A0A077ZKV1_TRITR Loading...

CDP-diacylglycerol--glycerol-3-phosphate 3-phosphatidyltransferase

Functions in the biosynthesis of the anionic phospholipids phosphatidylglycerol and cardiolipin.

AlphaFold DB , UniProt , Accession A0A077ZKV1, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 343 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	30.1	Very low	33.9	Very low	237 Å²	237	110.3 Å²	110.3	100%	1.167	57%	0.574	S	S	*	*				0	119.7	0	-76.4	175.9	168.8	0	0	107.7	P3	M1-P3 WeakPolarHBondContact O-CD 3.13Å
2	S	30.7	Very low	33.7	Very low	87 Å²	87	113.7 Å²	113.7	61%	0.608	59%	0.585	S	S	*	*			trans	-66.4	119	179.8	177.4	0	0	0	0	109.5	I4 N33	S2-I4 VanDerWaalsContact C-N 3.33Å; S2-I4 PolarHBondContact O-N 3.03Å; S2-I4 PolarHBondContact OG-O 2.88Å; S2-N33 PolarHBondContact O-ND2 2.99Å
3	P	41	Very low	33.2	Very low	92 Å²	92	111 Å²	111	60%	0.597	57%	0.566	S	S	*	*	S	Bend	trans	-78.9	-12.8	-172.3	28.5	-32	0	0	0	114.3	M1 N33	M1-P3 WeakPolarHBondContact O-CD 3.13Å; P3-N33 PolarHBondContact O-ND2 3.32Å
4	I	36.5	Very low	32.9	Very low	70 Å²	70	110.6 Å²	110.6	36%	0.359	58%	0.579	S	S	.	*	B	Isolated β-bridge	trans	-134.9	122.5	-175.8	-62.2	143.7	0	0	0	108.8	S2 F7	S2-I4 VanDerWaalsContact C-N 3.33Å; S2-I4 PolarHBondContact O-N 3.03Å; S2-I4 PolarHBondContact OG-O 2.88Å; I4-F7 HydrophobicContact CB-CE2 3.98Å; I4-F7 HydrophobicContact CD1-CE2 3.71Å; I4-F7 HydrophobicContact CD1-CZ 3.7Å; I4-F7 HydrophobicContact CG1-CE2 4.21Å; I4-F7 HydrophobicContact CG1-CZ 4.31Å; I4-F7 HydrophobicContact CG2-CD2 3.57Å; I4-F7 HydrophobicContact CG2-CE2 3.33Å; I4-F7 HydrophobicContact CG2-CG 4.34Å; I4-F7 HydrophobicContact CG2-CZ 3.9Å
5	T	34.9	Very low	33.1	Very low	85 Å²	85	107.1 Å²	107.1	52%	0.521	58%	0.579	S	S	.	*	S	Bend	trans	-88.4	-35.5	-175.7	-51.7	0	0	0	0	112.1	N33	T5-N33 PolarHBondContact OG1-OD1 2.82Å
6	R	33.8	Very low	33	Very low	135 Å²	135	110.5 Å²	110.5	51%	0.509	59%	0.588	S	S	.	*			trans	-150.8	136.7	177.4	-69.6	-173.1	179.1	167.6	1.5	113
7	F	32.9	Very low	32.7	Very low	114 Å²	114	109.3 Å²	109.3	50%	0.5	58%	0.581	S	S	.	*			trans	-110.7	132.6	164.7	-80.7	-82.9	0	0	0	109.5	I4 L30	I4-F7 HydrophobicContact CB-CE2 3.98Å; I4-F7 HydrophobicContact CD1-CE2 3.71Å; I4-F7 HydrophobicContact CD1-CZ 3.7Å; I4-F7 HydrophobicContact CG1-CE2 4.21Å; I4-F7 HydrophobicContact CG1-CZ 4.31Å; I4-F7 HydrophobicContact CG2-CD2 3.57Å; I4-F7 HydrophobicContact CG2-CE2 3.33Å; I4-F7 HydrophobicContact CG2-CG 4.34Å; I4-F7 HydrophobicContact CG2-CZ 3.9Å; F7-L30 HydrophobicContact CD1-CD2 3.81Å; F7-L30 HydrophobicContact CE1-CD2 3.58Å
8	H	36	Very low	32.7	Very low	77 Å²	77	110 Å²	110	36%	0.356	58%	0.578	S	S	.	*			trans	-122.3	106.8	167.4	-77.5	-16.5	0	0	0	109.6	I72	H8-I72 HydrophobicContact CB-CG2 4Å; H8-I72 WeakPolarHBondContact CD2-CG2 3.32Å
9	I	35.7	Very low	32.6	Very low	128 Å²	128	116.2 Å²	116.2	66%	0.656	59%	0.593	S	S	*	*	P	Polyproline II helix	trans	-99.7	117.8	175.9	-61.4	172.3	0	0	0	107.2	L11	I9-L11 PolarHBondContact O-N 2.91Å
10	T	34.6	Very low	32.4	Very low	62 Å²	62	114.5 Å²	114.5	38%	0.38	59%	0.588	S	S	.	*	P	Polyproline II helix	trans	-77.9	120.9	166	-45.9	0	0	0	0	108.8	H12 L25	T10-H12 PolarHBondContact O-N 2.77Å; T10-L25 WeakPolarHBondContact CB-O 2.92Å; T10-L25 HydrophobicContact CG2-CB 4.37Å; T10-L25 VanDerWaalsContact CG2-O 3.26Å; T10-L25 WeakPolarHBondContact CG2-O 3.37Å; T10-L25 PolarHBondContact OG1-O 2.68Å
11	L	26.8	Very low	32.3	Very low	126 Å²	126	110.7 Å²	110.7	66%	0.66	57%	0.572	S	S	*	*	P	Polyproline II helix	trans	-57.7	131.2	-175.6	-67.7	164.1	0	0	0	112.2	I9 F13	I9-L11 PolarHBondContact O-N 2.91Å; L11-F13 HydrophobicContact CB-CE2 4.3Å; L11-F13 HydrophobicContact CB-CZ 4.26Å; L11-F13 HydrophobicContact CD1-CZ 4.4Å; L11-F13 PolarHBondContact O-N 3.46Å
12	H	31.3	Very low	32.5	Very low	151 Å²	151	102.2 Å²	102.2	70%	0.699	53%	0.534	S	S	*	.			trans	-85	98.7	171.4	-146.7	-94.8	0	0	0	108.3	T10	T10-H12 PolarHBondContact O-N 2.77Å
13	F	27.3	Very low	33.1	Very low	79 Å²	79	102.3 Å²	102.3	35%	0.346	53%	0.527	S	S	.	.			trans	-73.6	130.5	176.4	-64.6	-78.4	0	0	0	111.2	L11 L17	L11-F13 HydrophobicContact CB-CE2 4.3Å; L11-F13 HydrophobicContact CB-CZ 4.26Å; L11-F13 HydrophobicContact CD1-CZ 4.4Å; L11-F13 PolarHBondContact O-N 3.46Å; F13-L17 HydrophobicContact CB-CB 4.25Å; F13-L17 HydrophobicContact CD1-CB 4.12Å; F13-L17 HydrophobicContact CD1-CD1 4.27Å; F13-L17 HydrophobicContact CG-CB 4.44Å
14	S	29.5	Very low	33.3	Very low	106 Å²	106	101.2 Å²	101.2	74%	0.741	51%	0.512	S	S	*	.			trans	-105.4	150.7	167.4	55.7	0	0	0	0	111.2
15	G	36.1	Very low	33.5	Very low	57 Å²	57	98.5 Å²	98.5	59%	0.588	50%	0.497	S	S	*	.	T	Hydrogen-bonded Turn	trans	82.1	-151	173.1	0	0	0	0	0	115.2	L17 K18	G15-L17 PolarHBondContact O-N 3.34Å; G15-K18 WeakPolarHBondContact O-CB 3.36Å; G15-K18 PolarHBondContact O-N 3.29Å
16	F	30.2	Very low	34.1	Very low	162 Å²	162	97.4 Å²	97.4	71%	0.711	49%	0.491	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.5	-35.2	-175.7	-176.4	-101.6	0	0	0	113	K18 R19 T20	F16-K18 PolarHBondContact O-N 3.19Å; F16-R19 WeakPolarHBondContact O-CB 3.48Å; F16-R19 PolarHBondContact O-N 3.21Å; F16-T20 HydrophobicContact CE1-CG2 4.18Å; F16-T20 HydrophobicContact CZ-CG2 4.38Å
17	L	28.9	Very low	34.8	Very low	90 Å²	90	91.6 Å²	91.6	47%	0.471	47%	0.471	S	S	.	.	H	α-helix	trans	-61.6	-26.2	177.4	-71.9	164.4	0	0	0	113.7	F13 G15 R19 T20 C21	F13-L17 HydrophobicContact CB-CB 4.25Å; F13-L17 HydrophobicContact CD1-CB 4.12Å; F13-L17 HydrophobicContact CD1-CD1 4.27Å; F13-L17 HydrophobicContact CG-CB 4.44Å; G15-L17 PolarHBondContact O-N 3.34Å; L17-R19 VanDerWaalsContact C-N 3.25Å; L17-R19 PolarHBondContact O-N 3.26Å; L17-T20 PolarHBondContact O-N 2.9Å; L17-T20 PolarHBondContact O-OG1 3.18Å; L17-C21 WeakPolarHBondContact O-CB 3.44Å; L17-C21 PolarHBondContact O-N 3.14Å
18	K	31.5	Very low	35.5	Very low	122 Å²	122	87.5 Å²	87.5	53%	0.53	45%	0.454	S	S	.	.	H	α-helix	trans	-70.8	-21	175	-161.8	178.1	-176.7	179.2	0	112.8	G15 F16	G15-K18 WeakPolarHBondContact O-CB 3.36Å; G15-K18 PolarHBondContact O-N 3.29Å; F16-K18 PolarHBondContact O-N 3.19Å
19	R	31.1	Very low	36.3	Very low	227 Å²	227	84.4 Å²	84.4	86%	0.857	44%	0.439	S	S	*	.	H	α-helix	trans	-87.6	-18.4	178.2	-67.2	-174	-175.3	-170.7	1.8	112.9	F16 L17	F16-R19 WeakPolarHBondContact O-CB 3.48Å; F16-R19 PolarHBondContact O-N 3.21Å; L17-R19 VanDerWaalsContact C-N 3.25Å; L17-R19 PolarHBondContact O-N 3.26Å
20	T	29.1	Very low	36.8	Very low	82 Å²	82	80.1 Å²	80.1	50%	0.503	42%	0.417	S	S	.	.	H	α-helix	trans	-112.9	-22.4	-175.1	52.3	0	0	0	0	113.7	F16 L17	F16-T20 HydrophobicContact CE1-CG2 4.18Å; F16-T20 HydrophobicContact CZ-CG2 4.38Å; L17-T20 PolarHBondContact O-N 2.9Å; L17-T20 PolarHBondContact O-OG1 3.18Å
21	C	29.7	Very low	37.2	Very low	36 Å²	36	79.7 Å²	79.7	24%	0.243	41%	0.411	C	S	.	.	S	Bend	trans	-102.9	116.8	175.1	-74.6	0	0	0	0	111.4	L17 I23 Y24	L17-C21 WeakPolarHBondContact O-CB 3.44Å; L17-C21 PolarHBondContact O-N 3.14Å; C21-I23 PolarHBondContact O-N 3.44Å; C21-Y24 HydrophobicContact CB-CE2 4Å
22	P	35	Very low	38	Very low	59 Å²	59	76.3 Å²	76.3	38%	0.383	39%	0.393	S	S	.	.			trans	-56.9	133.4	167.8	16.2	-24.2	0	0	0	109.9	Y24	P22-Y24 HydrophobicContact CB-CE1 4.47Å; P22-Y24 VanDerWaalsContact CD-OH 3.31Å; P22-Y24 WeakPolarHBondContact CD-OH 3.41Å; P22-Y24 HydrophobicContact CG-CE1 3.74Å; P22-Y24 HydrophobicContact CG-CE2 4.34Å; P22-Y24 WeakPolarHBondContact CG-OH 3.41Å; P22-Y24 WeakPolarHBondContact O-CD2 3.22Å; P22-Y24 WeakPolarHBondContact O-CE2 3.39Å; P22-Y24 PolarHBondContact O-N 2.98Å
23	I	43.5	Very low	38.3	Very low	89 Å²	89	73.7 Å²	73.7	46%	0.456	38%	0.384	S	S	.	.			trans	-61.9	110.6	-178.2	-63.7	167.5	0	0	0	108.4	C21	C21-I23 PolarHBondContact O-N 3.44Å
24	Y	44.3	Very low	38.9	Very low	69 Å²	69	74.2 Å²	74.2	27%	0.271	40%	0.397	S	S	.	.			trans	-83.2	-25.5	-158.8	-74.7	-72	0	0	0	116.4	C21 P22 A263	C21-Y24 HydrophobicContact CB-CE2 4Å; P22-Y24 HydrophobicContact CB-CE1 4.47Å; P22-Y24 VanDerWaalsContact CD-OH 3.31Å; P22-Y24 WeakPolarHBondContact CD-OH 3.41Å; P22-Y24 HydrophobicContact CG-CE1 3.74Å; P22-Y24 HydrophobicContact CG-CE2 4.34Å; P22-Y24 WeakPolarHBondContact CG-OH 3.41Å; P22-Y24 WeakPolarHBondContact O-CD2 3.22Å; P22-Y24 WeakPolarHBondContact O-CE2 3.39Å; P22-Y24 PolarHBondContact O-N 2.98Å; Y24-A263 VanDerWaalsContact O-CB 3.3Å; Y24-A263 WeakPolarHBondContact O-CB 3.39Å
25	L	42.2	Very low	39.3	Very low	12 Å²	12	70.5 Å²	70.5	6%	0.063	38%	0.375	C	S	.	.			trans	-173.8	117.5	173.7	-160	65.6	0	0	0	111.1	T10 F29 A263 V265	T10-L25 WeakPolarHBondContact CB-O 2.92Å; T10-L25 HydrophobicContact CG2-CB 4.37Å; T10-L25 VanDerWaalsContact CG2-O 3.26Å; T10-L25 WeakPolarHBondContact CG2-O 3.37Å; T10-L25 PolarHBondContact OG1-O 2.68Å; L25-F29 HydrophobicContact CD2-CE2 4.49Å; L25-A263 HydrophobicContact CD1-CB 4.03Å; L25-V265 HydrophobicContact CD1-CG2 4.24Å
26	T	46.8	Very low	39.3	Very low	62 Å²	62	67.9 Å²	67.9	38%	0.38	35%	0.348	S	S	.	.			trans	-111.9	62.5	176.1	-43	0	0	0	0	110.7	N43	T26-N43 WeakPolarHBondContact CG2-OD1 3.24Å
27	V	49.2	Very low	40	Very low	14 Å²	14	60.2 Å²	60.2	9%	0.085	31%	0.314	C	S	.	.			trans	-140.8	124.6	167.4	-176.4	0	0	0	0	107.2	F29 V265	V27-F29 HydrophobicContact CB-CD2 4.45Å; V27-F29 HydrophobicContact CB-CE2 3.68Å; V27-F29 HydrophobicContact CB-CZ 3.87Å; V27-F29 HydrophobicContact CG1-CD1 4.49Å; V27-F29 HydrophobicContact CG1-CD2 4.21Å; V27-F29 HydrophobicContact CG1-CE1 3.94Å; V27-F29 HydrophobicContact CG1-CE2 3.65Å; V27-F29 HydrophobicContact CG1-CZ 3.49Å; V27-F29 VanDerWaalsContact CG1-CZ 3.49Å; V27-F29 WeakPolarHBondContact O-CD2 3.13Å; V27-F29 WeakPolarHBondContact O-CE2 3.48Å; V27-V265 HydrophobicContact CG2-CB 4.33Å
