I	81.3	Confident	80.9	Confident	102 Å²	102	78.7 Å²	78.7	52%	0.523	42%	0.417	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.6	138.7	-177.3	-55.5	172.4	0	0	0	109.1	A306 L313	I299-A306 HydrophobicContact CG1-CB 4.03Å; I299-L313 WeakPolarHBondContact O-CD2 3.33Å
300	C	85	Confident	81.2	Confident	5 Å²	5	80.2 Å²	80.2	3%	0.034	42%	0.424	C	S	.	.			trans	-77.5	130	171.3	-172.5	0	0	0	0	110	L302 C303 K305 L313 H320	C300-L302 PolarHBondContact O-N 2.77Å; C300-C303 WeakPolarHBondContact CB-O 3.45Å; C300-K305 WeakPolarHBondContact CB-O 3.47Å; C300-K305 PolarHBondContact N-O 3.03Å; C300-L313 HydrophobicContact CB-CD1 3.6Å; C300-H320 VanDerWaalsContact SG-CD2 3.56Å; C300-H320 PolarHBondContact SG-NE2 3.32Å
301	N	79.9	Confident	81.1	Confident	150 Å²	150	84.1 Å²	84.1	80%	0.802	44%	0.442	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.5	-7.8	-179.7	-60.8	-25.7	0	0	0	113.2
302	L	78.4	Confident	81.3	Confident	122 Å²	122	85.4 Å²	85.4	64%	0.639	44%	0.438	S	S	*	.	T	Hydrogen-bonded Turn	trans	-104.8	-11.2	-178.6	-60	176.4	0	0	0	113	C300 H320	C300-L302 PolarHBondContact O-N 2.77Å; L302-H320 HydrophobicContact CD1-CB 3.58Å
303	C	81.7	Confident	81.6	Confident	34 Å²	34	82.6 Å²	82.6	23%	0.23	43%	0.426	C	S	.	.	S	Bend	trans	-161.1	163.8	172.8	71.6	0	0	0	0	111.1	C300 K305 H316 H320	C300-C303 WeakPolarHBondContact CB-O 3.45Å; C303-K305 PolarHBondContact O-N 3.26Å; C303-H316 PolarHBondContact SG-NE2 2.77Å; C303-H320 VanDerWaalsContact SG-CE1 3.51Å; C303-H320 PolarHBondContact SG-NE2 2.99Å
304	D	75.9	Confident	81.7	Confident	172 Å²	172	83.1 Å²	83.1	92%	0.92	42%	0.422	S	S	*	.	S	Bend	trans	-72.6	26.7	-175.5	-52.3	-42.9	0	0	0	115.5
305	K	79.4	Confident	81.7	Confident	119 Å²	119	82.7 Å²	82.7	52%	0.517	41%	0.408	S	S	.	.			trans	-94.5	122.3	-180	-69.2	178.6	-175.9	166.5	0	110.8	C300 C303 Y307	C300-K305 WeakPolarHBondContact CB-O 3.47Å; C300-K305 PolarHBondContact N-O 3.03Å; C303-K305 PolarHBondContact O-N 3.26Å; K305-Y307 HydrophobicContact CB-CE2 3.85Å; K305-Y307 WeakPolarHBondContact O-CE2 3.31Å
306	A	84.3	Confident	81.8	Confident	32 Å²	32	78.2 Å²	78.2	26%	0.264	39%	0.387	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	150.8	175.2	0	0	0	0	0	112.1	K296 Y298 I299	K296-A306 HydrophobicContact CB-CB 3.49Å; K296-A306 VanDerWaalsContact CB-CB 3.49Å; K296-A306 HydrophobicContact CD-CB 4.07Å; K296-A306 WeakPolarHBondContact CD-O 3.41Å; K296-A306 HydrophobicContact CG-CB 4.42Å; Y298-A306 CarbonylContact O-C 3.42Å; Y298-A306 WeakPolarHBondContact O-CA 3.4Å; I299-A306 HydrophobicContact CG1-CB 4.03Å
307	Y	84.5	Confident	81.6	Confident	49 Å²	49	75.6 Å²	75.6	19%	0.192	38%	0.377	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.5	146.5	-174.8	-62.1	-87.5	0	0	0	111.7	K296 Y298 K305 H309 L313 H316	K296-Y307 CarbonylContact C-O 3.41Å; K296-Y307 VanDerWaalsContact C-O 3.28Å; K296-Y307 WeakPolarHBondContact CA-O 3.44Å; Y298-Y307 PolarHBondContact N-O 2.93Å; Y298-Y307 VanDerWaalsContact N-O 3.13Å; Y298-Y307 PolarHBondContact O-N 3.29Å; K305-Y307 HydrophobicContact CB-CE2 3.85Å; K305-Y307 WeakPolarHBondContact O-CE2 3.31Å; Y307-H309 PolarHBondContact O-N 3.44Å; Y307-L313 HydrophobicContact CD2-CB 3.92Å; Y307-L313 HydrophobicContact CD2-CD1 3.86Å; Y307-L313 HydrophobicContact CE2-CD1 4.11Å; Y307-L313 HydrophobicContact CG-CB 4.26Å; Y307-H316 HydrophobicContact CE1-CB 4.05Å; Y307-H316 HydrophobicContact CE2-CB 3.8Å; Y307-H316 AromaticContact CE2-CD2 3.35Å; Y307-H316 WeakPolarHBondContact CE2-CD2 3.43Å; Y307-H316 AromaticContact CE2-CG 3.69Å; Y307-H316 VanDerWaalsContact CZ-CB 3.44Å; Y307-H316 AromaticContact CZ-CD2 3.54Å; Y307-H316 AromaticContact CZ-CG 3.41Å; Y307-H316 VanDerWaalsContact CZ-CG 3.41Å; Y307-H316 VanDerWaalsContact OH-CB 3.32Å; Y307-H316 WeakPolarHBondContact OH-CB 3.45Å; Y307-H316 PolarHBondContact OH-CD2 3.39Å; Y307-H316 PolarHBondContact OH-ND1 3.03Å
308	S	82.8	Confident	81.4	Confident	27 Å²	27	75.4 Å²	75.4	19%	0.189	37%	0.369	C	S	.	.	S	Bend	trans	-75.4	-11.9	178.4	57.7	0	0	0	0	113.6	R290	R290-S308 WeakPolarHBondContact CD-O 3.5Å; R290-S308 PolarHBondContact NH1-O 3.47Å
309	H	83.4	Confident	80.9	Confident	54 Å²	54	76.2 Å²	76.2	25%	0.25	38%	0.38	C	S	.	.	S	Bend	trans	-152.4	142.9	-178.4	-172	-100.8	0	0	0	112.3	I287 Y298 Y307 K311 Y312 L313	I287-H309 WeakPolarHBondContact CD1-CD2 3.28Å; I287-H309 HydrophobicContact CG2-CB 4.19Å; Y298-H309 VanDerWaalsContact CD2-C 3.47Å; Y298-H309 VanDerWaalsContact CD2-CA 3.48Å; Y307-H309 PolarHBondContact O-N 3.44Å; H309-K311 VanDerWaalsContact C-N 3.33Å; H309-K311 WeakPolarHBondContact ND1-CB 3.19Å; H309-K311 PolarHBondContact ND1-N 2.84Å; H309-K311 PolarHBondContact O-N 2.94Å; H309-Y312 HydrophobicContact CB-CD2 3.63Å; H309-Y312 HydrophobicContact CB-CE2 3.88Å; H309-Y312 WeakPolarHBondContact O-CB 3.43Å; H309-Y312 PolarHBondContact O-N 2.87Å; H309-L313 PolarHBondContact O-N 2.83Å
310	Q	82.6	Confident	80.5	Confident	100 Å²	100	74.9 Å²	74.9	47%	0.467	37%	0.372	S	S	.	.	H	α-helix	trans	-55.8	-41.6	-176.3	-168	177.4	-1.5	0	0	113.5	Y298 Y312 L313 Q314	Y298-Q310 HydrophobicContact CD1-CB 3.76Å; Y298-Q310 HydrophobicContact CD1-CG 4.13Å; Y298-Q310 HydrophobicContact CE1-CB 3.54Å; Y298-Q310 HydrophobicContact CE1-CG 4.08Å; Y298-Q310 HydrophobicContact CG-CB 4.35Å; Q310-Y312 PolarHBondContact O-N 3.09Å; Q310-L313 WeakPolarHBondContact O-CB 3.3Å; Q310-L313 PolarHBondContact O-N 3.45Å; Q310-L313 VanDerWaalsContact O-N 3.11Å; Q310-Q314 WeakPolarHBondContact O-CG 3.44Å; Q310-Q314 PolarHBondContact O-N 3.12Å
311	K	82.2	Confident	79.9	Confident	126 Å²	126	78.6 Å²	78.6	55%	0.548	39%	0.394	S	S	.	.	H	α-helix	trans	-58	-32.7	178.1	-174.2	177.4	179.8	174.1	0	112.7	H309 I315	H309-K311 VanDerWaalsContact C-N 3.33Å; H309-K311 WeakPolarHBondContact ND1-CB 3.19Å; H309-K311 PolarHBondContact ND1-N 2.84Å; H309-K311 PolarHBondContact O-N 2.94Å; K311-I315 HydrophobicContact CG-CD1 4.28Å; K311-I315 WeakPolarHBondContact O-CD1 3.41Å; K311-I315 VanDerWaalsContact O-CG1 3.24Å; K311-I315 WeakPolarHBondContact O-CG1 3.39Å; K311-I315 PolarHBondContact O-N 3.49Å
312	Y	81.7	Confident	79.5	Confident	116 Å²	116	73.7 Å²	73.7	46%	0.455	38%	0.38	S	S	.	.	H	α-helix	trans	-76.7	-36.5	178.6	-60.3	-50.2	0	0	0	111.8	H309 Q310 I315 H316	H309-Y312 HydrophobicContact CB-CD2 3.63Å; H309-Y312 HydrophobicContact CB-CE2 3.88Å; H309-Y312 WeakPolarHBondContact O-CB 3.43Å; H309-Y312 PolarHBondContact O-N 2.87Å; Q310-Y312 PolarHBondContact O-N 3.09Å; Y312-I315 PolarHBondContact O-N 3.47Å; Y312-H316 WeakPolarHBondContact O-CB 3.3Å; Y312-H316 PolarHBondContact O-N 2.92Å
313	L	84.1	Confident	79.2	Confident	18 Å²	18	73 Å²	73	9%	0.094	37%	0.373	C	S	.	.	H	α-helix	trans	-60.6	-50.1	170.4	173.1	61.1	0	0	0	110.7	I299 C300 Y307 H309 Q310 I315 H316 E317	I299-L313 WeakPolarHBondContact O-CD2 3.33Å; C300-L313 HydrophobicContact CB-CD1 3.6Å; Y307-L313 HydrophobicContact CD2-CB 3.92Å; Y307-L313 HydrophobicContact CD2-CD1 3.86Å; Y307-L313 HydrophobicContact CE2-CD1 4.11Å; Y307-L313 HydrophobicContact CG-CB 4.26Å; H309-L313 PolarHBondContact O-N 2.83Å; Q310-L313 WeakPolarHBondContact O-CB 3.3Å; Q310-L313 PolarHBondContact O-N 3.45Å; Q310-L313 VanDerWaalsContact O-N 3.11Å; L313-I315 PolarHBondContact O-N 3.47Å; L313-H316 CarbonylContact O-C 3.54Å; L313-H316 WeakPolarHBondContact O-CA 3.5Å; L313-H316 WeakPolarHBondContact O-CB 3.3Å; L313-H316 PolarHBondContact O-N 3.46Å; L313-E317 HydrophobicContact CD1-CG 3.97Å; L313-E317 HydrophobicContact CG-CG 4.27Å; L313-E317 WeakPolarHBondContact O-CG 3.22Å; L313-E317 PolarHBondContact O-N 3.23Å
314	Q	80.4	Confident	79	Confident	99 Å²	99	77.3 Å²	77.3	46%	0.463	39%	0.388	S	S	.	.	H	α-helix	trans	-57.5	-36.2	177.5	-72.7	178.6	-20.4	0	0	113.5	Q310 E317	Q310-Q314 WeakPolarHBondContact O-CG 3.44Å; Q310-Q314 PolarHBondContact O-N 3.12Å; Q314-E317 WeakPolarHBondContact CA-OE2 3.43Å
315	I	77.3	Confident	79.2	Confident	39 Å²	39	72.5 Å²	72.5	20%	0.2	37%	0.366	C	S	.	.	H	α-helix	trans	-69.4	-37.8	174.5	-76	169.2	0	0	0	111	K311 Y312 L313 Q337	K311-I315 HydrophobicContact CG-CD1 4.28Å; K311-I315 WeakPolarHBondContact O-CD1 3.41Å; K311-I315 VanDerWaalsContact O-CG1 3.24Å; K311-I315 WeakPolarHBondContact O-CG1 3.39Å; K311-I315 PolarHBondContact O-N 3.49Å; Y312-I315 PolarHBondContact O-N 3.47Å; L313-I315 PolarHBondContact O-N 3.47Å; I315-Q337 HydrophobicContact CG2-CG 4.26Å
316	H	80.2	Confident	79.2	Confident	14 Å²	14	70.9 Å²	70.9	7%	0.065	36%	0.358	C	S	.	.	H	α-helix	trans	-71.7	-37.9	177.9	169.4	56	0	0	0	112.4	C303 Y307 Y312 L313 K318 T319 H320	C303-H316 PolarHBondContact SG-NE2 2.77Å; Y307-H316 HydrophobicContact CE1-CB 4.05Å; Y307-H316 HydrophobicContact CE2-CB 3.8Å; Y307-H316 AromaticContact CE2-CD2 3.35Å; Y307-H316 WeakPolarHBondContact CE2-CD2 3.43Å; Y307-H316 AromaticContact CE2-CG 3.69Å; Y307-H316 VanDerWaalsContact CZ-CB 3.44Å; Y307-H316 AromaticContact CZ-CD2 3.54Å; Y307-H316 AromaticContact CZ-CG 3.41Å; Y307-H316 VanDerWaalsContact CZ-CG 3.41Å; Y307-H316 VanDerWaalsContact OH-CB 3.32Å; Y307-H316 WeakPolarHBondContact OH-CB 3.45Å; Y307-H316 PolarHBondContact OH-CD2 3.39Å; Y307-H316 PolarHBondContact OH-ND1 3.03Å; Y312-H316 WeakPolarHBondContact O-CB 3.3Å; Y312-H316 PolarHBondContact O-N 2.92Å; L313-H316 CarbonylContact O-C 3.54Å; L313-H316 WeakPolarHBondContact O-CA 3.5Å; L313-H316 WeakPolarHBondContact O-CB 3.3Å; L313-H316 PolarHBondContact O-N 3.46Å; H316-K318 PolarHBondContact O-N 3.1Å; H316-K318 VanDerWaalsContact O-N 3.15Å; H316-T319 PolarHBondContact CE1-OG1 3.45Å; H316-T319 PolarHBondContact ND1-OG1 3.35Å; H316-T319 VanDerWaalsContact ND1-OG1 3.1Å; H316-T319 WeakPolarHBondContact O-CA 3.35Å; H316-T319 VanDerWaalsContact O-CB 3.26Å; H316-T319 WeakPolarHBondContact O-CB 3.41Å; H316-T319 WeakPolarHBondContact O-CG2 3.46Å; H316-T319 PolarHBondContact O-N 3.19Å; H316-T319 PolarHBondContact O-OG1 3.28Å; H316-H320 AromaticContact CD2-NE2 3.96Å; H316-H320 AromaticContact CE1-CE1 3.97Å; H316-H320 AromaticContact CE1-NE2 3.43Å; H316-H320 PolarHBondContact CE1-NE2 3.19Å; H316-H320 AromaticContact NE2-CD2 3.87Å; H316-H320 AromaticContact NE2-CE1 3.93Å; H316-H320 AromaticContact NE2-NE2 3.08Å; H316-H320 PolarHBondContact NE2-NE2 3.41Å
317	E	79.6	Confident	79.1	Confident	68 Å²	68	76.8 Å²	76.8	32%	0.318	38%	0.377	S	S	.	.	H	α-helix	trans	-57.2	-32	178	-73.3	169.8	155	0	0	112.1	L313 Q314 T319 H320 T321	L313-E317 HydrophobicContact CD1-CG 3.97Å; L313-E317 HydrophobicContact CG-CG 4.27Å; L313-E317 WeakPolarHBondContact O-CG 3.22Å; L313-E317 PolarHBondContact O-N 3.23Å; Q314-E317 WeakPolarHBondContact CA-OE2 3.43Å; E317-T319 PolarHBondContact O-N 3.08Å; E317-T319 VanDerWaalsContact O-N 3.11Å; E317-H320 WeakPolarHBondContact O-CB 3.4Å; E317-H320 PolarHBondContact O-N 3.46Å; E317-T321 PolarHBondContact O-N 2.89Å
318	K	80.1	Confident	79.1	Confident	70 Å²	70	75 Å²	75	30%	0.304	37%	0.371	S	S	.	.	H	α-helix	trans	-61	-18.7	171.8	-62.5	-178.9	-179.3	-162.7	0	114.4	H316 T321 G322 E323	H316-K318 PolarHBondContact O-N 3.1Å; H316-K318 VanDerWaalsContact O-N 3.15Å; K318-T321 WeakPolarHBondContact CA-OG1 3.24Å; K318-T321 PolarHBondContact O-OG1 3.46Å; K318-G322 PolarHBondContact O-N 3.09Å; K318-E323 PolarHBondContact O-N 3.33Å
319	T	73.7	Confident	79	Confident	84 Å²	84	81 Å²	81	52%	0.515	40%	0.401	S	S	.	.	H	α-helix	trans	-77.3	-27.2	174.7	67.5	0	0	0	0	112.4	H316 E317	H316-T319 PolarHBondContact CE1-OG1 3.45Å; H316-T319 PolarHBondContact ND1-OG1 3.35Å; H316-T319 VanDerWaalsContact ND1-OG1 3.1Å; H316-T319 WeakPolarHBondContact O-CA 3.35Å; H316-T319 VanDerWaalsContact O-CB 3.26Å; H316-T319 WeakPolarHBondContact O-CB 3.41Å; H316-T319 WeakPolarHBondContact O-CG2 3.46Å; H316-T319 PolarHBondContact O-N 3.19Å; H316-T319 PolarHBondContact O-OG1 3.28Å; E317-T319 PolarHBondContact O-N 3.08Å; E317-T319 VanDerWaalsContact O-N 3.11Å
320	H	74.6	Confident	78.7	Confident	75 Å²	75	84.3 Å²	84.3	35%	0.347	42%	0.417	S	S	.	.	H	α-helix	trans	-80.1	-38.4	175.5	-63.8	-58.4	0	0	0	111.7	C300 L302 C303 H316 E317 G322	C300-H320 VanDerWaalsContact SG-CD2 3.56Å; C300-H320 PolarHBondContact SG-NE2 3.32Å; L302-H320 HydrophobicContact CD1-CB 3.58Å; C303-H320 VanDerWaalsContact SG-CE1 3.51Å; C303-H320 PolarHBondContact SG-NE2 2.99Å; H316-H320 AromaticContact CD2-NE2 3.96Å; H316-H320 AromaticContact CE1-CE1 3.97Å; H316-H320 AromaticContact CE1-NE2 3.43Å; H316-H320 PolarHBondContact CE1-NE2 3.19Å; H316-H320 AromaticContact NE2-CD2 3.87Å; H316-H320 AromaticContact NE2-CE1 3.93Å; H316-H320 AromaticContact NE2-NE2 3.08Å; H316-H320 PolarHBondContact NE2-NE2 3.41Å; E317-H320 WeakPolarHBondContact O-CB 3.4Å; E317-H320 PolarHBondContact O-N 3.46Å; H320-G322 PolarHBondContact O-N 2.76Å
321	T	72	Confident	78.8	Confident	82 Å²	82	81.2 Å²	81.2	50%	0.503	41%	0.406	S	S	.	.	S	Bend	trans	-76.3	-10.9	177.1	62.5	0	0	0	0	113.2	E317 K318 E323	E317-T321 PolarHBondContact O-N 2.89Å; K318-T321 WeakPolarHBondContact CA-OG1 3.24Å; K318-T321 PolarHBondContact O-OG1 3.46Å; T321-E323 PolarHBondContact O-N 3.13Å; T321-E323 VanDerWaalsContact O-N 3.11Å; T321-E323 WeakPolarHBondContact OG1-CG 3.32Å
322	G	70.3	Confident	78.5	Confident	48 Å²	48	83.7 Å²	83.7	50%	0.495	43%	0.425	S	S	.	.			trans	66.3	7.1	-175.2	0	0	0	0	0	113.9	K318 H320 K324	K318-G322 PolarHBondContact O-N 3.09Å; H320-G322 PolarHBondContact O-N 2.76Å; G322-K324 PolarHBondContact O-N 2.76Å
323	E	72.1	Confident	78.4	Confident	107 Å²	107	84 Å²	84	50%	0.5	43%	0.429	S	S	.	.			trans	-61.4	120.4	-178.2	-77.6	177.9	-161.1	0	0	110.6	K318 T321 P325	K318-E323 PolarHBondContact O-N 3.33Å; T321-E323 PolarHBondContact O-N 3.13Å; T321-E323 VanDerWaalsContact O-N 3.11Å; T321-E323 WeakPolarHBondContact OG1-CG 3.32Å; E323-P325 VanDerWaalsContact C-CD 3.45Å; E323-P325 WeakPolarHBondContact O-CD 3.31Å
324	K	78	Confident	78.2	Confident	124 Å²	124	83.9 Å²	83.9	54%	0.539	43%	0.433	S	S	.	.			trans	-118.4	75.2	175	-72.9	166	174.7	179.1	0	109.5	G322 Y326 G334 F335	G322-K324 PolarHBondContact O-N 2.76Å; K324-Y326 PolarHBondContact O-N 3.39Å; K324-Y326 VanDerWaalsContact O-N 3.12Å; K324-G334 VanDerWaalsContact CD-O 3.27Å; K324-G334 WeakPolarHBondContact CD-O 3.31Å; K324-F335 CarbonylContact C-O 3.58Å; K324-F335 WeakPolarHBondContact CA-O 3.46Å
325	P	79.7	Confident	78.2	Confident	72 Å²	72	81.1 Å²	81.1	47%	0.468	42%	0.419	S	S	.	.			trans	-63.8	-20.5	-175	-21.1	33.5	0	0	0	113.4	E323	E323-P325 VanDerWaalsContact C-CD 3.45Å; E323-P325 WeakPolarHBondContact O-CD 3.31Å
326	Y	80.5	Confident	78.3	Confident	85 Å²	85	80.6 Å²	80.6	33%	0.333	42%	0.42	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	95.6	-175.6	-55	-77.4	0	0	0	109.6	K324 G334 F335 Q337 L338	K324-Y326 PolarHBondContact O-N 3.39Å; K324-Y326 VanDerWaalsContact O-N 3.12Å; Y326-G334 CarbonylContact O-C 3.6Å; Y326-F335 WeakPolarHBondContact CB-O 3.41Å; Y326-F335 PolarHBondContact N-O 3.5Å; Y326-F335 PolarHBondContact O-N 2.89Å; Y326-Q337 VanDerWaalsContact CD2-C 3.4Å; Y326-L338 HydrophobicContact CD1-CB 3.88Å; Y326-L338 HydrophobicContact CD1-CD1 3.82Å; Y326-L338 HydrophobicContact CD1-CG 4.42Å; Y326-L338 VanDerWaalsContact CD2-N 3.31Å; Y326-L338 HydrophobicContact CE1-CB 3.71Å; Y326-L338 HydrophobicContact CE1-CD1 4.16Å; Y326-L338 HydrophobicContact CE1-CG 4.37Å; Y326-L338 HydrophobicContact CE2-CB 4.38Å; Y326-L338 HydrophobicContact CG-CB 4.29Å
327	K	82	Confident	78.2	Confident	155 Å²	155	81.4 Å²	81.4	67%	0.674	42%	0.424	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-89.9	143.7	177.9	-63.3	-177.6	-179.5	-179	0	110.8	L341	K327-L341 WeakPolarHBondContact O-CD2 3.47Å
328	C	84.8	Confident	78.1	Confident	11 Å²	11	81.3 Å²	81.3	7%	0.074	43%	0.426	C	S	.	.			trans	-79	135.8	171.3	-174.4	0	0	0	0	109.8	Q330 K333 F335 L341 H348	C328-Q330 VanDerWaalsContact C-N 3.26Å; C328-Q330 PolarHBondContact O-N 2.74Å; C328-Q330 PolarHBondContact SG-N 3.17Å; C328-K333 WeakPolarHBondContact CB-O 3.25Å; C328-K333 PolarHBondContact N-O 2.93Å; C328-F335 HydrophobicContact CB-CE2 4.44Å; C328-L341 HydrophobicContact CB-CD1 3.72Å; C328-H348 PolarHBondContact SG-NE2 3.06Å; C328-H348 VanDerWaalsContact SG-NE2 3.4Å
329	N	79.1	Confident	78	Confident	153 Å²	153	85.6 Å²	85.6	82%	0.818	44%	0.44	S	S	*	.	S	Bend	trans	-81.8	-7.4	179	-62.8	-11.9	0	0	0	112.9
330	Q	77.4	Confident	78.2	Confident	124 Å²	124	87.4 Å²	87.4	58%	0.579	44%	0.438	S	S	*	.	S	Bend	trans	-112.1	-5.4	-175.9	-59.3	-178.4	32	0	0	113.1	C328	C328-Q330 VanDerWaalsContact C-N 3.26Å; C328-Q330 PolarHBondContact O-N 2.74Å; C328-Q330 PolarHBondContact SG-N 3.17Å
331	C	84.1	Confident	78.5	Confident	36 Å²	36	84.4 Å²	84.4	24%	0.243	42%	0.424	C	S	.	.	S	Bend	trans	-163.6	166.9	172.7	69.9	0	0	0	0	110.7	K333 H344 H348	C331-K333 PolarHBondContact O-N 3.5Å; C331-H344 PolarHBondContact SG-NE2 3.41Å; C331-H348 PolarHBondContact SG-NE2 3.22Å; C331-H348 VanDerWaalsContact SG-NE2 3.45Å
332	D	77.9	Confident	78.8	Confident	177 Å²	177	87.7 Å²	87.7	95%	0.947	43%	0.428	S	S	*	.	S	Bend	trans	-71.7	13.6	-176.4	-58.2	-38.4	0	0	0	115.2	G334	D332-G334 PolarHBondContact O-N 3.25Å
333	K	77.8	Confident	79	Confident	123 Å²	123	86.3 Å²	86.3	54%	0.535	41%	0.411	S	S	.	.			trans	-82.7	118	-178.8	-66.1	-179.6	-177.1	172.8	0	111.3	C328 C331 F335	C328-K333 WeakPolarHBondContact CB-O 3.25Å; C328-K333 PolarHBondContact N-O 2.93Å; C331-K333 PolarHBondContact O-N 3.5Å; K333-F335 HydrophobicContact CB-CE2 3.84Å; K333-F335 HydrophobicContact CB-CZ 3.88Å; K333-F335 WeakPolarHBondContact O-CE2 3.49Å
334	G	80.9	Confident	79.4	Confident	16 Å²	16	82 Å²	82	17%	0.165	39%	0.392	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.2	147	168.7	0	0	0	0	0	113.3	K324 Y326 D332	K324-G334 VanDerWaalsContact CD-O 3.27Å; K324-G334 WeakPolarHBondContact CD-O 3.31Å; Y326-G334 CarbonylContact O-C 3.6Å; D332-G334 PolarHBondContact O-N 3.25Å
335	F	80	Confident	79.4	Confident	41 Å²	41	79 Å²	79	18%	0.18	38%	0.379	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	144.9	-177.3	-58.2	-89.7	0	0	0	111.7	K324 Y326 C328 K333 Q337 L341 H344	K324-F335 CarbonylContact C-O 3.58Å; K324-F335 WeakPolarHBondContact CA-O 3.46Å; Y326-F335 WeakPolarHBondContact CB-O 3.41Å; Y326-F335 PolarHBondContact N-O 3.5Å; Y326-F335 PolarHBondContact O-N 2.89Å; C328-F335 HydrophobicContact CB-CE2 4.44Å; K333-F335 HydrophobicContact CB-CE2 3.84Å; K333-F335 HydrophobicContact CB-CZ 3.88Å; K333-F335 WeakPolarHBondContact O-CE2 3.49Å; F335-Q337 VanDerWaalsContact C-N 3.29Å; F335-Q337 PolarHBondContact O-N 2.96Å; F335-L341 HydrophobicContact CB-CB 4.28Å; F335-L341 HydrophobicContact CD2-CB 3.85Å; F335-L341 HydrophobicContact CD2-CD1 3.75Å; F335-L341 HydrophobicContact CD2-CG 4.41Å; F335-L341 HydrophobicContact CE2-CD1 3.93Å; F335-L341 HydrophobicContact CG-CB 4.21Å; F335-H344 HydrophobicContact CE1-CB 3.88Å; F335-H344 HydrophobicContact CE2-CB 3.87Å; F335-H344 AromaticContact CE2-CD2 3.28Å; F335-H344 WeakPolarHBondContact CE2-CD2 3.4Å; F335-H344 AromaticContact CE2-CG 3.71Å; F335-H344 HydrophobicContact CZ-CB 3.35Å; F335-H344 AromaticContact CZ-CD2 3.28Å; F335-H344 WeakPolarHBondContact CZ-CD2 3.37Å; F335-H344 AromaticContact CZ-CG 3.23Å
336	A	78.7	Confident	79.2	Confident	27 Å²	27	79.4 Å²	79.4	22%	0.223	37%	0.371	C	S	.	.	S	Bend	trans	-74.3	-17.5	176.3	0	0	0	0	0	113.4
337	Q	78.1	Confident	78.7	Confident	31 Å²	31	79.2 Å²	79.2	15%	0.145	38%	0.379	C	S	.	.	S	Bend	trans	-139.9	142.5	178.9	-54.7	178.9	34.4	0	0	112.3	I315 Y326 F335 R339 Y340 L341	I315-Q337 HydrophobicContact CG2-CG 4.26Å; Y326-Q337 VanDerWaalsContact CD2-C 3.4Å; F335-Q337 VanDerWaalsContact C-N 3.29Å; F335-Q337 PolarHBondContact O-N 2.96Å; Q337-R339 VanDerWaalsContact C-N 3.26Å; Q337-R339 HydrophobicContact CB-CG 4.32Å; Q337-R339 PolarHBondContact O-N 3.24Å; Q337-Y340 HydrophobicContact CB-CD2 3.67Å; Q337-Y340 HydrophobicContact CB-CE2 4.07Å; Q337-Y340 HydrophobicContact CG-CD2 4.05Å; Q337-Y340 HydrophobicContact CG-CE2 4Å; Q337-Y340 PolarHBondContact O-N 2.81Å; Q337-L341 PolarHBondContact O-N 2.88Å
338	L	78.9	Confident	78.4	Confident	67 Å²	67	74.9 Å²	74.9	35%	0.351	36%	0.362	S	S	.	.	H	α-helix	trans	-56.5	-35.9	178.2	-175.3	60.2	0	0	0	113.5	Y326 Y340 L341 R342	Y326-L338 HydrophobicContact CD1-CB 3.88Å; Y326-L338 HydrophobicContact CD1-CD1 3.82Å; Y326-L338 HydrophobicContact CD1-CG 4.42Å; Y326-L338 VanDerWaalsContact CD2-N 3.31Å; Y326-L338 HydrophobicContact CE1-CB 3.71Å; Y326-L338 HydrophobicContact CE1-CD1 4.16Å; Y326-L338 HydrophobicContact CE1-CG 4.37Å; Y326-L338 HydrophobicContact CE2-CB 4.38Å; Y326-L338 HydrophobicContact CG-CB 4.29Å; L338-Y340 PolarHBondContact O-N 3.5Å; L338-L341 HydrophobicContact CD1-CD2 4.33Å; L338-L341 PolarHBondContact O-N 2.9Å; L338-R342 HydrophobicContact CD1-CG 4.46Å; L338-R342 HydrophobicContact CG-CG 4.47Å; L338-R342 WeakPolarHBondContact O-CG 3.37Å; L338-R342 PolarHBondContact O-N 3Å
339	R	77.1	Confident	77.5	Confident	159 Å²	159	77.8 Å²	77.8	60%	0.6	38%	0.379	S	S	*	.	H	α-helix	trans	-61.2	-33.4	178.4	80.6	177.6	87.9	-160.7	6.8	112.6	Q337 A343	Q337-R339 VanDerWaalsContact C-N 3.26Å; Q337-R339 HydrophobicContact CB-CG 4.32Å; Q337-R339 PolarHBondContact O-N 3.24Å; R339-A343 WeakPolarHBondContact O-CB 3.39Å; R339-A343 PolarHBondContact O-N 3.4Å; R339-A343 VanDerWaalsContact O-N 3.12Å
340	Y	77.1	Confident	76.7	Confident	123 Å²	123	77.9 Å²	77.9	48%	0.482	37%	0.374	S	S	.	.	H	α-helix	trans	-80.4	-37.3	-179.4	-62.9	-52.1	0	0	0	111.2	Q337 L338 A343 H344	Q337-Y340 HydrophobicContact CB-CD2 3.67Å; Q337-Y340 HydrophobicContact CB-CE2 4.07Å; Q337-Y340 HydrophobicContact CG-CD2 4.05Å; Q337-Y340 HydrophobicContact CG-CE2 4Å; Q337-Y340 PolarHBondContact O-N 2.81Å; L338-Y340 PolarHBondContact O-N 3.5Å; Y340-A343 PolarHBondContact O-N 3.09Å; Y340-H344 WeakPolarHBondContact O-CB 3.46Å; Y340-H344 PolarHBondContact O-N 3.09Å
341	L	81.5	Confident	76.1	Confident	11 Å²	11	77.7 Å²	77.7	6%	0.058	37%	0.373	C	S	.	.	H	α-helix	trans	-57.7	-52.4	169.3	173.9	61.5	0	0	0	110.4	K327 C328 F335 Q337 L338 A343 H344 E345	K327-L341 WeakPolarHBondContact O-CD2 3.47Å; C328-L341 HydrophobicContact CB-CD1 3.72Å; F335-L341 HydrophobicContact CB-CB 4.28Å; F335-L341 HydrophobicContact CD2-CB 3.85Å; F335-L341 HydrophobicContact CD2-CD1 3.75Å; F335-L341 HydrophobicContact CD2-CG 4.41Å; F335-L341 HydrophobicContact CE2-CD1 3.93Å; F335-L341 HydrophobicContact CG-CB 4.21Å; Q337-L341 PolarHBondContact O-N 2.88Å; L338-L341 HydrophobicContact CD1-CD2 4.33Å; L338-L341 PolarHBondContact O-N 2.9Å; L341-A343 VanDerWaalsContact C-N 3.26Å; L341-A343 PolarHBondContact O-N 3.27Å; L341-H344 CarbonylContact O-C 3.54Å; L341-H344 WeakPolarHBondContact O-CA 3.29Å; L341-H344 WeakPolarHBondContact O-CB 3.45Å; L341-H344 PolarHBondContact O-N 3.21Å; L341-E345 HydrophobicContact CD1-CG 3.95Å; L341-E345 HydrophobicContact CG-CG 4.28Å; L341-E345 WeakPolarHBondContact O-CG 3.05Å; L341-E345 PolarHBondContact O-N 2.93Å
342	R	79.6	Confident	75.4	Confident	151 Å²	151	81.5 Å²	81.5	57%	0.57	39%	0.386	S	S	*	.	H	α-helix	trans	-57.6	-37.7	177.4	-72.2	179.9	179.5	-178.8	-1.2	113.4	L338 H344 E345 R346	L338-R342 HydrophobicContact CD1-CG 4.46Å; L338-R342 HydrophobicContact CG-CG 4.47Å; L338-R342 WeakPolarHBondContact O-CG 3.37Å; L338-R342 PolarHBondContact O-N 3Å; R342-H344 VanDerWaalsContact C-N 3.32Å; R342-E345 WeakPolarHBondContact CA-OE2 3.32Å; R342-R346 WeakPolarHBondContact O-CG 3.38Å