28	I	47.6	Very low	40.9	Very low	28 Å²	28	56.4 Å²	56.4	14%	0.144	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.5	127.3	176	-62.5	172.5	0	0	0	107.6	L30 F40 L44	I28-L30 HydrophobicContact CG2-CD2 4.36Å; I28-L30 HydrophobicContact CG2-CG 4.46Å; I28-F40 HydrophobicContact CB-CB 4.19Å; I28-F40 PolarHBondContact N-O 2.94Å; I28-F40 VanDerWaalsContact N-O 3.12Å; I28-F40 PolarHBondContact O-N 2.66Å; I28-L44 HydrophobicContact CD1-CD1 3.86Å; I28-L44 HydrophobicContact CD1-CD2 4.17Å; I28-L44 HydrophobicContact CD1-CG 3.52Å
29	F	52.2	Low	41.8	Very low	11 Å²	11	51.4 Å²	51.4	5%	0.048	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	118.2	177.6	-61.7	-88.7	0	0	0	107.2	L25 V27 M37 F39 Y68 I72 V265 Y267	L25-F29 HydrophobicContact CD2-CE2 4.49Å; V27-F29 HydrophobicContact CB-CD2 4.45Å; V27-F29 HydrophobicContact CB-CE2 3.68Å; V27-F29 HydrophobicContact CB-CZ 3.87Å; V27-F29 HydrophobicContact CG1-CD1 4.49Å; V27-F29 HydrophobicContact CG1-CD2 4.21Å; V27-F29 HydrophobicContact CG1-CE1 3.94Å; V27-F29 HydrophobicContact CG1-CE2 3.65Å; V27-F29 HydrophobicContact CG1-CZ 3.49Å; V27-F29 VanDerWaalsContact CG1-CZ 3.49Å; V27-F29 WeakPolarHBondContact O-CD2 3.13Å; V27-F29 WeakPolarHBondContact O-CE2 3.48Å; F29-M37 HydrophobicContact CB-CE 4.49Å; F29-M37 HydrophobicContact CB-SD 3.72Å; F29-M37 HydrophobicContact CD1-CG 4.37Å; F29-M37 HydrophobicContact CD1-SD 4.15Å; F29-M37 HydrophobicContact CG-SD 4.45Å; F29-F39 AromaticContact CD1-CD1 3.52Å; F29-F39 HydrophobicContact CD1-CD1 3.52Å; F29-F39 AromaticContact CD1-CE1 3.42Å; F29-F39 HydrophobicContact CD1-CE1 3.42Å; F29-F39 VanDerWaalsContact CD1-CE1 3.42Å; F29-F39 AromaticContact CE1-CD1 3.5Å; F29-F39 HydrophobicContact CE1-CD1 3.5Å; F29-F39 AromaticContact CE1-CE1 3.38Å; F29-F39 HydrophobicContact CE1-CE1 3.38Å; F29-Y68 HydrophobicContact CD1-CD1 4.07Å; F29-Y68 HydrophobicContact CD1-CD2 4.35Å; F29-Y68 AromaticContact CD1-CG 3.77Å; F29-Y68 HydrophobicContact CD1-CG 3.77Å; F29-Y68 AromaticContact CE1-CD1 3.16Å; F29-Y68 HydrophobicContact CE1-CD1 3.16Å; F29-Y68 AromaticContact CE1-CD2 3.89Å; F29-Y68 HydrophobicContact CE1-CD2 3.89Å; F29-Y68 AromaticContact CE1-CE1 3.73Å; F29-Y68 HydrophobicContact CE1-CE1 3.73Å; F29-Y68 HydrophobicContact CE1-CE2 4.39Å; F29-Y68 AromaticContact CE1-CG 3.27Å; F29-Y68 HydrophobicContact CE1-CG 3.27Å; F29-Y68 HydrophobicContact CE2-CD1 4.37Å; F29-Y68 AromaticContact CZ-CD1 3.35Å; F29-Y68 HydrophobicContact CZ-CD1 3.35Å; F29-Y68 AromaticContact CZ-CE1 3.83Å; F29-Y68 HydrophobicContact CZ-CE1 3.83Å; F29-Y68 AromaticContact CZ-CG 3.95Å; F29-Y68 HydrophobicContact CZ-CG 3.95Å; F29-I72 HydrophobicContact CB-CD1 3.86Å; F29-I72 HydrophobicContact CD2-CD1 3.46Å; F29-I72 VanDerWaalsContact CD2-CD1 3.46Å; F29-I72 HydrophobicContact CD2-CG1 3.99Å; F29-I72 HydrophobicContact CE2-CD1 4.15Å; F29-I72 HydrophobicContact CE2-CG1 4.21Å; F29-I72 HydrophobicContact CG-CD1 3.77Å; F29-V265 HydrophobicContact CZ-CG1 4.42Å; F29-V265 HydrophobicContact CZ-CG2 4.41Å; F29-Y267 WeakPolarHBondContact CE1-OH 3.29Å
30	L	45.5	Very low	42.7	Very low	39 Å²	39	42.3 Å²	42.3	20%	0.204	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	112.8	168.6	-63.1	-178.5	0	0	0	108.3	F7 I28 M37 C38 F40	F7-L30 HydrophobicContact CD1-CD2 3.81Å; F7-L30 HydrophobicContact CE1-CD2 3.58Å; I28-L30 HydrophobicContact CG2-CD2 4.36Å; I28-L30 HydrophobicContact CG2-CG 4.46Å; L30-M37 WeakPolarHBondContact O-CA 3.26Å; L30-C38 HydrophobicContact CB-CB 4.24Å; L30-C38 PolarHBondContact N-O 3.18Å; L30-C38 PolarHBondContact O-N 2.96Å; L30-F40 HydrophobicContact CB-CE2 4.25Å; L30-F40 HydrophobicContact CD1-CD2 4.08Å; L30-F40 HydrophobicContact CD1-CE2 3.34Å; L30-F40 HydrophobicContact CD1-CZ 4.04Å; L30-F40 HydrophobicContact CG-CD2 4.12Å; L30-F40 HydrophobicContact CG-CE2 3.75Å
31	E	43.7	Very low	43.7	Very low	53 Å²	53	39.3 Å²	39.3	25%	0.248	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.6	114.6	166.5	-169.6	-174.3	165.5	0	0	108.4
32	L	43.6	Very low	44.7	Very low	54 Å²	54	37.7 Å²	37.7	28%	0.283	21%	0.209	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.9	143.1	172	-60.5	173.2	0	0	0	108.7	C34 G35 A36	L32-C34 PolarHBondContact O-N 3.37Å; L32-G35 PolarHBondContact O-N 3.43Å; L32-A36 HydrophobicContact CB-CB 4.23Å; L32-A36 HydrophobicContact CD1-CB 4.14Å; L32-A36 PolarHBondContact N-O 3.28Å
33	N	37.8	Very low	45.8	Very low	97 Å²	97	37.2 Å²	37.2	52%	0.519	20%	0.203	S	C	.	.	T	Hydrogen-bonded Turn	trans	-50.2	-4.9	-179.4	-77.8	-17.5	0	0	0	117	S2 P3 T5	S2-N33 PolarHBondContact O-ND2 2.99Å; P3-N33 PolarHBondContact O-ND2 3.32Å; T5-N33 PolarHBondContact OG1-OD1 2.82Å
34	C	39	Very low	46.8	Very low	90 Å²	90	37.6 Å²	37.6	61%	0.608	21%	0.205	S	C	*	.	T	Hydrogen-bonded Turn	trans	-107.8	17.8	-179.8	57.2	0	0	0	0	114	L32 A36	L32-C34 PolarHBondContact O-N 3.37Å; C34-A36 VanDerWaalsContact C-N 3.26Å; C34-A36 PolarHBondContact O-N 3.5Å
35	G	39.1	Very low	48	Very low	28 Å²	28	36.4 Å²	36.4	29%	0.289	21%	0.207	S	C	.	.	T	Hydrogen-bonded Turn	trans	71.8	20.1	-178	0	0	0	0	0	113.7	L32	L32-G35 PolarHBondContact O-N 3.43Å
36	A	35.4	Very low	49.7	Very low	1 Å²	1	40.8 Å²	40.8	1%	0.008	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.5	135.4	176.5	0	0	0	0	0	110.6	L32 C34 R60	L32-A36 HydrophobicContact CB-CB 4.23Å; L32-A36 HydrophobicContact CD1-CB 4.14Å; L32-A36 PolarHBondContact N-O 3.28Å; C34-A36 VanDerWaalsContact C-N 3.26Å; C34-A36 PolarHBondContact O-N 3.5Å; A36-R60 HydrophobicContact CB-CB 4.21Å; A36-R60 HydrophobicContact CB-CG 3.7Å
37	M	44.9	Very low	51.2	Low	2 Å²	2	41.7 Å²	41.7	1%	0.01	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	117.5	177.7	-172.8	68	79.4	0	0	109.7	F29 L30 F39 L58 L59 A65 V69	F29-M37 HydrophobicContact CB-CE 4.49Å; F29-M37 HydrophobicContact CB-SD 3.72Å; F29-M37 HydrophobicContact CD1-CG 4.37Å; F29-M37 HydrophobicContact CD1-SD 4.15Å; F29-M37 HydrophobicContact CG-SD 4.45Å; L30-M37 WeakPolarHBondContact O-CA 3.26Å; M37-F39 HydrophobicContact CB-CE1 4.48Å; M37-F39 HydrophobicContact CB-CZ 4.15Å; M37-F39 HydrophobicContact CG-CD1 4.13Å; M37-F39 HydrophobicContact CG-CE1 3.47Å; M37-F39 VanDerWaalsContact CG-CE1 3.47Å; M37-F39 HydrophobicContact CG-CE2 4.29Å; M37-F39 HydrophobicContact CG-CZ 3.59Å; M37-L58 WeakPolarHBondContact O-CD1 3.46Å; M37-L59 PolarHBondContact N-O 2.77Å; M37-L59 PolarHBondContact O-N 2.75Å; M37-A65 HydrophobicContact CB-CB 4.08Å; M37-A65 VanDerWaalsContact CE-CA 3.43Å; M37-A65 HydrophobicContact CE-CB 3.68Å; M37-A65 WeakPolarHBondContact CE-O 3.39Å; M37-V69 HydrophobicContact CE-CG2 4.25Å
38	C	47.8	Very low	52.6	Low	10 Å²	10	42 Å²	42	7%	0.068	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.8	126	170.8	-61.8	0	0	0	0	109.5	L30 F40 L58	L30-C38 HydrophobicContact CB-CB 4.24Å; L30-C38 PolarHBondContact N-O 3.18Å; L30-C38 PolarHBondContact O-N 2.96Å; C38-F40 HydrophobicContact CB-CD2 4.05Å; C38-F40 HydrophobicContact CB-CE2 3.26Å; C38-F40 HydrophobicContact CB-CZ 3.77Å; C38-L58 HydrophobicContact CB-CD1 4.12Å; C38-L58 WeakPolarHBondContact SG-CD1 3.31Å
39	F	51.3	Low	54.1	Low	17 Å²	17	46.8 Å²	46.8	8%	0.075	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	109.5	173.4	-59.4	-65.4	0	0	0	110.1	F29 M37 V57 L59 L64 Y68 Y267	F29-F39 AromaticContact CD1-CD1 3.52Å; F29-F39 HydrophobicContact CD1-CD1 3.52Å; F29-F39 AromaticContact CD1-CE1 3.42Å; F29-F39 HydrophobicContact CD1-CE1 3.42Å; F29-F39 VanDerWaalsContact CD1-CE1 3.42Å; F29-F39 AromaticContact CE1-CD1 3.5Å; F29-F39 HydrophobicContact CE1-CD1 3.5Å; F29-F39 AromaticContact CE1-CE1 3.38Å; F29-F39 HydrophobicContact CE1-CE1 3.38Å; M37-F39 HydrophobicContact CB-CE1 4.48Å; M37-F39 HydrophobicContact CB-CZ 4.15Å; M37-F39 HydrophobicContact CG-CD1 4.13Å; M37-F39 HydrophobicContact CG-CE1 3.47Å; M37-F39 VanDerWaalsContact CG-CE1 3.47Å; M37-F39 HydrophobicContact CG-CE2 4.29Å; M37-F39 HydrophobicContact CG-CZ 3.59Å; F39-V57 PolarHBondContact N-O 2.73Å; F39-L59 HydrophobicContact CD2-CB 4.45Å; F39-L59 HydrophobicContact CD2-CD1 4.27Å; F39-L59 HydrophobicContact CD2-CG 4.28Å; F39-L59 HydrophobicContact CE2-CB 3.91Å; F39-L59 HydrophobicContact CE2-CD1 3.82Å; F39-L59 HydrophobicContact CE2-CG 4.03Å; F39-L64 HydrophobicContact CE2-CD2 3.88Å; F39-L64 HydrophobicContact CZ-CD2 3.83Å; F39-L64 HydrophobicContact CZ-CG 4.15Å; F39-Y68 AromaticContact CE1-CD2 3.6Å; F39-Y68 HydrophobicContact CE1-CD2 3.6Å; F39-Y68 AromaticContact CE1-CE2 3.79Å; F39-Y68 HydrophobicContact CE1-CE2 3.79Å; F39-Y68 HydrophobicContact CE1-CG 4.2Å; F39-Y68 AromaticContact CZ-CD2 3.77Å; F39-Y68 HydrophobicContact CZ-CD2 3.77Å; F39-Y68 AromaticContact CZ-CE2 3.77Å; F39-Y68 HydrophobicContact CZ-CE2 3.77Å; F39-Y267 HydrophobicContact CD1-CE1 4.27Å; F39-Y267 HydrophobicContact CD1-CE2 4.29Å; F39-Y267 AromaticContact CD1-CZ 3.6Å; F39-Y267 WeakPolarHBondContact CD1-OH 3.45Å; F39-Y267 HydrophobicContact CD2-CE1 4.2Å; F39-Y267 AromaticContact CE1-CE1 3.83Å; F39-Y267 HydrophobicContact CE1-CE1 3.83Å; F39-Y267 AromaticContact CE1-CZ 3.53Å; F39-Y267 WeakPolarHBondContact CE1-OH 3.36Å; F39-Y267 AromaticContact CE2-CE1 3.72Å; F39-Y267 HydrophobicContact CE2-CE1 3.72Å; F39-Y267 AromaticContact CE2-CZ 4Å; F39-Y267 HydrophobicContact CG-CE1 4.44Å; F39-Y267 HydrophobicContact CG-CE2 4.28Å; F39-Y267 AromaticContact CG-CZ 3.88Å; F39-Y267 AromaticContact CZ-CE1 3.51Å; F39-Y267 HydrophobicContact CZ-CE1 3.51Å; F39-Y267 AromaticContact CZ-CZ 3.71Å; F39-Y267 WeakPolarHBondContact CZ-OH 2.87Å
40	F	48.1	Very low	55.6	Low	36 Å²	36	49.5 Å²	49.5	16%	0.158	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100	118.7	171.2	-59.8	-86.6	0	0	0	109.4	I28 L30 C38 Y56	I28-F40 HydrophobicContact CB-CB 4.19Å; I28-F40 PolarHBondContact N-O 2.94Å; I28-F40 VanDerWaalsContact N-O 3.12Å; I28-F40 PolarHBondContact O-N 2.66Å; L30-F40 HydrophobicContact CB-CE2 4.25Å; L30-F40 HydrophobicContact CD1-CD2 4.08Å; L30-F40 HydrophobicContact CD1-CE2 3.34Å; L30-F40 HydrophobicContact CD1-CZ 4.04Å; L30-F40 HydrophobicContact CG-CD2 4.12Å; L30-F40 HydrophobicContact CG-CE2 3.75Å; C38-F40 HydrophobicContact CB-CD2 4.05Å; C38-F40 HydrophobicContact CB-CE2 3.26Å; C38-F40 HydrophobicContact CB-CZ 3.77Å; F40-Y56 HydrophobicContact CD1-CD1 4.01Å; F40-Y56 HydrophobicContact CD1-CE1 4.22Å
41	R	52.2	Low	57.5	Low	19 Å²	19	50.4 Å²	50.4	7%	0.072	28%	0.28	C	S	.	.			trans	-80.8	-14.7	170.4	-163.6	166.5	-178.6	-71	-17.5	112.6	D54 H231 K233 G251 S252	R41-D54 WeakPolarHBondContact CD-OD1 3.47Å; R41-D54 IonicContact CZ-OD1 3.2Å; R41-D54 IonicContact NH1-OD1 3.75Å; R41-D54 PolarHBondContact NH1-OD1 2.98Å; R41-D54 IonicContact NH1-OD2 3.36Å; R41-D54 PolarHBondContact NH1-OD2 3.36Å; R41-H231 PolarHBondContact NH1-O 3.22Å; R41-K233 VanDerWaalsContact CZ-CG 3.49Å; R41-K233 VanDerWaalsContact NH2-CB 3.34Å; R41-G251 PolarHBondContact NE-O 2.91Å; R41-G251 PolarHBondContact NH2-O 3.42Å; R41-G251 VanDerWaalsContact NH2-O 3.1Å; R41-S252 PolarHBondContact NH2-O 2.81Å
42	A	49.7	Very low	59.4	Low	2 Å²	2	49.2 Å²	49.2	2%	0.017	27%	0.273	C	S	.	.	S	Bend	trans	-82.3	139.4	-177.7	0	0	0	0	0	111.7	Y48 Y56	A42-Y48 VanDerWaalsContact CA-CD1 3.49Å; A42-Y48 VanDerWaalsContact CA-CE1 3.48Å; A42-Y48 HydrophobicContact CB-CD1 3.16Å; A42-Y48 HydrophobicContact CB-CD2 4.19Å; A42-Y48 HydrophobicContact CB-CE1 3.75Å; A42-Y48 HydrophobicContact CB-CG 3.4Å; A42-Y56 HydrophobicContact CB-CE1 3.92Å
43	N	58.6	Low	61.4	Low	49 Å²	49	48.9 Å²	48.9	26%	0.262	27%	0.27	S	S	.	.			trans	-63	147.3	152.7	-67.2	-21.8	0	0	0	107.4	T26 S45 Y48	T26-N43 WeakPolarHBondContact CG2-OD1 3.24Å; N43-S45 PolarHBondContact O-N 2.88Å; N43-Y48 HydrophobicContact CB-CD2 4.1Å; N43-Y48 HydrophobicContact CB-CE2 3.68Å; N43-Y48 WeakPolarHBondContact O-CD2 3.27Å
44	L	63.7	Low	63.5	Low	96 Å²	96	44.5 Å²	44.5	50%	0.503	25%	0.246	S	C	.	.	S	Bend	trans	-77.2	46.6	177	-59.8	172.8	0	0	0	111.9	I28 F49	I28-L44 HydrophobicContact CD1-CD1 3.86Å; I28-L44 HydrophobicContact CD1-CD2 4.17Å; I28-L44 HydrophobicContact CD1-CG 3.52Å; L44-F49 HydrophobicContact CD2-CE2 4.21Å; L44-F49 HydrophobicContact CD2-CZ 3.78Å
45	S	70.3	Confident	65.2	Low	45 Å²	45	41.2 Å²	41.2	32%	0.315	22%	0.221	S	C	.	.	S	Bend	trans	-94.3	154.3	172	70	0	0	0	0	110.8	N43 D47 Y48 F49	N43-S45 PolarHBondContact O-N 2.88Å; S45-D47 PolarHBondContact O-N 3.22Å; S45-D47 VanDerWaalsContact O-N 3.12Å; S45-Y48 PolarHBondContact O-N 3.2Å; S45-Y48 VanDerWaalsContact O-N 3.11Å; S45-Y48 WeakPolarHBondContact OG-CD2 3.25Å; S45-F49 WeakPolarHBondContact O-CD2 3.48Å
46	T	77.9	Confident	66.7	Low	103 Å²	103	43.6 Å²	43.6	63%	0.632	22%	0.222	S	C	*	.	H	α-helix	trans	-49.3	-40.1	179.7	-51.9	0	0	0	0	112.6	Y48 F49 T50	T46-Y48 VanDerWaalsContact C-N 3.31Å; T46-Y48 PolarHBondContact O-N 3.3Å; T46-F49 PolarHBondContact O-N 2.71Å; T46-T50 HydrophobicContact CG2-CG2 3.87Å; T46-T50 WeakPolarHBondContact O-CB 3.43Å; T46-T50 WeakPolarHBondContact O-CG2 3.49Å; T46-T50 PolarHBondContact O-N 3.46Å; T46-T50 VanDerWaalsContact O-N 3.09Å; T46-T50 PolarHBondContact O-OG1 3.47Å
47	D	78.6	Confident	68.2	Low	82 Å²	82	45.1 Å²	45.1	44%	0.439	23%	0.231	S	C	.	.	H	α-helix	trans	-57.1	-41.6	-177.7	-51.8	-19.8	0	0	0	112.3	S45 F49 T50 N51 R52	S45-D47 PolarHBondContact O-N 3.22Å; S45-D47 VanDerWaalsContact O-N 3.12Å; D47-F49 PolarHBondContact O-N 3Å; D47-T50 WeakPolarHBondContact CA-OG1 3.49Å; D47-T50 PolarHBondContact O-N 2.84Å; D47-T50 VanDerWaalsContact O-N 3.15Å; D47-N51 WeakPolarHBondContact CA-OD1 3.22Å; D47-N51 CarbonylContact O-C 3.49Å; D47-N51 PolarHBondContact O-N 2.99Å; D47-N51 PolarHBondContact O-OD1 3.01Å; D47-R52 HydrophobicContact CB-CB 4.22Å; D47-R52 WeakPolarHBondContact O-CB 3.4Å; D47-R52 PolarHBondContact O-N 2.79Å
48	Y	77.3	Confident	69.5	Low	20 Å²	20	47.9 Å²	47.9	8%	0.078	25%	0.245	C	C	.	.	H	α-helix	trans	-64	-24.6	179.3	-79.3	-83.8	0	0	0	114	A42 N43 S45 T46 R52 D54 Y56 H231	A42-Y48 VanDerWaalsContact CA-CD1 3.49Å; A42-Y48 VanDerWaalsContact CA-CE1 3.48Å; A42-Y48 HydrophobicContact CB-CD1 3.16Å; A42-Y48 HydrophobicContact CB-CD2 4.19Å; A42-Y48 HydrophobicContact CB-CE1 3.75Å; A42-Y48 HydrophobicContact CB-CG 3.4Å; N43-Y48 HydrophobicContact CB-CD2 4.1Å; N43-Y48 HydrophobicContact CB-CE2 3.68Å; N43-Y48 WeakPolarHBondContact O-CD2 3.27Å; S45-Y48 PolarHBondContact O-N 3.2Å; S45-Y48 VanDerWaalsContact O-N 3.11Å; S45-Y48 WeakPolarHBondContact OG-CD2 3.25Å; T46-Y48 VanDerWaalsContact C-N 3.31Å; T46-Y48 PolarHBondContact O-N 3.3Å; Y48-R52 HydrophobicContact CD1-CG 4.13Å; Y48-R52 HydrophobicContact CE1-CG 4.18Å; Y48-R52 VanDerWaalsContact CZ-NE 3.3Å; Y48-R52 PolarHBondContact OH-NE 2.97Å; Y48-D54 HydrophobicContact CD1-CB 4.34Å; Y48-D54 HydrophobicContact CE1-CB 4.45Å; Y48-D54 WeakPolarHBondContact CE1-OD2 3.29Å; Y48-Y56 PolarHBondContact O-OH 3Å; Y48-H231 AromaticContact CE1-ND1 3.7Å; Y48-H231 PolarHBondContact OH-CE1 3.47Å; Y48-H231 VanDerWaalsContact OH-CE1 3.27Å; Y48-H231 PolarHBondContact OH-ND1 2.77Å
49	F	79.5	Confident	70.5	Confident	128 Å²	128	48.7 Å²	48.7	56%	0.561	25%	0.249	S	C	*	.	H	α-helix	trans	-97.5	-9.6	178.2	-60.7	-71.8	0	0	0	113.4	L44 S45 T46 D47	L44-F49 HydrophobicContact CD2-CE2 4.21Å; L44-F49 HydrophobicContact CD2-CZ 3.78Å; S45-F49 WeakPolarHBondContact O-CD2 3.48Å; T46-F49 PolarHBondContact O-N 2.71Å; D47-F49 PolarHBondContact O-N 3Å
50	T	83.3	Confident	71.6	Confident	69 Å²	69	54.4 Å²	54.4	42%	0.423	27%	0.27	S	S	.	.	H	α-helix	trans	-120.4	-57.7	-171.7	52.2	0	0	0	0	112.9	T46 D47 W228	T46-T50 HydrophobicContact CG2-CG2 3.87Å; T46-T50 WeakPolarHBondContact O-CB 3.43Å; T46-T50 WeakPolarHBondContact O-CG2 3.49Å; T46-T50 PolarHBondContact O-N 3.46Å; T46-T50 VanDerWaalsContact O-N 3.09Å; T46-T50 PolarHBondContact O-OG1 3.47Å; D47-T50 WeakPolarHBondContact CA-OG1 3.49Å; D47-T50 PolarHBondContact O-N 2.84Å; D47-T50 VanDerWaalsContact O-N 3.15Å; T50-W228 WeakPolarHBondContact O-CH2 3.24Å; T50-W228 VanDerWaalsContact O-CZ2 3.24Å; T50-W228 WeakPolarHBondContact O-CZ2 3.12Å
51	N	85.9	Confident	72.9	Confident	58 Å²	58	56.4 Å²	56.4	31%	0.31	28%	0.282	S	S	.	.	T	Hydrogen-bonded Turn	trans	-143	19.9	-167.7	68.3	-4.4	0	0	0	114.3	D47 G227 W228 T229	D47-N51 WeakPolarHBondContact CA-OD1 3.22Å; D47-N51 CarbonylContact O-C 3.49Å; D47-N51 PolarHBondContact O-N 2.99Å; D47-N51 PolarHBondContact O-OD1 3.01Å; N51-G227 WeakPolarHBondContact CB-O 3.5Å; N51-W228 VanDerWaalsContact C-CE3 3.49Å; N51-W228 HydrophobicContact CB-CD2 4.4Å; N51-W228 CarbonylContact O-C 3.52Å; N51-W228 VanDerWaalsContact O-CA 3.25Å; N51-W228 WeakPolarHBondContact O-CA 3.18Å; N51-T229 PolarHBondContact O-N 2.98Å
52	R	83.9	Confident	74.2	Confident	28 Å²	28	58 Å²	58	11%	0.106	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	108.6	173.2	-177.4	172.6	-167.6	89.8	-6	110	D47 Y48 D54 Y154 T229 H231	D47-R52 HydrophobicContact CB-CB 4.22Å; D47-R52 WeakPolarHBondContact O-CB 3.4Å; D47-R52 PolarHBondContact O-N 2.79Å; Y48-R52 HydrophobicContact CD1-CG 4.13Å; Y48-R52 HydrophobicContact CE1-CG 4.18Å; Y48-R52 VanDerWaalsContact CZ-NE 3.3Å; Y48-R52 PolarHBondContact OH-NE 2.97Å; R52-D54 PolarHBondContact O-N 3.26Å; R52-Y154 PolarHBondContact NH2-OH 2.84Å; R52-T229 CarbonylContact C-O 3.58Å; R52-T229 WeakPolarHBondContact CA-O 3.45Å; R52-T229 WeakPolarHBondContact CB-OG1 3.37Å; R52-T229 WeakPolarHBondContact CG-OG1 2.86Å; R52-T229 PolarHBondContact NH1-OG1 2.93Å; R52-H231 HydrophobicContact CG-CB 4.03Å; R52-H231 PolarHBondContact NH2-CD2 3.18Å
53	Q	85.7	Confident	75.5	Confident	47 Å²	47	63 Å²	63	22%	0.22	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.3	111.4	177.1	-175.5	66.2	70	0	0	110.3	Y223 W228 T229 F230 H231 A232 L284	Q53-Y223 HydrophobicContact CB-CE1 4.43Å; Q53-Y223 HydrophobicContact CB-CE2 4.48Å; Q53-Y223 HydrophobicContact CG-CE2 4.09Å; Q53-W228 HydrophobicContact CB-CE3 4.35Å; Q53-T229 PolarHBondContact N-O 3.2Å; Q53-F230 HydrophobicContact CB-CD2 4.29Å; Q53-F230 HydrophobicContact CG-CD2 4.14Å; Q53-F230 HydrophobicContact CG-CE2 4.47Å; Q53-H231 WeakPolarHBondContact O-CA 3.5Å; Q53-H231 PolarHBondContact O-N 3.08Å; Q53-A232 PolarHBondContact O-N 3.47Å; Q53-L284 HydrophobicContact CG-CD2 3.71Å
54	D	81.9	Confident	76.3	Confident	4 Å²	4	61.5 Å²	61.5	2%	0.021	32%	0.318	C	S	.	.			trans	-128.7	-173.5	168.8	-146.4	-35.3	0	0	0	109.8	R41 Y48 R52 H231	R41-D54 WeakPolarHBondContact CD-OD1 3.47Å; R41-D54 IonicContact CZ-OD1 3.2Å; R41-D54 IonicContact NH1-OD1 3.75Å; R41-D54 PolarHBondContact NH1-OD1 2.98Å; R41-D54 IonicContact NH1-OD2 3.36Å; R41-D54 PolarHBondContact NH1-OD2 3.36Å; Y48-D54 HydrophobicContact CD1-CB 4.34Å; Y48-D54 HydrophobicContact CE1-CB 4.45Å; Y48-D54 WeakPolarHBondContact CE1-OD2 3.29Å; R52-D54 PolarHBondContact O-N 3.26Å; D54-H231 IonicContact OD2-CE1 3.76Å; D54-H231 IonicContact OD2-CG 3.68Å; D54-H231 IonicContact OD2-ND1 2.95Å; D54-H231 PolarHBondContact OD2-ND1 3.41Å
55	R	74.2	Confident	77	Confident	22 Å²	22	57 Å²	57	8%	0.083	30%	0.295	C	S	.	.			trans	-113.8	144.9	173	-55.9	174.6	-57.8	164.4	6.5	109.8	A232 K233 L284	R55-A232 HydrophobicContact CG-CB 3.86Å; R55-K233 PolarHBondContact NE-O 2.95Å; R55-K233 PolarHBondContact NH1-O 3.1Å; R55-K233 PolarHBondContact NH2-O 2.92Å; R55-L284 HydrophobicContact CG-CD1 3.99Å
56	Y	70.3	Confident	77.3	Confident	78 Å²	78	58.3 Å²	58.3	31%	0.306	30%	0.299	S	S	.	.			trans	-128	131.7	176.5	-56	-80.3	0	0	0	108.3	F40 A42 Y48	F40-Y56 HydrophobicContact CD1-CD1 4.01Å; F40-Y56 HydrophobicContact CD1-CE1 4.22Å; A42-Y56 HydrophobicContact CB-CE1 3.92Å; Y48-Y56 PolarHBondContact O-OH 3Å
57	V	68.1	Low	77.4	Confident	32 Å²	32	53.6 Å²	53.6	19%	0.194	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	126	174.3	-180	0	0	0	0	108.5	F39 L59 I250 I279	F39-V57 PolarHBondContact N-O 2.73Å; V57-L59 HydrophobicContact CG1-CD2 3.74Å; V57-L59 HydrophobicContact CG1-CG 3.93Å; V57-I250 HydrophobicContact CB-CD1 4.35Å; V57-I250 HydrophobicContact CG2-CD1 3.55Å; V57-I279 HydrophobicContact CG1-CD1 4.23Å; V57-I279 HydrophobicContact CG1-CG1 4.31Å