343	A	74.4	Confident	75.3	Confident	19 Å²	19	77.4 Å²	77.4	16%	0.157	37%	0.367	C	S	.	.	H	α-helix	trans	-72.3	-28.7	176.9	0	0	0	0	0	112.6	R339 Y340 L341	R339-A343 WeakPolarHBondContact O-CB 3.39Å; R339-A343 PolarHBondContact O-N 3.4Å; R339-A343 VanDerWaalsContact O-N 3.12Å; Y340-A343 PolarHBondContact O-N 3.09Å; L341-A343 VanDerWaalsContact C-N 3.26Å; L341-A343 PolarHBondContact O-N 3.27Å
344	H	79.1	Confident	75.3	Confident	18 Å²	18	74.8 Å²	74.8	8%	0.083	36%	0.355	C	S	.	.	H	α-helix	trans	-78.8	-38.3	174.5	169.2	57.1	0	0	0	112.5	C331 F335 Y340 L341 R342 R346 T347 H348	C331-H344 PolarHBondContact SG-NE2 3.41Å; F335-H344 HydrophobicContact CE1-CB 3.88Å; F335-H344 HydrophobicContact CE2-CB 3.87Å; F335-H344 AromaticContact CE2-CD2 3.28Å; F335-H344 WeakPolarHBondContact CE2-CD2 3.4Å; F335-H344 AromaticContact CE2-CG 3.71Å; F335-H344 HydrophobicContact CZ-CB 3.35Å; F335-H344 AromaticContact CZ-CD2 3.28Å; F335-H344 WeakPolarHBondContact CZ-CD2 3.37Å; F335-H344 AromaticContact CZ-CG 3.23Å; Y340-H344 WeakPolarHBondContact O-CB 3.46Å; Y340-H344 PolarHBondContact O-N 3.09Å; L341-H344 CarbonylContact O-C 3.54Å; L341-H344 WeakPolarHBondContact O-CA 3.29Å; L341-H344 WeakPolarHBondContact O-CB 3.45Å; L341-H344 PolarHBondContact O-N 3.21Å; R342-H344 VanDerWaalsContact C-N 3.32Å; H344-R346 PolarHBondContact O-N 3.33Å; H344-R346 VanDerWaalsContact O-N 3.13Å; H344-T347 PolarHBondContact ND1-OG1 3.26Å; H344-T347 WeakPolarHBondContact O-CB 3.42Å; H344-T347 PolarHBondContact O-N 3.12Å; H344-T347 PolarHBondContact O-OG1 3.22Å; H344-H348 AromaticContact CD2-NE2 3.92Å; H344-H348 AromaticContact CE1-CE1 3.76Å; H344-H348 AromaticContact CE1-NE2 3.35Å; H344-H348 PolarHBondContact CE1-NE2 3.25Å; H344-H348 VanDerWaalsContact CE1-NE2 3.35Å; H344-H348 AromaticContact NE2-CD2 3.93Å; H344-H348 AromaticContact NE2-CE1 3.81Å; H344-H348 AromaticContact NE2-NE2 3.04Å; H344-H348 PolarHBondContact NE2-NE2 2.65Å
345	E	77.7	Confident	75.3	Confident	60 Å²	60	80.8 Å²	80.8	28%	0.28	38%	0.376	S	S	.	.	H	α-helix	trans	-57.3	-31.8	177.9	-73.3	169.1	151.7	0	0	112	L341 R342 T347 H348 T349	L341-E345 HydrophobicContact CD1-CG 3.95Å; L341-E345 HydrophobicContact CG-CG 4.28Å; L341-E345 WeakPolarHBondContact O-CG 3.05Å; L341-E345 PolarHBondContact O-N 2.93Å; R342-E345 WeakPolarHBondContact CA-OE2 3.32Å; E345-T347 PolarHBondContact O-N 3.27Å; E345-T347 VanDerWaalsContact O-N 3.16Å; E345-H348 PolarHBondContact O-N 3.25Å; E345-T349 PolarHBondContact O-N 3.42Å
346	R	75.7	Confident	75.5	Confident	80 Å²	80	78.9 Å²	78.9	30%	0.302	37%	0.368	S	S	.	.	H	α-helix	trans	-62.1	-18.2	172	-63.8	175.5	-169.4	-167	-5	114.6	R342 H344 H348 Q350 A364	R342-R346 WeakPolarHBondContact O-CG 3.38Å; H344-R346 PolarHBondContact O-N 3.33Å; H344-R346 VanDerWaalsContact O-N 3.13Å; R346-H348 VanDerWaalsContact C-N 3.34Å; R346-Q350 PolarHBondContact O-N 3.17Å; R346-A364 HydrophobicContact CB-CB 4.34Å; R346-A364 WeakPolarHBondContact CD-O 3.49Å; R346-A364 PolarHBondContact NH1-O 3.34Å
347	T	71.3	Confident	75.6	Confident	82 Å²	82	85 Å²	85	50%	0.503	40%	0.397	S	S	.	.	H	α-helix	trans	-76.5	-26.7	174.6	68.6	0	0	0	0	112	H344 E345	H344-T347 PolarHBondContact ND1-OG1 3.26Å; H344-T347 WeakPolarHBondContact O-CB 3.42Å; H344-T347 PolarHBondContact O-N 3.12Å; H344-T347 PolarHBondContact O-OG1 3.22Å; E345-T347 PolarHBondContact O-N 3.27Å; E345-T347 VanDerWaalsContact O-N 3.16Å
348	H	74.4	Confident	75.7	Confident	64 Å²	64	90.1 Å²	90.1	30%	0.296	42%	0.421	S	S	.	.	H	α-helix	trans	-83.2	-38.8	177.1	-57.5	-57.5	0	0	0	111.7	C328 C331 H344 E345 R346 Q350	C328-H348 PolarHBondContact SG-NE2 3.06Å; C328-H348 VanDerWaalsContact SG-NE2 3.4Å; C331-H348 PolarHBondContact SG-NE2 3.22Å; C331-H348 VanDerWaalsContact SG-NE2 3.45Å; H344-H348 AromaticContact CD2-NE2 3.92Å; H344-H348 AromaticContact CE1-CE1 3.76Å; H344-H348 AromaticContact CE1-NE2 3.35Å; H344-H348 PolarHBondContact CE1-NE2 3.25Å; H344-H348 VanDerWaalsContact CE1-NE2 3.35Å; H344-H348 AromaticContact NE2-CD2 3.93Å; H344-H348 AromaticContact NE2-CE1 3.81Å; H344-H348 AromaticContact NE2-NE2 3.04Å; H344-H348 PolarHBondContact NE2-NE2 2.65Å; E345-H348 PolarHBondContact O-N 3.25Å; R346-H348 VanDerWaalsContact C-N 3.34Å; H348-Q350 PolarHBondContact O-N 2.95Å
349	T	66.3	Low	76	Confident	72 Å²	72	89.4 Å²	89.4	44%	0.442	42%	0.421	S	S	.	.	S	Bend	trans	-76.9	-6.8	177.3	63.2	0	0	0	0	113.6	E345 E351	E345-T349 PolarHBondContact O-N 3.42Å; T349-E351 PolarHBondContact O-N 3.04Å
350	Q	63.7	Low	76	Confident	154 Å²	154	84.5 Å²	84.5	72%	0.72	42%	0.42	S	S	*	.			trans	49.9	16.3	-170.3	-60.1	-170.6	14.7	0	0	114.8	R346 H348 K352	R346-Q350 PolarHBondContact O-N 3.17Å; H348-Q350 PolarHBondContact O-N 2.95Å; Q350-K352 PolarHBondContact O-N 2.77Å
351	E	64.7	Low	76.1	Confident	120 Å²	120	84 Å²	84	56%	0.561	42%	0.42	S	S	*	.			trans	-67.5	96	178.7	-80	-172.9	140.1	0	0	110.3	T349 T353	T349-E351 PolarHBondContact O-N 3.04Å; E351-T353 VanDerWaalsContact C-N 3.34Å; E351-T353 PolarHBondContact O-N 2.95Å
352	K	69.4	Low	76.1	Confident	117 Å²	117	84.9 Å²	84.9	51%	0.509	43%	0.429	S	S	.	.			trans	-91.4	73.3	173.1	-70.2	165.7	174.9	174.5	0	108.9	Q350 Y354 A362 F363	Q350-K352 PolarHBondContact O-N 2.77Å; K352-Y354 PolarHBondContact O-N 3.41Å; K352-A362 HydrophobicContact CB-CB 3.36Å; K352-A362 HydrophobicContact CD-CB 4.07Å; K352-A362 WeakPolarHBondContact CD-O 3.26Å; K352-A362 HydrophobicContact CG-CB 4.28Å; K352-F363 CarbonylContact C-O 3.44Å; K352-F363 WeakPolarHBondContact CA-O 3.28Å
353	T	74.6	Confident	76	Confident	90 Å²	90	79.8 Å²	79.8	55%	0.552	41%	0.411	S	S	*	.			trans	-62	-27.7	-175.2	-35.2	0	0	0	0	113.1	E351 F363	E351-T353 VanDerWaalsContact C-N 3.34Å; E351-T353 PolarHBondContact O-N 2.95Å; T353-F363 PolarHBondContact N-O 3.45Å
354	Y	77.7	Confident	76.2	Confident	69 Å²	69	79.9 Å²	79.9	27%	0.271	41%	0.411	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.6	99	-173.6	-55.1	-76.8	0	0	0	110.7	K352 A362 F363 Q365 L366	K352-Y354 PolarHBondContact O-N 3.41Å; Y354-A362 CarbonylContact O-C 3.52Å; Y354-A362 WeakPolarHBondContact O-CA 3.4Å; Y354-F363 PolarHBondContact N-O 3.43Å; Y354-F363 VanDerWaalsContact N-O 3.1Å; Y354-F363 PolarHBondContact O-N 3.32Å; Y354-Q365 VanDerWaalsContact CD2-C 3.45Å; Y354-L366 HydrophobicContact CD1-CB 3.95Å; Y354-L366 HydrophobicContact CD1-CD1 3.8Å; Y354-L366 HydrophobicContact CD1-CG 4.42Å; Y354-L366 HydrophobicContact CD2-CB 4.38Å; Y354-L366 VanDerWaalsContact CD2-N 3.32Å; Y354-L366 HydrophobicContact CE1-CB 3.85Å; Y354-L366 HydrophobicContact CE1-CD1 4.21Å; Y354-L366 HydrophobicContact CE1-CG 4.45Å; Y354-L366 HydrophobicContact CE2-CB 4.26Å; Y354-L366 HydrophobicContact CG-CB 4.21Å; Y354-L366 HydrophobicContact CG-CD1 4.42Å
355	K	80.8	Confident	76	Confident	142 Å²	142	81.5 Å²	81.5	62%	0.617	42%	0.419	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-91.1	138.2	179.2	-62	-177.6	-178.9	178	0	110.9	A362	K355-A362 HydrophobicContact CG-CB 3.86Å
356	C	84.9	Confident	75.9	Confident	1 Å²	1	82 Å²	82	1%	0.007	42%	0.424	C	S	.	.			trans	-78.9	120.6	171	179	0	0	0	0	109.5	Q358 G360 K361 F363 L369 H376	C356-Q358 PolarHBondContact O-N 2.93Å; C356-G360 VanDerWaalsContact O-CA 3.26Å; C356-G360 WeakPolarHBondContact O-CA 3.4Å; C356-G360 PolarHBondContact O-N 3.09Å; C356-K361 WeakPolarHBondContact CB-O 3.35Å; C356-K361 PolarHBondContact N-O 2.94Å; C356-F363 HydrophobicContact CB-CE2 4.37Å; C356-L369 HydrophobicContact CB-CD1 3.53Å; C356-H376 PolarHBondContact SG-NE2 3.39Å; C356-H376 VanDerWaalsContact SG-NE2 3.38Å
357	N	80.4	Confident	76	Confident	155 Å²	155	82.1 Å²	82.1	83%	0.829	43%	0.433	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66	-23	-178.2	-64.3	-13.3	0	0	0	113.1
358	Q	81.2	Confident	76.4	Confident	138 Å²	138	84.5 Å²	84.5	65%	0.645	43%	0.434	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.7	-24.6	-175.6	-60.2	-175.9	16.5	0	0	114.5	C356 H376	C356-Q358 PolarHBondContact O-N 2.93Å; Q358-H376 VanDerWaalsContact OE1-CG 3.27Å
359	C	83.4	Confident	76.8	Confident	52 Å²	52	82 Å²	82	35%	0.351	42%	0.422	S	S	.	.	T	Hydrogen-bonded Turn	trans	-138.5	8.2	-178.1	73	0	0	0	0	114.3	K361 H372 H376	C359-K361 PolarHBondContact O-N 3.29Å; C359-H372 VanDerWaalsContact SG-CE1 3.59Å; C359-H372 PolarHBondContact SG-NE2 3.37Å; C359-H376 PolarHBondContact SG-NE2 3.19Å
360	G	78.2	Confident	77.5	Confident	56 Å²	56	85.7 Å²	85.7	58%	0.577	43%	0.428	S	S	*	.			trans	68.3	-5.5	179.5	0	0	0	0	0	115.5	C356 A362	C356-G360 VanDerWaalsContact O-CA 3.26Å; C356-G360 WeakPolarHBondContact O-CA 3.4Å; C356-G360 PolarHBondContact O-N 3.09Å; G360-A362 PolarHBondContact O-N 2.93Å
361	K	78.8	Confident	78.3	Confident	114 Å²	114	80.3 Å²	80.3	50%	0.496	41%	0.406	S	S	.	.			trans	-65.4	129.4	-177.4	-72.2	-177.1	178.5	179.4	0	111.1	C356 C359 F363	C356-K361 WeakPolarHBondContact CB-O 3.35Å; C356-K361 PolarHBondContact N-O 2.94Å; C359-K361 PolarHBondContact O-N 3.29Å; K361-F363 HydrophobicContact CB-CE2 3.98Å; K361-F363 HydrophobicContact CB-CZ 4.05Å; K361-F363 VanDerWaalsContact O-CE2 3.28Å; K361-F363 WeakPolarHBondContact O-CE2 3.46Å
362	A	81.1	Confident	79.1	Confident	28 Å²	28	75.6 Å²	75.6	23%	0.231	38%	0.384	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	141.3	-174.8	0	0	0	0	0	111.6	K352 Y354 K355 G360	K352-A362 HydrophobicContact CB-CB 3.36Å; K352-A362 HydrophobicContact CD-CB 4.07Å; K352-A362 WeakPolarHBondContact CD-O 3.26Å; K352-A362 HydrophobicContact CG-CB 4.28Å; Y354-A362 CarbonylContact O-C 3.52Å; Y354-A362 WeakPolarHBondContact O-CA 3.4Å; K355-A362 HydrophobicContact CG-CB 3.86Å; G360-A362 PolarHBondContact O-N 2.93Å
363	F	79.2	Confident	79.6	Confident	44 Å²	44	73.1 Å²	73.1	19%	0.193	37%	0.374	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	146.5	-176.4	-58.1	-88.1	0	0	0	111.2	K352 T353 Y354 C356 K361 Q365 L369 H372	K352-F363 CarbonylContact C-O 3.44Å; K352-F363 WeakPolarHBondContact CA-O 3.28Å; T353-F363 PolarHBondContact N-O 3.45Å; Y354-F363 PolarHBondContact N-O 3.43Å; Y354-F363 VanDerWaalsContact N-O 3.1Å; Y354-F363 PolarHBondContact O-N 3.32Å; C356-F363 HydrophobicContact CB-CE2 4.37Å; K361-F363 HydrophobicContact CB-CE2 3.98Å; K361-F363 HydrophobicContact CB-CZ 4.05Å; K361-F363 VanDerWaalsContact O-CE2 3.28Å; K361-F363 WeakPolarHBondContact O-CE2 3.46Å; F363-Q365 VanDerWaalsContact C-N 3.29Å; F363-Q365 PolarHBondContact O-N 3.5Å; F363-L369 HydrophobicContact CB-CB 4.32Å; F363-L369 HydrophobicContact CD2-CB 3.88Å; F363-L369 HydrophobicContact CD2-CD1 3.73Å; F363-L369 HydrophobicContact CD2-CG 4.4Å; F363-L369 HydrophobicContact CE2-CD1 3.89Å; F363-L369 HydrophobicContact CG-CB 4.29Å; F363-H372 HydrophobicContact CE1-CB 4.04Å; F363-H372 HydrophobicContact CE2-CB 3.9Å; F363-H372 AromaticContact CE2-CD2 3.58Å; F363-H372 AromaticContact CE2-CG 3.61Å; F363-H372 HydrophobicContact CZ-CB 3.51Å; F363-H372 AromaticContact CZ-CD2 3.7Å; F363-H372 AromaticContact CZ-CE1 3.8Å; F363-H372 AromaticContact CZ-CG 3.25Å; F363-H372 AromaticContact CZ-ND1 3.38Å; F363-H372 WeakPolarHBondContact CZ-ND1 3.5Å
364	A	77.1	Confident	80	Confident	21 Å²	21	71.9 Å²	71.9	17%	0.174	36%	0.359	C	S	.	.	S	Bend	trans	-73.5	-20.1	177.4	0	0	0	0	0	113.5	R346	R346-A364 HydrophobicContact CB-CB 4.34Å; R346-A364 WeakPolarHBondContact CD-O 3.49Å; R346-A364 PolarHBondContact NH1-O 3.34Å
365	Q	74.6	Confident	80	Confident	53 Å²	53	75.3 Å²	75.3	25%	0.248	37%	0.372	C	S	.	.	S	Bend	trans	-134.6	140.2	-178.8	-55.5	179.6	15.4	0	0	111.3	Y354 F363 T367 Y368 L369	Y354-Q365 VanDerWaalsContact CD2-C 3.45Å; F363-Q365 VanDerWaalsContact C-N 3.29Å; F363-Q365 PolarHBondContact O-N 3.5Å; Q365-T367 PolarHBondContact O-N 3.31Å; Q365-T367 PolarHBondContact OE1-OG1 3.19Å; Q365-Y368 HydrophobicContact CB-CD2 3.67Å; Q365-Y368 HydrophobicContact CB-CE2 4.07Å; Q365-Y368 HydrophobicContact CB-CG 4.37Å; Q365-Y368 VanDerWaalsContact CD-CE2 3.43Å; Q365-Y368 HydrophobicContact CG-CD2 3.99Å; Q365-Y368 HydrophobicContact CG-CE2 3.93Å; Q365-Y368 PolarHBondContact O-N 3.33Å; Q365-Y368 VanDerWaalsContact O-N 3.13Å; Q365-L369 PolarHBondContact O-N 3.15Å
366	L	76.6	Confident	80	Confident	71 Å²	71	71.6 Å²	71.6	37%	0.372	36%	0.357	S	S	.	.	H	α-helix	trans	-60.9	-33	178	-176.7	62	0	0	0	112.7	Y354 Y368 L369 R370	Y354-L366 HydrophobicContact CD1-CB 3.95Å; Y354-L366 HydrophobicContact CD1-CD1 3.8Å; Y354-L366 HydrophobicContact CD1-CG 4.42Å; Y354-L366 HydrophobicContact CD2-CB 4.38Å; Y354-L366 VanDerWaalsContact CD2-N 3.32Å; Y354-L366 HydrophobicContact CE1-CB 3.85Å; Y354-L366 HydrophobicContact CE1-CD1 4.21Å; Y354-L366 HydrophobicContact CE1-CG 4.45Å; Y354-L366 HydrophobicContact CE2-CB 4.26Å; Y354-L366 HydrophobicContact CG-CB 4.21Å; Y354-L366 HydrophobicContact CG-CD1 4.42Å; L366-Y368 VanDerWaalsContact C-N 3.32Å; L366-Y368 PolarHBondContact O-N 3.2Å; L366-L369 HydrophobicContact CD1-CD2 4.27Å; L366-L369 PolarHBondContact O-N 2.57Å; L366-R370 WeakPolarHBondContact O-CG 3.19Å; L366-R370 PolarHBondContact O-N 3.03Å
367	T	76.9	Confident	79.7	Confident	82 Å²	82	74.9 Å²	74.9	50%	0.503	38%	0.379	S	S	.	.	H	α-helix	trans	-61.1	-40.1	175.8	45.8	0	0	0	0	112.1	Q365 V371	Q365-T367 PolarHBondContact O-N 3.31Å; Q365-T367 PolarHBondContact OE1-OG1 3.19Å; T367-V371 VanDerWaalsContact O-CG2 3.31Å; T367-V371 WeakPolarHBondContact O-CG2 3.45Å; T367-V371 PolarHBondContact O-N 3.37Å; T367-V371 VanDerWaalsContact O-N 3.12Å
368	Y	79.9	Confident	79.5	Confident	132 Å²	132	69.7 Å²	69.7	52%	0.518	36%	0.363	S	S	.	.	H	α-helix	trans	-71.6	-38.1	176.8	-62.4	-41.6	0	0	0	112.1	Q365 L366 V371 H372	Q365-Y368 HydrophobicContact CB-CD2 3.67Å; Q365-Y368 HydrophobicContact CB-CE2 4.07Å; Q365-Y368 HydrophobicContact CB-CG 4.37Å; Q365-Y368 VanDerWaalsContact CD-CE2 3.43Å; Q365-Y368 HydrophobicContact CG-CD2 3.99Å; Q365-Y368 HydrophobicContact CG-CE2 3.93Å; Q365-Y368 PolarHBondContact O-N 3.33Å; Q365-Y368 VanDerWaalsContact O-N 3.13Å; L366-Y368 VanDerWaalsContact C-N 3.32Å; L366-Y368 PolarHBondContact O-N 3.2Å; Y368-V371 PolarHBondContact O-N 3.38Å; Y368-H372 VanDerWaalsContact O-CB 3.28Å; Y368-H372 WeakPolarHBondContact O-CB 3.39Å; Y368-H372 PolarHBondContact O-N 3.26Å
369	L	82.6	Confident	79.4	Confident	11 Å²	11	68.6 Å²	68.6	6%	0.058	36%	0.358	C	S	.	.	H	α-helix	trans	-59.2	-51.1	171.9	173.7	60.8	0	0	0	110.8	C356 F363 Q365 L366 V371 H372 E373	C356-L369 HydrophobicContact CB-CD1 3.53Å; F363-L369 HydrophobicContact CB-CB 4.32Å; F363-L369 HydrophobicContact CD2-CB 3.88Å; F363-L369 HydrophobicContact CD2-CD1 3.73Å; F363-L369 HydrophobicContact CD2-CG 4.4Å; F363-L369 HydrophobicContact CE2-CD1 3.89Å; F363-L369 HydrophobicContact CG-CB 4.29Å; Q365-L369 PolarHBondContact O-N 3.15Å; L366-L369 HydrophobicContact CD1-CD2 4.27Å; L366-L369 PolarHBondContact O-N 2.57Å; L369-V371 VanDerWaalsContact C-N 3.29Å; L369-V371 PolarHBondContact O-N 3.16Å; L369-H372 CarbonylContact O-C 3.35Å; L369-H372 WeakPolarHBondContact O-CA 3.19Å; L369-H372 VanDerWaalsContact O-CB 3.32Å; L369-H372 WeakPolarHBondContact O-CB 3.45Å; L369-H372 PolarHBondContact O-N 3.49Å; L369-E373 HydrophobicContact CD1-CG 3.93Å; L369-E373 HydrophobicContact CG-CG 4.27Å; L369-E373 WeakPolarHBondContact O-CG 3.26Å; L369-E373 PolarHBondContact O-N 3.08Å
370	R	81	Confident	79.4	Confident	149 Å²	149	71.4 Å²	71.4	56%	0.562	36%	0.364	S	S	*	.	H	α-helix	trans	-57.2	-41.5	178.8	-74.6	-178.3	-178.1	-174.4	-0.2	113.1	L366 H372 E373 R374	L366-R370 WeakPolarHBondContact O-CG 3.19Å; L366-R370 PolarHBondContact O-N 3.03Å; R370-H372 VanDerWaalsContact C-N 3.32Å; R370-E373 PolarHBondContact O-N 2.77Å; R370-R374 WeakPolarHBondContact O-CG 3.42Å; R370-R374 PolarHBondContact O-N 3.43Å
371	V	80.4	Confident	79.6	Confident	42 Å²	42	72 Å²	72	26%	0.255	36%	0.358	S	S	.	.	H	α-helix	trans	-68.8	-34.7	177.1	169.1	0	0	0	0	111.6	T367 Y368 L369 Q393	T367-V371 VanDerWaalsContact O-CG2 3.31Å; T367-V371 WeakPolarHBondContact O-CG2 3.45Å; T367-V371 PolarHBondContact O-N 3.37Å; T367-V371 VanDerWaalsContact O-N 3.12Å; Y368-V371 PolarHBondContact O-N 3.38Å; L369-V371 VanDerWaalsContact C-N 3.29Å; L369-V371 PolarHBondContact O-N 3.16Å; V371-Q393 HydrophobicContact CG1-CG 3.8Å
372	H	82.4	Confident	79.9	Confident	20 Å²	20	70.3 Å²	70.3	9%	0.093	35%	0.349	C	S	.	.	H	α-helix	trans	-68.6	-40.8	174.3	166.3	89.8	0	0	0	112.3	C359 F363 Y368 L369 R370 R374 R375 H376	C359-H372 VanDerWaalsContact SG-CE1 3.59Å; C359-H372 PolarHBondContact SG-NE2 3.37Å; F363-H372 HydrophobicContact CE1-CB 4.04Å; F363-H372 HydrophobicContact CE2-CB 3.9Å; F363-H372 AromaticContact CE2-CD2 3.58Å; F363-H372 AromaticContact CE2-CG 3.61Å; F363-H372 HydrophobicContact CZ-CB 3.51Å; F363-H372 AromaticContact CZ-CD2 3.7Å; F363-H372 AromaticContact CZ-CE1 3.8Å; F363-H372 AromaticContact CZ-CG 3.25Å; F363-H372 AromaticContact CZ-ND1 3.38Å; F363-H372 WeakPolarHBondContact CZ-ND1 3.5Å; Y368-H372 VanDerWaalsContact O-CB 3.28Å; Y368-H372 WeakPolarHBondContact O-CB 3.39Å; Y368-H372 PolarHBondContact O-N 3.26Å; L369-H372 CarbonylContact O-C 3.35Å; L369-H372 WeakPolarHBondContact O-CA 3.19Å; L369-H372 VanDerWaalsContact O-CB 3.32Å; L369-H372 WeakPolarHBondContact O-CB 3.45Å; L369-H372 PolarHBondContact O-N 3.49Å; R370-H372 VanDerWaalsContact C-N 3.32Å; H372-R374 PolarHBondContact O-N 3.32Å; H372-R375 PolarHBondContact CE1-NH2 3.09Å; H372-R375 PolarHBondContact ND1-NH2 2.74Å; H372-R375 WeakPolarHBondContact O-CB 3.5Å; H372-R375 PolarHBondContact O-N 3.38Å; H372-H376 AromaticContact CD2-NE2 3.78Å; H372-H376 AromaticContact CE1-NE2 3.85Å; H372-H376 AromaticContact NE2-CE1 3.94Å; H372-H376 AromaticContact NE2-NE2 3.13Å; H372-H376 PolarHBondContact NE2-NE2 3.31Å; H372-H376 VanDerWaalsContact NE2-NE2 3.13Å
373	E	80.8	Confident	80.1	Confident	66 Å²	66	76.3 Å²	76.3	31%	0.308	37%	0.37	S	S	.	.	H	α-helix	trans	-59.4	-32.4	178.6	-74.4	170.8	154	0	0	112.3	L369 R370 R375 H376 S377	L369-E373 HydrophobicContact CD1-CG 3.93Å; L369-E373 HydrophobicContact CG-CG 4.27Å; L369-E373 WeakPolarHBondContact O-CG 3.26Å; L369-E373 PolarHBondContact O-N 3.08Å; R370-E373 PolarHBondContact O-N 2.77Å; E373-R375 PolarHBondContact O-N 2.91Å; E373-R375 VanDerWaalsContact O-N 3.12Å; E373-H376 PolarHBondContact O-N 3.38Å; E373-S377 PolarHBondContact O-N 3.33Å; E373-S377 VanDerWaalsContact O-N 3.1Å
374	R	82.9	Confident	80.4	Confident	63 Å²	63	74.7 Å²	74.7	24%	0.238	36%	0.364	C	S	.	.	H	α-helix	trans	-60.1	-21.9	173.1	-65.2	176.3	-172.5	177.2	-2	114.2	R370 H372 H376 S377 G378 E379 L392	R370-R374 WeakPolarHBondContact O-CG 3.42Å; R370-R374 PolarHBondContact O-N 3.43Å; H372-R374 PolarHBondContact O-N 3.32Å; R374-H376 VanDerWaalsContact C-N 3.28Å; R374-S377 WeakPolarHBondContact CA-OG 3.39Å; R374-G378 PolarHBondContact O-N 3.36Å; R374-E379 PolarHBondContact O-N 3.45Å; R374-L392 HydrophobicContact CB-CD2 3.61Å; R374-L392 PolarHBondContact NH1-O 3.12Å; R374-L392 WeakPolarHBondContact O-CD2 3.29Å
375	R	77.8	Confident	80.8	Confident	141 Å²	141	81.3 Å²	81.3	53%	0.532	40%	0.396	S	S	.	.	H	α-helix	trans	-69.4	-31.7	173.8	-173.9	172.8	62.3	-175.6	3.2	111.6	H372 E373	H372-R375 PolarHBondContact CE1-NH2 3.09Å; H372-R375 PolarHBondContact ND1-NH2 2.74Å; H372-R375 WeakPolarHBondContact O-CB 3.5Å; H372-R375 PolarHBondContact O-N 3.38Å; E373-R375 PolarHBondContact O-N 2.91Å; E373-R375 VanDerWaalsContact O-N 3.12Å
376	H	79.6	Confident	81.1	Confident	65 Å²	65	85.2 Å²	85.2	30%	0.301	41%	0.414	S	S	.	.	H	α-helix	trans	-84.4	-40.5	178.9	-52	-60.2	0	0	0	111.9	C356 Q358 C359 H372 E373 R374 G378	C356-H376 PolarHBondContact SG-NE2 3.39Å; C356-H376 VanDerWaalsContact SG-NE2 3.38Å; Q358-H376 VanDerWaalsContact OE1-CG 3.27Å; C359-H376 PolarHBondContact SG-NE2 3.19Å; H372-H376 AromaticContact CD2-NE2 3.78Å; H372-H376 AromaticContact CE1-NE2 3.85Å; H372-H376 AromaticContact NE2-CE1 3.94Å; H372-H376 AromaticContact NE2-NE2 3.13Å; H372-H376 PolarHBondContact NE2-NE2 3.31Å; H372-H376 VanDerWaalsContact NE2-NE2 3.13Å; E373-H376 PolarHBondContact O-N 3.38Å; R374-H376 VanDerWaalsContact C-N 3.28Å; H376-G378 PolarHBondContact O-N 3.28Å
377	S	78.9	Confident	81.6	Confident	69 Å²	69	83.6 Å²	83.6	48%	0.483	41%	0.409	S	S	.	.	H	α-helix	trans	-72	-14.4	175.3	65.6	0	0	0	0	113.5	E373 R374 E379	E373-S377 PolarHBondContact O-N 3.33Å; E373-S377 VanDerWaalsContact O-N 3.1Å; R374-S377 WeakPolarHBondContact CA-OG 3.39Å; S377-E379 PolarHBondContact O-N 3.22Å; S377-E379 VanDerWaalsContact O-N 3.14Å; S377-E379 WeakPolarHBondContact OG-CG 3.43Å; S377-E379 PolarHBondContact OG-N 3.27Å
378	G	76.5	Confident	81.8	Confident	47 Å²	47	88 Å²	88	49%	0.485	43%	0.429	S	S	.	.			trans	70.3	1.7	-175.4	0	0	0	0	0	113.9	R374 H376 K380	R374-G378 PolarHBondContact O-N 3.36Å; H376-G378 PolarHBondContact O-N 3.28Å; G378-K380 PolarHBondContact O-N 3.04Å
379	E	78.9	Confident	81.9	Confident	115 Å²	115	86.8 Å²	86.8	54%	0.537	43%	0.427	S	S	.	.			trans	-61.3	122.5	-179.6	-74.8	-178.4	179.1	0	0	111.1	R374 S377 P381 L392	R374-E379 PolarHBondContact O-N 3.45Å; S377-E379 PolarHBondContact O-N 3.22Å; S377-E379 VanDerWaalsContact O-N 3.14Å; S377-E379 WeakPolarHBondContact OG-CG 3.43Å; S377-E379 PolarHBondContact OG-N 3.27Å; E379-P381 WeakPolarHBondContact O-CD 3.31Å; E379-L392 WeakPolarHBondContact O-CD2 3.4Å
380	K	82.3	Confident	82.1	Confident	110 Å²	110	87.5 Å²	87.5	48%	0.478	43%	0.434	S	S	.	.			trans	-121	81.8	176.3	-70.3	165	179.2	-175.7	0	109	G378 Y382 A390 F391 L392	G378-K380 PolarHBondContact O-N 3.04Å; K380-Y382 PolarHBondContact O-N 2.94Å; K380-Y382 VanDerWaalsContact O-N 3.14Å; K380-A390 HydrophobicContact CB-CB 3.5Å; K380-A390 VanDerWaalsContact CB-CB 3.5Å; K380-A390 HydrophobicContact CD-CB 4.15Å; K380-A390 WeakPolarHBondContact CD-O 3.38Å; K380-A390 HydrophobicContact CG-CB 4.43Å; K380-F391 CarbonylContact C-O 3.52Å; K380-F391 WeakPolarHBondContact CA-O 3.44Å; K380-L392 HydrophobicContact CG-CG 4.29Å
381	P	82.9	Confident	82.2	Confident	70 Å²	70	82.5 Å²	82.5	46%	0.455	42%	0.416	S	S	.	.			trans	-65.9	-18.8	-172	-21.8	34	0	0	0	114	E379	E379-P381 WeakPolarHBondContact O-CD 3.31Å
382	Y	85.4	Confident	82.3	Confident	77 Å²	77	83 Å²	83	30%	0.302	42%	0.418	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	94	-173.2	-56.2	-79	0	0	0	109.5	K380 A390 F391 Q393 L394	K380-Y382 PolarHBondContact O-N 2.94Å; K380-Y382 VanDerWaalsContact O-N 3.14Å; Y382-A390 CarbonylContact O-C 3.4Å; Y382-A390 WeakPolarHBondContact O-CA 3.27Å; Y382-F391 PolarHBondContact N-O 3.27Å; Y382-F391 PolarHBondContact O-N 3.22Å; Y382-Q393 VanDerWaalsContact CD2-C 3.42Å; Y382-L394 HydrophobicContact CD1-CB 3.89Å; Y382-L394 HydrophobicContact CD1-CD1 3.85Å; Y382-L394 HydrophobicContact CD1-CG 4.45Å; Y382-L394 HydrophobicContact CE1-CB 3.68Å; Y382-L394 HydrophobicContact CE1-CD1 4.17Å; Y382-L394 HydrophobicContact CE1-CG 4.39Å; Y382-L394 HydrophobicContact CG-CB 4.38Å
383	K	84.3	Confident	82.2	Confident	154 Å²	154	84.3 Å²	84.3	67%	0.67	42%	0.424	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-87.5	142.5	178	-60.4	-177.1	-179.6	-178.4	0	110.3	A390 L397	K383-A390 HydrophobicContact CG-CB 3.99Å; K383-L397 WeakPolarHBondContact O-CD2 3.32Å
384	C	87.5	Confident	82.2	Confident	11 Å²	11	84.5 Å²	84.5	7%	0.074	43%	0.426	C	S	.	.			trans	-78.7	139.7	169.1	-177.7	0	0	0	0	109.4	E386 K389 L397 H400 H404	C384-E386 VanDerWaalsContact C-N 3.35Å; C384-E386 PolarHBondContact SG-N 3.14Å; C384-E386 VanDerWaalsContact SG-N 3.44Å; C384-K389 VanDerWaalsContact CB-O 3.31Å; C384-K389 WeakPolarHBondContact CB-O 3.39Å; C384-K389 PolarHBondContact N-O 3.24Å; C384-L397 HydrophobicContact CB-CD1 3.74Å; C384-H400 PolarHBondContact SG-NE2 3.5Å; C384-H400 VanDerWaalsContact SG-NE2 3.4Å; C384-H404 PolarHBondContact SG-NE2 3.21Å