58	L	71.2	Confident	77.3	Confident	60 Å²	60	49.7 Å²	49.7	31%	0.314	25%	0.249	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-102	114	175	175	53.5	0	0	0	108.8	M37 C38 R60	M37-L58 WeakPolarHBondContact O-CD1 3.46Å; C38-L58 HydrophobicContact CB-CD1 4.12Å; C38-L58 WeakPolarHBondContact SG-CD1 3.31Å; L58-R60 HydrophobicContact CD1-CG 4.46Å; L58-R60 HydrophobicContact CG-CG 4.4Å
59	L	69.1	Low	77.4	Confident	28 Å²	28	50 Å²	50	15%	0.147	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	124	173.4	-54.3	176.1	0	0	0	109.2	M37 F39 V57 L64 V115 Y267 I279	M37-L59 PolarHBondContact N-O 2.77Å; M37-L59 PolarHBondContact O-N 2.75Å; F39-L59 HydrophobicContact CD2-CB 4.45Å; F39-L59 HydrophobicContact CD2-CD1 4.27Å; F39-L59 HydrophobicContact CD2-CG 4.28Å; F39-L59 HydrophobicContact CE2-CB 3.91Å; F39-L59 HydrophobicContact CE2-CD1 3.82Å; F39-L59 HydrophobicContact CE2-CG 4.03Å; V57-L59 HydrophobicContact CG1-CD2 3.74Å; V57-L59 HydrophobicContact CG1-CG 3.93Å; L59-L64 HydrophobicContact CB-CD2 4.09Å; L59-L64 HydrophobicContact CD1-CD2 3.75Å; L59-V115 HydrophobicContact CD1-CG1 4.08Å; L59-V115 HydrophobicContact CD1-CG2 4.11Å; L59-Y267 HydrophobicContact CD1-CD1 4.45Å; L59-I279 HydrophobicContact CD2-CD1 4.48Å
60	R	73.6	Confident	77.4	Confident	136 Å²	136	46.2 Å²	46.2	51%	0.513	24%	0.238	S	C	.	.			trans	-100.6	96.3	177.9	-58.7	-171.9	174.9	-108.9	2.4	109	A36 L58	A36-R60 HydrophobicContact CB-CB 4.21Å; A36-R60 HydrophobicContact CB-CG 3.7Å; L58-R60 HydrophobicContact CD1-CG 4.46Å; L58-R60 HydrophobicContact CG-CG 4.4Å
61	N	75.8	Confident	77.1	Confident	78 Å²	78	43.1 Å²	43.1	42%	0.417	22%	0.219	S	C	.	.			trans	-153.8	118.5	178.3	-175	-78.1	0	0	0	110.3	N63 L64 A65	N61-N63 PolarHBondContact O-N 3.22Å; N61-N63 WeakPolarHBondContact OD1-CB 3.48Å; N61-N63 PolarHBondContact OD1-N 2.79Å; N61-N63 VanDerWaalsContact OD1-N 3.14Å; N61-L64 HydrophobicContact CB-CB 3.87Å; N61-L64 PolarHBondContact O-N 3.32Å; N61-L64 PolarHBondContact OD1-N 2.83Å; N61-A65 WeakPolarHBondContact O-CB 3.22Å; N61-A65 PolarHBondContact O-N 3.36Å
62	A	78.8	Confident	76.5	Confident	54 Å²	54	41.2 Å²	41.2	45%	0.446	21%	0.208	S	C	.	.	H	α-helix	trans	-62.7	-42.2	-176.9	0	0	0	0	0	112.5	L64 A65 D66	A62-L64 VanDerWaalsContact C-N 3.33Å; A62-L64 PolarHBondContact O-N 3.19Å; A62-A65 WeakPolarHBondContact O-CB 3.45Å; A62-A65 PolarHBondContact O-N 3.06Å; A62-A65 VanDerWaalsContact O-N 3.15Å; A62-D66 WeakPolarHBondContact O-CB 3.33Å; A62-D66 VanDerWaalsContact O-CG 3.25Å; A62-D66 PolarHBondContact O-N 2.89Å
63	N	77.8	Confident	76.1	Confident	107 Å²	107	42.3 Å²	42.3	57%	0.572	22%	0.217	S	C	*	.	H	α-helix	trans	-63.9	-39.4	178.2	-66.6	-35.1	0	0	0	112.1	N61 F67 W99	N61-N63 PolarHBondContact O-N 3.22Å; N61-N63 WeakPolarHBondContact OD1-CB 3.48Å; N61-N63 PolarHBondContact OD1-N 2.79Å; N61-N63 VanDerWaalsContact OD1-N 3.14Å; N63-F67 WeakPolarHBondContact O-CB 3.49Å; N63-F67 PolarHBondContact O-N 2.81Å; N63-W99 VanDerWaalsContact O-CH2 3.31Å; N63-W99 WeakPolarHBondContact O-CH2 3.34Å
64	L	76.2	Confident	75.5	Confident	16 Å²	16	40.5 Å²	40.5	8%	0.084	21%	0.208	C	C	.	.	H	α-helix	trans	-67.1	-40.4	174.8	-169.5	66.7	0	0	0	110.7	F39 L59 N61 A62 F67 Y68 V115 P117 Y267	F39-L64 HydrophobicContact CE2-CD2 3.88Å; F39-L64 HydrophobicContact CZ-CD2 3.83Å; F39-L64 HydrophobicContact CZ-CG 4.15Å; L59-L64 HydrophobicContact CB-CD2 4.09Å; L59-L64 HydrophobicContact CD1-CD2 3.75Å; N61-L64 HydrophobicContact CB-CB 3.87Å; N61-L64 PolarHBondContact O-N 3.32Å; N61-L64 PolarHBondContact OD1-N 2.83Å; A62-L64 VanDerWaalsContact C-N 3.33Å; A62-L64 PolarHBondContact O-N 3.19Å; L64-F67 WeakPolarHBondContact O-CB 3.43Å; L64-F67 PolarHBondContact O-N 2.81Å; L64-Y68 HydrophobicContact CD1-CD2 4.33Å; L64-Y68 HydrophobicContact CD1-CE2 3.67Å; L64-Y68 HydrophobicContact CG-CD2 4.19Å; L64-Y68 HydrophobicContact CG-CE2 3.9Å; L64-Y68 WeakPolarHBondContact O-CD2 3.38Å; L64-Y68 PolarHBondContact O-N 2.8Å; L64-V115 HydrophobicContact CD1-CG1 4.36Å; L64-V115 HydrophobicContact CD2-CG1 4.2Å; L64-P117 HydrophobicContact CD1-CB 4.28Å; L64-P117 HydrophobicContact CD1-CG 4.34Å; L64-Y267 HydrophobicContact CD2-CE1 4.48Å
65	A	77.3	Confident	74.9	Confident	2 Å²	2	41 Å²	41	2%	0.017	21%	0.211	C	C	.	.	H	α-helix	trans	-59.7	-51.4	175.6	0	0	0	0	0	111.2	M37 N61 A62 F67 Y68 V69	M37-A65 HydrophobicContact CB-CB 4.08Å; M37-A65 VanDerWaalsContact CE-CA 3.43Å; M37-A65 HydrophobicContact CE-CB 3.68Å; M37-A65 WeakPolarHBondContact CE-O 3.39Å; N61-A65 WeakPolarHBondContact O-CB 3.22Å; N61-A65 PolarHBondContact O-N 3.36Å; A62-A65 WeakPolarHBondContact O-CB 3.45Å; A62-A65 PolarHBondContact O-N 3.06Å; A62-A65 VanDerWaalsContact O-N 3.15Å; A65-F67 VanDerWaalsContact C-N 3.3Å; A65-F67 PolarHBondContact O-N 2.89Å; A65-Y68 PolarHBondContact O-N 2.9Å; A65-Y68 VanDerWaalsContact O-N 3.1Å; A65-V69 WeakPolarHBondContact O-CG2 3.32Å; A65-V69 PolarHBondContact O-N 2.92Å
66	D	77.9	Confident	74.6	Confident	73 Å²	73	41.6 Å²	41.6	39%	0.39	22%	0.221	S	C	.	.	H	α-helix	trans	-57.9	-40.8	177.3	-70.6	-17.3	0	0	0	111.9	A62 Y68 V69 D70 W99	A62-D66 WeakPolarHBondContact O-CB 3.33Å; A62-D66 VanDerWaalsContact O-CG 3.25Å; A62-D66 PolarHBondContact O-N 2.89Å; D66-Y68 VanDerWaalsContact C-N 3.32Å; D66-Y68 PolarHBondContact O-N 3.27Å; D66-V69 PolarHBondContact O-N 2.93Å; D66-D70 WeakPolarHBondContact O-CB 3.48Å; D66-D70 PolarHBondContact O-N 2.83Å; D66-W99 HydrophobicContact CB-CH2 3.86Å; D66-W99 HydrophobicContact CB-CZ2 4.18Å
67	F	79.4	Confident	74.5	Confident	4 Å²	4	44.9 Å²	44.9	2%	0.018	23%	0.233	C	C	.	.	H	α-helix	trans	-56.3	-46.5	174.9	171.3	-90.7	0	0	0	111.9	N63 L64 A65 D70 L71 W99 P117 V119	N63-F67 WeakPolarHBondContact O-CB 3.49Å; N63-F67 PolarHBondContact O-N 2.81Å; L64-F67 WeakPolarHBondContact O-CB 3.43Å; L64-F67 PolarHBondContact O-N 2.81Å; A65-F67 VanDerWaalsContact C-N 3.3Å; A65-F67 PolarHBondContact O-N 2.89Å; F67-D70 PolarHBondContact O-N 2.85Å; F67-L71 HydrophobicContact CE1-CD2 4.2Å; F67-L71 WeakPolarHBondContact O-CB 3.28Å; F67-L71 PolarHBondContact O-N 2.85Å; F67-W99 HydrophobicContact CB-CD2 4.14Å; F67-W99 HydrophobicContact CB-CE3 4.08Å; F67-W99 HydrophobicContact CB-CH2 3.78Å; F67-W99 HydrophobicContact CB-CZ2 3.86Å; F67-W99 HydrophobicContact CB-CZ3 3.89Å; F67-W99 HydrophobicContact CD2-CB 4Å; F67-W99 AromaticContact CD2-CD1 3.82Å; F67-W99 AromaticContact CD2-CD2 3.5Å; F67-W99 HydrophobicContact CD2-CD2 3.5Å; F67-W99 AromaticContact CD2-CE2 3.88Å; F67-W99 AromaticContact CD2-CE3 3.9Å; F67-W99 HydrophobicContact CD2-CE3 3.9Å; F67-W99 AromaticContact CD2-CG 3.51Å; F67-W99 HydrophobicContact CD2-CG 3.51Å; F67-W99 HydrophobicContact CE2-CB 4.07Å; F67-W99 HydrophobicContact CE2-CD2 4.41Å; F67-W99 AromaticContact CE2-CG 3.97Å; F67-W99 HydrophobicContact CE2-CG 3.97Å; F67-W99 HydrophobicContact CG-CD2 4.31Å; F67-W99 HydrophobicContact CG-CE3 4.49Å; F67-W99 VanDerWaalsContact N-CH2 3.33Å; F67-W99 VanDerWaalsContact N-CZ2 3.33Å; F67-P117 HydrophobicContact CD1-CB 3.89Å; F67-P117 HydrophobicContact CD1-CG 4.15Å; F67-P117 HydrophobicContact CD2-CG 4.4Å; F67-P117 HydrophobicContact CE1-CB 3.5Å; F67-P117 HydrophobicContact CE1-CG 4.01Å; F67-P117 HydrophobicContact CE2-CG 4.27Å; F67-P117 HydrophobicContact CG-CG 4.36Å; F67-P117 HydrophobicContact CZ-CB 3.89Å; F67-P117 HydrophobicContact CZ-CG 4.06Å; F67-V119 HydrophobicContact CE1-CG2 4.17Å; F67-V119 HydrophobicContact CZ-CG2 3.73Å
68	Y	76.1	Confident	74.2	Confident	0 Å²	0	44.6 Å²	44.6	0%	0	23%	0.23	C	C	.	.	H	α-helix	trans	-74	-36.2	-179.7	-76.9	-65.4	0	0	0	113	F29 F39 L64 A65 D66 D70 L71 I72 P117 V265 Y267	F29-Y68 HydrophobicContact CD1-CD1 4.07Å; F29-Y68 HydrophobicContact CD1-CD2 4.35Å; F29-Y68 AromaticContact CD1-CG 3.77Å; F29-Y68 HydrophobicContact CD1-CG 3.77Å; F29-Y68 AromaticContact CE1-CD1 3.16Å; F29-Y68 HydrophobicContact CE1-CD1 3.16Å; F29-Y68 AromaticContact CE1-CD2 3.89Å; F29-Y68 HydrophobicContact CE1-CD2 3.89Å; F29-Y68 AromaticContact CE1-CE1 3.73Å; F29-Y68 HydrophobicContact CE1-CE1 3.73Å; F29-Y68 HydrophobicContact CE1-CE2 4.39Å; F29-Y68 AromaticContact CE1-CG 3.27Å; F29-Y68 HydrophobicContact CE1-CG 3.27Å; F29-Y68 HydrophobicContact CE2-CD1 4.37Å; F29-Y68 AromaticContact CZ-CD1 3.35Å; F29-Y68 HydrophobicContact CZ-CD1 3.35Å; F29-Y68 AromaticContact CZ-CE1 3.83Å; F29-Y68 HydrophobicContact CZ-CE1 3.83Å; F29-Y68 AromaticContact CZ-CG 3.95Å; F29-Y68 HydrophobicContact CZ-CG 3.95Å; F39-Y68 AromaticContact CE1-CD2 3.6Å; F39-Y68 HydrophobicContact CE1-CD2 3.6Å; F39-Y68 AromaticContact CE1-CE2 3.79Å; F39-Y68 HydrophobicContact CE1-CE2 3.79Å; F39-Y68 HydrophobicContact CE1-CG 4.2Å; F39-Y68 AromaticContact CZ-CD2 3.77Å; F39-Y68 HydrophobicContact CZ-CD2 3.77Å; F39-Y68 AromaticContact CZ-CE2 3.77Å; F39-Y68 HydrophobicContact CZ-CE2 3.77Å; L64-Y68 HydrophobicContact CD1-CD2 4.33Å; L64-Y68 HydrophobicContact CD1-CE2 3.67Å; L64-Y68 HydrophobicContact CG-CD2 4.19Å; L64-Y68 HydrophobicContact CG-CE2 3.9Å; L64-Y68 WeakPolarHBondContact O-CD2 3.38Å; L64-Y68 PolarHBondContact O-N 2.8Å; A65-Y68 PolarHBondContact O-N 2.9Å; A65-Y68 VanDerWaalsContact O-N 3.1Å; D66-Y68 VanDerWaalsContact C-N 3.32Å; D66-Y68 PolarHBondContact O-N 3.27Å; Y68-D70 VanDerWaalsContact C-N 3.3Å; Y68-D70 PolarHBondContact O-N 2.67Å; Y68-L71 HydrophobicContact CD1-CD2 4Å; Y68-L71 HydrophobicContact CE1-CD2 4.04Å; Y68-L71 PolarHBondContact O-N 3.48Å; Y68-I72 WeakPolarHBondContact O-CD1 3.41Å; Y68-I72 WeakPolarHBondContact O-CG1 3.11Å; Y68-I72 PolarHBondContact O-N 2.8Å; Y68-P117 HydrophobicContact CE2-CB 4.47Å; Y68-P117 WeakPolarHBondContact OH-CB 3Å; Y68-V265 HydrophobicContact CD1-CG1 4.38Å; Y68-V265 HydrophobicContact CE1-CB 4.38Å; Y68-V265 HydrophobicContact CE1-CG1 3.29Å; Y68-V265 HydrophobicContact CE1-CG2 4.2Å; Y68-V265 WeakPolarHBondContact OH-CG1 3.49Å; Y68-Y267 HydrophobicContact CD2-CE1 4.47Å; Y68-Y267 WeakPolarHBondContact CE1-OH 3.05Å; Y68-Y267 HydrophobicContact CE2-CD1 4.44Å; Y68-Y267 AromaticContact CE2-CE1 3.35Å; Y68-Y267 HydrophobicContact CE2-CE1 3.35Å; Y68-Y267 AromaticContact CE2-CZ 3.75Å; Y68-Y267 VanDerWaalsContact CE2-OH 3.31Å; Y68-Y267 WeakPolarHBondContact CE2-OH 3.34Å; Y68-Y267 AromaticContact CZ-CE1 3.37Å; Y68-Y267 AromaticContact CZ-CZ 3.46Å; Y68-Y267 VanDerWaalsContact CZ-CZ 3.46Å; Y68-Y267 WeakPolarHBondContact OH-CE1 3.47Å; Y68-Y267 PolarHBondContact OH-OH 2.98Å