385	N	84.1	Confident	82	Confident	159 Å²	159	87.1 Å²	87.1	85%	0.85	44%	0.439	S	S	*	.	S	Bend	trans	-81.7	-17.9	178.9	-64.2	-19.2	0	0	0	112.6
386	E	80.4	Confident	82.2	Confident	135 Å²	135	85.4 Å²	85.4	63%	0.631	43%	0.434	S	S	*	.	S	Bend	trans	-103.3	-8.5	-174.8	-63.2	176.5	-179.4	0	0	113.2	C384 H404	C384-E386 VanDerWaalsContact C-N 3.35Å; C384-E386 PolarHBondContact SG-N 3.14Å; C384-E386 VanDerWaalsContact SG-N 3.44Å; E386-H404 WeakPolarHBondContact OE2-CB 3.46Å; E386-H404 IonicContact OE2-CD2 3.28Å; E386-H404 PolarHBondContact OE2-CD2 3.34Å; E386-H404 IonicContact OE2-CG 3.92Å; E386-H404 IonicContact OE2-NE2 3.09Å
387	C	87.3	Confident	82.4	Confident	37 Å²	37	82.8 Å²	82.8	25%	0.25	42%	0.422	C	S	.	.	S	Bend	trans	-158.7	165.2	172.5	74	0	0	0	0	111.5	K389 H400	C387-K389 PolarHBondContact O-N 3.11Å; C387-H400 PolarHBondContact SG-CE1 2.59Å; C387-H400 PolarHBondContact SG-NE2 3.13Å
388	D	82	Confident	82.5	Confident	176 Å²	176	86.9 Å²	86.9	94%	0.941	43%	0.427	S	S	*	.	S	Bend	trans	-69.8	10.5	-176.4	-55.6	-46.9	0	0	0	115.2
389	K	81.9	Confident	82.6	Confident	106 Å²	106	86.8 Å²	86.8	46%	0.461	42%	0.415	S	S	.	.			trans	-82.5	127.1	-178.3	-66	-176.6	179.7	179.8	0	110.8	C384 C387 F391	C384-K389 VanDerWaalsContact CB-O 3.31Å; C384-K389 WeakPolarHBondContact CB-O 3.39Å; C384-K389 PolarHBondContact N-O 3.24Å; C387-K389 PolarHBondContact O-N 3.11Å; K389-F391 HydrophobicContact CB-CE2 3.9Å; K389-F391 HydrophobicContact CB-CZ 3.94Å
390	A	86.5	Confident	82.7	Confident	26 Å²	26	82 Å²	82	22%	0.215	39%	0.393	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	150.4	173.7	0	0	0	0	0	111.6	K380 Y382 K383	K380-A390 HydrophobicContact CB-CB 3.5Å; K380-A390 VanDerWaalsContact CB-CB 3.5Å; K380-A390 HydrophobicContact CD-CB 4.15Å; K380-A390 WeakPolarHBondContact CD-O 3.38Å; K380-A390 HydrophobicContact CG-CB 4.43Å; Y382-A390 CarbonylContact O-C 3.4Å; Y382-A390 WeakPolarHBondContact O-CA 3.27Å; K383-A390 HydrophobicContact CG-CB 3.99Å
391	F	84.1	Confident	82.6	Confident	43 Å²	43	80.1 Å²	80.1	19%	0.189	39%	0.386	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	150.9	-173.4	-58.9	-88.8	0	0	0	112.1	K380 Y382 K389 Q393 L397 H400	K380-F391 CarbonylContact C-O 3.52Å; K380-F391 WeakPolarHBondContact CA-O 3.44Å; Y382-F391 PolarHBondContact N-O 3.27Å; Y382-F391 PolarHBondContact O-N 3.22Å; K389-F391 HydrophobicContact CB-CE2 3.9Å; K389-F391 HydrophobicContact CB-CZ 3.94Å; F391-Q393 VanDerWaalsContact C-N 3.34Å; F391-L397 HydrophobicContact CB-CB 4.33Å; F391-L397 HydrophobicContact CD2-CB 3.93Å; F391-L397 HydrophobicContact CD2-CD1 3.83Å; F391-L397 HydrophobicContact CE2-CD1 4.06Å; F391-L397 HydrophobicContact CG-CB 4.33Å; F391-H400 HydrophobicContact CE1-CB 3.89Å; F391-H400 HydrophobicContact CE2-CB 3.73Å; F391-H400 AromaticContact CE2-CD2 3.22Å; F391-H400 WeakPolarHBondContact CE2-CD2 3.48Å; F391-H400 AromaticContact CE2-CG 3.46Å; F391-H400 VanDerWaalsContact CE2-CG 3.46Å; F391-H400 AromaticContact CE2-NE2 3.88Å; F391-H400 HydrophobicContact CZ-CB 3.32Å; F391-H400 AromaticContact CZ-CD2 3.43Å; F391-H400 VanDerWaalsContact CZ-CD2 3.43Å; F391-H400 WeakPolarHBondContact CZ-CD2 3.34Å; F391-H400 AromaticContact CZ-CG 3.15Å; F391-H400 AromaticContact CZ-ND1 3.68Å
392	L	81.6	Confident	82.5	Confident	53 Å²	53	80.3 Å²	80.3	28%	0.277	38%	0.377	S	S	.	.	S	Bend	trans	-72	-27.1	179.1	-70.2	140.9	0	0	0	113	R374 E379 K380	R374-L392 HydrophobicContact CB-CD2 3.61Å; R374-L392 PolarHBondContact NH1-O 3.12Å; R374-L392 WeakPolarHBondContact O-CD2 3.29Å; E379-L392 WeakPolarHBondContact O-CD2 3.4Å; K380-L392 HydrophobicContact CG-CG 4.29Å
393	Q	81.3	Confident	82.1	Confident	48 Å²	48	82.8 Å²	82.8	22%	0.224	39%	0.386	C	S	.	.	S	Bend	trans	-139.8	144.6	-176.8	-57.2	175.8	26.2	0	0	111.1	V371 Y382 F391 K395 Y396 L397	V371-Q393 HydrophobicContact CG1-CG 3.8Å; Y382-Q393 VanDerWaalsContact CD2-C 3.42Å; F391-Q393 VanDerWaalsContact C-N 3.34Å; Q393-K395 VanDerWaalsContact C-N 3.25Å; Q393-K395 HydrophobicContact CB-CG 4.2Å; Q393-K395 PolarHBondContact O-N 2.99Å; Q393-Y396 HydrophobicContact CB-CD2 3.75Å; Q393-Y396 HydrophobicContact CB-CE2 4.15Å; Q393-Y396 HydrophobicContact CG-CD2 4.2Å; Q393-Y396 HydrophobicContact CG-CE2 4.16Å; Q393-Y396 PolarHBondContact O-N 3.11Å; Q393-L397 PolarHBondContact O-N 3.3Å
394	L	79.3	Confident	81.8	Confident	69 Å²	69	78.7 Å²	78.7	36%	0.361	37%	0.369	S	S	.	.	H	α-helix	trans	-55.9	-36.4	178.6	-175.1	60.7	0	0	0	113.4	Y382 Y396 L397 R398	Y382-L394 HydrophobicContact CD1-CB 3.89Å; Y382-L394 HydrophobicContact CD1-CD1 3.85Å; Y382-L394 HydrophobicContact CD1-CG 4.45Å; Y382-L394 HydrophobicContact CE1-CB 3.68Å; Y382-L394 HydrophobicContact CE1-CD1 4.17Å; Y382-L394 HydrophobicContact CE1-CG 4.39Å; Y382-L394 HydrophobicContact CG-CB 4.38Å; L394-Y396 PolarHBondContact O-N 3.37Å; L394-L397 HydrophobicContact CD1-CD2 4.25Å; L394-L397 PolarHBondContact O-N 2.89Å; L394-R398 WeakPolarHBondContact O-CG 3.48Å; L394-R398 PolarHBondContact O-N 2.8Å
395	K	80.3	Confident	81.3	Confident	118 Å²	118	81.6 Å²	81.6	51%	0.513	39%	0.39	S	S	.	.	H	α-helix	trans	-60	-33.4	178.5	76.3	-173.8	-168.3	-161.6	0	112.9	Q393 L399	Q393-K395 VanDerWaalsContact C-N 3.25Å; Q393-K395 HydrophobicContact CB-CG 4.2Å; Q393-K395 PolarHBondContact O-N 2.99Å; K395-L399 PolarHBondContact O-N 2.79Å
396	Y	80.8	Confident	80.9	Confident	105 Å²	105	76.3 Å²	76.3	41%	0.412	37%	0.372	S	S	.	.	H	α-helix	trans	-80.1	-35	179.5	-63.8	-55.8	0	0	0	111.4	Q393 L394 L399 H400	Q393-Y396 HydrophobicContact CB-CD2 3.75Å; Q393-Y396 HydrophobicContact CB-CE2 4.15Å; Q393-Y396 HydrophobicContact CG-CD2 4.2Å; Q393-Y396 HydrophobicContact CG-CE2 4.16Å; Q393-Y396 PolarHBondContact O-N 3.11Å; L394-Y396 PolarHBondContact O-N 3.37Å; Y396-L399 PolarHBondContact O-N 3.19Å; Y396-H400 VanDerWaalsContact O-CB 3.3Å; Y396-H400 WeakPolarHBondContact O-CB 3.32Å; Y396-H400 PolarHBondContact O-N 3.1Å
397	L	84	Confident	80.8	Confident	11 Å²	11	75.4 Å²	75.4	6%	0.058	37%	0.368	C	S	.	.	H	α-helix	trans	-59.9	-51.2	170	173.5	61.4	0	0	0	110.5	K383 C384 F391 Q393 L394 L399 H400 E401	K383-L397 WeakPolarHBondContact O-CD2 3.32Å; C384-L397 HydrophobicContact CB-CD1 3.74Å; F391-L397 HydrophobicContact CB-CB 4.33Å; F391-L397 HydrophobicContact CD2-CB 3.93Å; F391-L397 HydrophobicContact CD2-CD1 3.83Å; F391-L397 HydrophobicContact CE2-CD1 4.06Å; F391-L397 HydrophobicContact CG-CB 4.33Å; Q393-L397 PolarHBondContact O-N 3.3Å; L394-L397 HydrophobicContact CD1-CD2 4.25Å; L394-L397 PolarHBondContact O-N 2.89Å; L397-L399 VanDerWaalsContact C-N 3.29Å; L397-L399 PolarHBondContact O-N 3.2Å; L397-H400 CarbonylContact O-C 3.29Å; L397-H400 WeakPolarHBondContact O-CA 3.42Å; L397-H400 WeakPolarHBondContact O-CB 3.39Å; L397-H400 PolarHBondContact O-N 3.13Å; L397-E401 HydrophobicContact CD1-CG 4.04Å; L397-E401 HydrophobicContact CG-CG 4.35Å; L397-E401 WeakPolarHBondContact O-CG 3.48Å; L397-E401 PolarHBondContact O-N 3.38Å
398	R	80.7	Confident	80.5	Confident	154 Å²	154	79.4 Å²	79.4	58%	0.581	38%	0.382	S	S	*	.	H	α-helix	trans	-57.2	-40.1	177.1	-71.5	-177.4	-179.6	-175.8	-2	113.3	L394 H400 E401 R402	L394-R398 WeakPolarHBondContact O-CG 3.48Å; L394-R398 PolarHBondContact O-N 2.8Å; R398-H400 VanDerWaalsContact C-N 3.3Å; R398-E401 WeakPolarHBondContact CA-OE2 3.43Å; R398-R402 WeakPolarHBondContact O-CG 3.1Å; R398-R402 PolarHBondContact O-N 3.11Å
399	L	78.3	Confident	80.5	Confident	46 Å²	46	74.4 Å²	74.4	24%	0.241	36%	0.359	C	S	.	.	H	α-helix	trans	-67.7	-34.6	175.9	-175.5	66.4	0	0	0	111.8	K395 Y396 L397 L420	K395-L399 PolarHBondContact O-N 2.79Å; Y396-L399 PolarHBondContact O-N 3.19Å; L397-L399 VanDerWaalsContact C-N 3.29Å; L397-L399 PolarHBondContact O-N 3.2Å; L399-L420 HydrophobicContact CD1-CD2 4.34Å; L399-L420 HydrophobicContact CD1-CG 4.06Å; L399-L420 HydrophobicContact CG-CD2 4.46Å
400	H	81.7	Confident	80.7	Confident	14 Å²	14	72.9 Å²	72.9	7%	0.065	35%	0.35	C	S	.	.	H	α-helix	trans	-72.6	-39.4	177.7	162.8	69.3	0	0	0	112.6	C384 C387 F391 Y396 L397 R398 R402 R403 H404	C384-H400 PolarHBondContact SG-NE2 3.5Å; C384-H400 VanDerWaalsContact SG-NE2 3.4Å; C387-H400 PolarHBondContact SG-CE1 2.59Å; C387-H400 PolarHBondContact SG-NE2 3.13Å; F391-H400 HydrophobicContact CE1-CB 3.89Å; F391-H400 HydrophobicContact CE2-CB 3.73Å; F391-H400 AromaticContact CE2-CD2 3.22Å; F391-H400 WeakPolarHBondContact CE2-CD2 3.48Å; F391-H400 AromaticContact CE2-CG 3.46Å; F391-H400 VanDerWaalsContact CE2-CG 3.46Å; F391-H400 AromaticContact CE2-NE2 3.88Å; F391-H400 HydrophobicContact CZ-CB 3.32Å; F391-H400 AromaticContact CZ-CD2 3.43Å; F391-H400 VanDerWaalsContact CZ-CD2 3.43Å; F391-H400 WeakPolarHBondContact CZ-CD2 3.34Å; F391-H400 AromaticContact CZ-CG 3.15Å; F391-H400 AromaticContact CZ-ND1 3.68Å; Y396-H400 VanDerWaalsContact O-CB 3.3Å; Y396-H400 WeakPolarHBondContact O-CB 3.32Å; Y396-H400 PolarHBondContact O-N 3.1Å; L397-H400 CarbonylContact O-C 3.29Å; L397-H400 WeakPolarHBondContact O-CA 3.42Å; L397-H400 WeakPolarHBondContact O-CB 3.39Å; L397-H400 PolarHBondContact O-N 3.13Å; R398-H400 VanDerWaalsContact C-N 3.3Å; H400-R402 PolarHBondContact O-N 2.8Å; H400-R403 PolarHBondContact CE1-NH2 2.76Å; H400-R403 PolarHBondContact ND1-NH2 3.15Å; H400-R403 WeakPolarHBondContact O-CB 3.48Å; H400-R403 PolarHBondContact O-N 3.17Å; H400-H404 AromaticContact CE1-CE1 3.84Å; H400-H404 AromaticContact CE1-NE2 3.5Å; H400-H404 PolarHBondContact CE1-NE2 3.37Å; H400-H404 AromaticContact NE2-CE1 3.97Å; H400-H404 AromaticContact NE2-NE2 3.22Å; H400-H404 PolarHBondContact NE2-NE2 2.6Å
401	E	80.3	Confident	80.7	Confident	70 Å²	70	77.1 Å²	77.1	33%	0.327	37%	0.366	S	S	.	.	H	α-helix	trans	-58.8	-32.1	175.7	-72.4	167.5	160.2	0	0	111.9	L397 R398 R403 H404 S405	L397-E401 HydrophobicContact CD1-CG 4.04Å; L397-E401 HydrophobicContact CG-CG 4.35Å; L397-E401 WeakPolarHBondContact O-CG 3.48Å; L397-E401 PolarHBondContact O-N 3.38Å; R398-E401 WeakPolarHBondContact CA-OE2 3.43Å; E401-R403 PolarHBondContact O-N 2.77Å; E401-R403 VanDerWaalsContact O-N 3.14Å; E401-H404 PolarHBondContact O-N 2.95Å; E401-S405 PolarHBondContact O-N 3.25Å; E401-S405 PolarHBondContact O-OG 3.36Å
402	R	81.1	Confident	81	Confident	74 Å²	74	75.1 Å²	75.1	28%	0.279	36%	0.357	S	S	.	.	H	α-helix	trans	-61.1	-20.4	172.2	-67.7	176.1	-172.2	178.8	-3.7	114.2	R398 H400 H404 S405 G406 E407 L420	R398-R402 WeakPolarHBondContact O-CG 3.1Å; R398-R402 PolarHBondContact O-N 3.11Å; H400-R402 PolarHBondContact O-N 2.8Å; R402-H404 VanDerWaalsContact C-N 3.34Å; R402-S405 WeakPolarHBondContact CA-OG 3.49Å; R402-G406 PolarHBondContact O-N 3.13Å; R402-G406 VanDerWaalsContact O-N 3.12Å; R402-E407 PolarHBondContact O-N 3.25Å; R402-L420 HydrophobicContact CB-CD1 3.39Å; R402-L420 HydrophobicContact CB-CG 4.39Å
403	R	76.1	Confident	81.2	Confident	130 Å²	130	80 Å²	80	49%	0.491	38%	0.384	S	S	.	.	H	α-helix	trans	-72.6	-32.1	174.4	-172.4	175.2	65.8	-165.1	0.8	111.8	H400 E401	H400-R403 PolarHBondContact CE1-NH2 2.76Å; H400-R403 PolarHBondContact ND1-NH2 3.15Å; H400-R403 WeakPolarHBondContact O-CB 3.48Å; H400-R403 PolarHBondContact O-N 3.17Å; E401-R403 PolarHBondContact O-N 2.77Å; E401-R403 VanDerWaalsContact O-N 3.14Å
404	H	78.1	Confident	81.3	Confident	67 Å²	67	84 Å²	84	31%	0.31	40%	0.403	S	S	.	.	H	α-helix	trans	-82.5	-41.9	-178.4	-56	-55.3	0	0	0	111.6	C384 E386 H400 E401 R402 G406	C384-H404 PolarHBondContact SG-NE2 3.21Å; E386-H404 WeakPolarHBondContact OE2-CB 3.46Å; E386-H404 IonicContact OE2-CD2 3.28Å; E386-H404 PolarHBondContact OE2-CD2 3.34Å; E386-H404 IonicContact OE2-CG 3.92Å; E386-H404 IonicContact OE2-NE2 3.09Å; H400-H404 AromaticContact CE1-CE1 3.84Å; H400-H404 AromaticContact CE1-NE2 3.5Å; H400-H404 PolarHBondContact CE1-NE2 3.37Å; H400-H404 AromaticContact NE2-CE1 3.97Å; H400-H404 AromaticContact NE2-NE2 3.22Å; H400-H404 PolarHBondContact NE2-NE2 2.6Å; E401-H404 PolarHBondContact O-N 2.95Å; R402-H404 VanDerWaalsContact C-N 3.34Å; H404-G406 PolarHBondContact O-N 3.13Å
405	S	77.9	Confident	81.7	Confident	73 Å²	73	83.3 Å²	83.3	51%	0.51	40%	0.403	S	S	.	.	H	α-helix	trans	-69.8	-16.2	172	50.4	0	0	0	0	113.6	E401 R402 E407	E401-S405 PolarHBondContact O-N 3.25Å; E401-S405 PolarHBondContact O-OG 3.36Å; R402-S405 WeakPolarHBondContact CA-OG 3.49Å; S405-E407 PolarHBondContact O-N 3.46Å
406	G	75	Confident	81.7	Confident	47 Å²	47	79.7 Å²	79.7	49%	0.485	40%	0.399	S	S	.	.			trans	71.8	2.9	-177.2	0	0	0	0	0	114.1	R402 H404 K408	R402-G406 PolarHBondContact O-N 3.13Å; R402-G406 VanDerWaalsContact O-N 3.12Å; H404-G406 PolarHBondContact O-N 3.13Å; G406-K408 PolarHBondContact O-N 3.44Å
407	E	78.1	Confident	81.9	Confident	116 Å²	116	80.8 Å²	80.8	54%	0.542	41%	0.406	S	S	.	.			trans	-61.1	122.8	177.9	-73	-173.4	173.3	0	0	111	R402 S405 P409 L420	R402-E407 PolarHBondContact O-N 3.25Å; S405-E407 PolarHBondContact O-N 3.46Å; E407-P409 WeakPolarHBondContact O-CD 3.44Å; E407-L420 WeakPolarHBondContact O-CD1 3.4Å
408	K	81.9	Confident	82	Confident	122 Å²	122	81.9 Å²	81.9	53%	0.53	42%	0.416	S	S	.	.			trans	-121.2	83.2	175	-65.2	-176.8	-161.7	168.1	0	109.2	G406 Y410 A418 F419	G406-K408 PolarHBondContact O-N 3.44Å; K408-Y410 PolarHBondContact O-N 3.14Å; K408-A418 HydrophobicContact CB-CB 3.52Å; K408-A418 HydrophobicContact CD-CB 4.22Å; K408-A418 WeakPolarHBondContact CD-O 3.44Å; K408-F419 CarbonylContact C-O 3.29Å; K408-F419 WeakPolarHBondContact CA-O 3.36Å
409	P	82.6	Confident	82.2	Confident	71 Å²	71	76.6 Å²	76.6	46%	0.461	40%	0.398	S	S	.	.			trans	-68.4	-9.4	-169.9	-21.5	34	0	0	0	115	E407	E407-P409 WeakPolarHBondContact O-CD 3.44Å
410	Y	85.5	Confident	82.2	Confident	73 Å²	73	76.7 Å²	76.7	29%	0.286	40%	0.398	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	90.2	-172.6	-54.8	-73.4	0	0	0	109.6	K408 A418 F419 L420 P422	K408-Y410 PolarHBondContact O-N 3.14Å; Y410-A418 CarbonylContact O-C 3.57Å; Y410-A418 WeakPolarHBondContact O-CA 3.35Å; Y410-F419 WeakPolarHBondContact CD2-O 3.4Å; Y410-F419 PolarHBondContact N-O 2.92Å; Y410-F419 PolarHBondContact O-N 3.43Å; Y410-L420 WeakPolarHBondContact CE2-O 3.38Å; Y410-P422 HydrophobicContact CD1-CB 4.3Å; Y410-P422 HydrophobicContact CD1-CG 4.1Å; Y410-P422 HydrophobicContact CD2-CG 4.4Å; Y410-P422 HydrophobicContact CE1-CB 4.21Å; Y410-P422 HydrophobicContact CE1-CG 3.58Å; Y410-P422 VanDerWaalsContact CE2-CD 3.45Å; Y410-P422 HydrophobicContact CE2-CG 3.91Å; Y410-P422 HydrophobicContact CG-CG 4.47Å; Y410-P422 VanDerWaalsContact CZ-CG 3.44Å
411	E	86.1	Confident	82	Confident	115 Å²	115	79.3 Å²	79.3	54%	0.537	41%	0.41	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.7	141.1	179.2	-168.4	174.7	166	0	0	112.1	G416 A418	E411-G416 WeakPolarHBondContact OE1-CA 3.41Å; E411-A418 HydrophobicContact CB-CB 4.48Å
412	C	89.7	Confident	82.1	Confident	1 Å²	1	77.9 Å²	77.9	1%	0.007	41%	0.407	C	S	.	.			trans	-85.6	113.9	172.1	-176	0	0	0	0	110.4	Q414 C415 G416 K417 F419 L425 H432	C412-Q414 PolarHBondContact O-N 3.33Å; C412-C415 PolarHBondContact O-N 3.19Å; C412-G416 WeakPolarHBondContact O-CA 3.48Å; C412-G416 PolarHBondContact O-N 3.35Å; C412-K417 WeakPolarHBondContact CB-O 3.39Å; C412-K417 PolarHBondContact N-O 3.18Å; C412-F419 HydrophobicContact CB-CE2 4.35Å; C412-L425 HydrophobicContact CB-CD1 3.56Å; C412-H432 PolarHBondContact SG-NE2 3.05Å
413	N	85.8	Confident	82.1	Confident	157 Å²	157	76.6 Å²	76.6	84%	0.84	41%	0.41	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.6	-19.6	-179.2	-62.7	-18.8	0	0	0	114
414	Q	84.5	Confident	82.4	Confident	132 Å²	132	76.3 Å²	76.3	62%	0.617	41%	0.409	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.4	-24.2	-177.4	-65	-178.4	3.5	0	0	113.9	C412 H432	C412-Q414 PolarHBondContact O-N 3.33Å; Q414-H432 PolarHBondContact OE1-CD2 3.28Å
415	C	86.4	Confident	82.8	Confident	54 Å²	54	74.2 Å²	74.2	37%	0.365	40%	0.4	S	S	.	.	T	Hydrogen-bonded Turn	trans	-142.1	4.3	-174.6	73.5	0	0	0	0	114.7	C412 K417 H428 H432	C412-C415 PolarHBondContact O-N 3.19Å; C415-K417 PolarHBondContact O-N 3.39Å; C415-K417 VanDerWaalsContact O-N 3.1Å; C415-K417 VanDerWaalsContact SG-CB 3.59Å; C415-H428 PolarHBondContact SG-NE2 3.43Å; C415-H432 PolarHBondContact SG-NE2 3.41Å
416	G	82.3	Confident	83.1	Confident	42 Å²	42	78.4 Å²	78.4	43%	0.433	41%	0.405	S	S	.	.			trans	68	3.7	-179.2	0	0	0	0	0	114.9	E411 C412 A418	E411-G416 WeakPolarHBondContact OE1-CA 3.41Å; C412-G416 WeakPolarHBondContact O-CA 3.48Å; C412-G416 PolarHBondContact O-N 3.35Å; G416-A418 PolarHBondContact O-N 2.99Å
417	K	83.6	Confident	83.3	Confident	127 Å²	127	78.8 Å²	78.8	55%	0.552	40%	0.395	S	S	*	.			trans	-72.8	123.9	179.2	-73.1	179.1	-178.7	170.7	0	110.3	C412 C415 F419	C412-K417 WeakPolarHBondContact CB-O 3.39Å; C412-K417 PolarHBondContact N-O 3.18Å; C415-K417 PolarHBondContact O-N 3.39Å; C415-K417 VanDerWaalsContact O-N 3.1Å; C415-K417 VanDerWaalsContact SG-CB 3.59Å; K417-F419 HydrophobicContact CB-CE2 3.94Å; K417-F419 HydrophobicContact CB-CZ 4Å; K417-F419 WeakPolarHBondContact O-CD2 3.49Å; K417-F419 WeakPolarHBondContact O-CE2 3.42Å
418	A	86.3	Confident	83.7	Confident	34 Å²	34	74.3 Å²	74.3	28%	0.281	37%	0.374	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.3	144.6	178.7	0	0	0	0	0	113.1	K408 Y410 E411 G416	K408-A418 HydrophobicContact CB-CB 3.52Å; K408-A418 HydrophobicContact CD-CB 4.22Å; K408-A418 WeakPolarHBondContact CD-O 3.44Å; Y410-A418 CarbonylContact O-C 3.57Å; Y410-A418 WeakPolarHBondContact O-CA 3.35Å; E411-A418 HydrophobicContact CB-CB 4.48Å; G416-A418 PolarHBondContact O-N 2.99Å
419	F	84.2	Confident	83.8	Confident	44 Å²	44	71.7 Å²	71.7	19%	0.193	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	154.5	-176.6	-59.2	-86.8	0	0	0	112.2	K408 Y410 C412 K417 L425 H428	K408-F419 CarbonylContact C-O 3.29Å; K408-F419 WeakPolarHBondContact CA-O 3.36Å; Y410-F419 WeakPolarHBondContact CD2-O 3.4Å; Y410-F419 PolarHBondContact N-O 2.92Å; Y410-F419 PolarHBondContact O-N 3.43Å; C412-F419 HydrophobicContact CB-CE2 4.35Å; K417-F419 HydrophobicContact CB-CE2 3.94Å; K417-F419 HydrophobicContact CB-CZ 4Å; K417-F419 WeakPolarHBondContact O-CD2 3.49Å; K417-F419 WeakPolarHBondContact O-CE2 3.42Å; F419-L425 HydrophobicContact CB-CB 4.37Å; F419-L425 HydrophobicContact CD2-CB 3.98Å; F419-L425 HydrophobicContact CD2-CD1 3.84Å; F419-L425 HydrophobicContact CE2-CD1 4.09Å; F419-L425 HydrophobicContact CG-CB 4.41Å; F419-H428 HydrophobicContact CE1-CB 3.91Å; F419-H428 HydrophobicContact CE2-CB 3.65Å; F419-H428 AromaticContact CE2-CD2 3.33Å; F419-H428 WeakPolarHBondContact CE2-CD2 3.37Å; F419-H428 AromaticContact CE2-CG 3.54Å; F419-H428 HydrophobicContact CZ-CB 3.3Å; F419-H428 AromaticContact CZ-CD2 3.39Å; F419-H428 WeakPolarHBondContact CZ-CD2 3.47Å; F419-H428 AromaticContact CZ-CG 3.15Å; F419-H428 AromaticContact CZ-ND1 3.78Å
420	L	79.6	Confident	83.9	Confident	47 Å²	47	72.2 Å²	72.2	25%	0.246	36%	0.356	C	S	.	.	S	Bend	trans	-76.3	-27.1	179.3	-162.8	72.4	0	0	0	113.2	L399 R402 E407 Y410	L399-L420 HydrophobicContact CD1-CD2 4.34Å; L399-L420 HydrophobicContact CD1-CG 4.06Å; L399-L420 HydrophobicContact CG-CD2 4.46Å; R402-L420 HydrophobicContact CB-CD1 3.39Å; R402-L420 HydrophobicContact CB-CG 4.39Å; E407-L420 WeakPolarHBondContact O-CD1 3.4Å; Y410-L420 WeakPolarHBondContact CE2-O 3.38Å
421	H	78.1	Confident	83.7	Confident	69 Å²	69	72.3 Å²	72.3	32%	0.319	36%	0.364	S	S	.	.	S	Bend	trans	-134.7	141.4	-171.3	-161.3	-97.8	0	0	0	111.4	S423 Y424 L425	H421-S423 WeakPolarHBondContact ND1-CB 3.35Å; H421-S423 PolarHBondContact ND1-N 3.19Å; H421-S423 PolarHBondContact ND1-OG 3.01Å; H421-S423 PolarHBondContact O-N 3.11Å; H421-Y424 HydrophobicContact CB-CD2 3.59Å; H421-Y424 HydrophobicContact CB-CE2 3.98Å; H421-Y424 HydrophobicContact CB-CG 4.29Å; H421-Y424 PolarHBondContact O-N 3.26Å; H421-L425 PolarHBondContact O-N 3.27Å
422	P	81.1	Confident	83.6	Confident	40 Å²	40	70.2 Å²	70.2	26%	0.26	35%	0.354	S	S	.	.	H	α-helix	trans	-61.7	-30.3	-179	-13.6	20.8	0	0	0	113.4	Y410 Y424 L425 R426	Y410-P422 HydrophobicContact CD1-CB 4.3Å; Y410-P422 HydrophobicContact CD1-CG 4.1Å; Y410-P422 HydrophobicContact CD2-CG 4.4Å; Y410-P422 HydrophobicContact CE1-CB 4.21Å; Y410-P422 HydrophobicContact CE1-CG 3.58Å; Y410-P422 VanDerWaalsContact CE2-CD 3.45Å; Y410-P422 HydrophobicContact CE2-CG 3.91Å; Y410-P422 HydrophobicContact CG-CG 4.47Å; Y410-P422 VanDerWaalsContact CZ-CG 3.44Å; P422-Y424 VanDerWaalsContact C-N 3.28Å; P422-Y424 PolarHBondContact O-N 3.4Å; P422-L425 PolarHBondContact O-N 3.46Å; P422-R426 PolarHBondContact O-N 2.89Å
423	S	82.2	Confident	83.1	Confident	48 Å²	48	74.1 Å²	74.1	34%	0.336	38%	0.378	S	S	.	.	H	α-helix	trans	-67.1	-31.5	176.9	67.5	0	0	0	0	112.4	H421 M427	H421-S423 WeakPolarHBondContact ND1-CB 3.35Å; H421-S423 PolarHBondContact ND1-N 3.19Å; H421-S423 PolarHBondContact ND1-OG 3.01Å; H421-S423 PolarHBondContact O-N 3.11Å; S423-M427 VanDerWaalsContact O-CB 3.28Å; S423-M427 WeakPolarHBondContact O-CB 3.49Å; S423-M427 PolarHBondContact O-N 3.41Å
424	Y	82.8	Confident	82.8	Confident	124 Å²	124	68.8 Å²	68.8	49%	0.486	36%	0.361	S	S	.	.	H	α-helix	trans	-75.9	-37.8	176.9	-63.2	-39	0	0	0	111.4	H421 P422 M427 H428	H421-Y424 HydrophobicContact CB-CD2 3.59Å; H421-Y424 HydrophobicContact CB-CE2 3.98Å; H421-Y424 HydrophobicContact CB-CG 4.29Å; H421-Y424 PolarHBondContact O-N 3.26Å; P422-Y424 VanDerWaalsContact C-N 3.28Å; P422-Y424 PolarHBondContact O-N 3.4Å; Y424-M427 HydrophobicContact CD1-CE 4Å; Y424-M427 PolarHBondContact O-N 3.46Å; Y424-H428 WeakPolarHBondContact O-CB 3.45Å; Y424-H428 PolarHBondContact O-N 2.92Å
425	L	86.3	Confident	82.6	Confident	22 Å²	22	68 Å²	68	12%	0.115	36%	0.357	C	S	.	.	H	α-helix	trans	-58.9	-54.1	170.1	173.9	59.8	0	0	0	110.9	C412 F419 H421 P422 M427 H428 E429	C412-L425 HydrophobicContact CB-CD1 3.56Å; F419-L425 HydrophobicContact CB-CB 4.37Å; F419-L425 HydrophobicContact CD2-CB 3.98Å; F419-L425 HydrophobicContact CD2-CD1 3.84Å; F419-L425 HydrophobicContact CE2-CD1 4.09Å; F419-L425 HydrophobicContact CG-CB 4.41Å; H421-L425 PolarHBondContact O-N 3.27Å; P422-L425 PolarHBondContact O-N 3.46Å; L425-M427 PolarHBondContact O-N 3.15Å; L425-H428 CarbonylContact O-C 3.48Å; L425-H428 WeakPolarHBondContact O-CA 3.26Å; L425-H428 WeakPolarHBondContact O-CB 3.46Å; L425-H428 PolarHBondContact O-N 3.43Å; L425-E429 HydrophobicContact CD1-CG 4.07Å; L425-E429 HydrophobicContact CG-CG 4.41Å; L425-E429 WeakPolarHBondContact O-CG 3.48Å; L425-E429 PolarHBondContact O-N 2.97Å
426	R	83	Confident	82.6	Confident	162 Å²	162	71.1 Å²	71.1	61%	0.611	36%	0.364	S	S	*	.	H	α-helix	trans	-56.4	-37.7	177.2	-79.5	-170	-67.9	-143.5	-0.7	113.7	P422 E429 R430	P422-R426 PolarHBondContact O-N 2.89Å; R426-E429 WeakPolarHBondContact CA-OE2 3.44Å; R426-R430 PolarHBondContact O-N 2.81Å
427	M	80.3	Confident	82.7	Confident	55 Å²	55	72.4 Å²	72.4	27%	0.271	37%	0.365	S	S	.	.	H	α-helix	trans	-68.9	-40.1	175.6	-178.7	-179.6	69.7	0	0	111.4	S423 Y424 L425 R430 L448	S423-M427 VanDerWaalsContact O-CB 3.28Å; S423-M427 WeakPolarHBondContact O-CB 3.49Å; S423-M427 PolarHBondContact O-N 3.41Å; Y424-M427 HydrophobicContact CD1-CE 4Å; Y424-M427 PolarHBondContact O-N 3.46Å; L425-M427 PolarHBondContact O-N 3.15Å; M427-R430 WeakPolarHBondContact O-CB 3.46Å; M427-R430 PolarHBondContact O-N 2.98Å; M427-L448 HydrophobicContact CG-CD2 3.67Å; M427-L448 HydrophobicContact CG-CG 4.19Å