69	V	78.6	Confident	73.6	Confident	27 Å²	27	45.4 Å²	45.4	16%	0.164	24%	0.241	C	C	.	.	H	α-helix	trans	-58.3	-47	171.8	171	0	0	0	0	110	M37 A65 D66 L71 I72 N73	M37-V69 HydrophobicContact CE-CG2 4.25Å; A65-V69 WeakPolarHBondContact O-CG2 3.32Å; A65-V69 PolarHBondContact O-N 2.92Å; D66-V69 PolarHBondContact O-N 2.93Å; V69-L71 PolarHBondContact O-N 2.9Å; V69-I72 PolarHBondContact O-N 3.44Å; V69-N73 WeakPolarHBondContact CG1-ND2 3.38Å; V69-N73 WeakPolarHBondContact O-CB 3.47Å; V69-N73 PolarHBondContact O-N 3.4Å; V69-N73 PolarHBondContact O-ND2 3.07Å
70	D	79.5	Confident	72.8	Confident	48 Å²	48	52.5 Å²	52.5	26%	0.257	27%	0.271	S	S	.	.	H	α-helix	trans	-59.9	-45.6	174.9	-90	-6.6	0	0	0	112.4	D66 F67 Y68 N73 L74 L95 R98 W99	D66-D70 WeakPolarHBondContact O-CB 3.48Å; D66-D70 PolarHBondContact O-N 2.83Å; F67-D70 PolarHBondContact O-N 2.85Å; Y68-D70 VanDerWaalsContact C-N 3.3Å; Y68-D70 PolarHBondContact O-N 2.67Å; D70-N73 PolarHBondContact O-N 2.79Å; D70-L74 WeakPolarHBondContact O-CB 3.44Å; D70-L74 PolarHBondContact O-N 2.74Å; D70-L95 HydrophobicContact CB-CD1 4.02Å; D70-L95 WeakPolarHBondContact O-CD1 3.22Å; D70-R98 IonicContact OD2-NH2 2.91Å; D70-W99 HydrophobicContact CB-CZ2 4.49Å; D70-W99 PolarHBondContact OD2-NE1 2.96Å
71	L	77	Confident	71.9	Confident	3 Å²	3	55 Å²	55	2%	0.016	28%	0.28	C	S	.	.	H	α-helix	trans	-62.8	-44.9	179.1	-179.3	62.8	0	0	0	111.4	F67 Y68 V69 L74 V75 I92 L95 V119 V265	F67-L71 HydrophobicContact CE1-CD2 4.2Å; F67-L71 WeakPolarHBondContact O-CB 3.28Å; F67-L71 PolarHBondContact O-N 2.85Å; Y68-L71 HydrophobicContact CD1-CD2 4Å; Y68-L71 HydrophobicContact CE1-CD2 4.04Å; Y68-L71 PolarHBondContact O-N 3.48Å; V69-L71 PolarHBondContact O-N 2.9Å; L71-L74 WeakPolarHBondContact O-CB 3.5Å; L71-L74 PolarHBondContact O-N 3.17Å; L71-V75 HydrophobicContact CD1-CG2 4.36Å; L71-V75 WeakPolarHBondContact O-CG2 3.39Å; L71-V75 PolarHBondContact O-N 3.28Å; L71-I92 HydrophobicContact CD1-CD1 4.39Å; L71-L95 HydrophobicContact CD1-CD2 4.31Å; L71-V119 HydrophobicContact CD1-CG1 4.15Å; L71-V119 HydrophobicContact CD1-CG2 4.24Å; L71-V119 HydrophobicContact CD2-CG1 4.43Å; L71-V119 HydrophobicContact CD2-CG2 3.68Å; L71-V265 HydrophobicContact CD2-CG2 3.9Å
72	I	75	Confident	71	Confident	18 Å²	18	57.7 Å²	57.7	9%	0.092	29%	0.294	C	S	.	.	H	α-helix	trans	-66.9	-43.9	178.7	-58.4	155.6	0	0	0	110.1	H8 F29 Y68 V69 L74 V75 A76	H8-I72 HydrophobicContact CB-CG2 4Å; H8-I72 WeakPolarHBondContact CD2-CG2 3.32Å; F29-I72 HydrophobicContact CB-CD1 3.86Å; F29-I72 HydrophobicContact CD2-CD1 3.46Å; F29-I72 VanDerWaalsContact CD2-CD1 3.46Å; F29-I72 HydrophobicContact CD2-CG1 3.99Å; F29-I72 HydrophobicContact CE2-CD1 4.15Å; F29-I72 HydrophobicContact CE2-CG1 4.21Å; F29-I72 HydrophobicContact CG-CD1 3.77Å; Y68-I72 WeakPolarHBondContact O-CD1 3.41Å; Y68-I72 WeakPolarHBondContact O-CG1 3.11Å; Y68-I72 PolarHBondContact O-N 2.8Å; V69-I72 PolarHBondContact O-N 3.44Å; I72-L74 PolarHBondContact O-N 3.34Å; I72-V75 PolarHBondContact O-N 3.03Å; I72-A76 WeakPolarHBondContact O-CB 3.37Å; I72-A76 PolarHBondContact O-N 3.45Å
73	N	75.4	Confident	70.2	Confident	52 Å²	52	56.3 Å²	56.3	28%	0.278	28%	0.282	S	S	.	.	H	α-helix	trans	-59.1	-35.8	175.2	-73.4	-34.5	0	0	0	111.7	V69 D70 R77	V69-N73 WeakPolarHBondContact CG1-ND2 3.38Å; V69-N73 WeakPolarHBondContact O-CB 3.47Å; V69-N73 PolarHBondContact O-N 3.4Å; V69-N73 PolarHBondContact O-ND2 3.07Å; D70-N73 PolarHBondContact O-N 2.79Å; N73-R77 VanDerWaalsContact O-CG 3.31Å; N73-R77 WeakPolarHBondContact O-CG 3.44Å; N73-R77 PolarHBondContact O-N 3.49Å; N73-R77 PolarHBondContact O-NE 3.22Å
74	L	72.2	Confident	69.4	Low	9 Å²	9	58.3 Å²	58.3	5%	0.047	30%	0.301	C	S	.	.	H	α-helix	trans	-65.5	-54.1	172.3	178.4	70.7	0	0	0	111.4	D70 L71 I72 A76 R77 L78 F90 I92 L95	D70-L74 WeakPolarHBondContact O-CB 3.44Å; D70-L74 PolarHBondContact O-N 2.74Å; L71-L74 WeakPolarHBondContact O-CB 3.5Å; L71-L74 PolarHBondContact O-N 3.17Å; I72-L74 PolarHBondContact O-N 3.34Å; L74-A76 VanDerWaalsContact C-N 3.33Å; L74-A76 PolarHBondContact O-N 2.94Å; L74-R77 WeakPolarHBondContact O-CB 3.43Å; L74-R77 PolarHBondContact O-N 2.74Å; L74-L78 WeakPolarHBondContact O-CG 3.43Å; L74-L78 PolarHBondContact O-N 2.81Å; L74-F90 HydrophobicContact CD1-CE2 4.36Å; L74-F90 HydrophobicContact CD2-CE2 3.78Å; L74-F90 HydrophobicContact CD2-CZ 4.24Å; L74-F90 HydrophobicContact CG-CE2 3.99Å; L74-I92 HydrophobicContact CD2-CB 3.94Å; L74-I92 HydrophobicContact CD2-CD1 4.09Å; L74-I92 HydrophobicContact CD2-CG1 3.84Å; L74-L95 HydrophobicContact CB-CD1 3.66Å; L74-L95 HydrophobicContact CD2-CB 3.75Å; L74-L95 HydrophobicContact CD2-CD1 3.72Å; L74-L95 HydrophobicContact CD2-CD2 4.41Å; L74-L95 HydrophobicContact CD2-CG 4.16Å; L74-L95 HydrophobicContact CG-CD1 4.24Å
75	V	68.9	Low	68.9	Low	14 Å²	14	62.2 Å²	62.2	9%	0.085	33%	0.33	C	S	.	.	H	α-helix	trans	-61.5	-41.4	-178	173.7	0	0	0	0	111.3	L71 I72 R77 L78 S79	L71-V75 HydrophobicContact CD1-CG2 4.36Å; L71-V75 WeakPolarHBondContact O-CG2 3.39Å; L71-V75 PolarHBondContact O-N 3.28Å; I72-V75 PolarHBondContact O-N 3.03Å; V75-R77 VanDerWaalsContact C-N 3.29Å; V75-R77 PolarHBondContact O-N 3.15Å; V75-L78 WeakPolarHBondContact O-CA 3.21Å; V75-L78 VanDerWaalsContact O-CB 3.23Å; V75-L78 WeakPolarHBondContact O-CB 3.34Å; V75-L78 PolarHBondContact O-N 3.48Å; V75-S79 PolarHBondContact O-N 2.72Å
76	A	69.3	Low	68	Low	34 Å²	34	64.2 Å²	64.2	28%	0.281	35%	0.351	S	S	.	.	H	α-helix	trans	-58.1	-41	176.7	0	0	0	0	0	111.5	I72 L74 L78 S79 F80	I72-A76 WeakPolarHBondContact O-CB 3.37Å; I72-A76 PolarHBondContact O-N 3.45Å; L74-A76 VanDerWaalsContact C-N 3.33Å; L74-A76 PolarHBondContact O-N 2.94Å; A76-L78 PolarHBondContact O-N 3.18Å; A76-S79 PolarHBondContact O-N 3.49Å; A76-F80 WeakPolarHBondContact O-CD2 3.44Å; A76-F80 WeakPolarHBondContact O-CE2 3.37Å
77	R	67.8	Low	67	Low	147 Å²	147	63 Å²	63	56%	0.555	35%	0.35	S	S	*	.	H	α-helix	trans	-62.9	-26.1	174.9	-73.7	-179.3	-65.9	178.4	4.2	113.3	N73 L74 V75	N73-R77 VanDerWaalsContact O-CG 3.31Å; N73-R77 WeakPolarHBondContact O-CG 3.44Å; N73-R77 PolarHBondContact O-N 3.49Å; N73-R77 PolarHBondContact O-NE 3.22Å; L74-R77 WeakPolarHBondContact O-CB 3.43Å; L74-R77 PolarHBondContact O-N 2.74Å; V75-R77 VanDerWaalsContact C-N 3.29Å; V75-R77 PolarHBondContact O-N 3.15Å
78	L	61.3	Low	65.8	Low	27 Å²	27	65.9 Å²	65.9	14%	0.141	37%	0.368	C	S	.	.	H	α-helix	trans	-73.9	-38.2	176.4	-47.6	174.8	0	0	0	112	L74 V75 A76 F80 R81 V88 F90 F121	L74-L78 WeakPolarHBondContact O-CG 3.43Å; L74-L78 PolarHBondContact O-N 2.81Å; V75-L78 WeakPolarHBondContact O-CA 3.21Å; V75-L78 VanDerWaalsContact O-CB 3.23Å; V75-L78 WeakPolarHBondContact O-CB 3.34Å; V75-L78 PolarHBondContact O-N 3.48Å; A76-L78 PolarHBondContact O-N 3.18Å; L78-F80 PolarHBondContact O-N 3.09Å; L78-R81 PolarHBondContact O-N 3.12Å; L78-V88 HydrophobicContact CB-CG1 4.42Å; L78-V88 HydrophobicContact CD2-CG1 4.19Å; L78-F90 HydrophobicContact CD1-CD2 3.9Å; L78-F90 HydrophobicContact CD1-CE2 3.34Å; L78-F90 HydrophobicContact CD1-CZ 3.89Å; L78-F90 HydrophobicContact CD2-CD2 3.48Å; L78-F90 VanDerWaalsContact CD2-CD2 3.48Å; L78-F90 HydrophobicContact CD2-CE2 3.71Å; L78-F90 HydrophobicContact CG-CD2 4.29Å; L78-F90 HydrophobicContact CG-CE2 4.04Å; L78-F121 HydrophobicContact CD1-CE1 3.62Å; L78-F121 HydrophobicContact CD1-CZ 4.31Å
79	S	58	Low	64.8	Low	76 Å²	76	71 Å²	71	53%	0.531	40%	0.4	S	S	.	.	H	α-helix	trans	-59.2	-16.4	178.7	-57.9	0	0	0	0	112.8	V75 A76	V75-S79 PolarHBondContact O-N 2.72Å; A76-S79 PolarHBondContact O-N 3.49Å
80	F	52.2	Low	64	Low	178 Å²	178	72.2 Å²	72.2	78%	0.781	40%	0.403	S	S	*	.	T	Hydrogen-bonded Turn	trans	-103	-1.4	178	-60.1	-68.2	0	0	0	115	A76 L78	A76-F80 WeakPolarHBondContact O-CD2 3.44Å; A76-F80 WeakPolarHBondContact O-CE2 3.37Å; L78-F80 PolarHBondContact O-N 3.09Å
81	R	55.2	Low	63.4	Low	188 Å²	188	74.4 Å²	74.4	71%	0.709	42%	0.415	S	S	*	.			trans	-129.7	104	-175.5	-68.6	-172.7	179.1	-174.9	-0.7	112	L78	L78-R81 PolarHBondContact O-N 3.12Å
82	L	57.4	Low	62.9	Low	134 Å²	134	74.4 Å²	74.4	70%	0.702	42%	0.415	S	S	*	.			trans	-106.7	123	165.8	-160.4	81.6	0	0	0	107.9
83	A	61.2	Low	62.6	Low	25 Å²	25	82.8 Å²	82.8	21%	0.207	45%	0.445	C	S	.	.			trans	-68.4	155.6	169.3	0	0	0	0	0	109.8	S85 G86 A87	A83-S85 PolarHBondContact O-N 3.04Å; A83-G86 WeakPolarHBondContact O-CA 3.44Å; A83-G86 PolarHBondContact O-N 3.28Å; A83-A87 HydrophobicContact CB-CB 4.42Å; A83-A87 WeakPolarHBondContact CB-O 3.31Å; A83-A87 PolarHBondContact N-O 2.82Å; A83-A87 VanDerWaalsContact N-O 3.15Å
84	P	61	Low	62.5	Low	149 Å²	149	82.8 Å²	82.8	97%	0.968	45%	0.449	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.4	-24.3	175	-26.7	34.9	0	0	0	114.1	G86	P84-G86 VanDerWaalsContact C-N 3.26Å; P84-G86 PolarHBondContact O-N 3.21Å
85	S	66.5	Low	62.5	Low	99 Å²	99	82.5 Å²	82.5	69%	0.692	45%	0.448	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.2	-1.4	173.5	57.8	0	0	0	0	114.4	A83 A87	A83-S85 PolarHBondContact O-N 3.04Å; S85-A87 PolarHBondContact O-N 2.85Å; S85-A87 WeakPolarHBondContact OG-CB 3.3Å; S85-A87 PolarHBondContact OG-N 2.76Å
86	G	59.1	Low	62.7	Low	44 Å²	44	83.4 Å²	83.4	45%	0.454	45%	0.452	S	S	.	.	S	Bend	trans	74.4	-1.2	-168.8	0	0	0	0	0	114.1	A83 P84	A83-G86 WeakPolarHBondContact O-CA 3.44Å; A83-G86 PolarHBondContact O-N 3.28Å; P84-G86 VanDerWaalsContact C-N 3.26Å; P84-G86 PolarHBondContact O-N 3.21Å
87	A	55.2	Low	63	Low	46 Å²	46	82.9 Å²	82.9	38%	0.38	45%	0.45	S	S	.	.			trans	-73.8	137.2	179.3	0	0	0	0	0	111.4	A83 S85	A83-A87 HydrophobicContact CB-CB 4.42Å; A83-A87 WeakPolarHBondContact CB-O 3.31Å; A83-A87 PolarHBondContact N-O 2.82Å; A83-A87 VanDerWaalsContact N-O 3.15Å; S85-A87 PolarHBondContact O-N 2.85Å; S85-A87 WeakPolarHBondContact OG-CB 3.3Å; S85-A87 PolarHBondContact OG-N 2.76Å
88	V	56	Low	63.5	Low	65 Å²	65	81.8 Å²	81.8	39%	0.394	45%	0.446	S	S	.	.			trans	-89.4	109	168.4	-179.6	0	0	0	0	107.2	L78	L78-V88 HydrophobicContact CB-CG1 4.42Å; L78-V88 HydrophobicContact CD2-CG1 4.19Å
89	T	54.7	Low	64.2	Low	109 Å²	109	81.1 Å²	81.1	67%	0.669	44%	0.441	S	S	*	.			trans	-79.2	123.4	171	49.5	0	0	0	0	108.8
90	F	62.2	Low	64.9	Low	51 Å²	51	81.3 Å²	81.3	22%	0.224	44%	0.436	C	S	.	.			trans	-126.6	136.7	-165.7	-168.1	-150.3	0	0	0	112.5	L74 L78 I92 F121 A124 L126	L74-F90 HydrophobicContact CD1-CE2 4.36Å; L74-F90 HydrophobicContact CD2-CE2 3.78Å; L74-F90 HydrophobicContact CD2-CZ 4.24Å; L74-F90 HydrophobicContact CG-CE2 3.99Å; L78-F90 HydrophobicContact CD1-CD2 3.9Å; L78-F90 HydrophobicContact CD1-CE2 3.34Å; L78-F90 HydrophobicContact CD1-CZ 3.89Å; L78-F90 HydrophobicContact CD2-CD2 3.48Å; L78-F90 VanDerWaalsContact CD2-CD2 3.48Å; L78-F90 HydrophobicContact CD2-CE2 3.71Å; L78-F90 HydrophobicContact CG-CD2 4.29Å; L78-F90 HydrophobicContact CG-CE2 4.04Å; F90-I92 HydrophobicContact CD1-CB 3.45Å; F90-I92 VanDerWaalsContact CD1-CB 3.45Å; F90-I92 HydrophobicContact CD1-CG2 3.09Å; F90-I92 HydrophobicContact CD2-CB 4.07Å; F90-I92 HydrophobicContact CE1-CB 3.04Å; F90-I92 HydrophobicContact CE1-CD1 3.48Å; F90-I92 VanDerWaalsContact CE1-CD1 3.48Å; F90-I92 HydrophobicContact CE1-CG1 3.79Å; F90-I92 HydrophobicContact CE1-CG2 3Å; F90-I92 HydrophobicContact CE2-CB 3.64Å; F90-I92 HydrophobicContact CE2-CD1 4.17Å; F90-I92 HydrophobicContact CE2-CG1 4.38Å; F90-I92 HydrophobicContact CE2-CG2 4.42Å; F90-I92 HydrophobicContact CG-CB 4.04Å; F90-I92 HydrophobicContact CG-CG2 4.03Å; F90-I92 HydrophobicContact CZ-CB 3.21Å; F90-I92 HydrophobicContact CZ-CD1 3.2Å; F90-I92 HydrophobicContact CZ-CG1 3.72Å; F90-I92 HydrophobicContact CZ-CG2 3.79Å; F90-F121 AromaticContact CE1-CD1 3.69Å; F90-F121 HydrophobicContact CE1-CD1 3.69Å; F90-F121 HydrophobicContact CE1-CE1 4.18Å; F90-F121 AromaticContact CZ-CD1 3.54Å; F90-F121 HydrophobicContact CZ-CD1 3.54Å; F90-F121 AromaticContact CZ-CE1 3.81Å; F90-F121 HydrophobicContact CZ-CE1 3.81Å; F90-A124 HydrophobicContact CD1-CB 3.26Å; F90-A124 HydrophobicContact CE1-CB 3.12Å; F90-A124 HydrophobicContact CG-CB 4.32Å; F90-A124 HydrophobicContact CZ-CB 4.2Å; F90-L126 HydrophobicContact CE1-CD1 4.39Å
91	D	65.5	Low	65.7	Low	95 Å²	95	76.7 Å²	76.7	51%	0.508	42%	0.42	S	S	.	.			trans	-120	46.2	168.8	-165	14.9	0	0	0	112.2	R93 S94 L95	D91-R93 PolarHBondContact O-N 3.4Å; D91-S94 PolarHBondContact O-N 2.86Å; D91-S94 WeakPolarHBondContact OD1-CB 3.47Å; D91-S94 PolarHBondContact OD1-N 3.42Å; D91-S94 WeakPolarHBondContact OD2-CB 3.47Å; D91-L95 PolarHBondContact O-N 2.83Å
92	I	66.7	Low	66.2	Low	3 Å²	3	73.5 Å²	73.5	2%	0.015	41%	0.411	C	S	.	.	H	α-helix	trans	-66.4	-26.8	165.8	-161.1	142.7	0	0	0	112.4	L71 L74 F90 S94 L95 L96 V119 L126	L71-I92 HydrophobicContact CD1-CD1 4.39Å; L74-I92 HydrophobicContact CD2-CB 3.94Å; L74-I92 HydrophobicContact CD2-CD1 4.09Å; L74-I92 HydrophobicContact CD2-CG1 3.84Å; F90-I92 HydrophobicContact CD1-CB 3.45Å; F90-I92 VanDerWaalsContact CD1-CB 3.45Å; F90-I92 HydrophobicContact CD1-CG2 3.09Å; F90-I92 HydrophobicContact CD2-CB 4.07Å; F90-I92 HydrophobicContact CE1-CB 3.04Å; F90-I92 HydrophobicContact CE1-CD1 3.48Å; F90-I92 VanDerWaalsContact CE1-CD1 3.48Å; F90-I92 HydrophobicContact CE1-CG1 3.79Å; F90-I92 HydrophobicContact CE1-CG2 3Å; F90-I92 HydrophobicContact CE2-CB 3.64Å; F90-I92 HydrophobicContact CE2-CD1 4.17Å; F90-I92 HydrophobicContact CE2-CG1 4.38Å; F90-I92 HydrophobicContact CE2-CG2 4.42Å; F90-I92 HydrophobicContact CG-CB 4.04Å; F90-I92 HydrophobicContact CG-CG2 4.03Å; F90-I92 HydrophobicContact CZ-CB 3.21Å; F90-I92 HydrophobicContact CZ-CD1 3.2Å; F90-I92 HydrophobicContact CZ-CG1 3.72Å; F90-I92 HydrophobicContact CZ-CG2 3.79Å; I92-S94 PolarHBondContact O-N 3.06Å; I92-L95 CarbonylContact O-C 3.51Å; I92-L95 PolarHBondContact O-N 3.11Å; I92-L95 VanDerWaalsContact O-N 3.1Å; I92-L96 HydrophobicContact CG1-CD1 3.8Å; I92-L96 HydrophobicContact CG1-CD2 4.48Å; I92-L96 HydrophobicContact CG1-CG 3.72Å; I92-L96 HydrophobicContact CG2-CD1 4.41Å; I92-L96 VanDerWaalsContact O-CB 3.29Å; I92-L96 WeakPolarHBondContact O-CB 3.18Å; I92-L96 VanDerWaalsContact O-CG 3.3Å; I92-L96 WeakPolarHBondContact O-CG 3.25Å; I92-L96 PolarHBondContact O-N 2.91Å; I92-V119 HydrophobicContact CD1-CG1 4.14Å; I92-L126 HydrophobicContact CB-CD1 4.24Å; I92-L126 HydrophobicContact CD1-CD1 3.36Å; I92-L126 HydrophobicContact CG1-CD1 3.72Å; I92-L126 HydrophobicContact CG2-CD1 3.63Å; I92-L126 HydrophobicContact CG2-CD2 4.14Å; I92-L126 HydrophobicContact CG2-CG 4.06Å
93	R	68.5	Low	66.5	Low	194 Å²	194	71.3 Å²	71.3	73%	0.732	40%	0.397	S	S	*	.	H	α-helix	trans	-64.3	-35.1	-179.6	-68.8	-172.5	178	-157	0.2	109.4	D91 G97	D91-R93 PolarHBondContact O-N 3.4Å; R93-G97 WeakPolarHBondContact O-CA 3.31Å; R93-G97 PolarHBondContact O-N 2.84Å
94	S	74.2	Confident	66.2	Low	51 Å²	51	78.5 Å²	78.5	36%	0.357	42%	0.419	S	S	.	.	H	α-helix	trans	-66.6	-45	168.1	178.4	0	0	0	0	113	D91 I92 G97 R98	D91-S94 PolarHBondContact O-N 2.86Å; D91-S94 WeakPolarHBondContact OD1-CB 3.47Å; D91-S94 PolarHBondContact OD1-N 3.42Å; D91-S94 WeakPolarHBondContact OD2-CB 3.47Å; I92-S94 PolarHBondContact O-N 3.06Å; S94-G97 PolarHBondContact O-N 2.89Å; S94-R98 WeakPolarHBondContact O-CG 3.16Å; S94-R98 PolarHBondContact O-N 2.95Å
95	L	72	Confident	66	Low	4 Å²	4	77.6 Å²	77.6	2%	0.021	41%	0.406	C	S	.	.	H	α-helix	trans	-61.3	-50.8	177.3	-178.8	141.8	0	0	0	111.9	D70 L71 L74 D91 I92 G97 R98 W99	D70-L95 HydrophobicContact CB-CD1 4.02Å; D70-L95 WeakPolarHBondContact O-CD1 3.22Å; L71-L95 HydrophobicContact CD1-CD2 4.31Å; L74-L95 HydrophobicContact CB-CD1 3.66Å; L74-L95 HydrophobicContact CD2-CB 3.75Å; L74-L95 HydrophobicContact CD2-CD1 3.72Å; L74-L95 HydrophobicContact CD2-CD2 4.41Å; L74-L95 HydrophobicContact CD2-CG 4.16Å; L74-L95 HydrophobicContact CG-CD1 4.24Å; D91-L95 PolarHBondContact O-N 2.83Å; I92-L95 CarbonylContact O-C 3.51Å; I92-L95 PolarHBondContact O-N 3.11Å; I92-L95 VanDerWaalsContact O-N 3.1Å; L95-G97 VanDerWaalsContact C-N 3.26Å; L95-G97 PolarHBondContact O-N 3.2Å; L95-R98 PolarHBondContact O-N 3.29Å; L95-W99 VanDerWaalsContact O-CD1 3.27Å; L95-W99 PolarHBondContact O-N 2.8Å
96	L	73.9	Confident	65.2	Low	32 Å²	32	77 Å²	77	17%	0.168	41%	0.407	C	S	.	.	H	α-helix	trans	-60.6	-38.4	174.5	-67.3	176.7	0	0	0	110.3	I92 W99 N100 L126	I92-L96 HydrophobicContact CG1-CD1 3.8Å; I92-L96 HydrophobicContact CG1-CD2 4.48Å; I92-L96 HydrophobicContact CG1-CG 3.72Å; I92-L96 HydrophobicContact CG2-CD1 4.41Å; I92-L96 VanDerWaalsContact O-CB 3.29Å; I92-L96 WeakPolarHBondContact O-CB 3.18Å; I92-L96 VanDerWaalsContact O-CG 3.3Å; I92-L96 WeakPolarHBondContact O-CG 3.25Å; I92-L96 PolarHBondContact O-N 2.91Å; L96-W99 PolarHBondContact O-N 2.73Å; L96-N100 WeakPolarHBondContact O-CA 3.25Å; L96-N100 WeakPolarHBondContact O-CB 3.43Å; L96-N100 PolarHBondContact O-N 2.91Å; L96-N100 PolarHBondContact O-ND2 2.9Å; L96-N100 PolarHBondContact O-OD1 3.09Å; L96-L126 HydrophobicContact CD1-CD1 3.77Å; L96-L126 HydrophobicContact CD1-CD2 3.93Å
97	G	75.6	Confident	65.2	Low	23 Å²	23	77.5 Å²	77.5	24%	0.237	40%	0.401	C	S	.	.	H	α-helix	trans	-58.3	-52.5	172.8	0	0	0	0	0	112.1	R93 S94 L95 W99 N100 D101	R93-G97 WeakPolarHBondContact O-CA 3.31Å; R93-G97 PolarHBondContact O-N 2.84Å; S94-G97 PolarHBondContact O-N 2.89Å; L95-G97 VanDerWaalsContact C-N 3.26Å; L95-G97 PolarHBondContact O-N 3.2Å; G97-W99 PolarHBondContact O-N 2.98Å; G97-N100 PolarHBondContact O-N 3.03Å; G97-D101 WeakPolarHBondContact O-CB 3.46Å; G97-D101 PolarHBondContact O-N 2.88Å
98	R	76.8	Confident	65	Low	124 Å²	124	79.2 Å²	79.2	47%	0.468	41%	0.407	S	S	.	.	H	α-helix	trans	-57.4	-37.5	177.6	-69.4	-174.2	-52.2	166.3	13.2	112.7	D70 S94 L95 K102	D70-R98 IonicContact OD2-NH2 2.91Å; S94-R98 WeakPolarHBondContact O-CG 3.16Å; S94-R98 PolarHBondContact O-N 2.95Å; L95-R98 PolarHBondContact O-N 3.29Å; R98-K102 PolarHBondContact O-N 3.47Å
99	W	75.9	Confident	65.2	Low	13 Å²	13	82 Å²	82	5%	0.049	42%	0.416	C	S	.	.	H	α-helix	trans	-83.5	-34	179.5	-76.7	103.2	0	0	0	113	N63 D66 F67 D70 L95 L96 G97 D101 K102 Q103	N63-W99 VanDerWaalsContact O-CH2 3.31Å; N63-W99 WeakPolarHBondContact O-CH2 3.34Å; D66-W99 HydrophobicContact CB-CH2 3.86Å; D66-W99 HydrophobicContact CB-CZ2 4.18Å; F67-W99 HydrophobicContact CB-CD2 4.14Å; F67-W99 HydrophobicContact CB-CE3 4.08Å; F67-W99 HydrophobicContact CB-CH2 3.78Å; F67-W99 HydrophobicContact CB-CZ2 3.86Å; F67-W99 HydrophobicContact CB-CZ3 3.89Å; F67-W99 HydrophobicContact CD2-CB 4Å; F67-W99 AromaticContact CD2-CD1 3.82Å; F67-W99 AromaticContact CD2-CD2 3.5Å; F67-W99 HydrophobicContact CD2-CD2 3.5Å; F67-W99 AromaticContact CD2-CE2 3.88Å; F67-W99 AromaticContact CD2-CE3 3.9Å; F67-W99 HydrophobicContact CD2-CE3 3.9Å; F67-W99 AromaticContact CD2-CG 3.51Å; F67-W99 HydrophobicContact CD2-CG 3.51Å; F67-W99 HydrophobicContact CE2-CB 4.07Å; F67-W99 HydrophobicContact CE2-CD2 4.41Å; F67-W99 AromaticContact CE2-CG 3.97Å; F67-W99 HydrophobicContact CE2-CG 3.97Å; F67-W99 HydrophobicContact CG-CD2 4.31Å; F67-W99 HydrophobicContact CG-CE3 4.49Å; F67-W99 VanDerWaalsContact N-CH2 3.33Å; F67-W99 VanDerWaalsContact N-CZ2 3.33Å; D70-W99 HydrophobicContact CB-CZ2 4.49Å; D70-W99 PolarHBondContact OD2-NE1 2.96Å; L95-W99 VanDerWaalsContact O-CD1 3.27Å; L95-W99 PolarHBondContact O-N 2.8Å; L96-W99 PolarHBondContact O-N 2.73Å; G97-W99 PolarHBondContact O-N 2.98Å; W99-D101 PolarHBondContact O-N 3.17Å; W99-K102 HydrophobicContact CD2-CD 4.19Å; W99-K102 HydrophobicContact CE3-CB 4.34Å; W99-K102 HydrophobicContact CE3-CD 3.68Å; W99-K102 HydrophobicContact CH2-CD 4.21Å; W99-K102 HydrophobicContact CZ3-CD 3.7Å; W99-K102 CarbonylContact O-C 3.49Å; W99-K102 WeakPolarHBondContact O-CB 3.46Å; W99-K102 PolarHBondContact O-N 2.99Å; W99-K102 VanDerWaalsContact O-N 3.15Å; W99-Q103 WeakPolarHBondContact O-CB 3.25Å; W99-Q103 WeakPolarHBondContact O-CG 3.03Å; W99-Q103 PolarHBondContact O-N 3.28Å