428	H	85.1	Confident	82.9	Confident	21 Å²	21	70 Å²	70	10%	0.097	35%	0.353	C	S	.	.	H	α-helix	trans	-66.3	-39.1	176	174.1	61.4	0	0	0	112.1	C415 F419 Y424 L425 R430 T431 H432	C415-H428 PolarHBondContact SG-NE2 3.43Å; F419-H428 HydrophobicContact CE1-CB 3.91Å; F419-H428 HydrophobicContact CE2-CB 3.65Å; F419-H428 AromaticContact CE2-CD2 3.33Å; F419-H428 WeakPolarHBondContact CE2-CD2 3.37Å; F419-H428 AromaticContact CE2-CG 3.54Å; F419-H428 HydrophobicContact CZ-CB 3.3Å; F419-H428 AromaticContact CZ-CD2 3.39Å; F419-H428 WeakPolarHBondContact CZ-CD2 3.47Å; F419-H428 AromaticContact CZ-CG 3.15Å; F419-H428 AromaticContact CZ-ND1 3.78Å; Y424-H428 WeakPolarHBondContact O-CB 3.45Å; Y424-H428 PolarHBondContact O-N 2.92Å; L425-H428 CarbonylContact O-C 3.48Å; L425-H428 WeakPolarHBondContact O-CA 3.26Å; L425-H428 WeakPolarHBondContact O-CB 3.46Å; L425-H428 PolarHBondContact O-N 3.43Å; H428-R430 PolarHBondContact O-N 3.12Å; H428-T431 PolarHBondContact ND1-OG1 3.31Å; H428-T431 WeakPolarHBondContact O-CA 3.44Å; H428-T431 VanDerWaalsContact O-CB 3.29Å; H428-T431 WeakPolarHBondContact O-CB 3.32Å; H428-T431 PolarHBondContact O-N 3.39Å; H428-T431 PolarHBondContact O-OG1 3.41Å; H428-H432 AromaticContact CD2-NE2 3.71Å; H428-H432 AromaticContact CE1-CE1 3.77Å; H428-H432 AromaticContact CE1-NE2 3.67Å; H428-H432 AromaticContact NE2-CE1 3.54Å; H428-H432 AromaticContact NE2-NE2 3.06Å; H428-H432 PolarHBondContact NE2-NE2 3.26Å
429	E	84.6	Confident	83	Confident	67 Å²	67	75.1 Å²	75.1	31%	0.313	37%	0.371	S	S	.	.	H	α-helix	trans	-56.7	-35	176.5	-72.4	170.7	154.8	0	0	112	L425 R426 T431 H432 T433	L425-E429 HydrophobicContact CD1-CG 4.07Å; L425-E429 HydrophobicContact CG-CG 4.41Å; L425-E429 WeakPolarHBondContact O-CG 3.48Å; L425-E429 PolarHBondContact O-N 2.97Å; R426-E429 WeakPolarHBondContact CA-OE2 3.44Å; E429-T431 PolarHBondContact O-N 2.97Å; E429-H432 WeakPolarHBondContact O-CB 3.45Å; E429-H432 PolarHBondContact O-N 3.2Å; E429-T433 PolarHBondContact O-N 2.99Å
430	R	84.6	Confident	83.3	Confident	83 Å²	83	73.5 Å²	73.5	31%	0.313	37%	0.365	S	S	.	.	H	α-helix	trans	-63.1	-19.6	173.2	-66.9	175.6	-178.9	176.3	-3.1	114.2	R426 M427 H428 H432 T433 G434 E435 L448	R426-R430 PolarHBondContact O-N 2.81Å; M427-R430 WeakPolarHBondContact O-CB 3.46Å; M427-R430 PolarHBondContact O-N 2.98Å; H428-R430 PolarHBondContact O-N 3.12Å; R430-H432 VanDerWaalsContact C-N 3.29Å; R430-T433 WeakPolarHBondContact CA-OG1 3.49Å; R430-T433 PolarHBondContact O-OG1 3.27Å; R430-G434 PolarHBondContact O-N 3.47Å; R430-E435 PolarHBondContact O-N 3.12Å; R430-L448 HydrophobicContact CB-CD1 3.41Å; R430-L448 VanDerWaalsContact CB-CD1 3.41Å; R430-L448 HydrophobicContact CB-CG 4.41Å; R430-L448 HydrophobicContact CG-CD1 4.48Å
431	T	81.9	Confident	83.6	Confident	75 Å²	75	78.6 Å²	78.6	46%	0.46	39%	0.393	S	S	.	.	H	α-helix	trans	-73.5	-23.9	174.2	68.2	0	0	0	0	112.5	H428 E429 L448	H428-T431 PolarHBondContact ND1-OG1 3.31Å; H428-T431 WeakPolarHBondContact O-CA 3.44Å; H428-T431 VanDerWaalsContact O-CB 3.29Å; H428-T431 WeakPolarHBondContact O-CB 3.32Å; H428-T431 PolarHBondContact O-N 3.39Å; H428-T431 PolarHBondContact O-OG1 3.41Å; E429-T431 PolarHBondContact O-N 2.97Å; T431-L448 HydrophobicContact CG2-CD2 3.78Å
432	H	82.6	Confident	83.9	Confident	71 Å²	71	81.5 Å²	81.5	33%	0.329	41%	0.406	S	S	.	.	H	α-helix	trans	-84.5	-39	175.1	-56	-53.4	0	0	0	112	C412 Q414 C415 H428 E429 R430 G434	C412-H432 PolarHBondContact SG-NE2 3.05Å; Q414-H432 PolarHBondContact OE1-CD2 3.28Å; C415-H432 PolarHBondContact SG-NE2 3.41Å; H428-H432 AromaticContact CD2-NE2 3.71Å; H428-H432 AromaticContact CE1-CE1 3.77Å; H428-H432 AromaticContact CE1-NE2 3.67Å; H428-H432 AromaticContact NE2-CE1 3.54Å; H428-H432 AromaticContact NE2-NE2 3.06Å; H428-H432 PolarHBondContact NE2-NE2 3.26Å; E429-H432 WeakPolarHBondContact O-CB 3.45Å; E429-H432 PolarHBondContact O-N 3.2Å; R430-H432 VanDerWaalsContact C-N 3.29Å; H432-G434 VanDerWaalsContact C-N 3.25Å; H432-G434 PolarHBondContact O-N 2.94Å
433	T	80.9	Confident	84.4	Confident	82 Å²	82	81.3 Å²	81.3	50%	0.503	41%	0.406	S	S	.	.	H	α-helix	trans	-75.9	-16	176.5	64.4	0	0	0	0	112.9	E429 R430 E435	E429-T433 PolarHBondContact O-N 2.99Å; R430-T433 WeakPolarHBondContact CA-OG1 3.49Å; R430-T433 PolarHBondContact O-OG1 3.27Å; T433-E435 PolarHBondContact O-N 2.81Å; T433-E435 WeakPolarHBondContact OG1-CG 3.5Å; T433-E435 PolarHBondContact OG1-N 3.03Å
434	G	78.8	Confident	84.5	Confident	46 Å²	46	87.5 Å²	87.5	47%	0.474	44%	0.435	S	S	.	.			trans	72	4.1	-175.1	0	0	0	0	0	113.9	R430 H432 K436	R430-G434 PolarHBondContact O-N 3.47Å; H432-G434 VanDerWaalsContact C-N 3.25Å; H432-G434 PolarHBondContact O-N 2.94Å; G434-K436 PolarHBondContact O-N 3.09Å
435	E	81	Confident	84.5	Confident	115 Å²	115	86.6 Å²	86.6	54%	0.537	43%	0.434	S	S	.	.			trans	-62.8	120.5	179	-75.5	-177.2	179	0	0	111.1	R430 T433 P437 L448	R430-E435 PolarHBondContact O-N 3.12Å; T433-E435 PolarHBondContact O-N 2.81Å; T433-E435 WeakPolarHBondContact OG1-CG 3.5Å; T433-E435 PolarHBondContact OG1-N 3.03Å; E435-P437 WeakPolarHBondContact O-CD 3.27Å; E435-L448 WeakPolarHBondContact O-CD1 3.35Å
436	K	85.2	Confident	84.6	Confident	119 Å²	119	86.9 Å²	86.9	52%	0.517	44%	0.439	S	S	.	.			trans	-122.5	85.3	176.6	-66.8	179.1	-166.6	173.3	0	109.4	G434 Y438 A446 F447	G434-K436 PolarHBondContact O-N 3.09Å; K436-Y438 PolarHBondContact O-N 3.1Å; K436-Y438 VanDerWaalsContact O-N 3.08Å; K436-A446 HydrophobicContact CB-CB 3.48Å; K436-A446 VanDerWaalsContact CB-CB 3.48Å; K436-A446 HydrophobicContact CD-CB 4.13Å; K436-A446 VanDerWaalsContact CD-O 3.31Å; K436-A446 WeakPolarHBondContact CD-O 3.36Å; K436-A446 HydrophobicContact CG-CB 4.47Å; K436-F447 CarbonylContact C-O 3.51Å; K436-F447 WeakPolarHBondContact CA-O 3.4Å
437	P	85.4	Confident	84.7	Confident	69 Å²	69	81.1 Å²	81.1	45%	0.448	42%	0.418	S	S	.	.			trans	-67.3	-12.4	-169.7	-22.1	34	0	0	0	115	E435	E435-P437 WeakPolarHBondContact O-CD 3.27Å
438	Y	87.5	Confident	84.8	Confident	78 Å²	78	80.1 Å²	80.1	31%	0.306	41%	0.414	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	93.3	-172.2	-55	-74.4	0	0	0	109.7	K436 A446 F447 L448 P450	K436-Y438 PolarHBondContact O-N 3.1Å; K436-Y438 VanDerWaalsContact O-N 3.08Å; Y438-A446 CarbonylContact O-C 3.56Å; Y438-A446 WeakPolarHBondContact O-CA 3.27Å; Y438-F447 PolarHBondContact N-O 2.92Å; Y438-F447 PolarHBondContact O-N 3.18Å; Y438-L448 WeakPolarHBondContact CE2-O 3.24Å; Y438-P450 HydrophobicContact CD1-CB 4.38Å; Y438-P450 HydrophobicContact CD1-CG 3.99Å; Y438-P450 HydrophobicContact CD2-CG 4.38Å; Y438-P450 HydrophobicContact CE1-CB 4.34Å; Y438-P450 HydrophobicContact CE1-CG 3.54Å; Y438-P450 VanDerWaalsContact CE2-CD 3.47Å; Y438-P450 HydrophobicContact CE2-CG 3.94Å; Y438-P450 HydrophobicContact CG-CG 4.39Å; Y438-P450 VanDerWaalsContact CZ-CG 3.48Å
439	Q	87.6	Confident	84.6	Confident	140 Å²	140	82.6 Å²	82.6	65%	0.654	43%	0.425	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-85.8	143.5	179.2	-67.5	177.8	-14.6	0	0	111.1	A446 L453	Q439-A446 HydrophobicContact CG-CB 3.87Å; Q439-L453 WeakPolarHBondContact O-CD2 3.38Å
440	C	90.4	Very high	84.6	Confident	10 Å²	10	81.4 Å²	81.4	7%	0.068	42%	0.423	C	S	.	.			trans	-79.1	135.8	169	-175.5	0	0	0	0	109.5	E442 K445 L453	C440-E442 VanDerWaalsContact C-N 3.27Å; C440-E442 PolarHBondContact O-N 3.41Å; C440-E442 PolarHBondContact SG-N 3.32Å; C440-K445 WeakPolarHBondContact CB-O 3.32Å; C440-K445 PolarHBondContact N-O 3.44Å; C440-L453 HydrophobicContact CB-CD1 3.79Å
441	N	87.1	Confident	84.5	Confident	155 Å²	155	79.7 Å²	79.7	83%	0.829	42%	0.424	S	S	*	.	S	Bend	trans	-78	-15	178.4	-63.5	-23.3	0	0	0	112.7
442	E	84.4	Confident	84.7	Confident	130 Å²	130	81.8 Å²	81.8	61%	0.607	42%	0.424	S	S	*	.	S	Bend	trans	-105.5	-9.5	-175.7	-63.1	-170.6	-144.9	0	0	114.1	C440 H460	C440-E442 VanDerWaalsContact C-N 3.27Å; C440-E442 PolarHBondContact O-N 3.41Å; C440-E442 PolarHBondContact SG-N 3.32Å; E442-H460 WeakPolarHBondContact OE2-CB 3.47Å; E442-H460 IonicContact OE2-CG 3.99Å; E442-H460 VanDerWaalsContact OE2-CG 3.28Å; E442-H460 IonicContact OE2-ND1 3.99Å; E442-H460 PolarHBondContact OE2-ND1 3.32Å; E442-H460 VanDerWaalsContact OE2-ND1 3.09Å
443	C	90	Very high	84.9	Confident	36 Å²	36	79.4 Å²	79.4	24%	0.243	41%	0.414	C	S	.	.	S	Bend	trans	-157.9	165.6	172	70.5	0	0	0	0	111.4	K445 H456	C443-K445 PolarHBondContact O-N 2.79Å; C443-H456 PolarHBondContact SG-NE2 3.1Å
444	D	84.4	Confident	85.1	Confident	177 Å²	177	83.1 Å²	83.1	95%	0.947	42%	0.419	S	S	*	.	S	Bend	trans	-69.4	10.7	-176.2	-52.5	-42	0	0	0	114.9	A446	D444-A446 PolarHBondContact O-N 2.85Å
445	K	84.3	Confident	85.4	Confident	106 Å²	106	83.9 Å²	83.9	46%	0.461	41%	0.41	S	S	.	.			trans	-83	119.1	-178.7	-67.6	-177.9	-177.4	177.1	0	110.7	C440 C443 F447 R459	C440-K445 WeakPolarHBondContact CB-O 3.32Å; C440-K445 PolarHBondContact N-O 3.44Å; C443-K445 PolarHBondContact O-N 2.79Å; K445-F447 HydrophobicContact CB-CE2 3.79Å; K445-F447 HydrophobicContact CB-CZ 3.89Å; K445-F447 WeakPolarHBondContact O-CE2 3.47Å; K445-R459 VanDerWaalsContact NZ-NH2 3.16Å
446	A	87.5	Confident	85.7	Confident	27 Å²	27	78.9 Å²	78.9	22%	0.223	39%	0.387	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.4	151.7	169.7	0	0	0	0	0	111.8	K436 Y438 Q439 D444	K436-A446 HydrophobicContact CB-CB 3.48Å; K436-A446 VanDerWaalsContact CB-CB 3.48Å; K436-A446 HydrophobicContact CD-CB 4.13Å; K436-A446 VanDerWaalsContact CD-O 3.31Å; K436-A446 WeakPolarHBondContact CD-O 3.36Å; K436-A446 HydrophobicContact CG-CB 4.47Å; Y438-A446 CarbonylContact O-C 3.56Å; Y438-A446 WeakPolarHBondContact O-CA 3.27Å; Q439-A446 HydrophobicContact CG-CB 3.87Å; D444-A446 PolarHBondContact O-N 2.85Å
447	F	85.8	Confident	85.7	Confident	42 Å²	42	76.2 Å²	76.2	18%	0.184	38%	0.376	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	154.9	-176.8	-60.1	-90.6	0	0	0	112.1	K436 Y438 K445 L453 H456	K436-F447 CarbonylContact C-O 3.51Å; K436-F447 WeakPolarHBondContact CA-O 3.4Å; Y438-F447 PolarHBondContact N-O 2.92Å; Y438-F447 PolarHBondContact O-N 3.18Å; K445-F447 HydrophobicContact CB-CE2 3.79Å; K445-F447 HydrophobicContact CB-CZ 3.89Å; K445-F447 WeakPolarHBondContact O-CE2 3.47Å; F447-L453 HydrophobicContact CB-CB 4.37Å; F447-L453 HydrophobicContact CD2-CB 4.08Å; F447-L453 HydrophobicContact CD2-CD1 3.91Å; F447-L453 HydrophobicContact CE2-CD1 4.21Å; F447-L453 HydrophobicContact CG-CB 4.39Å; F447-H456 HydrophobicContact CE1-CB 3.92Å; F447-H456 HydrophobicContact CE2-CB 3.87Å; F447-H456 AromaticContact CE2-CD2 3.05Å; F447-H456 WeakPolarHBondContact CE2-CD2 3.5Å; F447-H456 AromaticContact CE2-CG 3.57Å; F447-H456 AromaticContact CE2-NE2 3.81Å; F447-H456 HydrophobicContact CZ-CB 3.43Å; F447-H456 VanDerWaalsContact CZ-CB 3.43Å; F447-H456 AromaticContact CZ-CD2 3.19Å; F447-H456 WeakPolarHBondContact CZ-CD2 3.43Å; F447-H456 AromaticContact CZ-CG 3.2Å; F447-H456 AromaticContact CZ-ND1 4Å; F447-H456 AromaticContact CZ-NE2 3.88Å
448	L	81.8	Confident	85.8	Confident	33 Å²	33	76.4 Å²	76.4	17%	0.173	37%	0.368	C	S	.	.	S	Bend	trans	-76.5	-24.9	179.1	-158.8	73.7	0	0	0	113.3	M427 R430 T431 E435 Y438	M427-L448 HydrophobicContact CG-CD2 3.67Å; M427-L448 HydrophobicContact CG-CG 4.19Å; R430-L448 HydrophobicContact CB-CD1 3.41Å; R430-L448 VanDerWaalsContact CB-CD1 3.41Å; R430-L448 HydrophobicContact CB-CG 4.41Å; R430-L448 HydrophobicContact CG-CD1 4.48Å; T431-L448 HydrophobicContact CG2-CD2 3.78Å; E435-L448 WeakPolarHBondContact O-CD1 3.35Å; Y438-L448 WeakPolarHBondContact CE2-O 3.24Å
449	H	80.6	Confident	85.5	Confident	74 Å²	74	79.2 Å²	79.2	34%	0.343	38%	0.378	S	S	.	.	S	Bend	trans	-140.7	142.7	-170.9	-167.8	-96.2	0	0	0	112.1	S451 Y452 L453	H449-S451 VanDerWaalsContact C-N 3.26Å; H449-S451 PolarHBondContact CE1-OG 2.95Å; H449-S451 WeakPolarHBondContact ND1-CB 3.21Å; H449-S451 PolarHBondContact ND1-N 3.12Å; H449-S451 VanDerWaalsContact ND1-N 3.17Å; H449-S451 PolarHBondContact ND1-OG 2.77Å; H449-S451 PolarHBondContact O-N 3.13Å; H449-Y452 HydrophobicContact CB-CD2 3.68Å; H449-Y452 HydrophobicContact CB-CE2 4.03Å; H449-Y452 HydrophobicContact CB-CG 4.35Å; H449-Y452 PolarHBondContact O-N 3.04Å; H449-L453 PolarHBondContact O-N 3.46Å
450	P	83.8	Confident	85.4	Confident	41 Å²	41	75.5 Å²	75.5	27%	0.266	36%	0.361	S	S	.	.	H	α-helix	trans	-61.7	-30.2	-178.2	-18.2	26.7	0	0	0	114.1	Y438 Y452 L453 R454	Y438-P450 HydrophobicContact CD1-CB 4.38Å; Y438-P450 HydrophobicContact CD1-CG 3.99Å; Y438-P450 HydrophobicContact CD2-CG 4.38Å; Y438-P450 HydrophobicContact CE1-CB 4.34Å; Y438-P450 HydrophobicContact CE1-CG 3.54Å; Y438-P450 VanDerWaalsContact CE2-CD 3.47Å; Y438-P450 HydrophobicContact CE2-CG 3.94Å; Y438-P450 HydrophobicContact CG-CG 4.39Å; Y438-P450 VanDerWaalsContact CZ-CG 3.48Å; P450-Y452 VanDerWaalsContact C-N 3.3Å; P450-Y452 PolarHBondContact O-N 3.45Å; P450-L453 PolarHBondContact O-N 3.32Å; P450-R454 PolarHBondContact O-N 3.32Å
451	S	84.1	Confident	85	Confident	47 Å²	47	78.3 Å²	78.3	33%	0.329	38%	0.38	S	S	.	.	H	α-helix	trans	-68.4	-31.9	177.5	69.5	0	0	0	0	112.3	H449 M455	H449-S451 VanDerWaalsContact C-N 3.26Å; H449-S451 PolarHBondContact CE1-OG 2.95Å; H449-S451 WeakPolarHBondContact ND1-CB 3.21Å; H449-S451 PolarHBondContact ND1-N 3.12Å; H449-S451 VanDerWaalsContact ND1-N 3.17Å; H449-S451 PolarHBondContact ND1-OG 2.77Å; H449-S451 PolarHBondContact O-N 3.13Å; S451-M455 VanDerWaalsContact O-CB 3.26Å; S451-M455 WeakPolarHBondContact O-CB 3.36Å; S451-M455 PolarHBondContact O-N 3.26Å
452	Y	85.1	Confident	84.7	Confident	119 Å²	119	73.1 Å²	73.1	47%	0.467	36%	0.364	S	S	.	.	H	α-helix	trans	-74.9	-38.5	177.3	-62	-36.5	0	0	0	111.1	H449 P450 M455 H456	H449-Y452 HydrophobicContact CB-CD2 3.68Å; H449-Y452 HydrophobicContact CB-CE2 4.03Å; H449-Y452 HydrophobicContact CB-CG 4.35Å; H449-Y452 PolarHBondContact O-N 3.04Å; P450-Y452 VanDerWaalsContact C-N 3.3Å; P450-Y452 PolarHBondContact O-N 3.45Å; Y452-M455 HydrophobicContact CD1-CE 4.27Å; Y452-M455 PolarHBondContact O-N 3.28Å; Y452-H456 VanDerWaalsContact O-CB 3.26Å; Y452-H456 WeakPolarHBondContact O-CB 3.49Å; Y452-H456 PolarHBondContact O-N 2.73Å
453	L	87.8	Confident	84.7	Confident	21 Å²	21	72.5 Å²	72.5	11%	0.11	36%	0.361	C	S	.	.	H	α-helix	trans	-58	-54.4	170	174.5	59.8	0	0	0	110.7	Q439 C440 F447 H449 P450 M455 H456 E457	Q439-L453 WeakPolarHBondContact O-CD2 3.38Å; C440-L453 HydrophobicContact CB-CD1 3.79Å; F447-L453 HydrophobicContact CB-CB 4.37Å; F447-L453 HydrophobicContact CD2-CB 4.08Å; F447-L453 HydrophobicContact CD2-CD1 3.91Å; F447-L453 HydrophobicContact CE2-CD1 4.21Å; F447-L453 HydrophobicContact CG-CB 4.39Å; H449-L453 PolarHBondContact O-N 3.46Å; P450-L453 PolarHBondContact O-N 3.32Å; L453-M455 VanDerWaalsContact C-N 3.29Å; L453-M455 PolarHBondContact O-N 3.22Å; L453-H456 CarbonylContact O-C 3.51Å; L453-H456 WeakPolarHBondContact O-CA 3.2Å; L453-H456 WeakPolarHBondContact O-CB 3.31Å; L453-H456 PolarHBondContact O-N 3.38Å; L453-E457 HydrophobicContact CD1-CG 3.97Å; L453-E457 HydrophobicContact CG-CG 4.3Å; L453-E457 WeakPolarHBondContact O-CG 3.28Å; L453-E457 PolarHBondContact O-N 3.03Å
454	R	84.8	Confident	84.6	Confident	161 Å²	161	76.6 Å²	76.6	61%	0.608	37%	0.374	S	S	*	.	H	α-helix	trans	-56.2	-40.9	177.1	-80.3	-171.6	-68.4	-153.2	-2	113.9	P450 H456 E457 R458	P450-R454 PolarHBondContact O-N 3.32Å; R454-H456 VanDerWaalsContact C-N 3.29Å; R454-H456 PolarHBondContact O-N 3.36Å; R454-E457 WeakPolarHBondContact CA-OE2 3.42Å; R454-R458 WeakPolarHBondContact O-CG 3.32Å; R454-R458 PolarHBondContact O-N 2.9Å
455	M	84.5	Confident	84.7	Confident	61 Å²	61	71.4 Å²	71.4	30%	0.3	35%	0.35	S	S	.	.	H	α-helix	trans	-66.1	-35.3	176.3	179.5	-170.1	75.2	0	0	111.9	S451 Y452 L453 Q477	S451-M455 VanDerWaalsContact O-CB 3.26Å; S451-M455 WeakPolarHBondContact O-CB 3.36Å; S451-M455 PolarHBondContact O-N 3.26Å; Y452-M455 HydrophobicContact CD1-CE 4.27Å; Y452-M455 PolarHBondContact O-N 3.28Å; L453-M455 VanDerWaalsContact C-N 3.29Å; L453-M455 PolarHBondContact O-N 3.22Å; M455-Q477 HydrophobicContact CG-CG 4.45Å; M455-Q477 HydrophobicContact SD-CG 4.44Å; M455-Q477 PolarHBondContact SD-NE2 3.29Å
456	H	87.3	Confident	85	Confident	10 Å²	10	69.9 Å²	69.9	5%	0.046	34%	0.342	C	S	.	.	H	α-helix	trans	-73.2	-40.6	176.9	165.1	49.1	0	0	0	112.4	C443 F447 Y452 L453 R454 R458 R459 H460	C443-H456 PolarHBondContact SG-NE2 3.1Å; F447-H456 HydrophobicContact CE1-CB 3.92Å; F447-H456 HydrophobicContact CE2-CB 3.87Å; F447-H456 AromaticContact CE2-CD2 3.05Å; F447-H456 WeakPolarHBondContact CE2-CD2 3.5Å; F447-H456 AromaticContact CE2-CG 3.57Å; F447-H456 AromaticContact CE2-NE2 3.81Å; F447-H456 HydrophobicContact CZ-CB 3.43Å; F447-H456 VanDerWaalsContact CZ-CB 3.43Å; F447-H456 AromaticContact CZ-CD2 3.19Å; F447-H456 WeakPolarHBondContact CZ-CD2 3.43Å; F447-H456 AromaticContact CZ-CG 3.2Å; F447-H456 AromaticContact CZ-ND1 4Å; F447-H456 AromaticContact CZ-NE2 3.88Å; Y452-H456 VanDerWaalsContact O-CB 3.26Å; Y452-H456 WeakPolarHBondContact O-CB 3.49Å; Y452-H456 PolarHBondContact O-N 2.73Å; L453-H456 CarbonylContact O-C 3.51Å; L453-H456 WeakPolarHBondContact O-CA 3.2Å; L453-H456 WeakPolarHBondContact O-CB 3.31Å; L453-H456 PolarHBondContact O-N 3.38Å; R454-H456 VanDerWaalsContact C-N 3.29Å; R454-H456 PolarHBondContact O-N 3.36Å; H456-R458 PolarHBondContact O-N 3.48Å; H456-R459 PolarHBondContact CE1-NH2 3.31Å; H456-R459 PolarHBondContact ND1-NH2 3.45Å; H456-R459 VanDerWaalsContact ND1-NH2 3.11Å; H456-R459 WeakPolarHBondContact O-CB 3.42Å; H456-R459 PolarHBondContact O-N 3.29Å; H456-H460 AromaticContact CE1-CD2 3.65Å; H456-H460 AromaticContact CE1-NE2 3.13Å; H456-H460 PolarHBondContact CE1-NE2 3.45Å; H456-H460 AromaticContact NE2-CD2 3.93Å; H456-H460 AromaticContact NE2-NE2 3.41Å; H456-H460 PolarHBondContact NE2-NE2 3.46Å
457	E	85.8	Confident	85.1	Confident	63 Å²	63	74.1 Å²	74.1	29%	0.294	36%	0.358	S	S	.	.	H	α-helix	trans	-56.7	-34.3	174.9	-72.7	169.3	160.3	0	0	111.4	L453 R454 R459 H460 S461	L453-E457 HydrophobicContact CD1-CG 3.97Å; L453-E457 HydrophobicContact CG-CG 4.3Å; L453-E457 WeakPolarHBondContact O-CG 3.28Å; L453-E457 PolarHBondContact O-N 3.03Å; R454-E457 WeakPolarHBondContact CA-OE2 3.42Å; E457-R459 PolarHBondContact O-N 3.47Å; E457-R459 VanDerWaalsContact O-N 3.09Å; E457-H460 WeakPolarHBondContact O-CA 3.27Å; E457-H460 VanDerWaalsContact O-CB 3.28Å; E457-H460 WeakPolarHBondContact O-CB 3.4Å; E457-H460 PolarHBondContact O-N 3.39Å; E457-S461 PolarHBondContact O-N 2.73Å; E457-S461 VanDerWaalsContact O-N 3.09Å
458	R	86.7	Confident	85.4	Confident	73 Å²	73	72.1 Å²	72.1	28%	0.275	35%	0.349	S	S	.	.	H	α-helix	trans	-60.7	-20.4	173.2	-65.9	174.7	-177	-180	-2.4	114.5	R454 H456 H460 S461 G462 E463 L476	R454-R458 WeakPolarHBondContact O-CG 3.32Å; R454-R458 PolarHBondContact O-N 2.9Å; H456-R458 PolarHBondContact O-N 3.48Å; R458-H460 VanDerWaalsContact C-N 3.31Å; R458-S461 WeakPolarHBondContact CA-OG 3.49Å; R458-G462 PolarHBondContact O-N 3.22Å; R458-G462 VanDerWaalsContact O-N 3.12Å; R458-E463 PolarHBondContact O-N 3.02Å; R458-L476 HydrophobicContact CB-CD1 3.31Å; R458-L476 HydrophobicContact CB-CG 4.31Å; R458-L476 HydrophobicContact CG-CD1 4.42Å
459	R	82.6	Confident	85.7	Confident	138 Å²	138	77.9 Å²	77.9	52%	0.521	38%	0.379	S	S	.	.	H	α-helix	trans	-70.9	-32.4	172.1	-177.3	173.4	66	-154.4	0.8	111.4	K445 H456 E457	K445-R459 VanDerWaalsContact NZ-NH2 3.16Å; H456-R459 PolarHBondContact CE1-NH2 3.31Å; H456-R459 PolarHBondContact ND1-NH2 3.45Å; H456-R459 VanDerWaalsContact ND1-NH2 3.11Å; H456-R459 WeakPolarHBondContact O-CB 3.42Å; H456-R459 PolarHBondContact O-N 3.29Å; E457-R459 PolarHBondContact O-N 3.47Å; E457-R459 VanDerWaalsContact O-N 3.09Å
460	H	84.1	Confident	85.9	Confident	62 Å²	62	80.4 Å²	80.4	29%	0.287	39%	0.392	S	S	.	.	H	α-helix	trans	-76.6	-50	178.8	-71.8	-88.2	0	0	0	111.3	E442 H456 E457 R458 G462	E442-H460 WeakPolarHBondContact OE2-CB 3.47Å; E442-H460 IonicContact OE2-CG 3.99Å; E442-H460 VanDerWaalsContact OE2-CG 3.28Å; E442-H460 IonicContact OE2-ND1 3.99Å; E442-H460 PolarHBondContact OE2-ND1 3.32Å; E442-H460 VanDerWaalsContact OE2-ND1 3.09Å; H456-H460 AromaticContact CE1-CD2 3.65Å; H456-H460 AromaticContact CE1-NE2 3.13Å; H456-H460 PolarHBondContact CE1-NE2 3.45Å; H456-H460 AromaticContact NE2-CD2 3.93Å; H456-H460 AromaticContact NE2-NE2 3.41Å; H456-H460 PolarHBondContact NE2-NE2 3.46Å; E457-H460 WeakPolarHBondContact O-CA 3.27Å; E457-H460 VanDerWaalsContact O-CB 3.28Å; E457-H460 WeakPolarHBondContact O-CB 3.4Å; E457-H460 PolarHBondContact O-N 3.39Å; R458-H460 VanDerWaalsContact C-N 3.31Å; H460-G462 PolarHBondContact O-N 3.31Å
461	S	82.8	Confident	86.2	Confident	68 Å²	68	81.1 Å²	81.1	48%	0.476	40%	0.397	S	S	.	.	H	α-helix	trans	-68.9	-15.8	177.8	66	0	0	0	0	113.6	E457 R458 E463	E457-S461 PolarHBondContact O-N 2.73Å; E457-S461 VanDerWaalsContact O-N 3.09Å; R458-S461 WeakPolarHBondContact CA-OG 3.49Å; S461-E463 PolarHBondContact O-N 3.45Å; S461-E463 WeakPolarHBondContact OG-CB 3.19Å; S461-E463 WeakPolarHBondContact OG-CG 3.41Å; S461-E463 PolarHBondContact OG-N 3.13Å
462	G	80.8	Confident	86.2	Confident	46 Å²	46	80.9 Å²	80.9	47%	0.474	40%	0.402	S	S	.	.			trans	70.4	4	-174.5	0	0	0	0	0	113.8	R458 H460 K464	R458-G462 PolarHBondContact O-N 3.22Å; R458-G462 VanDerWaalsContact O-N 3.12Å; H460-G462 PolarHBondContact O-N 3.31Å; G462-K464 PolarHBondContact O-N 2.92Å
463	E	83.4	Confident	86.4	Confident	118 Å²	118	81.2 Å²	81.2	55%	0.551	41%	0.406	S	S	*	.			trans	-60.6	122.3	178.9	-76.2	-175.4	173.7	0	0	111	R458 S461 P465 L476	R458-E463 PolarHBondContact O-N 3.02Å; S461-E463 PolarHBondContact O-N 3.45Å; S461-E463 WeakPolarHBondContact OG-CB 3.19Å; S461-E463 WeakPolarHBondContact OG-CG 3.41Å; S461-E463 PolarHBondContact OG-N 3.13Å; E463-P465 WeakPolarHBondContact O-CD 3.33Å; E463-L476 WeakPolarHBondContact O-CD1 3.34Å
464	K	87.8	Confident	86.5	Confident	121 Å²	121	82 Å²	82	53%	0.526	42%	0.415	S	S	.	.			trans	-120.8	83.1	175.6	-67.3	179.4	-166.6	173.4	0	109.4	G462 Y466 A474 F475	G462-K464 PolarHBondContact O-N 2.92Å; K464-Y466 PolarHBondContact O-N 2.87Å; K464-A474 HydrophobicContact CB-CB 3.56Å; K464-A474 HydrophobicContact CD-CB 4.22Å; K464-A474 VanDerWaalsContact CD-O 3.31Å; K464-A474 WeakPolarHBondContact CD-O 3.4Å; K464-F475 CarbonylContact C-O 3.57Å; K464-F475 WeakPolarHBondContact CA-O 3.48Å
465	P	87.8	Confident	86.7	Confident	68 Å²	68	76.5 Å²	76.5	44%	0.442	40%	0.396	S	S	.	.			trans	-69	-7.1	-169.4	-20.8	33.7	0	0	0	115.3	E463	E463-P465 WeakPolarHBondContact O-CD 3.33Å
466	Y	90	Very high	86.7	Confident	75 Å²	75	75.7 Å²	75.7	29%	0.294	39%	0.392	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	92.5	-172.1	-56.4	-77.1	0	0	0	109.6	K464 A474 F475 L476 Q477 S478	K464-Y466 PolarHBondContact O-N 2.87Å; Y466-A474 CarbonylContact O-C 3.54Å; Y466-A474 WeakPolarHBondContact O-CA 3.46Å; Y466-F475 PolarHBondContact N-O 3.38Å; Y466-F475 PolarHBondContact O-N 3.13Å; Y466-L476 WeakPolarHBondContact CE2-O 3.41Å; Y466-Q477 VanDerWaalsContact CD2-CA 3.46Å; Y466-S478 VanDerWaalsContact CD2-N 3.31Å
467	E	89.6	Confident	86.6	Confident	116 Å²	116	77.4 Å²	77.4	54%	0.542	40%	0.4	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.6	140	-179.2	-168.2	176.2	166.3	0	0	112.2	A474 L481	E467-A474 HydrophobicContact CB-CB 4.49Å; E467-L481 WeakPolarHBondContact O-CD2 3.41Å
468	C	91.4	Very high	86.6	Confident	0 Å²	0	77.5 Å²	77.5	0%	0	41%	0.408	C	S	.	.			trans	-84.1	116.4	172.5	-176.1	0	0	0	0	110.7	Q470 C471 G472 K473 F475 L481 H488	C468-Q470 PolarHBondContact O-N 2.8Å; C468-Q470 VanDerWaalsContact O-N 3.09Å; C468-C471 PolarHBondContact O-N 3.35Å; C468-G472 WeakPolarHBondContact O-CA 3.42Å; C468-G472 PolarHBondContact O-N 3.35Å; C468-K473 WeakPolarHBondContact CB-O 3.47Å; C468-K473 PolarHBondContact N-O 3.25Å; C468-F475 HydrophobicContact CB-CE2 4.44Å; C468-L481 HydrophobicContact CB-CD1 3.58Å; C468-H488 PolarHBondContact SG-NE2 3.02Å
469	N	88	Confident	86.5	Confident	153 Å²	153	77 Å²	77	82%	0.818	41%	0.409	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.7	-18.6	-180	-62.4	-23.1	0	0	0	114
470	Q	86.6	Confident	86.6	Confident	128 Å²	128	76.1 Å²	76.1	60%	0.598	41%	0.406	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.4	-28.2	-176.4	-60.6	-172.1	32	0	0	114	C468 H488	C468-Q470 PolarHBondContact O-N 2.8Å; C468-Q470 VanDerWaalsContact O-N 3.09Å; Q470-H488 VanDerWaalsContact OE1-CG 3.25Å
471	C	89	Confident	86.8	Confident	55 Å²	55	74.2 Å²	74.2	37%	0.372	40%	0.398	S	S	.	.	T	Hydrogen-bonded Turn	trans	-137.5	6.9	-178	71	0	0	0	0	114.9	C468 K473 H484 H488	C468-C471 PolarHBondContact O-N 3.35Å; C471-K473 PolarHBondContact O-N 3.25Å; C471-K473 VanDerWaalsContact O-N 3.09Å; C471-H484 PolarHBondContact SG-NE2 2.8Å; C471-H488 PolarHBondContact SG-NE2 3.28Å; C471-H488 VanDerWaalsContact SG-NE2 3.45Å
472	G	85.5	Confident	86.9	Confident	42 Å²	42	78.4 Å²	78.4	43%	0.433	40%	0.403	S	S	.	.			trans	68.1	3.1	179.7	0	0	0	0	0	114.7	C468 A474	C468-G472 WeakPolarHBondContact O-CA 3.42Å; C468-G472 PolarHBondContact O-N 3.35Å; G472-A474 PolarHBondContact O-N 3.13Å
473	K	88.1	Confident	87	Confident	126 Å²	126	78.5 Å²	78.5	55%	0.548	39%	0.392	S	S	.	.			trans	-70.5	121.4	179.4	-74.1	-178.3	-177.8	174.8	0	110.3	C468 C471 F475	C468-K473 WeakPolarHBondContact CB-O 3.47Å; C468-K473 PolarHBondContact N-O 3.25Å; C471-K473 PolarHBondContact O-N 3.25Å; C471-K473 VanDerWaalsContact O-N 3.09Å; K473-F475 HydrophobicContact CB-CE2 3.95Å; K473-F475 HydrophobicContact CB-CZ 4.08Å; K473-F475 WeakPolarHBondContact O-CD2 3.34Å; K473-F475 VanDerWaalsContact O-CE2 3.24Å; K473-F475 WeakPolarHBondContact O-CE2 3.4Å
474	A	90.2	Very high	87.1	Confident	37 Å²	37	74.1 Å²	74.1	31%	0.306	37%	0.372	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.2	144.6	177.2	0	0	0	0	0	112.6	K464 Y466 E467 G472	K464-A474 HydrophobicContact CB-CB 3.56Å; K464-A474 HydrophobicContact CD-CB 4.22Å; K464-A474 VanDerWaalsContact CD-O 3.31Å; K464-A474 WeakPolarHBondContact CD-O 3.4Å; Y466-A474 CarbonylContact O-C 3.54Å; Y466-A474 WeakPolarHBondContact O-CA 3.46Å; E467-A474 HydrophobicContact CB-CB 4.49Å; G472-A474 PolarHBondContact O-N 3.13Å
475	F	88.1	Confident	87	Confident	46 Å²	46	71.7 Å²	71.7	20%	0.202	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	151.4	-177.9	-60.4	-88.4	0	0	0	111.8	K464 Y466 C468 K473 Q477 L481 H484	K464-F475 CarbonylContact C-O 3.57Å; K464-F475 WeakPolarHBondContact CA-O 3.48Å; Y466-F475 PolarHBondContact N-O 3.38Å; Y466-F475 PolarHBondContact O-N 3.13Å; C468-F475 HydrophobicContact CB-CE2 4.44Å; K473-F475 HydrophobicContact CB-CE2 3.95Å; K473-F475 HydrophobicContact CB-CZ 4.08Å; K473-F475 WeakPolarHBondContact O-CD2 3.34Å; K473-F475 VanDerWaalsContact O-CE2 3.24Å; K473-F475 WeakPolarHBondContact O-CE2 3.4Å; F475-Q477 VanDerWaalsContact C-N 3.31Å; F475-Q477 PolarHBondContact O-N 3.46Å; F475-L481 HydrophobicContact CB-CB 4.38Å; F475-L481 HydrophobicContact CD2-CB 3.94Å; F475-L481 HydrophobicContact CD2-CD1 3.92Å; F475-L481 HydrophobicContact CE2-CD1 4.13Å; F475-L481 HydrophobicContact CG-CB 4.38Å; F475-H484 HydrophobicContact CE1-CB 3.99Å; F475-H484 HydrophobicContact CE2-CB 3.73Å; F475-H484 AromaticContact CE2-CD2 3.31Å; F475-H484 WeakPolarHBondContact CE2-CD2 3.28Å; F475-H484 AromaticContact CE2-CG 3.58Å; F475-H484 HydrophobicContact CZ-CB 3.36Å; F475-H484 AromaticContact CZ-CD2 3.4Å; F475-H484 VanDerWaalsContact CZ-CD2 3.4Å; F475-H484 WeakPolarHBondContact CZ-CD2 3.28Å; F475-H484 AromaticContact CZ-CG 3.21Å; F475-H484 AromaticContact CZ-ND1 3.81Å
476	L	85.3	Confident	86.9	Confident	45 Å²	45	71.1 Å²	71.1	24%	0.236	35%	0.351	C	S	.	.	S	Bend	trans	-70.8	-27.5	179.4	-165.5	66.9	0	0	0	113.1	R458 E463 Y466	R458-L476 HydrophobicContact CB-CD1 3.31Å; R458-L476 HydrophobicContact CB-CG 4.31Å; R458-L476 HydrophobicContact CG-CD1 4.42Å; E463-L476 WeakPolarHBondContact O-CD1 3.34Å; Y466-L476 WeakPolarHBondContact CE2-O 3.41Å
477	Q	84.9	Confident	86.7	Confident	45 Å²	45	71.1 Å²	71.1	21%	0.21	36%	0.359	C	S	.	.	S	Bend	trans	-138	145	-174.7	-50.6	-174.9	22.6	0	0	111.4	M455 Y466 F475 H479 Y480 L481	M455-Q477 HydrophobicContact CG-CG 4.45Å; M455-Q477 HydrophobicContact SD-CG 4.44Å; M455-Q477 PolarHBondContact SD-NE2 3.29Å; Y466-Q477 VanDerWaalsContact CD2-CA 3.46Å; F475-Q477 VanDerWaalsContact C-N 3.31Å; F475-Q477 PolarHBondContact O-N 3.46Å; Q477-H479 VanDerWaalsContact C-N 3.28Å; Q477-H479 PolarHBondContact O-N 3.47Å; Q477-H479 PolarHBondContact OE1-CE1 3.4Å; Q477-H479 PolarHBondContact OE1-ND1 3.47Å; Q477-H479 VanDerWaalsContact OE1-ND1 3.09Å; Q477-Y480 HydrophobicContact CB-CD2 3.77Å; Q477-Y480 HydrophobicContact CB-CE2 4.26Å; Q477-Y480 HydrophobicContact CG-CD2 4.09Å; Q477-Y480 HydrophobicContact CG-CE2 4.16Å; Q477-Y480 PolarHBondContact O-N 3.47Å; Q477-Y480 VanDerWaalsContact O-N 3.14Å; Q477-L481 PolarHBondContact O-N 3.14Å
478	S	86.3	Confident	86.4	Confident	65 Å²	65	69 Å²	69	46%	0.455	35%	0.349	S	S	.	.	H	α-helix	trans	-60.1	-34.8	-178	58.3	0	0	0	0	113.7	Y466 Y480 L481 R482	Y466-S478 VanDerWaalsContact CD2-N 3.31Å; S478-Y480 VanDerWaalsContact C-N 3.3Å; S478-Y480 PolarHBondContact O-N 3.35Å; S478-L481 PolarHBondContact O-N 2.92Å; S478-R482 PolarHBondContact O-N 2.77Å
479	H	83.6	Confident	86	Confident	63 Å²	63	72.8 Å²	72.8	29%	0.292	37%	0.372	S	S	.	.	H	α-helix	trans	-67.7	-33.3	-179.6	81.7	-93.7	0	0	0	111.7	Q477 M483	Q477-H479 VanDerWaalsContact C-N 3.28Å; Q477-H479 PolarHBondContact O-N 3.47Å; Q477-H479 PolarHBondContact OE1-CE1 3.4Å; Q477-H479 PolarHBondContact OE1-ND1 3.47Å; Q477-H479 VanDerWaalsContact OE1-ND1 3.09Å; H479-M483 WeakPolarHBondContact O-CB 3.35Å; H479-M483 WeakPolarHBondContact O-CG 3.36Å; H479-M483 PolarHBondContact O-N 3.27Å
480	Y	84.9	Confident	85.6	Confident	120 Å²	120	67.8 Å²	67.8	47%	0.471	36%	0.357	S	S	.	.	H	α-helix	trans	-69.3	-39.5	174.3	-69.3	-55.2	0	0	0	111.5	Q477 S478 M483 H484	Q477-Y480 HydrophobicContact CB-CD2 3.77Å; Q477-Y480 HydrophobicContact CB-CE2 4.26Å; Q477-Y480 HydrophobicContact CG-CD2 4.09Å; Q477-Y480 HydrophobicContact CG-CE2 4.16Å; Q477-Y480 PolarHBondContact O-N 3.47Å; Q477-Y480 VanDerWaalsContact O-N 3.14Å; S478-Y480 VanDerWaalsContact C-N 3.3Å; S478-Y480 PolarHBondContact O-N 3.35Å; Y480-M483 PolarHBondContact O-N 2.93Å; Y480-H484 VanDerWaalsContact O-CB 3.32Å; Y480-H484 WeakPolarHBondContact O-CB 3.39Å; Y480-H484 PolarHBondContact O-N 3.23Å
481	L	88.7	Confident	85.4	Confident	22 Å²	22	67.2 Å²	67.2	12%	0.115	35%	0.354	C	S	.	.	H	α-helix	trans	-58.9	-53.6	171.8	171.4	61.5	0	0	0	110.9	E467 C468 F475 Q477 S478 M483 H484 E485	E467-L481 WeakPolarHBondContact O-CD2 3.41Å; C468-L481 HydrophobicContact CB-CD1 3.58Å; F475-L481 HydrophobicContact CB-CB 4.38Å; F475-L481 HydrophobicContact CD2-CB 3.94Å; F475-L481 HydrophobicContact CD2-CD1 3.92Å; F475-L481 HydrophobicContact CE2-CD1 4.13Å; F475-L481 HydrophobicContact CG-CB 4.38Å; Q477-L481 PolarHBondContact O-N 3.14Å; S478-L481 PolarHBondContact O-N 2.92Å; L481-M483 PolarHBondContact O-N 3.38Å; L481-H484 CarbonylContact O-C 3.59Å; L481-H484 WeakPolarHBondContact O-CA 3.19Å; L481-H484 WeakPolarHBondContact O-CB 3.33Å; L481-H484 PolarHBondContact O-N 2.93Å; L481-E485 HydrophobicContact CD1-CG 4.09Å; L481-E485 HydrophobicContact CG-CG 4.44Å; L481-E485 WeakPolarHBondContact O-CG 3.25Å; L481-E485 PolarHBondContact O-N 2.95Å
482	R	84.8	Confident	85.3	Confident	155 Å²	155	70.5 Å²	70.5	59%	0.585	36%	0.362	S	S	*	.	H	α-helix	trans	-56.8	-36.2	178.6	-173.2	179.8	66.3	-174.4	0.7	112.8	S478 E485	S478-R482 PolarHBondContact O-N 2.77Å; R482-E485 WeakPolarHBondContact CA-OE2 3.28Å
483	M	82.3	Confident	85.3	Confident	48 Å²	48	71.8 Å²	71.8	24%	0.236	36%	0.363	C	S	.	.	H	α-helix	trans	-72.4	-37.4	176.1	-72.9	175.5	79.4	0	0	112.3	H479 Y480 L481 R486 H505	H479-M483 WeakPolarHBondContact O-CB 3.35Å; H479-M483 WeakPolarHBondContact O-CG 3.36Å; H479-M483 PolarHBondContact O-N 3.27Å; Y480-M483 PolarHBondContact O-N 2.93Å; L481-M483 PolarHBondContact O-N 3.38Å; M483-R486 WeakPolarHBondContact O-CB 3.32Å; M483-R486 PolarHBondContact O-N 3.03Å; M483-H505 WeakPolarHBondContact CE-CE1 3.37Å; M483-H505 WeakPolarHBondContact CE-ND1 3.11Å
484	H	87	Confident	85.3	Confident	27 Å²	27	69.3 Å²	69.3	13%	0.125	35%	0.351	C	S	.	.	H	α-helix	trans	-67	-38.7	174.8	171.2	63.2	0	0	0	112	C471 F475 Y480 L481 R486 T487 H488	C471-H484 PolarHBondContact SG-NE2 2.8Å; F475-H484 HydrophobicContact CE1-CB 3.99Å; F475-H484 HydrophobicContact CE2-CB 3.73Å; F475-H484 AromaticContact CE2-CD2 3.31Å; F475-H484 WeakPolarHBondContact CE2-CD2 3.28Å; F475-H484 AromaticContact CE2-CG 3.58Å; F475-H484 HydrophobicContact CZ-CB 3.36Å; F475-H484 AromaticContact CZ-CD2 3.4Å; F475-H484 VanDerWaalsContact CZ-CD2 3.4Å; F475-H484 WeakPolarHBondContact CZ-CD2 3.28Å; F475-H484 AromaticContact CZ-CG 3.21Å; F475-H484 AromaticContact CZ-ND1 3.81Å; Y480-H484 VanDerWaalsContact O-CB 3.32Å; Y480-H484 WeakPolarHBondContact O-CB 3.39Å; Y480-H484 PolarHBondContact O-N 3.23Å; L481-H484 CarbonylContact O-C 3.59Å; L481-H484 WeakPolarHBondContact O-CA 3.19Å; L481-H484 WeakPolarHBondContact O-CB 3.33Å; L481-H484 PolarHBondContact O-N 2.93Å; H484-R486 PolarHBondContact O-N 3.16Å; H484-R486 VanDerWaalsContact O-N 3.13Å; H484-T487 PolarHBondContact ND1-OG1 3.13Å; H484-T487 WeakPolarHBondContact O-CA 3.23Å; H484-T487 VanDerWaalsContact O-CB 3.3Å; H484-T487 WeakPolarHBondContact O-CB 3.47Å; H484-T487 PolarHBondContact O-N 3.28Å; H484-T487 PolarHBondContact O-OG1 3.29Å; H484-H488 AromaticContact CE1-NE2 3.72Å; H484-H488 AromaticContact NE2-NE2 3.28Å; H484-H488 PolarHBondContact NE2-NE2 3.23Å
485	E	85.9	Confident	85.2	Confident	70 Å²	70	73 Å²	73	33%	0.327	36%	0.361	S	S	.	.	H	α-helix	trans	-55.8	-32.4	176.7	-73.3	172.4	154	0	0	112.6	L481 R482 T487 H488 T489	L481-E485 HydrophobicContact CD1-CG 4.09Å; L481-E485 HydrophobicContact CG-CG 4.44Å; L481-E485 WeakPolarHBondContact O-CG 3.25Å; L481-E485 PolarHBondContact O-N 2.95Å; R482-E485 WeakPolarHBondContact CA-OE2 3.28Å; E485-T487 PolarHBondContact O-N 2.81Å; E485-H488 WeakPolarHBondContact O-CB 3.42Å; E485-H488 PolarHBondContact O-N 3.32Å; E485-T489 PolarHBondContact O-N 3.24Å
486	R	85.4	Confident	85.3	Confident	56 Å²	56	70.8 Å²	70.8	21%	0.211	35%	0.352	C	S	.	.	H	α-helix	trans	-63.7	-21	173.9	-64.5	176	179.1	-179	-5	114.1	M483 H484 H488 T489 G490 E491 L504	M483-R486 WeakPolarHBondContact O-CB 3.32Å; M483-R486 PolarHBondContact O-N 3.03Å; H484-R486 PolarHBondContact O-N 3.16Å; H484-R486 VanDerWaalsContact O-N 3.13Å; R486-H488 VanDerWaalsContact C-N 3.27Å; R486-T489 WeakPolarHBondContact CA-OG1 3.28Å; R486-T489 PolarHBondContact O-OG1 3.12Å; R486-G490 PolarHBondContact O-N 3.33Å; R486-E491 PolarHBondContact O-N 3.09Å; R486-L504 HydrophobicContact CB-CD1 3.41Å; R486-L504 VanDerWaalsContact CB-CD1 3.41Å; R486-L504 HydrophobicContact CG-CD1 4.46Å
487	T	84.4	Confident	85.3	Confident	74 Å²	74	76 Å²	76	45%	0.454	38%	0.38	S	S	.	.	H	α-helix	trans	-71.5	-25.5	173.9	67.5	0	0	0	0	112.3	H484 E485 L504	H484-T487 PolarHBondContact ND1-OG1 3.13Å; H484-T487 WeakPolarHBondContact O-CA 3.23Å; H484-T487 VanDerWaalsContact O-CB 3.3Å; H484-T487 WeakPolarHBondContact O-CB 3.47Å; H484-T487 PolarHBondContact O-N 3.28Å; H484-T487 PolarHBondContact O-OG1 3.29Å; E485-T487 PolarHBondContact O-N 2.81Å; T487-L504 HydrophobicContact CG2-CD2 3.62Å
488	H	84.9	Confident	85.3	Confident	71 Å²	71	80.4 Å²	80.4	33%	0.329	40%	0.401	S	S	.	.	H	α-helix	trans	-82.3	-40.3	175.5	-62.6	-61.5	0	0	0	112.2	C468 Q470 C471 H484 E485 R486 G490	C468-H488 PolarHBondContact SG-NE2 3.02Å; Q470-H488 VanDerWaalsContact OE1-CG 3.25Å; C471-H488 PolarHBondContact SG-NE2 3.28Å; C471-H488 VanDerWaalsContact SG-NE2 3.45Å; H484-H488 AromaticContact CE1-NE2 3.72Å; H484-H488 AromaticContact NE2-NE2 3.28Å; H484-H488 PolarHBondContact NE2-NE2 3.23Å; E485-H488 WeakPolarHBondContact O-CB 3.42Å; E485-H488 PolarHBondContact O-N 3.32Å; R486-H488 VanDerWaalsContact C-N 3.27Å; H488-G490 VanDerWaalsContact C-N 3.26Å; H488-G490 PolarHBondContact O-N 2.84Å
489	T	82.3	Confident	85.4	Confident	80 Å²	80	79.9 Å²	79.9	49%	0.491	40%	0.396	S	S	.	.	H	α-helix	trans	-76.4	-16.7	178.1	62.2	0	0	0	0	112.9	E485 R486 E491	E485-T489 PolarHBondContact O-N 3.24Å; R486-T489 WeakPolarHBondContact CA-OG1 3.28Å; R486-T489 PolarHBondContact O-OG1 3.12Å; T489-E491 PolarHBondContact O-N 3.22Å; T489-E491 WeakPolarHBondContact OG1-CB 3.34Å; T489-E491 WeakPolarHBondContact OG1-CG 3.43Å; T489-E491 PolarHBondContact OG1-N 2.95Å
490	G	80.6	Confident	85.4	Confident	49 Å²	49	78.9 Å²	78.9	51%	0.505	40%	0.403	S	S	.	.			trans	71.5	5.2	-174.2	0	0	0	0	0	113.7	R486 H488 K492	R486-G490 PolarHBondContact O-N 3.33Å; H488-G490 VanDerWaalsContact C-N 3.26Å; H488-G490 PolarHBondContact O-N 2.84Å; G490-K492 PolarHBondContact O-N 2.84Å
491	E	82.2	Confident	85.5	Confident	116 Å²	116	78.8 Å²	78.8	54%	0.542	41%	0.405	S	S	.	.			trans	-62.1	121	179.1	-75.6	-179.1	-178.4	0	0	110.9	R486 T489 P493 L504	R486-E491 PolarHBondContact O-N 3.09Å; T489-E491 PolarHBondContact O-N 3.22Å; T489-E491 WeakPolarHBondContact OG1-CB 3.34Å; T489-E491 WeakPolarHBondContact OG1-CG 3.43Å; T489-E491 PolarHBondContact OG1-N 2.95Å; E491-P493 WeakPolarHBondContact O-CD 3.39Å; E491-L504 VanDerWaalsContact O-CD1 3.25Å; E491-L504 WeakPolarHBondContact O-CD1 3.41Å
492	K	86.1	Confident	85.5	Confident	124 Å²	124	79.5 Å²	79.5	54%	0.539	41%	0.414	S	S	.	.			trans	-120.8	85.1	175.8	-67.2	-179.8	-167.2	172.1	0	109.3	G490 Y494 A502 F503	G490-K492 PolarHBondContact O-N 2.84Å; K492-Y494 PolarHBondContact O-N 3.26Å; K492-Y494 VanDerWaalsContact O-N 3.09Å; K492-A502 HydrophobicContact CB-CB 3.56Å; K492-A502 HydrophobicContact CD-CB 4.29Å; K492-A502 VanDerWaalsContact CD-O 3.31Å; K492-A502 WeakPolarHBondContact CD-O 3.38Å; K492-F503 CarbonylContact C-O 3.53Å; K492-F503 WeakPolarHBondContact CA-O 3.46Å
493	P	85.3	Confident	85.6	Confident	68 Å²	68	74.2 Å²	74.2	44%	0.442	40%	0.396	S	S	.	.			trans	-69.5	-9.6	-169.6	-20.7	33.7	0	0	0	115	E491	E491-P493 WeakPolarHBondContact O-CD 3.39Å
494	Y	87.8	Confident	85.5	Confident	74 Å²	74	73.5 Å²	73.5	29%	0.29	39%	0.393	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	93.9	-171.3	-56.5	-71.5	0	0	0	110	K492 A502 F503 L504 H505 L506	K492-Y494 PolarHBondContact O-N 3.26Å; K492-Y494 VanDerWaalsContact O-N 3.09Å; Y494-A502 CarbonylContact O-C 3.53Å; Y494-A502 WeakPolarHBondContact O-CA 3.44Å; Y494-F503 PolarHBondContact N-O 3.46Å; Y494-F503 PolarHBondContact O-N 2.87Å; Y494-L504 WeakPolarHBondContact CE2-O 3.39Å; Y494-H505 VanDerWaalsContact CD2-C 3.5Å; Y494-L506 HydrophobicContact CD1-CB 3.96Å; Y494-L506 HydrophobicContact CD1-CD1 3.83Å; Y494-L506 HydrophobicContact CD1-CG 4.46Å; Y494-L506 HydrophobicContact CD2-CB 4.47Å; Y494-L506 HydrophobicContact CE1-CB 3.82Å; Y494-L506 HydrophobicContact CE1-CD1 4.18Å; Y494-L506 HydrophobicContact CE1-CG 4.43Å; Y494-L506 HydrophobicContact CE2-CB 4.32Å; Y494-L506 HydrophobicContact CG-CB 4.28Å
495	E	87.9	Confident	85.2	Confident	114 Å²	114	74.2 Å²	74.2	53%	0.533	40%	0.396	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.3	138.5	179.7	-167.3	174.9	167.4	0	0	112.2	G500	E495-G500 WeakPolarHBondContact OE1-CA 3.39Å
496	C	90.5	Very high	85.1	Confident	0 Å²	0	74.3 Å²	74.3	0%	0	40%	0.398	C	S	.	.			trans	-82.6	112.9	171.1	-179.2	0	0	0	0	110.5	Q498 C499 G500 K501 F503 L509 H512 H516	C496-Q498 PolarHBondContact O-N 3.24Å; C496-C499 PolarHBondContact O-N 2.91Å; C496-G500 WeakPolarHBondContact O-CA 3.4Å; C496-G500 PolarHBondContact O-N 3.26Å; C496-K501 WeakPolarHBondContact CB-O 3.45Å; C496-K501 PolarHBondContact N-O 3.1Å; C496-F503 HydrophobicContact CB-CE2 4.35Å; C496-L509 HydrophobicContact CB-CD1 3.54Å; C496-H512 VanDerWaalsContact SG-CD2 3.58Å; C496-H512 PolarHBondContact SG-NE2 3.12Å; C496-H516 PolarHBondContact SG-NE2 2.82Å; C496-H516 VanDerWaalsContact SG-NE2 3.37Å
497	N	86.1	Confident	85	Confident	154 Å²	154	74.8 Å²	74.8	82%	0.824	41%	0.41	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.3	-22.2	179.8	-63.1	-21.8	0	0	0	114
498	Q	85.5	Confident	85	Confident	139 Å²	139	77 Å²	77	65%	0.65	41%	0.411	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.4	-24.3	-176.6	-62	-175.3	12.7	0	0	114.2	C496 H516	C496-Q498 PolarHBondContact O-N 3.24Å; Q498-H516 PolarHBondContact OE1-CD2 3.39Å
499	C	88.1	Confident	85.1	Confident	53 Å²	53	74.2 Å²	74.2	36%	0.358	40%	0.399	S	S	.	.	T	Hydrogen-bonded Turn	trans	-140	8.5	-178.1	73.5	0	0	0	0	115	C496 K501 H512 H516	C496-C499 PolarHBondContact O-N 2.91Å; C499-K501 PolarHBondContact O-N 3.12Å; C499-H512 VanDerWaalsContact SG-CE1 3.57Å; C499-H512 PolarHBondContact SG-NE2 3.07Å; C499-H516 PolarHBondContact SG-NE2 2.99Å
500	G	83.9	Confident	85.2	Confident	43 Å²	43	77.8 Å²	77.8	44%	0.443	40%	0.403	S	S	.	.			trans	66	2.7	179.3	0	0	0	0	0	114.9	E495 C496 A502	E495-G500 WeakPolarHBondContact OE1-CA 3.39Å; C496-G500 WeakPolarHBondContact O-CA 3.4Å; C496-G500 PolarHBondContact O-N 3.26Å; G500-A502 PolarHBondContact O-N 3.44Å
501	K	86.6	Confident	85.3	Confident	117 Å²	117	78.2 Å²	78.2	51%	0.509	39%	0.393	S	S	.	.			trans	-72.8	119.8	179.9	-74.2	-175.9	177.9	178.6	0	110	C496 C499 F503	C496-K501 WeakPolarHBondContact CB-O 3.45Å; C496-K501 PolarHBondContact N-O 3.1Å; C499-K501 PolarHBondContact O-N 3.12Å; K501-F503 HydrophobicContact CB-CE2 3.95Å; K501-F503 HydrophobicContact CB-CZ 4.05Å; K501-F503 WeakPolarHBondContact O-CD2 3.4Å; K501-F503 WeakPolarHBondContact O-CE2 3.41Å
502	A	88.5	Confident	85.5	Confident	37 Å²	37	73.4 Å²	73.4	31%	0.306	37%	0.37	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.2	142.8	175.9	0	0	0	0	0	112.3	K492 Y494 G500	K492-A502 HydrophobicContact CB-CB 3.56Å; K492-A502 HydrophobicContact CD-CB 4.29Å; K492-A502 VanDerWaalsContact CD-O 3.31Å; K492-A502 WeakPolarHBondContact CD-O 3.38Å; Y494-A502 CarbonylContact O-C 3.53Å; Y494-A502 WeakPolarHBondContact O-CA 3.44Å; G500-A502 PolarHBondContact O-N 3.44Å
503	F	85.6	Confident	85.4	Confident	44 Å²	44	70.9 Å²	70.9	19%	0.193	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	151	-179	-62.4	-85.1	0	0	0	111.4	K492 Y494 C496 K501 H505 L509 H512	K492-F503 CarbonylContact C-O 3.53Å; K492-F503 WeakPolarHBondContact CA-O 3.46Å; Y494-F503 PolarHBondContact N-O 3.46Å; Y494-F503 PolarHBondContact O-N 2.87Å; C496-F503 HydrophobicContact CB-CE2 4.35Å; K501-F503 HydrophobicContact CB-CE2 3.95Å; K501-F503 HydrophobicContact CB-CZ 4.05Å; K501-F503 WeakPolarHBondContact O-CD2 3.4Å; K501-F503 WeakPolarHBondContact O-CE2 3.41Å; F503-H505 VanDerWaalsContact C-N 3.34Å; F503-L509 HydrophobicContact CB-CB 4.37Å; F503-L509 HydrophobicContact CD2-CB 4.01Å; F503-L509 HydrophobicContact CD2-CD1 3.89Å; F503-L509 HydrophobicContact CE2-CD1 4.17Å; F503-L509 HydrophobicContact CG-CB 4.41Å; F503-H512 HydrophobicContact CE1-CB 4.13Å; F503-H512 HydrophobicContact CE2-CB 3.81Å; F503-H512 AromaticContact CE2-CD2 3.58Å; F503-H512 AromaticContact CE2-CG 3.5Å; F503-H512 VanDerWaalsContact CE2-CG 3.5Å; F503-H512 AromaticContact CE2-ND1 3.85Å; F503-H512 AromaticContact CE2-NE2 3.93Å; F503-H512 HydrophobicContact CZ-CB 3.57Å; F503-H512 AromaticContact CZ-CD2 3.81Å; F503-H512 AromaticContact CZ-CE1 3.66Å; F503-H512 AromaticContact CZ-CG 3.28Å; F503-H512 AromaticContact CZ-ND1 3.24Å; F503-H512 WeakPolarHBondContact CZ-ND1 3.36Å
504	L	82.1	Confident	85.4	Confident	34 Å²	34	70.7 Å²	70.7	18%	0.178	35%	0.351	C	S	.	.	S	Bend	trans	-73.3	-28.1	176	-168.6	69.1	0	0	0	112.5	R486 T487 E491 Y494	R486-L504 HydrophobicContact CB-CD1 3.41Å; R486-L504 VanDerWaalsContact CB-CD1 3.41Å; R486-L504 HydrophobicContact CG-CD1 4.46Å; T487-L504 HydrophobicContact CG2-CD2 3.62Å; E491-L504 VanDerWaalsContact O-CD1 3.25Å; E491-L504 WeakPolarHBondContact O-CD1 3.41Å; Y494-L504 WeakPolarHBondContact CE2-O 3.39Å
505	H	79.9	Confident	85.1	Confident	42 Å²	42	73.7 Å²	73.7	19%	0.194	36%	0.362	C	S	.	.			trans	-125.1	137.8	-174.4	-59.2	-95.9	0	0	0	111.6	M483 Y494 F503 S507 Y508 L509	M483-H505 WeakPolarHBondContact CE-CE1 3.37Å; M483-H505 WeakPolarHBondContact CE-ND1 3.11Å; Y494-H505 VanDerWaalsContact CD2-C 3.5Å; F503-H505 VanDerWaalsContact C-N 3.34Å; H505-S507 VanDerWaalsContact C-N 3.28Å; H505-S507 PolarHBondContact O-N 2.8Å; H505-Y508 HydrophobicContact CB-CD1 4.38Å; H505-Y508 HydrophobicContact CB-CD2 3.78Å; H505-Y508 HydrophobicContact CB-CE2 4.26Å; H505-Y508 HydrophobicContact CB-CG 3.85Å; H505-Y508 AromaticContact CD2-CD2 3.39Å; H505-Y508 WeakPolarHBondContact CD2-CD2 3.18Å; H505-Y508 AromaticContact CD2-CE2 3.18Å; H505-Y508 WeakPolarHBondContact CD2-CE2 3.49Å; H505-Y508 AromaticContact CD2-CZ 3.98Å; H505-Y508 AromaticContact CG-CD2 3.88Å; H505-Y508 AromaticContact CG-CE2 3.89Å; H505-Y508 AromaticContact NE2-CE2 3.85Å; H505-Y508 PolarHBondContact O-N 3.36Å; H505-Y508 VanDerWaalsContact O-N 3.1Å; H505-L509 PolarHBondContact O-N 2.96Å
506	L	83.4	Confident	84.8	Confident	72 Å²	72	71.4 Å²	71.4	38%	0.377	35%	0.351	S	S	.	.	H	α-helix	trans	-61.5	-35.5	173.4	-177.2	61.9	0	0	0	112.5	Y494 Y508 L509 R510	Y494-L506 HydrophobicContact CD1-CB 3.96Å; Y494-L506 HydrophobicContact CD1-CD1 3.83Å; Y494-L506 HydrophobicContact CD1-CG 4.46Å; Y494-L506 HydrophobicContact CD2-CB 4.47Å; Y494-L506 HydrophobicContact CE1-CB 3.82Å; Y494-L506 HydrophobicContact CE1-CD1 4.18Å; Y494-L506 HydrophobicContact CE1-CG 4.43Å; Y494-L506 HydrophobicContact CE2-CB 4.32Å; Y494-L506 HydrophobicContact CG-CB 4.28Å; L506-Y508 VanDerWaalsContact C-N 3.27Å; L506-Y508 PolarHBondContact O-N 3.36Å; L506-L509 HydrophobicContact CD1-CD2 4.27Å; L506-L509 PolarHBondContact O-N 3.49Å; L506-R510 WeakPolarHBondContact O-CG 3.49Å; L506-R510 PolarHBondContact O-N 2.78Å
507	S	83.4	Confident	84.3	Confident	66 Å²	66	74.6 Å²	74.6	46%	0.462	37%	0.373	S	S	.	.	H	α-helix	trans	-62.3	-36.7	175.1	51.2	0	0	0	0	112	H505 M511	H505-S507 VanDerWaalsContact C-N 3.28Å; H505-S507 PolarHBondContact O-N 2.8Å; S507-M511 WeakPolarHBondContact O-CB 3.34Å; S507-M511 VanDerWaalsContact O-CG 3.31Å; S507-M511 WeakPolarHBondContact O-CG 3.42Å; S507-M511 PolarHBondContact O-N 3.36Å
508	Y	83.7	Confident	83.9	Confident	119 Å²	119	69.6 Å²	69.6	47%	0.467	36%	0.358	S	S	.	.	H	α-helix	trans	-72.7	-38.8	177.3	-64.5	-11	0	0	0	111.8	H505 L506 M511 H512	H505-Y508 HydrophobicContact CB-CD1 4.38Å; H505-Y508 HydrophobicContact CB-CD2 3.78Å; H505-Y508 HydrophobicContact CB-CE2 4.26Å; H505-Y508 HydrophobicContact CB-CG 3.85Å; H505-Y508 AromaticContact CD2-CD2 3.39Å; H505-Y508 WeakPolarHBondContact CD2-CD2 3.18Å; H505-Y508 AromaticContact CD2-CE2 3.18Å; H505-Y508 WeakPolarHBondContact CD2-CE2 3.49Å; H505-Y508 AromaticContact CD2-CZ 3.98Å; H505-Y508 AromaticContact CG-CD2 3.88Å; H505-Y508 AromaticContact CG-CE2 3.89Å; H505-Y508 AromaticContact NE2-CE2 3.85Å; H505-Y508 PolarHBondContact O-N 3.36Å; H505-Y508 VanDerWaalsContact O-N 3.1Å; L506-Y508 VanDerWaalsContact C-N 3.27Å; L506-Y508 PolarHBondContact O-N 3.36Å; Y508-M511 HydrophobicContact CD1-CE 3.6Å; Y508-M511 HydrophobicContact CE1-CE 4.13Å; Y508-M511 PolarHBondContact O-N 3.23Å; Y508-H512 WeakPolarHBondContact O-CB 3.48Å; Y508-H512 PolarHBondContact O-N 3.23Å