100	N	72.6	Confident	65.8	Low	80 Å²	80	85.4 Å²	85.4	43%	0.428	42%	0.421	S	S	.	.	H	α-helix	trans	-56.9	-43.8	168.5	-75.8	-12.3	0	0	0	109.4	L96 G97 K102 Q103 R104	L96-N100 WeakPolarHBondContact O-CA 3.25Å; L96-N100 WeakPolarHBondContact O-CB 3.43Å; L96-N100 PolarHBondContact O-N 2.91Å; L96-N100 PolarHBondContact O-ND2 2.9Å; L96-N100 PolarHBondContact O-OD1 3.09Å; G97-N100 PolarHBondContact O-N 3.03Å; N100-K102 VanDerWaalsContact C-N 3.32Å; N100-K102 PolarHBondContact O-N 2.97Å; N100-Q103 CarbonylContact O-C 3.58Å; N100-Q103 WeakPolarHBondContact O-CA 3.28Å; N100-Q103 WeakPolarHBondContact O-CB 3.03Å; N100-Q103 PolarHBondContact O-N 2.75Å; N100-R104 WeakPolarHBondContact O-CG 3.42Å; N100-R104 PolarHBondContact O-N 2.98Å
101	D	68.8	Low	66.4	Low	81 Å²	81	90.1 Å²	90.1	43%	0.433	44%	0.438	S	S	.	.	H	α-helix	trans	-60.6	-40.1	177.4	-69.4	14.7	0	0	0	112.3	G97 W99 Q103 R104	G97-D101 WeakPolarHBondContact O-CB 3.46Å; G97-D101 PolarHBondContact O-N 2.88Å; W99-D101 PolarHBondContact O-N 3.17Å; D101-Q103 VanDerWaalsContact C-N 3.32Å; D101-R104 VanDerWaalsContact CG-CZ 3.4Å; D101-R104 IonicContact OD1-CZ 3.87Å; D101-R104 IonicContact OD1-NE 2.98Å; D101-R104 IonicContact OD1-NH1 3.29Å; D101-R104 PolarHBondContact OD1-NH1 3.19Å; D101-R104 IonicContact OD1-NH2 3.89Å; D101-R104 PolarHBondContact OD1-NH2 2.82Å; D101-R104 IonicContact OD2-CZ 3.75Å; D101-R104 IonicContact OD2-NH2 2.74Å; D101-R104 PolarHBondContact OD2-NH2 2.84Å
102	K	66.4	Low	66.9	Low	122 Å²	122	89.7 Å²	89.7	53%	0.53	44%	0.436	S	S	.	.	H	α-helix	trans	-69	-29.4	172.2	-71.9	-178.5	176.1	-175.6	0	112.8	R98 W99 N100	R98-K102 PolarHBondContact O-N 3.47Å; W99-K102 HydrophobicContact CD2-CD 4.19Å; W99-K102 HydrophobicContact CE3-CB 4.34Å; W99-K102 HydrophobicContact CE3-CD 3.68Å; W99-K102 HydrophobicContact CH2-CD 4.21Å; W99-K102 HydrophobicContact CZ3-CD 3.7Å; W99-K102 CarbonylContact O-C 3.49Å; W99-K102 WeakPolarHBondContact O-CB 3.46Å; W99-K102 PolarHBondContact O-N 2.99Å; W99-K102 VanDerWaalsContact O-N 3.15Å; N100-K102 VanDerWaalsContact C-N 3.32Å; N100-K102 PolarHBondContact O-N 2.97Å
103	Q	63.8	Low	67.4	Low	88 Å²	88	91.3 Å²	91.3	41%	0.411	45%	0.446	S	S	.	.	H	α-helix	trans	-86.9	-15.7	-179.3	-71.8	171.5	-8.2	0	0	113.8	W99 N100 D101 N105	W99-Q103 WeakPolarHBondContact O-CB 3.25Å; W99-Q103 WeakPolarHBondContact O-CG 3.03Å; W99-Q103 PolarHBondContact O-N 3.28Å; N100-Q103 CarbonylContact O-C 3.58Å; N100-Q103 WeakPolarHBondContact O-CA 3.28Å; N100-Q103 WeakPolarHBondContact O-CB 3.03Å; N100-Q103 PolarHBondContact O-N 2.75Å; D101-Q103 VanDerWaalsContact C-N 3.32Å; Q103-N105 PolarHBondContact O-N 3.05Å; Q103-N105 VanDerWaalsContact O-O 3.1Å
104	R	56	Low	68	Low	175 Å²	175	82.9 Å²	82.9	66%	0.66	42%	0.416	S	S	*	.			trans	-63.2	-19.6	179.5	-82.5	-166.3	-66.3	-115.6	12.4	113.4	N100 D101 A106	N100-R104 WeakPolarHBondContact O-CG 3.42Å; N100-R104 PolarHBondContact O-N 2.98Å; D101-R104 VanDerWaalsContact CG-CZ 3.4Å; D101-R104 IonicContact OD1-CZ 3.87Å; D101-R104 IonicContact OD1-NE 2.98Å; D101-R104 IonicContact OD1-NH1 3.29Å; D101-R104 PolarHBondContact OD1-NH1 3.19Å; D101-R104 IonicContact OD1-NH2 3.89Å; D101-R104 PolarHBondContact OD1-NH2 2.82Å; D101-R104 IonicContact OD2-CZ 3.75Å; D101-R104 IonicContact OD2-NH2 2.74Å; D101-R104 PolarHBondContact OD2-NH2 2.84Å; R104-A106 PolarHBondContact O-N 3.02Å; R104-A106 VanDerWaalsContact O-N 3.11Å
105	N	55.9	Low	68.2	Low	130 Å²	130	82.5 Å²	82.5	70%	0.695	41%	0.412	S	S	*	.	S	Bend	trans	-64.1	114.1	166.7	-69.3	-34.9	0	0	0	107.9	Q103 V107	Q103-N105 PolarHBondContact O-N 3.05Å; Q103-N105 VanDerWaalsContact O-O 3.1Å; N105-V107 PolarHBondContact O-N 3.07Å; N105-V107 VanDerWaalsContact O-N 3.11Å
106	A	50.4	Low	68.6	Low	86 Å²	86	86.1 Å²	86.1	71%	0.711	43%	0.426	S	S	*	.			trans	-43.8	124.1	177.4	0	0	0	0	0	108.9	R104 T108	R104-A106 PolarHBondContact O-N 3.02Å; R104-A106 VanDerWaalsContact O-N 3.11Å; A106-T108 VanDerWaalsContact C-N 3.31Å; A106-T108 PolarHBondContact O-N 3.46Å
107	V	57.5	Low	68.7	Low	56 Å²	56	85.6 Å²	85.6	34%	0.339	42%	0.424	S	S	.	.			trans	-53.8	104.2	172.3	174.4	0	0	0	0	106.2	N105 H109 V114 Y116	N105-V107 PolarHBondContact O-N 3.07Å; N105-V107 VanDerWaalsContact O-N 3.11Å; V107-H109 PolarHBondContact O-N 2.8Å; V107-V114 HydrophobicContact CB-CG1 4.37Å; V107-V114 HydrophobicContact CG1-CB 4.1Å; V107-V114 HydrophobicContact CG1-CG1 3.46Å; V107-V114 VanDerWaalsContact CG1-CG1 3.46Å; V107-V114 HydrophobicContact CG1-CG2 3.44Å; V107-V114 VanDerWaalsContact CG1-CG2 3.44Å; V107-V114 HydrophobicContact CG2-CG1 4.02Å; V107-Y116 HydrophobicContact CG2-CE1 4.2Å
108	T	51.9	Low	68.7	Low	81 Å²	81	86.4 Å²	86.4	50%	0.497	42%	0.423	S	S	.	.			trans	-65.2	123.5	175.5	57.8	0	0	0	0	106.2	A106 K110	A106-T108 VanDerWaalsContact C-N 3.31Å; A106-T108 PolarHBondContact O-N 3.46Å; T108-K110 PolarHBondContact O-N 3.48Å
109	H	59.4	Low	68.5	Low	124 Å²	124	81.5 Å²	81.5	57%	0.574	41%	0.407	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.5	21.5	172.6	-67.1	-66.6	0	0	0	113	V107 Y111	V107-H109 PolarHBondContact O-N 2.8Å; H109-Y111 VanDerWaalsContact C-N 3.26Å
110	K	67.3	Low	68.4	Low	181 Å²	181	81 Å²	81	79%	0.787	41%	0.405	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.4	-22.4	172.9	-172.5	176.1	178.2	-178.7	0	111.8	T108	T108-K110 PolarHBondContact O-N 3.48Å
111	Y	74.6	Confident	68.4	Low	149 Å²	149	77.9 Å²	77.9	58%	0.584	39%	0.388	S	S	*	.	S	Bend	trans	-94.1	148.7	178.5	-58.2	-76.9	0	0	0	111.4	H109 Q272	H109-Y111 VanDerWaalsContact C-N 3.26Å; Y111-Q272 PolarHBondContact O-NE2 3.32Å
112	D	76.8	Confident	68.3	Low	87 Å²	87	74.7 Å²	74.7	47%	0.465	37%	0.373	S	S	.	.	S	Bend	trans	-77.9	-24.2	177.9	63.8	-5.7	0	0	0	112.6	A271 Q272 V275	D112-A271 CarbonylContact O-C 3.46Å; D112-A271 WeakPolarHBondContact O-CA 3.39Å; D112-Q272 PolarHBondContact O-N 3.35Å; D112-V275 HydrophobicContact CB-CG2 3.59Å
113	T	77	Confident	68.3	Low	36 Å²	36	72.1 Å²	72.1	22%	0.221	38%	0.375	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.2	133	177.3	-52.6	0	0	0	0	110.8	V115 E270 A271	T113-V115 HydrophobicContact CG2-CG2 4.5Å; T113-E270 CarbonylContact C-O 3.49Å; T113-E270 VanDerWaalsContact CA-O 3.28Å; T113-E270 WeakPolarHBondContact CA-O 3.37Å; T113-A271 HydrophobicContact CG2-CB 4.33Å
114	V	80.6	Confident	68.3	Low	18 Å²	18	69.4 Å²	69.4	11%	0.109	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	135.8	174.2	-172.8	0	0	0	0	108.6	V107 Y116 T269 E270	V107-V114 HydrophobicContact CB-CG1 4.37Å; V107-V114 HydrophobicContact CG1-CB 4.1Å; V107-V114 HydrophobicContact CG1-CG1 3.46Å; V107-V114 VanDerWaalsContact CG1-CG1 3.46Å; V107-V114 HydrophobicContact CG1-CG2 3.44Å; V107-V114 VanDerWaalsContact CG1-CG2 3.44Å; V107-V114 HydrophobicContact CG2-CG1 4.02Å; V114-Y116 HydrophobicContact CB-CE2 3.81Å; V114-Y116 HydrophobicContact CG1-CD2 3.95Å; V114-Y116 HydrophobicContact CG1-CE1 4.23Å; V114-Y116 HydrophobicContact CG1-CE2 3.33Å; V114-Y116 VanDerWaalsContact CG1-CZ 3.49Å; V114-T269 CarbonylContact O-C 3.48Å; V114-T269 WeakPolarHBondContact O-CA 3.34Å; V114-E270 PolarHBondContact N-O 2.89Å; V114-E270 PolarHBondContact O-N 3.33Å
115	V	79.4	Confident	68.9	Low	43 Å²	43	63.3 Å²	63.3	26%	0.261	36%	0.359	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118	124	178	-176.5	0	0	0	0	109.5	L59 L64 T113 Y267 F268 T269	L59-V115 HydrophobicContact CD1-CG1 4.08Å; L59-V115 HydrophobicContact CD1-CG2 4.11Å; L64-V115 HydrophobicContact CD1-CG1 4.36Å; L64-V115 HydrophobicContact CD2-CG1 4.2Å; T113-V115 HydrophobicContact CG2-CG2 4.5Å; V115-Y267 HydrophobicContact CG1-CD1 4Å; V115-F268 CarbonylContact C-O 3.6Å; V115-F268 WeakPolarHBondContact CA-O 3.27Å; V115-T269 HydrophobicContact CB-CG2 4.44Å; V115-T269 HydrophobicContact CG1-CG2 4.27Å; V115-T269 HydrophobicContact CG2-CG2 3.91Å
116	Y	79.4	Confident	69.6	Low	79 Å²	79	57.7 Å²	57.7	31%	0.31	33%	0.329	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	109.6	177.1	-55.8	-102.3	0	0	0	108.6	V107 V114 L118 F268	V107-Y116 HydrophobicContact CG2-CE1 4.2Å; V114-Y116 HydrophobicContact CB-CE2 3.81Å; V114-Y116 HydrophobicContact CG1-CD2 3.95Å; V114-Y116 HydrophobicContact CG1-CE1 4.23Å; V114-Y116 HydrophobicContact CG1-CE2 3.33Å; V114-Y116 VanDerWaalsContact CG1-CZ 3.49Å; Y116-L118 PolarHBondContact O-N 2.67Å; Y116-F268 AromaticContact CD2-CD1 3.56Å; Y116-F268 HydrophobicContact CD2-CD1 3.56Å; Y116-F268 HydrophobicContact CD2-CE1 4.24Å; Y116-F268 HydrophobicContact CE2-CD1 4.06Å; Y116-F268 HydrophobicContact CE2-CE1 4.29Å; Y116-F268 HydrophobicContact CG-CD1 4.28Å; Y116-F268 PolarHBondContact N-O 3.38Å; Y116-F268 PolarHBondContact O-N 3.37Å
117	P	77.4	Confident	70.7	Confident	21 Å²	21	56.7 Å²	56.7	14%	0.136	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.5	120.3	173.9	30	-32.1	0	0	0	109.5	L64 F67 Y68	L64-P117 HydrophobicContact CD1-CB 4.28Å; L64-P117 HydrophobicContact CD1-CG 4.34Å; F67-P117 HydrophobicContact CD1-CB 3.89Å; F67-P117 HydrophobicContact CD1-CG 4.15Å; F67-P117 HydrophobicContact CD2-CG 4.4Å; F67-P117 HydrophobicContact CE1-CB 3.5Å; F67-P117 HydrophobicContact CE1-CG 4.01Å; F67-P117 HydrophobicContact CE2-CG 4.27Å; F67-P117 HydrophobicContact CG-CG 4.36Å; F67-P117 HydrophobicContact CZ-CB 3.89Å; F67-P117 HydrophobicContact CZ-CG 4.06Å; Y68-P117 HydrophobicContact CE2-CB 4.47Å; Y68-P117 WeakPolarHBondContact OH-CB 3Å