509	L	87.6	Confident	83.7	Confident	13 Å²	13	68.9 Å²	68.9	7%	0.068	36%	0.355	C	S	.	.	H	α-helix	trans	-58.4	-51.9	169.8	173.4	60.6	0	0	0	110.8	C496 F503 H505 L506 M511 H512 E513	C496-L509 HydrophobicContact CB-CD1 3.54Å; F503-L509 HydrophobicContact CB-CB 4.37Å; F503-L509 HydrophobicContact CD2-CB 4.01Å; F503-L509 HydrophobicContact CD2-CD1 3.89Å; F503-L509 HydrophobicContact CE2-CD1 4.17Å; F503-L509 HydrophobicContact CG-CB 4.41Å; H505-L509 PolarHBondContact O-N 2.96Å; L506-L509 HydrophobicContact CD1-CD2 4.27Å; L506-L509 PolarHBondContact O-N 3.49Å; L509-M511 VanDerWaalsContact C-N 3.3Å; L509-M511 PolarHBondContact O-N 2.86Å; L509-H512 CarbonylContact O-C 3.4Å; L509-H512 WeakPolarHBondContact O-CA 3.44Å; L509-H512 WeakPolarHBondContact O-CB 3.28Å; L509-H512 PolarHBondContact O-N 3.08Å; L509-E513 HydrophobicContact CD1-CG 4.01Å; L509-E513 HydrophobicContact CG-CG 4.39Å; L509-E513 WeakPolarHBondContact O-CG 3.43Å; L509-E513 PolarHBondContact O-N 2.98Å
510	R	84.4	Confident	83.5	Confident	155 Å²	155	72.2 Å²	72.2	59%	0.585	36%	0.363	S	S	*	.	H	α-helix	trans	-57.6	-41	177.9	-73.9	-179.7	-179.3	-174.2	-1	113	L506	L506-R510 WeakPolarHBondContact O-CG 3.49Å; L506-R510 PolarHBondContact O-N 2.78Å
511	M	82.3	Confident	83.5	Confident	59 Å²	59	73.6 Å²	73.6	29%	0.291	36%	0.364	S	S	.	.	H	α-helix	trans	-67.4	-39	175.1	-77.7	-166.9	-36.5	0	0	112.2	S507 Y508 L509 R514 Y533	S507-M511 WeakPolarHBondContact O-CB 3.34Å; S507-M511 VanDerWaalsContact O-CG 3.31Å; S507-M511 WeakPolarHBondContact O-CG 3.42Å; S507-M511 PolarHBondContact O-N 3.36Å; Y508-M511 HydrophobicContact CD1-CE 3.6Å; Y508-M511 HydrophobicContact CE1-CE 4.13Å; Y508-M511 PolarHBondContact O-N 3.23Å; L509-M511 VanDerWaalsContact C-N 3.3Å; L509-M511 PolarHBondContact O-N 2.86Å; M511-R514 WeakPolarHBondContact O-CB 3.35Å; M511-R514 PolarHBondContact O-N 2.98Å; M511-Y533 HydrophobicContact CB-CE1 3.99Å; M511-Y533 HydrophobicContact CE-CE1 4.05Å; M511-Y533 HydrophobicContact CG-CE1 4.21Å; M511-Y533 HydrophobicContact SD-CD1 3.8Å; M511-Y533 HydrophobicContact SD-CE1 3.75Å
512	H	86.6	Confident	83.6	Confident	15 Å²	15	71.2 Å²	71.2	7%	0.069	35%	0.352	C	S	.	.	H	α-helix	trans	-65.5	-41	177.2	167.2	92.1	0	0	0	111.9	C496 C499 F503 Y508 L509 R514 R515 H516	C496-H512 VanDerWaalsContact SG-CD2 3.58Å; C496-H512 PolarHBondContact SG-NE2 3.12Å; C499-H512 VanDerWaalsContact SG-CE1 3.57Å; C499-H512 PolarHBondContact SG-NE2 3.07Å; F503-H512 HydrophobicContact CE1-CB 4.13Å; F503-H512 HydrophobicContact CE2-CB 3.81Å; F503-H512 AromaticContact CE2-CD2 3.58Å; F503-H512 AromaticContact CE2-CG 3.5Å; F503-H512 VanDerWaalsContact CE2-CG 3.5Å; F503-H512 AromaticContact CE2-ND1 3.85Å; F503-H512 AromaticContact CE2-NE2 3.93Å; F503-H512 HydrophobicContact CZ-CB 3.57Å; F503-H512 AromaticContact CZ-CD2 3.81Å; F503-H512 AromaticContact CZ-CE1 3.66Å; F503-H512 AromaticContact CZ-CG 3.28Å; F503-H512 AromaticContact CZ-ND1 3.24Å; F503-H512 WeakPolarHBondContact CZ-ND1 3.36Å; Y508-H512 WeakPolarHBondContact O-CB 3.48Å; Y508-H512 PolarHBondContact O-N 3.23Å; L509-H512 CarbonylContact O-C 3.4Å; L509-H512 WeakPolarHBondContact O-CA 3.44Å; L509-H512 WeakPolarHBondContact O-CB 3.28Å; L509-H512 PolarHBondContact O-N 3.08Å; H512-R514 PolarHBondContact O-N 2.94Å; H512-R515 PolarHBondContact CE1-NH2 3.47Å; H512-R515 PolarHBondContact ND1-NH2 3.08Å; H512-R515 VanDerWaalsContact O-CB 3.24Å; H512-R515 WeakPolarHBondContact O-CB 3.26Å; H512-R515 PolarHBondContact O-N 2.82Å; H512-H516 AromaticContact CD2-NE2 3.64Å; H512-H516 AromaticContact CE1-NE2 3.85Å; H512-H516 AromaticContact NE2-CD2 3.97Å; H512-H516 AromaticContact NE2-CE1 3.81Å; H512-H516 AromaticContact NE2-NE2 3.04Å; H512-H516 PolarHBondContact NE2-NE2 3.28Å
513	E	84.9	Confident	83.5	Confident	70 Å²	70	75 Å²	75	33%	0.327	36%	0.364	S	S	.	.	H	α-helix	trans	-57.9	-32.3	177.5	-74.1	171.5	152.7	0	0	112.1	L509 R515 H516 S517	L509-E513 HydrophobicContact CD1-CG 4.01Å; L509-E513 HydrophobicContact CG-CG 4.39Å; L509-E513 WeakPolarHBondContact O-CG 3.43Å; L509-E513 PolarHBondContact O-N 2.98Å; E513-R515 PolarHBondContact O-N 3.12Å; E513-R515 VanDerWaalsContact O-N 3.17Å; E513-H516 PolarHBondContact O-N 3Å; E513-S517 PolarHBondContact O-N 3.09Å; E513-S517 VanDerWaalsContact O-N 3.12Å
514	R	84.3	Confident	83.8	Confident	64 Å²	64	72.9 Å²	72.9	24%	0.242	35%	0.354	C	S	.	.	H	α-helix	trans	-61.8	-23.2	174.6	-62.8	177.7	-178.3	158.4	2.1	113.8	M511 H512 H516 S517 G518 L532	M511-R514 WeakPolarHBondContact O-CB 3.35Å; M511-R514 PolarHBondContact O-N 2.98Å; H512-R514 PolarHBondContact O-N 2.94Å; R514-H516 VanDerWaalsContact C-N 3.28Å; R514-S517 WeakPolarHBondContact CA-OG 3.48Å; R514-S517 PolarHBondContact O-OG 3.22Å; R514-G518 PolarHBondContact O-N 2.77Å; R514-L532 HydrophobicContact CB-CD1 3.41Å; R514-L532 VanDerWaalsContact CB-CD1 3.41Å; R514-L532 HydrophobicContact CB-CG 4.38Å
515	R	81.2	Confident	84	Confident	138 Å²	138	78.5 Å²	78.5	52%	0.521	39%	0.385	S	S	.	.	H	α-helix	trans	-69.5	-30.8	174.4	-176.2	174	61.1	-174.3	1.5	111.7	H512 E513 L532	H512-R515 PolarHBondContact CE1-NH2 3.47Å; H512-R515 PolarHBondContact ND1-NH2 3.08Å; H512-R515 VanDerWaalsContact O-CB 3.24Å; H512-R515 WeakPolarHBondContact O-CB 3.26Å; H512-R515 PolarHBondContact O-N 2.82Å; E513-R515 PolarHBondContact O-N 3.12Å; E513-R515 VanDerWaalsContact O-N 3.17Å; R515-L532 HydrophobicContact CB-CD2 4.49Å
516	H	82.9	Confident	84.3	Confident	66 Å²	66	83 Å²	83	31%	0.306	41%	0.406	S	S	.	.	H	α-helix	trans	-82.9	-39.6	178.1	-53.9	-57.8	0	0	0	111.9	C496 Q498 C499 H512 E513 R514 G518	C496-H516 PolarHBondContact SG-NE2 2.82Å; C496-H516 VanDerWaalsContact SG-NE2 3.37Å; Q498-H516 PolarHBondContact OE1-CD2 3.39Å; C499-H516 PolarHBondContact SG-NE2 2.99Å; H512-H516 AromaticContact CD2-NE2 3.64Å; H512-H516 AromaticContact CE1-NE2 3.85Å; H512-H516 AromaticContact NE2-CD2 3.97Å; H512-H516 AromaticContact NE2-CE1 3.81Å; H512-H516 AromaticContact NE2-NE2 3.04Å; H512-H516 PolarHBondContact NE2-NE2 3.28Å; E513-H516 PolarHBondContact O-N 3Å; R514-H516 VanDerWaalsContact C-N 3.28Å; H516-G518 PolarHBondContact O-N 2.83Å
517	S	80.6	Confident	84.5	Confident	67 Å²	67	82.2 Å²	82.2	47%	0.469	41%	0.405	S	S	.	.	H	α-helix	trans	-70.9	-20.3	175.4	66.6	0	0	0	0	113	E513 R514 E519	E513-S517 PolarHBondContact O-N 3.09Å; E513-S517 VanDerWaalsContact O-N 3.12Å; R514-S517 WeakPolarHBondContact CA-OG 3.48Å; R514-S517 PolarHBondContact O-OG 3.22Å; S517-E519 PolarHBondContact O-N 3.01Å; S517-E519 WeakPolarHBondContact OG-CB 3.47Å; S517-E519 WeakPolarHBondContact OG-CG 3.46Å; S517-E519 PolarHBondContact OG-N 3.13Å
518	G	77.3	Confident	84.5	Confident	49 Å²	49	80.9 Å²	80.9	51%	0.505	40%	0.403	S	S	.	.			trans	71.3	2.7	-174.7	0	0	0	0	0	113.6	R514 H516 K520	R514-G518 PolarHBondContact O-N 2.77Å; H516-G518 PolarHBondContact O-N 2.83Å; G518-K520 PolarHBondContact O-N 3.39Å
519	E	80	Confident	84.7	Confident	124 Å²	124	81.3 Å²	81.3	58%	0.579	41%	0.407	S	S	*	.			trans	-62.1	126.8	178.7	-73.5	179.8	175.2	0	0	110.7	S517 P521 L532	S517-E519 PolarHBondContact O-N 3.01Å; S517-E519 WeakPolarHBondContact OG-CB 3.47Å; S517-E519 WeakPolarHBondContact OG-CG 3.46Å; S517-E519 PolarHBondContact OG-N 3.13Å; E519-P521 WeakPolarHBondContact O-CD 3.47Å; E519-L532 WeakPolarHBondContact O-CD1 3.44Å
520	K	84.9	Confident	84.7	Confident	123 Å²	123	82.5 Å²	82.5	54%	0.535	42%	0.419	S	S	.	.			trans	-120	83.8	175.7	-66.2	-176.2	-165.6	170.8	0	109.2	G518 Y522 A530 F531	G518-K520 PolarHBondContact O-N 3.39Å; K520-Y522 PolarHBondContact O-N 3.36Å; K520-Y522 VanDerWaalsContact O-N 3.13Å; K520-A530 HydrophobicContact CB-CB 3.6Å; K520-A530 HydrophobicContact CD-CB 4.35Å; K520-A530 VanDerWaalsContact CD-O 3.22Å; K520-A530 WeakPolarHBondContact CD-O 3.3Å; K520-F531 CarbonylContact C-O 3.28Å; K520-F531 WeakPolarHBondContact CA-O 3.39Å; K520-F531 WeakPolarHBondContact CB-O 3.45Å
521	P	84.1	Confident	84.8	Confident	72 Å²	72	77.1 Å²	77.1	47%	0.468	40%	0.4	S	S	.	.			trans	-70.6	-10.9	-169.3	-19.2	32.6	0	0	0	114.7	E519	E519-P521 WeakPolarHBondContact O-CD 3.47Å
522	Y	87.3	Confident	84.8	Confident	66 Å²	66	75.8 Å²	75.8	26%	0.259	39%	0.394	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	93	-170.9	-55.5	-78.8	0	0	0	109.5	K520 A530 F531 P534	K520-Y522 PolarHBondContact O-N 3.36Å; K520-Y522 VanDerWaalsContact O-N 3.13Å; Y522-A530 CarbonylContact O-C 3.56Å; Y522-A530 WeakPolarHBondContact O-CA 3.45Å; Y522-F531 WeakPolarHBondContact CD2-O 3.41Å; Y522-F531 PolarHBondContact N-O 3.09Å; Y522-F531 PolarHBondContact O-N 3.46Å; Y522-P534 HydrophobicContact CD1-CB 3.82Å; Y522-P534 HydrophobicContact CD1-CG 4.13Å; Y522-P534 HydrophobicContact CD2-CG 4.48Å; Y522-P534 HydrophobicContact CE1-CB 3.73Å; Y522-P534 HydrophobicContact CE1-CG 3.58Å; Y522-P534 VanDerWaalsContact CE2-CD 3.47Å; Y522-P534 HydrophobicContact CE2-CG 4Å; Y522-P534 HydrophobicContact CG-CB 4.29Å
523	E	87.6	Confident	84.6	Confident	116 Å²	116	77.8 Å²	77.8	54%	0.542	40%	0.401	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.3	138.4	179.4	-167.4	175.1	167.1	0	0	111.8	G528	E523-G528 WeakPolarHBondContact OE1-CA 3.49Å
524	C	90.6	Very high	84.6	Confident	0 Å²	0	77.4 Å²	77.4	0%	0	41%	0.405	C	S	.	.			trans	-80.8	116	171.4	-176.7	0	0	0	0	110.3	Q526 C527 G528 K529 F531 L537	C524-Q526 PolarHBondContact O-N 3.36Å; C524-C527 PolarHBondContact O-N 3.45Å; C524-G528 WeakPolarHBondContact O-CA 3.43Å; C524-G528 PolarHBondContact O-N 3.25Å; C524-K529 WeakPolarHBondContact CB-O 3.49Å; C524-K529 PolarHBondContact N-O 3.32Å; C524-F531 HydrophobicContact CB-CE2 4.32Å; C524-L537 VanDerWaalsContact CA-CD1 3.5Å; C524-L537 HydrophobicContact CB-CD1 3.58Å
525	N	86.8	Confident	84.5	Confident	152 Å²	152	77.9 Å²	77.9	81%	0.813	42%	0.418	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.9	-18.7	179.5	-63.3	-28.4	0	0	0	113.8
526	Q	85.4	Confident	84.7	Confident	138 Å²	138	76.8 Å²	76.8	65%	0.645	41%	0.414	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.3	-28.4	-176.7	-61	-173.5	12.8	0	0	114	C524	C524-Q526 PolarHBondContact O-N 3.36Å
527	C	87.6	Confident	84.9	Confident	54 Å²	54	74.7 Å²	74.7	37%	0.365	41%	0.405	S	S	.	.	T	Hydrogen-bonded Turn	trans	-136.5	5.5	-177.2	72	0	0	0	0	115	C524 K529 H540 H544	C524-C527 PolarHBondContact O-N 3.45Å; C527-K529 PolarHBondContact O-N 3.09Å; C527-K529 VanDerWaalsContact O-N 3.08Å; C527-H540 PolarHBondContact SG-NE2 3.47Å; C527-H544 PolarHBondContact SG-NE2 2.94Å; C527-H544 VanDerWaalsContact SG-NE2 3.36Å
528	G	84.5	Confident	85.1	Confident	39 Å²	39	79.6 Å²	79.6	40%	0.402	41%	0.413	S	S	.	.			trans	67.5	4	179.5	0	0	0	0	0	114.7	E523 C524 A530	E523-G528 WeakPolarHBondContact OE1-CA 3.49Å; C524-G528 WeakPolarHBondContact O-CA 3.43Å; C524-G528 PolarHBondContact O-N 3.25Å; G528-A530 PolarHBondContact O-N 2.93Å
529	K	87.5	Confident	85.3	Confident	127 Å²	127	80 Å²	80	55%	0.552	40%	0.403	S	S	*	.			trans	-71.6	123.8	178.6	-74.9	-178.4	-178.2	172.4	0	110.2	C524 C527 F531	C524-K529 WeakPolarHBondContact CB-O 3.49Å; C524-K529 PolarHBondContact N-O 3.32Å; C527-K529 PolarHBondContact O-N 3.09Å; C527-K529 VanDerWaalsContact O-N 3.08Å; K529-F531 HydrophobicContact CB-CE2 3.87Å; K529-F531 HydrophobicContact CB-CZ 4.01Å; K529-F531 WeakPolarHBondContact O-CD2 3.25Å; K529-F531 WeakPolarHBondContact O-CE2 3.13Å
530	A	88.9	Confident	85.6	Confident	39 Å²	39	75.4 Å²	75.4	32%	0.322	38%	0.381	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.9	140.9	177.2	0	0	0	0	0	112.3	K520 Y522 G528	K520-A530 HydrophobicContact CB-CB 3.6Å; K520-A530 HydrophobicContact CD-CB 4.35Å; K520-A530 VanDerWaalsContact CD-O 3.22Å; K520-A530 WeakPolarHBondContact CD-O 3.3Å; Y522-A530 CarbonylContact O-C 3.56Å; Y522-A530 WeakPolarHBondContact O-CA 3.45Å; G528-A530 PolarHBondContact O-N 2.93Å
531	F	85.8	Confident	85.6	Confident	41 Å²	41	73 Å²	73	18%	0.18	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	151.4	-178.8	-61.4	-87.7	0	0	0	111.8	K520 Y522 C524 K529 L537 H540	K520-F531 CarbonylContact C-O 3.28Å; K520-F531 WeakPolarHBondContact CA-O 3.39Å; K520-F531 WeakPolarHBondContact CB-O 3.45Å; Y522-F531 WeakPolarHBondContact CD2-O 3.41Å; Y522-F531 PolarHBondContact N-O 3.09Å; Y522-F531 PolarHBondContact O-N 3.46Å; C524-F531 HydrophobicContact CB-CE2 4.32Å; K529-F531 HydrophobicContact CB-CE2 3.87Å; K529-F531 HydrophobicContact CB-CZ 4.01Å; K529-F531 WeakPolarHBondContact O-CD2 3.25Å; K529-F531 WeakPolarHBondContact O-CE2 3.13Å; F531-L537 HydrophobicContact CB-CB 4.32Å; F531-L537 HydrophobicContact CD2-CB 4.03Å; F531-L537 HydrophobicContact CD2-CD1 3.89Å; F531-L537 HydrophobicContact CE2-CD1 4.16Å; F531-L537 HydrophobicContact CG-CB 4.38Å; F531-H540 HydrophobicContact CE1-CB 3.89Å; F531-H540 HydrophobicContact CE2-CB 3.75Å; F531-H540 AromaticContact CE2-CD2 3.27Å; F531-H540 WeakPolarHBondContact CE2-CD2 3.46Å; F531-H540 AromaticContact CE2-CG 3.57Å; F531-H540 HydrophobicContact CZ-CB 3.38Å; F531-H540 AromaticContact CZ-CD2 3.28Å; F531-H540 WeakPolarHBondContact CZ-CD2 3.49Å; F531-H540 AromaticContact CZ-CG 3.14Å; F531-H540 AromaticContact CZ-ND1 3.72Å; F531-H540 AromaticContact CZ-NE2 3.85Å
532	L	82.4	Confident	85.7	Confident	32 Å²	32	72.5 Å²	72.5	17%	0.168	36%	0.361	C	S	.	.	S	Bend	trans	-74.2	-29.2	179.2	-168	66	0	0	0	112.7	R514 R515 E519	R514-L532 HydrophobicContact CB-CD1 3.41Å; R514-L532 VanDerWaalsContact CB-CD1 3.41Å; R514-L532 HydrophobicContact CB-CG 4.38Å; R515-L532 HydrophobicContact CB-CD2 4.49Å; E519-L532 WeakPolarHBondContact O-CD1 3.44Å
533	Y	81.8	Confident	85.5	Confident	57 Å²	57	72.9 Å²	72.9	22%	0.224	37%	0.37	C	S	.	.	S	Bend	trans	-128.4	143	-174.5	-55.9	-80.6	0	0	0	111.4	M511 S535 Y536 L537	M511-Y533 HydrophobicContact CB-CE1 3.99Å; M511-Y533 HydrophobicContact CE-CE1 4.05Å; M511-Y533 HydrophobicContact CG-CE1 4.21Å; M511-Y533 HydrophobicContact SD-CD1 3.8Å; M511-Y533 HydrophobicContact SD-CE1 3.75Å; Y533-S535 VanDerWaalsContact C-N 3.26Å; Y533-S535 PolarHBondContact O-N 3.11Å; Y533-Y536 AromaticContact CD2-CD2 3.51Å; Y533-Y536 HydrophobicContact CD2-CD2 3.51Å; Y533-Y536 AromaticContact CD2-CE2 3.33Å; Y533-Y536 HydrophobicContact CD2-CE2 3.33Å; Y533-Y536 HydrophobicContact CD2-CG 4.27Å; Y533-Y536 AromaticContact CD2-CZ 3.97Å; Y533-Y536 HydrophobicContact CE2-CD2 4.37Å; Y533-Y536 AromaticContact CE2-CE2 3.79Å; Y533-Y536 HydrophobicContact CE2-CE2 3.79Å; Y533-Y536 HydrophobicContact CG-CD2 4.35Å; Y533-Y536 HydrophobicContact CG-CE2 4.38Å; Y533-Y536 PolarHBondContact O-N 3.18Å; Y533-Y536 VanDerWaalsContact O-N 3.12Å; Y533-L537 PolarHBondContact O-N 3.03Å
534	P	84.3	Confident	85.3	Confident	62 Å²	62	70.8 Å²	70.8	40%	0.403	36%	0.36	S	S	.	.	H	α-helix	trans	-65.8	-29.2	177.7	6.4	-2.7	0	0	0	112.8	Y522 Y536 L537 R538	Y522-P534 HydrophobicContact CD1-CB 3.82Å; Y522-P534 HydrophobicContact CD1-CG 4.13Å; Y522-P534 HydrophobicContact CD2-CG 4.48Å; Y522-P534 HydrophobicContact CE1-CB 3.73Å; Y522-P534 HydrophobicContact CE1-CG 3.58Å; Y522-P534 VanDerWaalsContact CE2-CD 3.47Å; Y522-P534 HydrophobicContact CE2-CG 4Å; Y522-P534 HydrophobicContact CG-CB 4.29Å; P534-Y536 VanDerWaalsContact C-N 3.3Å; P534-Y536 PolarHBondContact O-N 3.41Å; P534-L537 PolarHBondContact O-N 3.4Å; P534-R538 WeakPolarHBondContact O-CB 3.49Å; P534-R538 PolarHBondContact O-N 3.41Å
535	S	84.1	Confident	84.8	Confident	74 Å²	74	74.1 Å²	74.1	52%	0.517	38%	0.383	S	S	.	.	H	α-helix	trans	-64.1	-36.2	174.1	51.5	0	0	0	0	112.1	Y533 M539	Y533-S535 VanDerWaalsContact C-N 3.26Å; Y533-S535 PolarHBondContact O-N 3.11Å; S535-M539 WeakPolarHBondContact O-CB 3.36Å; S535-M539 PolarHBondContact O-N 3.36Å
536	Y	84.4	Confident	84.4	Confident	114 Å²	114	69.3 Å²	69.3	45%	0.447	37%	0.37	S	S	.	.	H	α-helix	trans	-74	-37	177.1	-67.9	-7.3	0	0	0	112	Y533 P534 M539 H540	Y533-Y536 AromaticContact CD2-CD2 3.51Å; Y533-Y536 HydrophobicContact CD2-CD2 3.51Å; Y533-Y536 AromaticContact CD2-CE2 3.33Å; Y533-Y536 HydrophobicContact CD2-CE2 3.33Å; Y533-Y536 HydrophobicContact CD2-CG 4.27Å; Y533-Y536 AromaticContact CD2-CZ 3.97Å; Y533-Y536 HydrophobicContact CE2-CD2 4.37Å; Y533-Y536 AromaticContact CE2-CE2 3.79Å; Y533-Y536 HydrophobicContact CE2-CE2 3.79Å; Y533-Y536 HydrophobicContact CG-CD2 4.35Å; Y533-Y536 HydrophobicContact CG-CE2 4.38Å; Y533-Y536 PolarHBondContact O-N 3.18Å; Y533-Y536 VanDerWaalsContact O-N 3.12Å; P534-Y536 VanDerWaalsContact C-N 3.3Å; P534-Y536 PolarHBondContact O-N 3.41Å; Y536-M539 HydrophobicContact CD1-CE 3.89Å; Y536-M539 HydrophobicContact CG-CE 4.35Å; Y536-M539 PolarHBondContact O-N 3.16Å; Y536-H540 VanDerWaalsContact O-CB 3.26Å; Y536-H540 WeakPolarHBondContact O-CB 3.49Å; Y536-H540 PolarHBondContact O-N 3.07Å
537	L	87.9	Confident	84.1	Confident	22 Å²	22	68.3 Å²	68.3	12%	0.115	37%	0.365	C	S	.	.	H	α-helix	trans	-59.3	-53.4	170.1	172.2	60.2	0	0	0	110.6	C524 F531 Y533 P534 M539 H540 E541	C524-L537 VanDerWaalsContact CA-CD1 3.5Å; C524-L537 HydrophobicContact CB-CD1 3.58Å; F531-L537 HydrophobicContact CB-CB 4.32Å; F531-L537 HydrophobicContact CD2-CB 4.03Å; F531-L537 HydrophobicContact CD2-CD1 3.89Å; F531-L537 HydrophobicContact CE2-CD1 4.16Å; F531-L537 HydrophobicContact CG-CB 4.38Å; Y533-L537 PolarHBondContact O-N 3.03Å; P534-L537 PolarHBondContact O-N 3.4Å; L537-M539 PolarHBondContact O-N 3.2Å; L537-H540 CarbonylContact O-C 3.4Å; L537-H540 WeakPolarHBondContact O-CA 3.49Å; L537-H540 WeakPolarHBondContact O-CB 3.19Å; L537-H540 PolarHBondContact O-N 3.01Å; L537-E541 HydrophobicContact CD1-CG 4.06Å; L537-E541 HydrophobicContact CG-CG 4.42Å; L537-E541 WeakPolarHBondContact O-CG 3.32Å; L537-E541 PolarHBondContact O-N 3.44Å
538	R	83.9	Confident	84	Confident	170 Å²	170	71.6 Å²	71.6	64%	0.642	37%	0.373	S	S	*	.	H	α-helix	trans	-56.9	-38.7	178.8	-171.5	-177.9	-62.8	-173.7	-1.4	112.7	P534 E541 R542	P534-R538 WeakPolarHBondContact O-CB 3.49Å; P534-R538 PolarHBondContact O-N 3.41Å; R538-E541 WeakPolarHBondContact CA-OE2 3.31Å; R538-R542 PolarHBondContact O-N 3.34Å
539	M	81.5	Confident	84	Confident	59 Å²	59	73.1 Å²	73.1	29%	0.291	38%	0.376	S	S	.	.	H	α-helix	trans	-69.8	-37.5	176.7	-178.5	-179.5	80	0	0	112.1	S535 Y536 L537 R542 H561	S535-M539 WeakPolarHBondContact O-CB 3.36Å; S535-M539 PolarHBondContact O-N 3.36Å; Y536-M539 HydrophobicContact CD1-CE 3.89Å; Y536-M539 HydrophobicContact CG-CE 4.35Å; Y536-M539 PolarHBondContact O-N 3.16Å; L537-M539 PolarHBondContact O-N 3.2Å; M539-R542 WeakPolarHBondContact O-CB 3.43Å; M539-R542 PolarHBondContact O-N 3.11Å; M539-H561 PolarHBondContact SD-CE1 2.6Å; M539-H561 PolarHBondContact SD-ND1 2.8Å; M539-H561 VanDerWaalsContact SD-ND1 3.4Å
540	H	86.4	Confident	84	Confident	26 Å²	26	70.7 Å²	70.7	12%	0.12	36%	0.364	C	S	.	.	H	α-helix	trans	-68.5	-39.2	174.3	175	62.5	0	0	0	112.1	C527 F531 Y536 L537 R542 T543 H544	C527-H540 PolarHBondContact SG-NE2 3.47Å; F531-H540 HydrophobicContact CE1-CB 3.89Å; F531-H540 HydrophobicContact CE2-CB 3.75Å; F531-H540 AromaticContact CE2-CD2 3.27Å; F531-H540 WeakPolarHBondContact CE2-CD2 3.46Å; F531-H540 AromaticContact CE2-CG 3.57Å; F531-H540 HydrophobicContact CZ-CB 3.38Å; F531-H540 AromaticContact CZ-CD2 3.28Å; F531-H540 WeakPolarHBondContact CZ-CD2 3.49Å; F531-H540 AromaticContact CZ-CG 3.14Å; F531-H540 AromaticContact CZ-ND1 3.72Å; F531-H540 AromaticContact CZ-NE2 3.85Å; Y536-H540 VanDerWaalsContact O-CB 3.26Å; Y536-H540 WeakPolarHBondContact O-CB 3.49Å; Y536-H540 PolarHBondContact O-N 3.07Å; L537-H540 CarbonylContact O-C 3.4Å; L537-H540 WeakPolarHBondContact O-CA 3.49Å; L537-H540 WeakPolarHBondContact O-CB 3.19Å; L537-H540 PolarHBondContact O-N 3.01Å; H540-R542 PolarHBondContact O-N 2.9Å; H540-R542 VanDerWaalsContact O-N 3.16Å; H540-T543 PolarHBondContact ND1-OG1 3.39Å; H540-T543 WeakPolarHBondContact O-CA 3.26Å; H540-T543 VanDerWaalsContact O-CB 3.29Å; H540-T543 WeakPolarHBondContact O-CB 3.45Å; H540-T543 PolarHBondContact O-N 2.99Å; H540-T543 PolarHBondContact O-OG1 3.47Å; H540-H544 AromaticContact CD2-NE2 3.91Å; H540-H544 AromaticContact CE1-NE2 3.77Å; H540-H544 AromaticContact NE2-NE2 3.25Å; H540-H544 PolarHBondContact NE2-NE2 3.09Å
541	E	85.3	Confident	83.9	Confident	73 Å²	73	74.4 Å²	74.4	34%	0.341	38%	0.375	S	S	.	.	H	α-helix	trans	-56.4	-33	176	-72.5	171.8	153.6	0	0	112.1	L537 R538 T543 H544 S545	L537-E541 HydrophobicContact CD1-CG 4.06Å; L537-E541 HydrophobicContact CG-CG 4.42Å; L537-E541 WeakPolarHBondContact O-CG 3.32Å; L537-E541 PolarHBondContact O-N 3.44Å; R538-E541 WeakPolarHBondContact CA-OE2 3.31Å; E541-T543 PolarHBondContact O-N 3.34Å; E541-H544 WeakPolarHBondContact O-CB 2.92Å; E541-H544 PolarHBondContact O-N 3.44Å; E541-S545 PolarHBondContact O-N 3.38Å
542	R	85.1	Confident	84.1	Confident	62 Å²	62	72.5 Å²	72.5	23%	0.234	37%	0.366	C	S	.	.	H	α-helix	trans	-63.2	-22.8	173.2	-65.1	175.5	-179.9	175.2	-3.1	113.9	R538 M539 H540 H544 S545 G546 E547 L560	R538-R542 PolarHBondContact O-N 3.34Å; M539-R542 WeakPolarHBondContact O-CB 3.43Å; M539-R542 PolarHBondContact O-N 3.11Å; H540-R542 PolarHBondContact O-N 2.9Å; H540-R542 VanDerWaalsContact O-N 3.16Å; R542-H544 VanDerWaalsContact C-N 3.27Å; R542-S545 WeakPolarHBondContact CA-OG 3.46Å; R542-S545 PolarHBondContact O-OG 3.49Å; R542-G546 WeakPolarHBondContact O-CA 3.47Å; R542-G546 PolarHBondContact O-N 3.18Å; R542-E547 PolarHBondContact O-N 2.83Å; R542-L560 HydrophobicContact CB-CD1 3.42Å; R542-L560 VanDerWaalsContact CB-CD1 3.42Å
543	T	83.1	Confident	84.3	Confident	74 Å²	74	78.3 Å²	78.3	45%	0.454	40%	0.398	S	S	.	.	H	α-helix	trans	-71.4	-25.2	173.3	68.7	0	0	0	0	112.4	H540 E541 L560	H540-T543 PolarHBondContact ND1-OG1 3.39Å; H540-T543 WeakPolarHBondContact O-CA 3.26Å; H540-T543 VanDerWaalsContact O-CB 3.29Å; H540-T543 WeakPolarHBondContact O-CB 3.45Å; H540-T543 PolarHBondContact O-N 2.99Å; H540-T543 PolarHBondContact O-OG1 3.47Å; E541-T543 PolarHBondContact O-N 3.34Å; T543-L560 HydrophobicContact CG2-CD2 3.57Å
544	H	83.2	Confident	84.4	Confident	71 Å²	71	81.8 Å²	81.8	33%	0.329	42%	0.416	S	S	.	.	H	α-helix	trans	-84.1	-41	175.2	-62.8	-61.8	0	0	0	112.4	C527 H540 E541 R542 G546	C527-H544 PolarHBondContact SG-NE2 2.94Å; C527-H544 VanDerWaalsContact SG-NE2 3.36Å; H540-H544 AromaticContact CD2-NE2 3.91Å; H540-H544 AromaticContact CE1-NE2 3.77Å; H540-H544 AromaticContact NE2-NE2 3.25Å; H540-H544 PolarHBondContact NE2-NE2 3.09Å; E541-H544 WeakPolarHBondContact O-CB 2.92Å; E541-H544 PolarHBondContact O-N 3.44Å; R542-H544 VanDerWaalsContact C-N 3.27Å; H544-G546 VanDerWaalsContact C-N 3.26Å; H544-G546 PolarHBondContact O-N 3.24Å
545	S	81.1	Confident	84.6	Confident	70 Å²	70	81.4 Å²	81.4	49%	0.49	41%	0.414	S	S	.	.	H	α-helix	trans	-74.4	-17.2	176.7	63.9	0	0	0	0	113.4	E541 R542 E547	E541-S545 PolarHBondContact O-N 3.38Å; R542-S545 WeakPolarHBondContact CA-OG 3.46Å; R542-S545 PolarHBondContact O-OG 3.49Å; S545-E547 PolarHBondContact O-N 3.05Å; S545-E547 WeakPolarHBondContact OG-CB 3.27Å; S545-E547 WeakPolarHBondContact OG-CG 3.4Å; S545-E547 PolarHBondContact OG-N 3.13Å
546	G	78.4	Confident	84.6	Confident	51 Å²	51	79.8 Å²	79.8	53%	0.526	41%	0.409	S	S	.	.			trans	71.4	5.6	-173.9	0	0	0	0	0	113.7	R542 H544 K548	R542-G546 WeakPolarHBondContact O-CA 3.47Å; R542-G546 PolarHBondContact O-N 3.18Å; H544-G546 VanDerWaalsContact C-N 3.26Å; H544-G546 PolarHBondContact O-N 3.24Å; G546-K548 PolarHBondContact O-N 2.76Å
547	E	80.2	Confident	84.7	Confident	117 Å²	117	80.4 Å²	80.4	55%	0.547	41%	0.414	S	S	.	.			trans	-62.4	123	178.3	-75.5	-179.6	-179.3	0	0	110.8	R542 S545 P549 L560	R542-E547 PolarHBondContact O-N 2.83Å; S545-E547 PolarHBondContact O-N 3.05Å; S545-E547 WeakPolarHBondContact OG-CB 3.27Å; S545-E547 WeakPolarHBondContact OG-CG 3.4Å; S545-E547 PolarHBondContact OG-N 3.13Å; E547-P549 WeakPolarHBondContact O-CD 3.37Å; E547-L560 VanDerWaalsContact O-CD1 3.26Å; E547-L560 WeakPolarHBondContact O-CD1 3.34Å
548	K	84.9	Confident	84.7	Confident	124 Å²	124	81.1 Å²	81.1	54%	0.539	42%	0.423	S	S	.	.			trans	-119.8	84.2	174.8	-65.1	-173.9	-165.5	171.6	0	109.4	G546 Y550 A558 F559	G546-K548 PolarHBondContact O-N 2.76Å; K548-Y550 PolarHBondContact O-N 3.41Å; K548-Y550 VanDerWaalsContact O-N 3.12Å; K548-A558 HydrophobicContact CB-CB 3.6Å; K548-A558 HydrophobicContact CD-CB 4.29Å; K548-A558 WeakPolarHBondContact CD-O 3.44Å; K548-F559 CarbonylContact C-O 3.53Å; K548-F559 WeakPolarHBondContact CA-O 3.4Å
549	P	84.3	Confident	84.8	Confident	70 Å²	70	75.1 Å²	75.1	46%	0.455	40%	0.402	S	S	.	.			trans	-70.7	-9.6	-169.4	-19.4	33.1	0	0	0	114.8	E547	E547-P549 WeakPolarHBondContact O-CD 3.37Å
550	Y	86.4	Confident	84.8	Confident	77 Å²	77	74 Å²	74	30%	0.302	40%	0.397	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110	91.6	-171.6	-56.4	-74.9	0	0	0	109.6	K548 A558 F559 L560 H561	K548-Y550 PolarHBondContact O-N 3.41Å; K548-Y550 VanDerWaalsContact O-N 3.12Å; Y550-A558 CarbonylContact O-C 3.5Å; Y550-A558 WeakPolarHBondContact O-CA 3.43Å; Y550-F559 PolarHBondContact N-O 3.18Å; Y550-F559 PolarHBondContact O-N 3.21Å; Y550-L560 WeakPolarHBondContact CE2-O 3.49Å; Y550-H561 VanDerWaalsContact CD2-C 3.44Å
551	E	87.1	Confident	84.5	Confident	117 Å²	117	74.8 Å²	74.8	55%	0.547	40%	0.401	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.3	136.8	179.4	-167.7	175.1	169.5	0	0	111.8	N553	E551-N553 PolarHBondContact O-N 3.47Å
552	C	90.5	Very high	84.4	Confident	0 Å²	0	74.3 Å²	74.3	0%	0	41%	0.405	C	S	.	.			trans	-80	113.1	172.4	-178.2	0	0	0	0	110.4	Q554 C555 G556 K557 F559 L565	C552-Q554 PolarHBondContact O-N 2.89Å; C552-C555 PolarHBondContact O-N 3.1Å; C552-G556 WeakPolarHBondContact O-CA 3.4Å; C552-G556 PolarHBondContact O-N 2.81Å; C552-K557 WeakPolarHBondContact CB-O 3.37Å; C552-K557 PolarHBondContact N-O 2.92Å; C552-F559 HydrophobicContact CB-CE2 4.32Å; C552-L565 VanDerWaalsContact CA-CD1 3.48Å; C552-L565 HydrophobicContact CB-CD1 3.52Å
553	N	86.7	Confident	84.3	Confident	155 Å²	155	74.4 Å²	74.4	83%	0.829	42%	0.415	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.2	-21.2	179.5	-64.5	-25.5	0	0	0	113.9	E551	E551-N553 PolarHBondContact O-N 3.47Å
554	Q	84.8	Confident	84.4	Confident	129 Å²	129	76.3 Å²	76.3	60%	0.603	42%	0.415	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.3	-25.6	-177.2	-60	-174.6	25.8	0	0	113.9	C552	C552-Q554 PolarHBondContact O-N 2.89Å
555	C	87.5	Confident	84.6	Confident	54 Å²	54	73.9 Å²	73.9	37%	0.365	41%	0.405	S	S	.	.	T	Hydrogen-bonded Turn	trans	-141.2	6	-175.8	72.3	0	0	0	0	115	C552 K557 H568 H572	C552-C555 PolarHBondContact O-N 3.1Å; C555-K557 PolarHBondContact O-N 3.01Å; C555-H568 PolarHBondContact SG-NE2 3.5Å; C555-H572 PolarHBondContact SG-NE2 3.28Å; C555-H572 VanDerWaalsContact SG-NE2 3.44Å
556	G	83.5	Confident	84.7	Confident	41 Å²	41	76.3 Å²	76.3	42%	0.423	41%	0.408	S	S	.	.			trans	67.7	1.5	179.2	0	0	0	0	0	115.1	C552 A558	C552-G556 WeakPolarHBondContact O-CA 3.4Å; C552-G556 PolarHBondContact O-N 2.81Å; G556-A558 PolarHBondContact O-N 3.24Å
557	K	87.4	Confident	84.9	Confident	127 Å²	127	77 Å²	77	55%	0.552	40%	0.398	S	S	*	.			trans	-69	120.5	178.4	-73.4	-178.3	-178	174	0	110	C552 C555 F559	C552-K557 WeakPolarHBondContact CB-O 3.37Å; C552-K557 PolarHBondContact N-O 2.92Å; C555-K557 PolarHBondContact O-N 3.01Å; K557-F559 HydrophobicContact CB-CE2 3.79Å; K557-F559 HydrophobicContact CB-CZ 3.94Å; K557-F559 WeakPolarHBondContact O-CD2 3.47Å; K557-F559 WeakPolarHBondContact O-CE2 3.47Å
558	A	88.3	Confident	85.2	Confident	37 Å²	37	72.5 Å²	72.5	31%	0.306	38%	0.378	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.1	138.6	176.3	0	0	0	0	0	111.9	K548 Y550 G556	K548-A558 HydrophobicContact CB-CB 3.6Å; K548-A558 HydrophobicContact CD-CB 4.29Å; K548-A558 WeakPolarHBondContact CD-O 3.44Å; Y550-A558 CarbonylContact O-C 3.5Å; Y550-A558 WeakPolarHBondContact O-CA 3.43Å; G556-A558 PolarHBondContact O-N 3.24Å
559	F	84.9	Confident	85.3	Confident	44 Å²	44	69.6 Å²	69.6	19%	0.193	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	151.4	-178.8	-60.9	-88.8	0	0	0	111	K548 Y550 C552 K557 H561 L565 H568	K548-F559 CarbonylContact C-O 3.53Å; K548-F559 WeakPolarHBondContact CA-O 3.4Å; Y550-F559 PolarHBondContact N-O 3.18Å; Y550-F559 PolarHBondContact O-N 3.21Å; C552-F559 HydrophobicContact CB-CE2 4.32Å; K557-F559 HydrophobicContact CB-CE2 3.79Å; K557-F559 HydrophobicContact CB-CZ 3.94Å; K557-F559 WeakPolarHBondContact O-CD2 3.47Å; K557-F559 WeakPolarHBondContact O-CE2 3.47Å; F559-H561 VanDerWaalsContact C-N 3.34Å; F559-L565 HydrophobicContact CB-CB 4.36Å; F559-L565 HydrophobicContact CD2-CB 4.02Å; F559-L565 HydrophobicContact CD2-CD1 3.89Å; F559-L565 HydrophobicContact CE2-CD1 4.14Å; F559-L565 HydrophobicContact CG-CB 4.41Å; F559-H568 HydrophobicContact CE1-CB 3.95Å; F559-H568 HydrophobicContact CE2-CB 3.78Å; F559-H568 AromaticContact CE2-CD2 3.29Å; F559-H568 WeakPolarHBondContact CE2-CD2 3.43Å; F559-H568 AromaticContact CE2-CG 3.57Å; F559-H568 HydrophobicContact CZ-CB 3.41Å; F559-H568 VanDerWaalsContact CZ-CB 3.41Å; F559-H568 AromaticContact CZ-CD2 3.36Å; F559-H568 WeakPolarHBondContact CZ-CD2 3.3Å; F559-H568 AromaticContact CZ-CG 3.17Å; F559-H568 AromaticContact CZ-ND1 3.75Å; F559-H568 AromaticContact CZ-NE2 3.97Å
560	L	81.1	Confident	85.4	Confident	36 Å²	36	69.2 Å²	69.2	19%	0.188	36%	0.355	C	S	.	.	S	Bend	trans	-74.5	-26.8	177.3	-172.3	71.7	0	0	0	112.6	R542 T543 E547 Y550	R542-L560 HydrophobicContact CB-CD1 3.42Å; R542-L560 VanDerWaalsContact CB-CD1 3.42Å; T543-L560 HydrophobicContact CG2-CD2 3.57Å; E547-L560 VanDerWaalsContact O-CD1 3.26Å; E547-L560 WeakPolarHBondContact O-CD1 3.34Å; Y550-L560 WeakPolarHBondContact CE2-O 3.49Å
561	H	79.9	Confident	85.3	Confident	41 Å²	41	69.9 Å²	69.9	19%	0.19	37%	0.368	C	S	.	.	S	Bend	trans	-126.1	141.7	-176.6	-58.1	-107.1	0	0	0	111.3	M539 Y550 F559 S563 Y564 L565	M539-H561 PolarHBondContact SD-CE1 2.6Å; M539-H561 PolarHBondContact SD-ND1 2.8Å; M539-H561 VanDerWaalsContact SD-ND1 3.4Å; Y550-H561 VanDerWaalsContact CD2-C 3.44Å; F559-H561 VanDerWaalsContact C-N 3.34Å; H561-S563 VanDerWaalsContact C-N 3.28Å; H561-S563 PolarHBondContact O-N 3.21Å; H561-Y564 HydrophobicContact CB-CD2 3.71Å; H561-Y564 HydrophobicContact CB-CE2 4.2Å; H561-Y564 HydrophobicContact CB-CG 4.02Å; H561-Y564 AromaticContact CD2-CD2 3.35Å; H561-Y564 WeakPolarHBondContact CD2-CD2 3.33Å; H561-Y564 AromaticContact CD2-CE2 3.17Å; H561-Y564 WeakPolarHBondContact CD2-CE2 3.38Å; H561-Y564 AromaticContact CG-CD2 3.8Å; H561-Y564 AromaticContact CG-CE2 3.82Å; H561-Y564 AromaticContact NE2-CE2 3.71Å; H561-Y564 PolarHBondContact O-N 3.26Å; H561-L565 PolarHBondContact O-N 3.34Å; H561-L565 VanDerWaalsContact O-N 3.1Å
562	S	84.4	Confident	85.2	Confident	63 Å²	63	67.8 Å²	67.8	44%	0.441	36%	0.358	S	S	.	.	H	α-helix	trans	-63.1	-33.5	173.5	58.7	0	0	0	0	112.8	Y564 L565 Q566	S562-Y564 VanDerWaalsContact C-N 3.32Å; S562-Y564 PolarHBondContact O-N 3.09Å; S562-L565 PolarHBondContact O-N 3.22Å; S562-Q566 PolarHBondContact O-N 2.96Å
563	S	83.6	Confident	84.8	Confident	64 Å²	64	70.9 Å²	70.9	45%	0.448	38%	0.379	S	S	.	.	H	α-helix	trans	-65.1	-35.8	175.6	53.8	0	0	0	0	112.3	H561 M567	H561-S563 VanDerWaalsContact C-N 3.28Å; H561-S563 PolarHBondContact O-N 3.21Å; S563-M567 WeakPolarHBondContact O-CB 3.37Å; S563-M567 PolarHBondContact O-N 3.48Å
564	Y	84.4	Confident	84.6	Confident	114 Å²	114	65.9 Å²	65.9	45%	0.447	36%	0.364	S	S	.	.	H	α-helix	trans	-72.8	-35.2	174.6	-64.2	-25.3	0	0	0	112	H561 S562 M567 H568	H561-Y564 HydrophobicContact CB-CD2 3.71Å; H561-Y564 HydrophobicContact CB-CE2 4.2Å; H561-Y564 HydrophobicContact CB-CG 4.02Å; H561-Y564 AromaticContact CD2-CD2 3.35Å; H561-Y564 WeakPolarHBondContact CD2-CD2 3.33Å; H561-Y564 AromaticContact CD2-CE2 3.17Å; H561-Y564 WeakPolarHBondContact CD2-CE2 3.38Å; H561-Y564 AromaticContact CG-CD2 3.8Å; H561-Y564 AromaticContact CG-CE2 3.82Å; H561-Y564 AromaticContact NE2-CE2 3.71Å; H561-Y564 PolarHBondContact O-N 3.26Å; S562-Y564 VanDerWaalsContact C-N 3.32Å; S562-Y564 PolarHBondContact O-N 3.09Å; Y564-M567 HydrophobicContact CD1-CE 3.86Å; Y564-H568 WeakPolarHBondContact O-CB 3.44Å; Y564-H568 PolarHBondContact O-N 3.41Å
565	L	87.5	Confident	84.5	Confident	21 Å²	21	65.3 Å²	65.3	11%	0.11	36%	0.361	C	S	.	.	H	α-helix	trans	-61.6	-53.5	170.1	173	60.4	0	0	0	110.9	C552 F559 H561 S562 M567 H568 E569	C552-L565 VanDerWaalsContact CA-CD1 3.48Å; C552-L565 HydrophobicContact CB-CD1 3.52Å; F559-L565 HydrophobicContact CB-CB 4.36Å; F559-L565 HydrophobicContact CD2-CB 4.02Å; F559-L565 HydrophobicContact CD2-CD1 3.89Å; F559-L565 HydrophobicContact CE2-CD1 4.14Å; F559-L565 HydrophobicContact CG-CB 4.41Å; H561-L565 PolarHBondContact O-N 3.34Å; H561-L565 VanDerWaalsContact O-N 3.1Å; S562-L565 PolarHBondContact O-N 3.22Å; L565-M567 VanDerWaalsContact C-N 3.26Å; L565-M567 PolarHBondContact O-N 3.37Å; L565-H568 CarbonylContact O-C 3.51Å; L565-H568 WeakPolarHBondContact O-CA 3.37Å; L565-H568 WeakPolarHBondContact O-CB 3.28Å; L565-H568 PolarHBondContact O-N 3.24Å; L565-E569 HydrophobicContact CD1-CG 4.01Å; L565-E569 HydrophobicContact CG-CG 4.4Å; L565-E569 WeakPolarHBondContact O-CG 3.45Å; L565-E569 PolarHBondContact O-N 3.36Å
566	Q	84.1	Confident	84.5	Confident	121 Å²	121	68.7 Å²	68.7	57%	0.565	37%	0.37	S	S	*	.	H	α-helix	trans	-56	-41.9	177.1	-81.2	-172	-18.2	0	0	112.5	S562 H568 E569 R570	S562-Q566 PolarHBondContact O-N 2.96Å; Q566-H568 VanDerWaalsContact C-N 3.34Å; Q566-E569 PolarHBondContact O-N 3.33Å; Q566-R570 PolarHBondContact O-N 3.47Å
567	M	82.3	Confident	84.7	Confident	64 Å²	64	70.3 Å²	70.3	32%	0.315	37%	0.373	S	S	.	.	H	α-helix	trans	-65.5	-38.8	176.7	-177.5	-178.4	76.9	0	0	111.8	S563 Y564 L565 R570 H589	S563-M567 WeakPolarHBondContact O-CB 3.37Å; S563-M567 PolarHBondContact O-N 3.48Å; Y564-M567 HydrophobicContact CD1-CE 3.86Å; L565-M567 VanDerWaalsContact C-N 3.26Å; L565-M567 PolarHBondContact O-N 3.37Å; M567-R570 WeakPolarHBondContact O-CB 3.47Å; M567-R570 PolarHBondContact O-N 3.33Å; M567-H589 WeakPolarHBondContact CG-NE2 3.2Å; M567-H589 PolarHBondContact SD-CE1 3.47Å; M567-H589 PolarHBondContact SD-NE2 3.01Å; M567-H589 VanDerWaalsContact SD-NE2 3.4Å
568	H	86.7	Confident	84.7	Confident	24 Å²	24	68 Å²	68	11%	0.111	36%	0.361	C	S	.	.	H	α-helix	trans	-68.6	-38.4	174.7	172.5	63.2	0	0	0	112	C555 F559 Y564 L565 Q566 R570 T571 H572	C555-H568 PolarHBondContact SG-NE2 3.5Å; F559-H568 HydrophobicContact CE1-CB 3.95Å; F559-H568 HydrophobicContact CE2-CB 3.78Å; F559-H568 AromaticContact CE2-CD2 3.29Å; F559-H568 WeakPolarHBondContact CE2-CD2 3.43Å; F559-H568 AromaticContact CE2-CG 3.57Å; F559-H568 HydrophobicContact CZ-CB 3.41Å; F559-H568 VanDerWaalsContact CZ-CB 3.41Å; F559-H568 AromaticContact CZ-CD2 3.36Å; F559-H568 WeakPolarHBondContact CZ-CD2 3.3Å; F559-H568 AromaticContact CZ-CG 3.17Å; F559-H568 AromaticContact CZ-ND1 3.75Å; F559-H568 AromaticContact CZ-NE2 3.97Å; Y564-H568 WeakPolarHBondContact O-CB 3.44Å; Y564-H568 PolarHBondContact O-N 3.41Å; L565-H568 CarbonylContact O-C 3.51Å; L565-H568 WeakPolarHBondContact O-CA 3.37Å; L565-H568 WeakPolarHBondContact O-CB 3.28Å; L565-H568 PolarHBondContact O-N 3.24Å; Q566-H568 VanDerWaalsContact C-N 3.34Å; H568-R570 PolarHBondContact O-N 3.09Å; H568-T571 PolarHBondContact ND1-OG1 2.85Å; H568-T571 VanDerWaalsContact O-CB 3.32Å; H568-T571 WeakPolarHBondContact O-CB 3.24Å; H568-T571 PolarHBondContact O-N 3.33Å; H568-T571 PolarHBondContact O-OG1 3.16Å; H568-H572 AromaticContact CD2-NE2 3.71Å; H568-H572 AromaticContact CE1-CE1 3.84Å; H568-H572 AromaticContact CE1-NE2 3.45Å; H568-H572 PolarHBondContact CE1-NE2 2.97Å; H568-H572 AromaticContact NE2-CD2 3.94Å; H568-H572 AromaticContact NE2-CE1 3.72Å; H568-H572 AromaticContact NE2-NE2 2.97Å; H568-H572 PolarHBondContact NE2-NE2 3.03Å
569	E	85.6	Confident	84.7	Confident	63 Å²	63	71.7 Å²	71.7	29%	0.294	37%	0.372	S	S	.	.	H	α-helix	trans	-58.7	-31.7	176.5	-73.4	173.8	150.8	0	0	112	L565 Q566 T571 H572 S573	L565-E569 HydrophobicContact CD1-CG 4.01Å; L565-E569 HydrophobicContact CG-CG 4.4Å; L565-E569 WeakPolarHBondContact O-CG 3.45Å; L565-E569 PolarHBondContact O-N 3.36Å; Q566-E569 PolarHBondContact O-N 3.33Å; E569-T571 PolarHBondContact O-N 2.57Å; E569-H572 PolarHBondContact O-N 3.27Å; E569-S573 PolarHBondContact O-N 3.34Å
570	R	87.1	Confident	84.9	Confident	62 Å²	62	69.6 Å²	69.6	23%	0.234	36%	0.363	C	S	.	.	H	α-helix	trans	-61.8	-22.4	172	-64	177	-174.4	172.5	1.5	114	Q566 M567 H568 H572 S573 G574 E575 S588	Q566-R570 PolarHBondContact O-N 3.47Å; M567-R570 WeakPolarHBondContact O-CB 3.47Å; M567-R570 PolarHBondContact O-N 3.33Å; H568-R570 PolarHBondContact O-N 3.09Å; R570-H572 VanDerWaalsContact C-N 3.29Å; R570-S573 WeakPolarHBondContact CA-OG 3.44Å; R570-G574 WeakPolarHBondContact O-CA 3.39Å; R570-G574 PolarHBondContact O-N 3.37Å; R570-E575 HydrophobicContact CG-CB 4.34Å; R570-E575 PolarHBondContact O-N 2.81Å; R570-S588 PolarHBondContact NH1-O 2.84Å
571	T	84	Confident	85.2	Confident	91 Å²	91	75.1 Å²	75.1	56%	0.558	39%	0.393	S	S	*	.	H	α-helix	trans	-73.8	-24.1	174.9	69	0	0	0	0	112.4	H568 E569	H568-T571 PolarHBondContact ND1-OG1 2.85Å; H568-T571 VanDerWaalsContact O-CB 3.32Å; H568-T571 WeakPolarHBondContact O-CB 3.24Å; H568-T571 PolarHBondContact O-N 3.33Å; H568-T571 PolarHBondContact O-OG1 3.16Å; E569-T571 PolarHBondContact O-N 2.57Å
572	H	84.5	Confident	85.4	Confident	73 Å²	73	79.5 Å²	79.5	34%	0.338	41%	0.413	S	S	.	.	H	α-helix	trans	-87.6	-42.6	174.5	-55.3	-57.4	0	0	0	111.7	C555 H568 E569 R570 G574	C555-H572 PolarHBondContact SG-NE2 3.28Å; C555-H572 VanDerWaalsContact SG-NE2 3.44Å; H568-H572 AromaticContact CD2-NE2 3.71Å; H568-H572 AromaticContact CE1-CE1 3.84Å; H568-H572 AromaticContact CE1-NE2 3.45Å; H568-H572 PolarHBondContact CE1-NE2 2.97Å; H568-H572 AromaticContact NE2-CD2 3.94Å; H568-H572 AromaticContact NE2-CE1 3.72Å; H568-H572 AromaticContact NE2-NE2 2.97Å; H568-H572 PolarHBondContact NE2-NE2 3.03Å; E569-H572 PolarHBondContact O-N 3.27Å; R570-H572 VanDerWaalsContact C-N 3.29Å; H572-G574 VanDerWaalsContact C-N 3.29Å; H572-G574 PolarHBondContact O-N 2.92Å
573	S	83.6	Confident	85.6	Confident	65 Å²	65	79.1 Å²	79.1	46%	0.455	41%	0.41	S	S	.	.	H	α-helix	trans	-75.3	-17.6	178.6	66.3	0	0	0	0	113.7	E569 R570 E575	E569-S573 PolarHBondContact O-N 3.34Å; R570-S573 WeakPolarHBondContact CA-OG 3.44Å; S573-E575 PolarHBondContact O-N 2.98Å; S573-E575 WeakPolarHBondContact OG-CB 3.32Å; S573-E575 WeakPolarHBondContact OG-CG 3.36Å; S573-E575 PolarHBondContact OG-N 3.49Å
574	G	81.2	Confident	85.6	Confident	49 Å²	49	78.1 Å²	78.1	51%	0.505	41%	0.409	S	S	.	.			trans	70.5	7.4	-173.8	0	0	0	0	0	113.9	R570 H572 K576	R570-G574 WeakPolarHBondContact O-CA 3.39Å; R570-G574 PolarHBondContact O-N 3.37Å; H572-G574 VanDerWaalsContact C-N 3.29Å; H572-G574 PolarHBondContact O-N 2.92Å; G574-K576 PolarHBondContact O-N 3.41Å
575	E	83.6	Confident	85.8	Confident	117 Å²	117	78.7 Å²	78.7	55%	0.547	41%	0.414	S	S	.	.			trans	-60.9	124.6	-179.2	-78.9	-178.4	-177.4	0	0	111.7	R570 S573 P577	R570-E575 HydrophobicContact CG-CB 4.34Å; R570-E575 PolarHBondContact O-N 2.81Å; S573-E575 PolarHBondContact O-N 2.98Å; S573-E575 WeakPolarHBondContact OG-CB 3.32Å; S573-E575 WeakPolarHBondContact OG-CG 3.36Å; S573-E575 PolarHBondContact OG-N 3.49Å; E575-P577 WeakPolarHBondContact O-CD 3.28Å
576	K	86.9	Confident	85.8	Confident	126 Å²	126	79.4 Å²	79.4	55%	0.548	42%	0.424	S	S	.	.			trans	-124.1	78.9	176.8	-68.8	173	178.8	-176	0	110.1	G574 Y578 A586 F587	G574-K576 PolarHBondContact O-N 3.41Å; K576-Y578 PolarHBondContact O-N 3.23Å; K576-Y578 VanDerWaalsContact O-N 3.15Å; K576-A586 HydrophobicContact CB-CB 3.63Å; K576-A586 HydrophobicContact CD-CB 4.31Å; K576-A586 WeakPolarHBondContact CD-O 3.09Å; K576-F587 CarbonylContact C-O 3.34Å; K576-F587 VanDerWaalsContact C-O 3.29Å; K576-F587 WeakPolarHBondContact CA-O 3.29Å
577	P	86.8	Confident	85.9	Confident	74 Å²	74	75.8 Å²	75.8	48%	0.481	41%	0.406	S	S	.	.			trans	-69.7	-11.8	-171.3	-19.2	32.8	0	0	0	114.7	E575	E575-P577 WeakPolarHBondContact O-CD 3.28Å
578	Y	87.6	Confident	85.9	Confident	78 Å²	78	74.1 Å²	74.1	31%	0.306	40%	0.401	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	96.6	-171.5	-56.1	-75.6	0	0	0	110.1	K576 A586 F587 S590	K576-Y578 PolarHBondContact O-N 3.23Å; K576-Y578 VanDerWaalsContact O-N 3.15Å; Y578-A586 CarbonylContact O-C 3.55Å; Y578-A586 WeakPolarHBondContact O-CA 3.4Å; Y578-F587 PolarHBondContact N-O 3.22Å; Y578-F587 PolarHBondContact O-N 3.35Å; Y578-S590 VanDerWaalsContact CD2-N 3.34Å
579	E	88.1	Confident	85.7	Confident	116 Å²	116	74.6 Å²	74.6	54%	0.542	40%	0.403	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.6	137.6	-179.8	-167.9	176.3	168.6	0	0	112.1	N581	E579-N581 PolarHBondContact O-N 2.94Å
580	C	90.5	Very high	85.7	Confident	0 Å²	0	74.5 Å²	74.5	0%	0	41%	0.409	C	S	.	.			trans	-79.4	114.8	172.5	-176.9	0	0	0	0	110.5	Q582 C583 G584 K585 F587 L593 H600	C580-Q582 PolarHBondContact O-N 3.42Å; C580-Q582 VanDerWaalsContact O-N 3.08Å; C580-C583 PolarHBondContact O-N 3.35Å; C580-G584 WeakPolarHBondContact O-CA 3.29Å; C580-G584 PolarHBondContact O-N 3.42Å; C580-K585 WeakPolarHBondContact CB-O 3.23Å; C580-K585 PolarHBondContact N-O 3.1Å; C580-F587 HydrophobicContact CB-CE2 4.49Å; C580-L593 HydrophobicContact CB-CD1 3.55Å; C580-H600 PolarHBondContact SG-NE2 3.3Å; C580-H600 VanDerWaalsContact SG-NE2 3.45Å
581	N	86.6	Confident	85.6	Confident	152 Å²	152	74.5 Å²	74.5	81%	0.813	42%	0.418	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.3	-20.3	179.8	-63.8	-30.6	0	0	0	113.9	E579	E579-N581 PolarHBondContact O-N 2.94Å
582	Q	84.6	Confident	85.7	Confident	132 Å²	132	75.2 Å²	75.2	62%	0.617	41%	0.412	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.4	-30.2	-177.5	-62.4	-175.2	14.7	0	0	113.6	C580 H600	C580-Q582 PolarHBondContact O-N 3.42Å; C580-Q582 VanDerWaalsContact O-N 3.08Å; Q582-H600 PolarHBondContact OE1-CD2 2.75Å; Q582-H600 VanDerWaalsContact OE1-CG 3.23Å
583	C	87.4	Confident	85.9	Confident	56 Å²	56	72.7 Å²	72.7	38%	0.378	40%	0.4	S	S	.	.	T	Hydrogen-bonded Turn	trans	-138.3	9.5	-175.3	79.3	0	0	0	0	114.7	C580 K585 H596	C580-C583 PolarHBondContact O-N 3.35Å; C583-K585 PolarHBondContact O-N 3.21Å; C583-H596 PolarHBondContact SG-NE2 3.05Å
584	G	84	Confident	85.9	Confident	42 Å²	42	75 Å²	75	43%	0.433	40%	0.404	S	S	.	.			trans	65.9	6.4	177.6	0	0	0	0	0	115.3	C580 A586	C580-G584 WeakPolarHBondContact O-CA 3.29Å; C580-G584 PolarHBondContact O-N 3.42Å; G584-A586 PolarHBondContact O-N 2.89Å
585	K	88.1	Confident	86	Confident	126 Å²	126	75.5 Å²	75.5	55%	0.548	39%	0.394	S	S	.	.			trans	-74.1	121.5	179.9	-76	-178	-177.6	175.7	0	109.6	C580 C583 F587	C580-K585 WeakPolarHBondContact CB-O 3.23Å; C580-K585 PolarHBondContact N-O 3.1Å; C583-K585 PolarHBondContact O-N 3.21Å; K585-F587 HydrophobicContact CB-CE2 3.87Å; K585-F587 HydrophobicContact CB-CZ 4Å; K585-F587 WeakPolarHBondContact O-CD2 3.38Å; K585-F587 VanDerWaalsContact O-CE2 3.22Å; K585-F587 WeakPolarHBondContact O-CE2 3.46Å
586	A	88.3	Confident	86.2	Confident	37 Å²	37	71.1 Å²	71.1	31%	0.306	37%	0.374	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.6	143.9	177.4	0	0	0	0	0	112.3	K576 Y578 G584	K576-A586 HydrophobicContact CB-CB 3.63Å; K576-A586 HydrophobicContact CD-CB 4.31Å; K576-A586 WeakPolarHBondContact CD-O 3.09Å; Y578-A586 CarbonylContact O-C 3.55Å; Y578-A586 WeakPolarHBondContact O-CA 3.4Å; G584-A586 PolarHBondContact O-N 2.89Å
587	F	86.1	Confident	86.1	Confident	45 Å²	45	68.4 Å²	68.4	20%	0.197	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	149.6	-178.9	-58.8	-89.1	0	0	0	110.6	K576 Y578 C580 K585 H589 L593 H596	K576-F587 CarbonylContact C-O 3.34Å; K576-F587 VanDerWaalsContact C-O 3.29Å; K576-F587 WeakPolarHBondContact CA-O 3.29Å; Y578-F587 PolarHBondContact N-O 3.22Å; Y578-F587 PolarHBondContact O-N 3.35Å; C580-F587 HydrophobicContact CB-CE2 4.49Å; K585-F587 HydrophobicContact CB-CE2 3.87Å; K585-F587 HydrophobicContact CB-CZ 4Å; K585-F587 WeakPolarHBondContact O-CD2 3.38Å; K585-F587 VanDerWaalsContact O-CE2 3.22Å; K585-F587 WeakPolarHBondContact O-CE2 3.46Å; F587-H589 VanDerWaalsContact C-N 3.29Å; F587-L593 HydrophobicContact CB-CB 4.42Å; F587-L593 HydrophobicContact CD2-CB 3.94Å; F587-L593 HydrophobicContact CD2-CD1 3.88Å; F587-L593 HydrophobicContact CE2-CD1 4.05Å; F587-L593 HydrophobicContact CG-CB 4.41Å; F587-H596 HydrophobicContact CE1-CB 4.08Å; F587-H596 HydrophobicContact CE2-CB 3.8Å; F587-H596 AromaticContact CE2-CD2 3.39Å; F587-H596 WeakPolarHBondContact CE2-CD2 3.47Å; F587-H596 AromaticContact CE2-CG 3.64Å; F587-H596 HydrophobicContact CZ-CB 3.44Å; F587-H596 VanDerWaalsContact CZ-CB 3.44Å; F587-H596 AromaticContact CZ-CD2 3.49Å; F587-H596 VanDerWaalsContact CZ-CD2 3.49Å; F587-H596 WeakPolarHBondContact CZ-CD2 3.1Å; F587-H596 AromaticContact CZ-CG 3.28Å; F587-H596 AromaticContact CZ-ND1 3.9Å
588	S	83.3	Confident	86.1	Confident	29 Å²	29	68 Å²	68	20%	0.203	35%	0.351	C	S	.	.	S	Bend	trans	-74.6	-21.3	176.6	52.5	0	0	0	0	112.8	R570	R570-S588 PolarHBondContact NH1-O 2.84Å
589	H	82.5	Confident	85.9	Confident	34 Å²	34	67.9 Å²	67.9	16%	0.157	36%	0.359	C	S	.	.	S	Bend	trans	-128.1	141.3	-175.9	-60.3	-163.8	0	0	0	111	M567 F587 S591 Y592 L593	M567-H589 WeakPolarHBondContact CG-NE2 3.2Å; M567-H589 PolarHBondContact SD-CE1 3.47Å; M567-H589 PolarHBondContact SD-NE2 3.01Å; M567-H589 VanDerWaalsContact SD-NE2 3.4Å; F587-H589 VanDerWaalsContact C-N 3.29Å; H589-S591 VanDerWaalsContact C-N 3.32Å; H589-S591 PolarHBondContact O-N 3.42Å; H589-Y592 HydrophobicContact CB-CD2 3.59Å; H589-Y592 HydrophobicContact CB-CE2 4.03Å; H589-Y592 HydrophobicContact CB-CG 4.03Å; H589-Y592 AromaticContact CE1-CE2 3.74Å; H589-Y592 AromaticContact CG-CD2 3.7Å; H589-Y592 AromaticContact CG-CE2 3.63Å; H589-Y592 AromaticContact ND1-CD2 3.92Å; H589-Y592 AromaticContact ND1-CE2 3.41Å; H589-Y592 WeakPolarHBondContact ND1-CE2 3.48Å; H589-Y592 AromaticContact ND1-CZ 3.81Å; H589-Y592 PolarHBondContact O-N 3.28Å; H589-L593 PolarHBondContact O-N 3.07Å
590	S	85.4	Confident	85.6	Confident	60 Å²	60	65.9 Å²	65.9	42%	0.42	35%	0.35	S	S	.	.	H	α-helix	trans	-65	-33.3	176.1	58.5	0	0	0	0	113.2	Y578 Y592 L593 Q594	Y578-S590 VanDerWaalsContact CD2-N 3.34Å; S590-Y592 VanDerWaalsContact C-N 3.32Å; S590-Y592 PolarHBondContact O-N 3.19Å; S590-L593 PolarHBondContact O-N 2.81Å; S590-Q594 WeakPolarHBondContact O-CG 3.47Å; S590-Q594 PolarHBondContact O-N 3.46Å
591	S	84.9	Confident	85.2	Confident	62 Å²	62	69.9 Å²	69.9	43%	0.434	37%	0.374	S	S	.	.	H	α-helix	trans	-66.6	-33.6	177.1	55.8	0	0	0	0	112.6	H589 M595	H589-S591 VanDerWaalsContact C-N 3.32Å; H589-S591 PolarHBondContact O-N 3.42Å; S591-M595 VanDerWaalsContact O-CB 3.23Å; S591-M595 WeakPolarHBondContact O-CB 3.18Å; S591-M595 PolarHBondContact O-N 3.08Å
592	Y	85.8	Confident	84.8	Confident	106 Å²	106	64.9 Å²	64.9	42%	0.416	36%	0.359	S	S	.	.	H	α-helix	trans	-71.8	-38	174.2	-63.6	-28.4	0	0	0	111.7	H589 S590 M595 H596	H589-Y592 HydrophobicContact CB-CD2 3.59Å; H589-Y592 HydrophobicContact CB-CE2 4.03Å; H589-Y592 HydrophobicContact CB-CG 4.03Å; H589-Y592 AromaticContact CE1-CE2 3.74Å; H589-Y592 AromaticContact CG-CD2 3.7Å; H589-Y592 AromaticContact CG-CE2 3.63Å; H589-Y592 AromaticContact ND1-CD2 3.92Å; H589-Y592 AromaticContact ND1-CE2 3.41Å; H589-Y592 WeakPolarHBondContact ND1-CE2 3.48Å; H589-Y592 AromaticContact ND1-CZ 3.81Å; H589-Y592 PolarHBondContact O-N 3.28Å; S590-Y592 VanDerWaalsContact C-N 3.32Å; S590-Y592 PolarHBondContact O-N 3.19Å; Y592-M595 HydrophobicContact CD1-CE 3.98Å; Y592-M595 PolarHBondContact O-N 3.18Å; Y592-H596 VanDerWaalsContact O-CB 3.27Å; Y592-H596 WeakPolarHBondContact O-CB 3.37Å; Y592-H596 PolarHBondContact O-N 2.76Å
593	L	87.6	Confident	84.7	Confident	20 Å²	20	64.2 Å²	64.2	11%	0.105	36%	0.356	C	S	.	.	H	α-helix	trans	-60.1	-52.6	170.4	173.6	61.2	0	0	0	111	C580 F587 H589 S590 M595 H596 E597	C580-L593 HydrophobicContact CB-CD1 3.55Å; F587-L593 HydrophobicContact CB-CB 4.42Å; F587-L593 HydrophobicContact CD2-CB 3.94Å; F587-L593 HydrophobicContact CD2-CD1 3.88Å; F587-L593 HydrophobicContact CE2-CD1 4.05Å; F587-L593 HydrophobicContact CG-CB 4.41Å; H589-L593 PolarHBondContact O-N 3.07Å; S590-L593 PolarHBondContact O-N 2.81Å; L593-M595 VanDerWaalsContact C-N 3.27Å; L593-M595 PolarHBondContact O-N 3.12Å; L593-H596 CarbonylContact O-C 3.52Å; L593-H596 WeakPolarHBondContact O-CA 3.37Å; L593-H596 WeakPolarHBondContact O-CB 3.39Å; L593-H596 PolarHBondContact O-N 3.34Å; L593-E597 HydrophobicContact CD1-CG 4.03Å; L593-E597 HydrophobicContact CG-CG 4.37Å; L593-E597 WeakPolarHBondContact O-CG 3.27Å; L593-E597 PolarHBondContact O-N 3.32Å
594	Q	84.4	Confident	84.6	Confident	114 Å²	114	67 Å²	67	53%	0.533	36%	0.362	S	S	.	.	H	α-helix	trans	-56.8	-40.5	178.2	-76.3	-174.2	-16	0	0	112.7	S590 H596 E597 R598	S590-Q594 WeakPolarHBondContact O-CG 3.47Å; S590-Q594 PolarHBondContact O-N 3.46Å; Q594-H596 VanDerWaalsContact C-N 3.34Å; Q594-E597 PolarHBondContact O-N 3.08Å; Q594-R598 WeakPolarHBondContact O-CG 3.46Å; Q594-R598 PolarHBondContact O-N 3.12Å
595	M	83.8	Confident	84.6	Confident	60 Å²	60	68.3 Å²	68.3	30%	0.296	36%	0.362	S	S	.	.	H	α-helix	trans	-68.4	-35.6	176.8	-177.7	177.7	75.7	0	0	112.3	S591 Y592 L593 Q617	S591-M595 VanDerWaalsContact O-CB 3.23Å; S591-M595 WeakPolarHBondContact O-CB 3.18Å; S591-M595 PolarHBondContact O-N 3.08Å; Y592-M595 HydrophobicContact CD1-CE 3.98Å; Y592-M595 PolarHBondContact O-N 3.18Å; L593-M595 VanDerWaalsContact C-N 3.27Å; L593-M595 PolarHBondContact O-N 3.12Å; M595-Q617 HydrophobicContact CG-CG 4.26Å; M595-Q617 HydrophobicContact SD-CG 3.78Å; M595-Q617 PolarHBondContact SD-NE2 3.19Å
596	H	86.5	Confident	84.4	Confident	25 Å²	25	65.7 Å²	65.7	12%	0.116	35%	0.349	C	S	.	.	H	α-helix	trans	-69.4	-40.4	173.5	171	62.4	0	0	0	111.6	C583 F587 Y592 L593 Q594 R598 T599 H600	C583-H596 PolarHBondContact SG-NE2 3.05Å; F587-H596 HydrophobicContact CE1-CB 4.08Å; F587-H596 HydrophobicContact CE2-CB 3.8Å; F587-H596 AromaticContact CE2-CD2 3.39Å; F587-H596 WeakPolarHBondContact CE2-CD2 3.47Å; F587-H596 AromaticContact CE2-CG 3.64Å; F587-H596 HydrophobicContact CZ-CB 3.44Å; F587-H596 VanDerWaalsContact CZ-CB 3.44Å; F587-H596 AromaticContact CZ-CD2 3.49Å; F587-H596 VanDerWaalsContact CZ-CD2 3.49Å; F587-H596 WeakPolarHBondContact CZ-CD2 3.1Å; F587-H596 AromaticContact CZ-CG 3.28Å; F587-H596 AromaticContact CZ-ND1 3.9Å; Y592-H596 VanDerWaalsContact O-CB 3.27Å; Y592-H596 WeakPolarHBondContact O-CB 3.37Å; Y592-H596 PolarHBondContact O-N 2.76Å; L593-H596 CarbonylContact O-C 3.52Å; L593-H596 WeakPolarHBondContact O-CA 3.37Å; L593-H596 WeakPolarHBondContact O-CB 3.39Å; L593-H596 PolarHBondContact O-N 3.34Å; Q594-H596 VanDerWaalsContact C-N 3.34Å; H596-R598 PolarHBondContact O-N 2.88Å; H596-T599 PolarHBondContact ND1-OG1 3.34Å; H596-T599 WeakPolarHBondContact O-CA 3.48Å; H596-T599 VanDerWaalsContact O-CB 3.3Å; H596-T599 WeakPolarHBondContact O-CB 3.42Å; H596-T599 PolarHBondContact O-N 3.5Å; H596-T599 PolarHBondContact O-OG1 2.83Å; H596-H600 AromaticContact CD2-NE2 3.84Å; H596-H600 AromaticContact CE1-CE1 3.87Å; H596-H600 AromaticContact CE1-NE2 3.51Å; H596-H600 AromaticContact NE2-CE1 3.79Å; H596-H600 AromaticContact NE2-NE2 3.07Å; H596-H600 PolarHBondContact NE2-NE2 3.35Å
597	E	85.9	Confident	84.3	Confident	68 Å²	68	69.4 Å²	69.4	32%	0.318	36%	0.36	S	S	.	.	H	α-helix	trans	-58.3	-34.1	176.6	-72.5	174.5	149.4	0	0	112.3	L593 Q594 T599 H600 T601	L593-E597 HydrophobicContact CD1-CG 4.03Å; L593-E597 HydrophobicContact CG-CG 4.37Å; L593-E597 WeakPolarHBondContact O-CG 3.27Å; L593-E597 PolarHBondContact O-N 3.32Å; Q594-E597 PolarHBondContact O-N 3.08Å; E597-T599 PolarHBondContact O-N 3.46Å; E597-H600 WeakPolarHBondContact O-CB 3.06Å; E597-H600 PolarHBondContact O-N 3.2Å; E597-T601 PolarHBondContact O-N 3.18Å
598	R	86.1	Confident	84.4	Confident	65 Å²	65	67.3 Å²	67.3	25%	0.245	35%	0.351	C	S	.	.	H	α-helix	trans	-61.4	-21.5	172.2	-66.7	175.5	-173.7	177.4	0.2	114	Q594 H596 H600 T601 G602 E603 L616	Q594-R598 WeakPolarHBondContact O-CG 3.46Å; Q594-R598 PolarHBondContact O-N 3.12Å; H596-R598 PolarHBondContact O-N 2.88Å; R598-H600 VanDerWaalsContact C-N 3.32Å; R598-T601 WeakPolarHBondContact CA-OG1 3.43Å; R598-T601 PolarHBondContact O-OG1 3.27Å; R598-G602 WeakPolarHBondContact O-CA 3.3Å; R598-G602 PolarHBondContact O-N 3.49Å; R598-E603 PolarHBondContact O-N 3.19Å; R598-L616 HydrophobicContact CB-CD2 3.9Å
599	T	83.3	Confident	84.5	Confident	77 Å²	77	73.4 Å²	73.4	47%	0.472	38%	0.382	S	S	.	.	H	α-helix	trans	-74.8	-25.2	175.3	69.2	0	0	0	0	112.5	H596 E597	H596-T599 PolarHBondContact ND1-OG1 3.34Å; H596-T599 WeakPolarHBondContact O-CA 3.48Å; H596-T599 VanDerWaalsContact O-CB 3.3Å; H596-T599 WeakPolarHBondContact O-CB 3.42Å; H596-T599 PolarHBondContact O-N 3.5Å; H596-T599 PolarHBondContact O-OG1 2.83Å; E597-T599 PolarHBondContact O-N 3.46Å
600	H	83.6	Confident	84.5	Confident	74 Å²	74	78.4 Å²	78.4	34%	0.343	41%	0.405	S	S	.	.	H	α-helix	trans	-80.5	-38.7	173.9	-59.6	-56.4	0	0	0	111.8	C580 Q582 H596 E597 R598	C580-H600 PolarHBondContact SG-NE2 3.3Å; C580-H600 VanDerWaalsContact SG-NE2 3.45Å; Q582-H600 PolarHBondContact OE1-CD2 2.75Å; Q582-H600 VanDerWaalsContact OE1-CG 3.23Å; H596-H600 AromaticContact CD2-NE2 3.84Å; H596-H600 AromaticContact CE1-CE1 3.87Å; H596-H600 AromaticContact CE1-NE2 3.51Å; H596-H600 AromaticContact NE2-CE1 3.79Å; H596-H600 AromaticContact NE2-NE2 3.07Å; H596-H600 PolarHBondContact NE2-NE2 3.35Å; E597-H600 WeakPolarHBondContact O-CB 3.06Å; E597-H600 PolarHBondContact O-N 3.2Å; R598-H600 VanDerWaalsContact C-N 3.32Å
601	T	81.6	Confident	84.5	Confident	83 Å²	83	78.1 Å²	78.1	51%	0.509	40%	0.403	S	S	.	.	H	α-helix	trans	-80.8	-17.4	178.9	63	0	0	0	0	113.3	E597 R598 E603	E597-T601 PolarHBondContact O-N 3.18Å; R598-T601 WeakPolarHBondContact CA-OG1 3.43Å; R598-T601 PolarHBondContact O-OG1 3.27Å; T601-E603 PolarHBondContact O-N 2.73Å; T601-E603 PolarHBondContact OG1-N 3.26Å
602	G	78.3	Confident	84.4	Confident	48 Å²	48	77.1 Å²	77.1	50%	0.495	40%	0.402	S	S	.	.			trans	71	6	-174.4	0	0	0	0	0	114.1	R598 K604	R598-G602 WeakPolarHBondContact O-CA 3.3Å; R598-G602 PolarHBondContact O-N 3.49Å; G602-K604 PolarHBondContact O-N 3.45Å
603	E	81.5	Confident	84.4	Confident	118 Å²	118	78 Å²	78	55%	0.551	41%	0.408	S	S	*	.			trans	-62	125.5	-179.7	-79.9	-171.7	156.2	0	0	111.5	R598 T601 P605 L616	R598-E603 PolarHBondContact O-N 3.19Å; T601-E603 PolarHBondContact O-N 2.73Å; T601-E603 PolarHBondContact OG1-N 3.26Å; E603-P605 WeakPolarHBondContact O-CD 3.45Å; E603-L616 VanDerWaalsContact O-CD2 3.25Å; E603-L616 WeakPolarHBondContact O-CD2 3.28Å
604	K	84.8	Confident	84.3	Confident	115 Å²	115	79 Å²	79	50%	0.5	42%	0.419	S	S	.	.			trans	-120.4	82.4	176.6	-69.4	-179.6	-175.1	176.8	0	110	G602 Y606 A614 F615 L616	G602-K604 PolarHBondContact O-N 3.45Å; K604-Y606 PolarHBondContact O-N 3.49Å; K604-Y606 VanDerWaalsContact O-N 3.13Å; K604-A614 HydrophobicContact CB-CB 3.59Å; K604-A614 HydrophobicContact CD-CB 4.35Å; K604-A614 WeakPolarHBondContact CD-O 3.39Å; K604-F615 CarbonylContact C-O 3.5Å; K604-F615 WeakPolarHBondContact CA-O 3.39Å; K604-L616 HydrophobicContact CG-CD2 4.44Å; K604-L616 HydrophobicContact CG-CG 4.06Å
605	P	84.3	Confident	84.4	Confident	69 Å²	69	75.6 Å²	75.6	45%	0.448	40%	0.403	S	S	.	.			trans	-70.7	-11.4	-169.4	-18.4	32.1	0	0	0	114.8	E603	E603-P605 WeakPolarHBondContact O-CD 3.45Å
606	Y	85.1	Confident	84.3	Confident	70 Å²	70	75.3 Å²	75.3	28%	0.275	40%	0.402	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	94.3	-170.6	-55.8	-72.6	0	0	0	110.2	K604 A614 F615 P618	K604-Y606 PolarHBondContact O-N 3.49Å; K604-Y606 VanDerWaalsContact O-N 3.13Å; Y606-A614 CarbonylContact O-C 3.53Å; Y606-A614 WeakPolarHBondContact O-CA 3.34Å; Y606-F615 PolarHBondContact N-O 2.87Å; Y606-F615 PolarHBondContact O-N 3.29Å; Y606-P618 HydrophobicContact CD1-CB 4.44Å; Y606-P618 HydrophobicContact CD1-CG 4.12Å; Y606-P618 HydrophobicContact CD2-CG 4.33Å; Y606-P618 HydrophobicContact CE1-CB 4.4Å; Y606-P618 HydrophobicContact CE1-CG 3.67Å; Y606-P618 VanDerWaalsContact CE2-CD 3.49Å; Y606-P618 HydrophobicContact CE2-CG 3.88Å; Y606-P618 HydrophobicContact CG-CG 4.43Å
607	E	85.9	Confident	84	Confident	115 Å²	115	76.1 Å²	76.1	54%	0.537	41%	0.406	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.1	138.6	180	-165.1	176.5	167.2	0	0	112.1	N609 G612	E607-N609 PolarHBondContact O-N 2.87Å; E607-G612 WeakPolarHBondContact OE1-CA 3.25Å
608	C	88.9	Confident	84	Confident	1 Å²	1	75.4 Å²	75.4	1%	0.007	41%	0.408	C	S	.	.			trans	-79.6	112.8	172.5	-177.2	0	0	0	0	110.2	Q610 C611 G612 K613 F615 L621 H628	C608-Q610 PolarHBondContact O-N 3.32Å; C608-C611 PolarHBondContact O-N 2.83Å; C608-G612 WeakPolarHBondContact O-CA 3.37Å; C608-G612 PolarHBondContact O-N 2.58Å; C608-K613 WeakPolarHBondContact CB-O 3.48Å; C608-K613 PolarHBondContact N-O 3.33Å; C608-F615 HydrophobicContact CB-CE2 4.35Å; C608-L621 HydrophobicContact CB-CD1 3.61Å; C608-H628 PolarHBondContact SG-NE2 3.05Å; C608-H628 VanDerWaalsContact SG-NE2 3.4Å
609	N	84.2	Confident	83.9	Confident	158 Å²	158	76.8 Å²	76.8	85%	0.845	42%	0.416	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.9	-21	179.1	-63.6	-28	0	0	0	114	E607	E607-N609 PolarHBondContact O-N 2.87Å
610	Q	81.9	Confident	84.1	Confident	138 Å²	138	78.3 Å²	78.3	65%	0.645	41%	0.414	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.4	-26.8	-178.3	-66.7	-178.7	-6	0	0	113.7	C608 H628	C608-Q610 PolarHBondContact O-N 3.32Å; Q610-H628 PolarHBondContact OE1-CD2 3.21Å
611	C	86.4	Confident	84.2	Confident	55 Å²	55	75.8 Å²	75.8	37%	0.372	40%	0.403	S	S	.	.	T	Hydrogen-bonded Turn	trans	-142.9	10.5	-175.5	78.7	0	0	0	0	114.9	C608 K613 H624	C608-C611 PolarHBondContact O-N 2.83Å; C611-K613 PolarHBondContact O-N 3.13Å; C611-H624 PolarHBondContact SG-NE2 2.78Å
612	G	81.9	Confident	84.4	Confident	41 Å²	41	80.1 Å²	80.1	42%	0.423	41%	0.41	S	S	.	.			trans	65.7	7	177.9	0	0	0	0	0	115.5	E607 C608 A614	E607-G612 WeakPolarHBondContact OE1-CA 3.25Å; C608-G612 WeakPolarHBondContact O-CA 3.37Å; C608-G612 PolarHBondContact O-N 2.58Å; G612-A614 PolarHBondContact O-N 2.98Å
613	K	86.3	Confident	84.7	Confident	124 Å²	124	84.9 Å²	84.9	54%	0.539	42%	0.417	S	S	.	.			trans	-74.4	121.3	-179.1	-77.3	-178.7	-179.1	176.2	0	110	C608 C611 F615	C608-K613 WeakPolarHBondContact CB-O 3.48Å; C608-K613 PolarHBondContact N-O 3.33Å; C611-K613 PolarHBondContact O-N 3.13Å; K613-F615 HydrophobicContact CB-CE2 3.77Å; K613-F615 HydrophobicContact CB-CZ 3.94Å; K613-F615 VanDerWaalsContact O-CD2 3.29Å; K613-F615 WeakPolarHBondContact O-CD2 3.41Å; K613-F615 WeakPolarHBondContact O-CE2 3.39Å
614	A	86.4	Confident	84.9	Confident	41 Å²	41	80.4 Å²	80.4	34%	0.339	40%	0.396	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.3	141.2	177.5	0	0	0	0	0	112.2	K604 Y606 G612	K604-A614 HydrophobicContact CB-CB 3.59Å; K604-A614 HydrophobicContact CD-CB 4.35Å; K604-A614 WeakPolarHBondContact CD-O 3.39Å; Y606-A614 CarbonylContact O-C 3.53Å; Y606-A614 WeakPolarHBondContact O-CA 3.34Å; G612-A614 PolarHBondContact O-N 2.98Å
615	F	85.3	Confident	84.9	Confident	43 Å²	43	78.3 Å²	78.3	19%	0.189	39%	0.388	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	151.8	-177.8	-61.3	-88.5	0	0	0	111.5	K604 Y606 C608 K613 L621 H624	K604-F615 CarbonylContact C-O 3.5Å; K604-F615 WeakPolarHBondContact CA-O 3.39Å; Y606-F615 PolarHBondContact N-O 2.87Å; Y606-F615 PolarHBondContact O-N 3.29Å; C608-F615 HydrophobicContact CB-CE2 4.35Å; K613-F615 HydrophobicContact CB-CE2 3.77Å; K613-F615 HydrophobicContact CB-CZ 3.94Å; K613-F615 VanDerWaalsContact O-CD2 3.29Å; K613-F615 WeakPolarHBondContact O-CD2 3.41Å; K613-F615 WeakPolarHBondContact O-CE2 3.39Å; F615-L621 HydrophobicContact CB-CB 4.39Å; F615-L621 HydrophobicContact CD2-CB 4Å; F615-L621 HydrophobicContact CD2-CD1 3.88Å; F615-L621 HydrophobicContact CE2-CD1 4.07Å; F615-L621 HydrophobicContact CG-CB 4.37Å; F615-H624 HydrophobicContact CE1-CB 3.98Å; F615-H624 HydrophobicContact CE2-CB 3.89Å; F615-H624 AromaticContact CE2-CD2 3.31Å; F615-H624 WeakPolarHBondContact CE2-CD2 3.47Å; F615-H624 AromaticContact CE2-CG 3.65Å; F615-H624 HydrophobicContact CZ-CB 3.43Å; F615-H624 VanDerWaalsContact CZ-CB 3.43Å; F615-H624 AromaticContact CZ-CD2 3.35Å; F615-H624 WeakPolarHBondContact CZ-CD2 3.27Å; F615-H624 AromaticContact CZ-CG 3.22Å; F615-H624 AromaticContact CZ-ND1 3.83Å; F615-H624 AromaticContact CZ-NE2 3.98Å
616	L	81.3	Confident	84.9	Confident	54 Å²	54	82.1 Å²	82.1	28%	0.283	40%	0.398	S	S	.	.	S	Bend	trans	-72.5	-28.1	177.2	-80.7	153.9	0	0	0	113.1	R598 E603 K604	R598-L616 HydrophobicContact CB-CD2 3.9Å; E603-L616 VanDerWaalsContact O-CD2 3.25Å; E603-L616 WeakPolarHBondContact O-CD2 3.28Å; K604-L616 HydrophobicContact CG-CD2 4.44Å; K604-L616 HydrophobicContact CG-CG 4.06Å
617	Q	82	Confident	84.8	Confident	41 Å²	41	82.4 Å²	82.4	19%	0.192	41%	0.407	C	S	.	.	S	Bend	trans	-134.7	149.1	-176	-56.4	177.6	6.4	0	0	112.4	M595 H619 Y620 L621	M595-Q617 HydrophobicContact CG-CG 4.26Å; M595-Q617 HydrophobicContact SD-CG 3.78Å; M595-Q617 PolarHBondContact SD-NE2 3.19Å; Q617-H619 VanDerWaalsContact C-N 3.27Å; Q617-H619 PolarHBondContact O-N 3.34Å; Q617-H619 PolarHBondContact OE1-CE1 3.14Å; Q617-H619 PolarHBondContact OE1-ND1 3.41Å; Q617-Y620 HydrophobicContact CB-CD2 3.69Å; Q617-Y620 HydrophobicContact CB-CE2 4.22Å; Q617-Y620 HydrophobicContact CG-CD2 3.96Å; Q617-Y620 HydrophobicContact CG-CE2 4.03Å; Q617-Y620 PolarHBondContact O-N 3.27Å; Q617-L621 PolarHBondContact O-N 3.26Å
618	P	84.4	Confident	84.4	Confident	54 Å²	54	80.7 Å²	80.7	35%	0.351	40%	0.399	S	S	.	.	H	α-helix	trans	-62.3	-32.1	178.2	-16.8	26.9	0	0	0	113.4	Y606 Y620 L621 R622	Y606-P618 HydrophobicContact CD1-CB 4.44Å; Y606-P618 HydrophobicContact CD1-CG 4.12Å; Y606-P618 HydrophobicContact CD2-CG 4.33Å; Y606-P618 HydrophobicContact CE1-CB 4.4Å; Y606-P618 HydrophobicContact CE1-CG 3.67Å; Y606-P618 VanDerWaalsContact CE2-CD 3.49Å; Y606-P618 HydrophobicContact CE2-CG 3.88Å; Y606-P618 HydrophobicContact CG-CG 4.43Å; P618-Y620 VanDerWaalsContact C-N 3.35Å; P618-L621 PolarHBondContact O-N 2.94Å; P618-R622 WeakPolarHBondContact O-CG 3.2Å; P618-R622 PolarHBondContact O-N 2.8Å
619	H	85	Confident	83.6	Confident	93 Å²	93	85.6 Å²	85.6	43%	0.431	43%	0.429	S	S	.	.	H	α-helix	trans	-68.4	-36.8	-178.5	108.7	-97.5	0	0	0	111.5	Q617 R622 K623	Q617-H619 VanDerWaalsContact C-N 3.27Å; Q617-H619 PolarHBondContact O-N 3.34Å; Q617-H619 PolarHBondContact OE1-CE1 3.14Å; Q617-H619 PolarHBondContact OE1-ND1 3.41Å; H619-R622 PolarHBondContact O-N 2.94Å; H619-K623 WeakPolarHBondContact O-CB 3.41Å; H619-K623 PolarHBondContact O-N 3.22Å
620	Y	86.3	Confident	82.2	Confident	110 Å²	110	88.3 Å²	88.3	43%	0.431	43%	0.427	S	S	.	.	H	α-helix	trans	-67.6	-40.4	175.4	-69.5	-54.5	0	0	0	110.9	Q617 P618 K623 H624	Q617-Y620 HydrophobicContact CB-CD2 3.69Å; Q617-Y620 HydrophobicContact CB-CE2 4.22Å; Q617-Y620 HydrophobicContact CG-CD2 3.96Å; Q617-Y620 HydrophobicContact CG-CE2 4.03Å; Q617-Y620 PolarHBondContact O-N 3.27Å; P618-Y620 VanDerWaalsContact C-N 3.35Å; Y620-K623 PolarHBondContact O-N 3.45Å; Y620-H624 VanDerWaalsContact O-CB 3.29Å; Y620-H624 WeakPolarHBondContact O-CB 3.43Å; Y620-H624 PolarHBondContact O-N 3.21Å
621	L	86.8	Confident	80.6	Confident	21 Å²	21	90.5 Å²	90.5	11%	0.11	44%	0.438	C	S	.	.	H	α-helix	trans	-58.4	-52.3	171.1	173.8	61.1	0	0	0	111	C608 F615 Q617 P618 K623 H624 E625	C608-L621 HydrophobicContact CB-CD1 3.61Å; F615-L621 HydrophobicContact CB-CB 4.39Å; F615-L621 HydrophobicContact CD2-CB 4Å; F615-L621 HydrophobicContact CD2-CD1 3.88Å; F615-L621 HydrophobicContact CE2-CD1 4.07Å; F615-L621 HydrophobicContact CG-CB 4.37Å; Q617-L621 PolarHBondContact O-N 3.26Å; P618-L621 PolarHBondContact O-N 2.94Å; L621-K623 VanDerWaalsContact C-N 3.3Å; L621-K623 PolarHBondContact O-N 3.28Å; L621-H624 CarbonylContact O-C 3.33Å; L621-H624 WeakPolarHBondContact O-CA 3.43Å; L621-H624 WeakPolarHBondContact O-CB 3.43Å; L621-H624 PolarHBondContact O-N 2.92Å; L621-E625 HydrophobicContact CD1-CG 3.92Å; L621-E625 HydrophobicContact CG-CG 4.26Å; L621-E625 WeakPolarHBondContact O-CG 2.85Å; L621-E625 PolarHBondContact O-N 2.95Å
622	R	85.3	Confident	78.5	Confident	173 Å²	173	97.2 Å²	97.2	65%	0.653	46%	0.46	S	S	*	.	H	α-helix	trans	-58.3	-39.2	177.8	-71.8	-179.9	-167.7	176.9	3.1	113.1	P618 H619 H624 K626	P618-R622 WeakPolarHBondContact O-CG 3.2Å; P618-R622 PolarHBondContact O-N 2.8Å; H619-R622 PolarHBondContact O-N 2.94Å; R622-H624 VanDerWaalsContact C-N 3.32Å; R622-K626 WeakPolarHBondContact O-CG 3.47Å; R622-K626 PolarHBondContact O-N 2.77Å
623	K	85.6	Confident	76.8	Confident	148 Å²	148	100.8 Å²	100.8	64%	0.643	48%	0.476	S	S	*	.	H	α-helix	trans	-66.2	-38.4	175.9	-173.2	-179.6	178.5	-177.9	0	110.9	H619 Y620 L621	H619-K623 WeakPolarHBondContact O-CB 3.41Å; H619-K623 PolarHBondContact O-N 3.22Å; Y620-K623 PolarHBondContact O-N 3.45Å; L621-K623 VanDerWaalsContact C-N 3.3Å; L621-K623 PolarHBondContact O-N 3.28Å
624	H	85.4	Confident	74.6	Confident	24 Å²	24	105.6 Å²	105.6	11%	0.111	49%	0.493	C	S	.	.	H	α-helix	trans	-70.1	-41.8	175.6	171.5	64.2	0	0	0	112.5	C611 F615 Y620 L621 R622 K626 T627 H628	C611-H624 PolarHBondContact SG-NE2 2.78Å; F615-H624 HydrophobicContact CE1-CB 3.98Å; F615-H624 HydrophobicContact CE2-CB 3.89Å; F615-H624 AromaticContact CE2-CD2 3.31Å; F615-H624 WeakPolarHBondContact CE2-CD2 3.47Å; F615-H624 AromaticContact CE2-CG 3.65Å; F615-H624 HydrophobicContact CZ-CB 3.43Å; F615-H624 VanDerWaalsContact CZ-CB 3.43Å; F615-H624 AromaticContact CZ-CD2 3.35Å; F615-H624 WeakPolarHBondContact CZ-CD2 3.27Å; F615-H624 AromaticContact CZ-CG 3.22Å; F615-H624 AromaticContact CZ-ND1 3.83Å; F615-H624 AromaticContact CZ-NE2 3.98Å; Y620-H624 VanDerWaalsContact O-CB 3.29Å; Y620-H624 WeakPolarHBondContact O-CB 3.43Å; Y620-H624 PolarHBondContact O-N 3.21Å; L621-H624 CarbonylContact O-C 3.33Å; L621-H624 WeakPolarHBondContact O-CA 3.43Å; L621-H624 WeakPolarHBondContact O-CB 3.43Å; L621-H624 PolarHBondContact O-N 2.92Å; R622-H624 VanDerWaalsContact C-N 3.32Å; H624-K626 PolarHBondContact O-N 3.07Å; H624-T627 WeakPolarHBondContact O-CA 3.46Å; H624-T627 WeakPolarHBondContact O-CB 3.36Å; H624-T627 PolarHBondContact O-N 3.33Å; H624-T627 PolarHBondContact O-OG1 3.25Å; H624-H628 AromaticContact CD2-NE2 3.8Å; H624-H628 AromaticContact CE1-CE1 3.74Å; H624-H628 AromaticContact CE1-NE2 3.48Å; H624-H628 PolarHBondContact CE1-NE2 3.37Å; H624-H628 AromaticContact NE2-CE1 3.72Å; H624-H628 AromaticContact NE2-NE2 3.08Å; H624-H628 PolarHBondContact NE2-NE2 2.87Å
625	E	84.2	Confident	72.2	Confident	72 Å²	72	116.9 Å²	116.9	34%	0.336	53%	0.534	S	S	.	.	H	α-helix	trans	-57.4	-36.3	175.7	-72.8	171.7	152.8	0	0	111.7	L621 T627 H628	L621-E625 HydrophobicContact CD1-CG 3.92Å; L621-E625 HydrophobicContact CG-CG 4.26Å; L621-E625 WeakPolarHBondContact O-CG 2.85Å; L621-E625 PolarHBondContact O-N 2.95Å; E625-T627 PolarHBondContact O-N 3.43Å; E625-H628 WeakPolarHBondContact O-CB 3.39Å; E625-H628 PolarHBondContact O-N 3.35Å; E625-H628 VanDerWaalsContact O-N 3.14Å
626	K	84.3	Confident	71.5	Confident	148 Å²	148	120.6 Å²	120.6	64%	0.643	55%	0.552	S	S	*	*	H	α-helix	trans	-64	-16.4	172.6	-69.9	178.8	-178.9	-168.9	0	114.6	R622 H624 T629	R622-K626 WeakPolarHBondContact O-CG 3.47Å; R622-K626 PolarHBondContact O-N 2.77Å; H624-K626 PolarHBondContact O-N 3.07Å; K626-T629 WeakPolarHBondContact CA-OG1 3.4Å; K626-T629 PolarHBondContact O-OG1 3.27Å
627	T	82.3	Confident	71	Confident	77 Å²	77	124.1 Å²	124.1	47%	0.472	57%	0.566	S	S	.	*	H	α-helix	trans	-80.2	-24.8	175.6	66.9	0	0	0	0	112.4	H624 E625 T629	H624-T627 WeakPolarHBondContact O-CA 3.46Å; H624-T627 WeakPolarHBondContact O-CB 3.36Å; H624-T627 PolarHBondContact O-N 3.33Å; H624-T627 PolarHBondContact O-OG1 3.25Å; E625-T627 PolarHBondContact O-N 3.43Å; T627-T629 VanDerWaalsContact C-N 3.27Å
628	H	79.2	Confident	70.4	Confident	78 Å²	78	128.7 Å²	128.7	36%	0.361	59%	0.586	S	S	.	*	H	α-helix	trans	-74.1	-21.5	171.8	-59.8	-53.6	0	0	0	112.4	C608 Q610 H624 E625	C608-H628 PolarHBondContact SG-NE2 3.05Å; C608-H628 VanDerWaalsContact SG-NE2 3.4Å; Q610-H628 PolarHBondContact OE1-CD2 3.21Å; H624-H628 AromaticContact CD2-NE2 3.8Å; H624-H628 AromaticContact CE1-CE1 3.74Å; H624-H628 AromaticContact CE1-NE2 3.48Å; H624-H628 PolarHBondContact CE1-NE2 3.37Å; H624-H628 AromaticContact NE2-CE1 3.72Å; H624-H628 AromaticContact NE2-NE2 3.08Å; H624-H628 PolarHBondContact NE2-NE2 2.87Å; E625-H628 WeakPolarHBondContact O-CB 3.39Å; E625-H628 PolarHBondContact O-N 3.35Å; E625-H628 VanDerWaalsContact O-N 3.14Å
629	T	70.5	Confident	69.6	Low	104 Å²	104	133.1 Å²	133.1	64%	0.638	60%	0.6	S	S	*	*	T	Hydrogen-bonded Turn	trans	-96.2	7.3	178.3	62.3	0	0	0	0	113.8	K626 T627 E631	K626-T629 WeakPolarHBondContact CA-OG1 3.4Å; K626-T629 PolarHBondContact O-OG1 3.27Å; T627-T629 VanDerWaalsContact C-N 3.27Å; T629-E631 PolarHBondContact O-N 3.22Å
630	R	55.4	Low	68.6	Low	215 Å²	215	135.6 Å²	135.6	81%	0.811	61%	0.611	S	S	*	*			trans	-87.6	97.4	175	-92.6	-174.9	167.6	-176.1	-5	110.1
631	E	48.3	Very low	67.5	Low	185 Å²	185	137.3 Å²	137.3	86%	0.864	62%	0.623	S	S	*	*			trans	-57.5	134.5	160.8	-69.7	-177.2	156.2	0	0	110	T629	T629-E631 PolarHBondContact O-N 3.22Å
632	K	41.9	Very low	66.1	Low	195 Å²	195	145.6 Å²	145.6	85%	0.848	66%	0.66	S	S	*	*			trans	-65.2	129.5	171.5	-72.2	174.5	174.5	176.4	0	109.1	Y634	K632-Y634 PolarHBondContact O-N 3.41Å
633	P	46.2	Very low	64.6	Low	117 Å²	117	143.5 Å²	143.5	76%	0.76	66%	0.66	S	S	*	*			trans	-80.9	112	167.8	30.5	-27.9	0	0	0	110
634	Y	39.6	Very low	62.9	Low	224 Å²	224	143.2 Å²	143.2	88%	0.878	66%	0.661	S	S	*	*			trans	-154.8	132.2	150.7	-80	-76.3	0	0	0	105.6	K632	K632-Y634 PolarHBondContact O-N 3.41Å
635	K	37	Very low	60.8	Low	279 Å²	279	154 Å²	154	100%	1.213	71%	0.711	S	S	*	*			cis	-120	0	31.3	-87.7	173.1	169.2	178.8	0	113.8

Retrieved 635 of 635 residues in 940.5 ms (Link to these results)

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