118	L	75.1	Confident	71.3	Confident	41 Å²	41	59 Å²	59	22%	0.215	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	128.6	174.5	-59.3	177	0	0	0	109.1	Y116 A132 T266 F268	Y116-L118 PolarHBondContact O-N 2.67Å; L118-A132 HydrophobicContact CD1-CB 4.41Å; L118-T266 WeakPolarHBondContact CA-O 3.3Å; L118-T266 WeakPolarHBondContact CB-O 3.14Å; L118-T266 HydrophobicContact CD1-CG2 4.32Å; L118-T266 PolarHBondContact N-O 2.88Å; L118-T266 PolarHBondContact O-N 2.75Å; L118-T266 VanDerWaalsContact O-O 3.1Å; L118-F268 HydrophobicContact CD1-CB 4.16Å
119	V	73.1	Confident	72.3	Confident	21 Å²	21	55.2 Å²	55.2	13%	0.127	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	122.2	175.8	-178.8	0	0	0	0	108.5	F67 L71 I92	F67-V119 HydrophobicContact CE1-CG2 4.17Å; F67-V119 HydrophobicContact CZ-CG2 3.73Å; L71-V119 HydrophobicContact CD1-CG1 4.15Å; L71-V119 HydrophobicContact CD1-CG2 4.24Å; L71-V119 HydrophobicContact CD2-CG1 4.43Å; L71-V119 HydrophobicContact CD2-CG2 3.68Å; I92-V119 HydrophobicContact CD1-CG1 4.14Å
120	Q	73.2	Confident	73.1	Confident	3 Å²	3	49.5 Å²	49.5	1%	0.014	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	133.1	169.5	168.7	152.6	-3.5	0	0	108.7	N130 I259 A263 V264	Q120-N130 VanDerWaalsContact NE2-CG 3.26Å; Q120-N130 PolarHBondContact NE2-ND2 3.4Å; Q120-N130 VanDerWaalsContact OE1-N 3.12Å; Q120-N130 PolarHBondContact OE1-OD1 3.25Å; Q120-I259 PolarHBondContact NE2-O 2.69Å; Q120-A263 CarbonylContact O-C 3.6Å; Q120-A263 VanDerWaalsContact O-CA 3.26Å; Q120-A263 WeakPolarHBondContact O-CA 3.33Å; Q120-V264 HydrophobicContact CB-CB 4.27Å; Q120-V264 PolarHBondContact N-O 3.24Å; Q120-V264 PolarHBondContact O-N 3.21Å
121	F	71.8	Confident	73.7	Confident	14 Å²	14	47 Å²	47	6%	0.061	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.3	90.9	174.4	-169.4	-163.8	0	0	0	109.3	L78 F90 A123 A124 G125 L126 A263	L78-F121 HydrophobicContact CD1-CE1 3.62Å; L78-F121 HydrophobicContact CD1-CZ 4.31Å; F90-F121 AromaticContact CE1-CD1 3.69Å; F90-F121 HydrophobicContact CE1-CD1 3.69Å; F90-F121 HydrophobicContact CE1-CE1 4.18Å; F90-F121 AromaticContact CZ-CD1 3.54Å; F90-F121 HydrophobicContact CZ-CD1 3.54Å; F90-F121 AromaticContact CZ-CE1 3.81Å; F90-F121 HydrophobicContact CZ-CE1 3.81Å; F121-A123 VanDerWaalsContact C-N 3.32Å; F121-A123 HydrophobicContact CD2-CB 4.22Å; F121-A123 HydrophobicContact CE2-CB 3.8Å; F121-A123 HydrophobicContact CZ-CB 4.34Å; F121-A123 PolarHBondContact O-N 2.95Å; F121-A124 HydrophobicContact CB-CB 4.17Å; F121-A124 HydrophobicContact CD1-CB 3.57Å; F121-A124 HydrophobicContact CE1-CB 4.12Å; F121-A124 HydrophobicContact CG-CB 3.92Å; F121-A124 CarbonylContact O-C 3.58Å; F121-A124 WeakPolarHBondContact O-CA 3.15Å; F121-A124 WeakPolarHBondContact O-CB 3.33Å; F121-A124 PolarHBondContact O-N 2.81Å; F121-G125 PolarHBondContact O-N 3.43Å; F121-L126 CarbonylContact C-O 3.55Å; F121-L126 HydrophobicContact CB-CB 4.39Å; F121-L126 HydrophobicContact CB-CD1 4.33Å; F121-L126 PolarHBondContact N-O 2.78Å; F121-L126 PolarHBondContact O-N 3.29Å; F121-L126 VanDerWaalsContact O-N 3.1Å; F121-A263 HydrophobicContact CB-CB 4.5Å; F121-A263 HydrophobicContact CD2-CB 3.61Å; F121-A263 HydrophobicContact CE2-CB 3.96Å; F121-A263 HydrophobicContact CG-CB 4.09Å
122	G	68.2	Low	74	Confident	13 Å²	13	42 Å²	42	13%	0.134	25%	0.252	C	S	.	.	G	3₁₀ helix	trans	-62	-37.1	-171.5	0	0	0	0	0	114.2	A124 G125 Y260	G122-A124 PolarHBondContact O-N 2.69Å; G122-A124 VanDerWaalsContact O-N 3.08Å; G122-G125 PolarHBondContact O-N 3.07Å; G122-Y260 VanDerWaalsContact CA-O 3.27Å; G122-Y260 WeakPolarHBondContact CA-O 3.35Å
123	A	65.1	Low	74.3	Confident	69 Å²	69	38 Å²	38	57%	0.57	23%	0.23	S	C	*	.	G	3₁₀ helix	trans	-61.3	-17.5	174.2	0	0	0	0	0	113.8	F121	F121-A123 VanDerWaalsContact C-N 3.32Å; F121-A123 HydrophobicContact CD2-CB 4.22Å; F121-A123 HydrophobicContact CE2-CB 3.8Å; F121-A123 HydrophobicContact CZ-CB 4.34Å; F121-A123 PolarHBondContact O-N 2.95Å
124	A	65.3	Low	74.7	Confident	31 Å²	31	37.5 Å²	37.5	26%	0.256	23%	0.226	S	C	.	.	G	3₁₀ helix	trans	-104.5	6.5	175.8	0	0	0	0	0	113.6	F90 F121 G122 L126	F90-A124 HydrophobicContact CD1-CB 3.26Å; F90-A124 HydrophobicContact CE1-CB 3.12Å; F90-A124 HydrophobicContact CG-CB 4.32Å; F90-A124 HydrophobicContact CZ-CB 4.2Å; F121-A124 HydrophobicContact CB-CB 4.17Å; F121-A124 HydrophobicContact CD1-CB 3.57Å; F121-A124 HydrophobicContact CE1-CB 4.12Å; F121-A124 HydrophobicContact CG-CB 3.92Å; F121-A124 CarbonylContact O-C 3.58Å; F121-A124 WeakPolarHBondContact O-CA 3.15Å; F121-A124 WeakPolarHBondContact O-CB 3.33Å; F121-A124 PolarHBondContact O-N 2.81Å; G122-A124 PolarHBondContact O-N 2.69Å; G122-A124 VanDerWaalsContact O-N 3.08Å; A124-L126 VanDerWaalsContact C-N 3.25Å; A124-L126 PolarHBondContact O-N 3.4Å
125	G	67.6	Low	74.9	Confident	46 Å²	46	40.7 Å²	40.7	47%	0.474	24%	0.24	S	C	.	.	T	Hydrogen-bonded Turn	trans	70.3	16.4	-176.6	0	0	0	0	0	114.5	F121 G122 H127	F121-G125 PolarHBondContact O-N 3.43Å; G122-G125 PolarHBondContact O-N 3.07Å; G125-H127 PolarHBondContact O-CD2 2.96Å
126	L	71.1	Confident	75	Confident	12 Å²	12	39.6 Å²	39.6	6%	0.063	23%	0.232	C	C	.	.	B	Isolated β-bridge	trans	-90.4	107.7	174.8	-66.1	-177.5	0	0	0	110.4	F90 I92 L96 F121 A124	F90-L126 HydrophobicContact CE1-CD1 4.39Å; I92-L126 HydrophobicContact CB-CD1 4.24Å; I92-L126 HydrophobicContact CD1-CD1 3.36Å; I92-L126 HydrophobicContact CG1-CD1 3.72Å; I92-L126 HydrophobicContact CG2-CD1 3.63Å; I92-L126 HydrophobicContact CG2-CD2 4.14Å; I92-L126 HydrophobicContact CG2-CG 4.06Å; L96-L126 HydrophobicContact CD1-CD1 3.77Å; L96-L126 HydrophobicContact CD1-CD2 3.93Å; F121-L126 CarbonylContact C-O 3.55Å; F121-L126 HydrophobicContact CB-CB 4.39Å; F121-L126 HydrophobicContact CB-CD1 4.33Å; F121-L126 PolarHBondContact N-O 2.78Å; F121-L126 PolarHBondContact O-N 3.29Å; F121-L126 VanDerWaalsContact O-N 3.1Å; A124-L126 VanDerWaalsContact C-N 3.25Å; A124-L126 PolarHBondContact O-N 3.4Å
127	H	72.4	Confident	75.4	Confident	65 Å²	65	35.9 Å²	35.9	30%	0.301	22%	0.217	S	C	.	.			trans	-122	2.1	-176.4	-58.6	-66.6	0	0	0	114	G125 G129 N130 Q131	G125-H127 PolarHBondContact O-CD2 2.96Å; H127-G129 PolarHBondContact O-N 3.14Å; H127-N130 WeakPolarHBondContact O-CB 3.47Å; H127-N130 PolarHBondContact O-N 3.48Å; H127-Q131 PolarHBondContact O-N 2.76Å
128	D	70.2	Confident	75.8	Confident	104 Å²	104	40 Å²	40	56%	0.556	23%	0.23	S	C	*	.	H	α-helix	trans	-57.9	-36.7	-172.9	-53.5	-17.3	0	0	0	112.3	N130 Q131 A132	D128-N130 VanDerWaalsContact C-N 3.32Å; D128-N130 PolarHBondContact O-N 2.77Å; D128-Q131 PolarHBondContact O-N 2.87Å; D128-A132 WeakPolarHBondContact O-CB 3.1Å; D128-A132 PolarHBondContact O-N 2.9Å
129	G	74	Confident	75.5	Confident	3 Å²	3	42.2 Å²	42.2	3%	0.031	24%	0.242	C	C	.	.	H	α-helix	trans	-58.7	-40	176.8	0	0	0	0	0	113.4	H127 I133	H127-G129 PolarHBondContact O-N 3.14Å; G129-I133 WeakPolarHBondContact O-CD1 3.3Å; G129-I133 WeakPolarHBondContact O-CG1 3.2Å; G129-I133 PolarHBondContact O-N 3.3Å; G129-I133 VanDerWaalsContact O-N 3.07Å
130	N	76.3	Confident	74.8	Confident	4 Å²	4	42.7 Å²	42.7	2%	0.021	25%	0.245	C	C	.	.	H	α-helix	trans	-65.5	-45	176.6	-96.5	-17	0	0	0	111.9	Q120 H127 D128 A132 I133 I134 Y161 I259 Y260	Q120-N130 VanDerWaalsContact NE2-CG 3.26Å; Q120-N130 PolarHBondContact NE2-ND2 3.4Å; Q120-N130 VanDerWaalsContact OE1-N 3.12Å; Q120-N130 PolarHBondContact OE1-OD1 3.25Å; H127-N130 WeakPolarHBondContact O-CB 3.47Å; H127-N130 PolarHBondContact O-N 3.48Å; D128-N130 VanDerWaalsContact C-N 3.32Å; D128-N130 PolarHBondContact O-N 2.77Å; N130-A132 VanDerWaalsContact C-N 3.33Å; N130-I133 PolarHBondContact O-N 3.11Å; N130-I134 WeakPolarHBondContact O-CG1 3.45Å; N130-I134 PolarHBondContact O-N 2.97Å; N130-Y161 PolarHBondContact OD1-OH 3.38Å; N130-I259 WeakPolarHBondContact OD1-CD1 3.36Å; N130-I259 WeakPolarHBondContact OD1-CG1 3.38Å; N130-I259 WeakPolarHBondContact OD1-CG2 3.16Å; N130-Y260 VanDerWaalsContact ND2-CE1 3.34Å; N130-Y260 WeakPolarHBondContact ND2-CE1 3.42Å
131	Q	79.1	Confident	73.8	Confident	129 Å²	129	50.7 Å²	50.7	60%	0.603	29%	0.288	S	S	*	.	H	α-helix	trans	-64.4	-42.6	-179.7	-69	-178.3	-19.1	0	0	110.6	H127 D128 I133 I134 Q135	H127-Q131 PolarHBondContact O-N 2.76Å; D128-Q131 PolarHBondContact O-N 2.87Å; Q131-I133 VanDerWaalsContact C-N 3.35Å; Q131-I133 PolarHBondContact O-N 3.31Å; Q131-I134 PolarHBondContact O-N 3.26Å; Q131-Q135 WeakPolarHBondContact O-CB 3.43Å; Q131-Q135 PolarHBondContact O-N 2.93Å
132	A	80.4	Confident	73.3	Confident	44 Å²	44	53.9 Å²	53.9	36%	0.364	30%	0.303	S	S	.	.	H	α-helix	trans	-59.5	-42.8	175	0	0	0	0	0	112.2	L118 D128 N130 Q135 F136	L118-A132 HydrophobicContact CD1-CB 4.41Å; D128-A132 WeakPolarHBondContact O-CB 3.1Å; D128-A132 PolarHBondContact O-N 2.9Å; N130-A132 VanDerWaalsContact C-N 3.33Å; A132-Q135 PolarHBondContact O-N 3.31Å; A132-F136 WeakPolarHBondContact O-CB 3.43Å; A132-F136 PolarHBondContact O-N 3.45Å
133	I	83.3	Confident	73	Confident	2 Å²	2	55 Å²	55	1%	0.01	31%	0.308	C	S	.	.	H	α-helix	trans	-68.9	-44.8	178.2	-60.6	161.4	0	0	0	111.4	G129 N130 Q131 Q135 F136 I137 Y161 I235 I249 L255	G129-I133 WeakPolarHBondContact O-CD1 3.3Å; G129-I133 WeakPolarHBondContact O-CG1 3.2Å; G129-I133 PolarHBondContact O-N 3.3Å; G129-I133 VanDerWaalsContact O-N 3.07Å; N130-I133 PolarHBondContact O-N 3.11Å; Q131-I133 VanDerWaalsContact C-N 3.35Å; Q131-I133 PolarHBondContact O-N 3.31Å; I133-Q135 VanDerWaalsContact C-N 3.26Å; I133-Q135 PolarHBondContact O-N 3.46Å; I133-F136 WeakPolarHBondContact O-CB 3.48Å; I133-F136 PolarHBondContact O-N 2.99Å; I133-I137 HydrophobicContact CG2-CD1 4.2Å; I133-I137 WeakPolarHBondContact O-CG1 3.49Å; I133-I137 PolarHBondContact O-N 3.16Å; I133-Y161 HydrophobicContact CB-CE1 4.09Å; I133-Y161 HydrophobicContact CG2-CE1 3.62Å; I133-I235 HydrophobicContact CG2-CD1 3.29Å; I133-I249 HydrophobicContact CB-CD1 4.46Å; I133-I249 HydrophobicContact CD1-CG2 4.42Å; I133-I249 HydrophobicContact CG1-CD1 3.99Å; I133-I249 HydrophobicContact CG1-CG2 4.23Å; I133-I249 HydrophobicContact CG2-CD1 4.24Å; I133-L255 HydrophobicContact CD1-CD2 4.28Å; I133-L255 HydrophobicContact CG2-CD2 4.39Å
134	I	86.4	Confident	73.3	Confident	25 Å²	25	57.3 Å²	57.3	13%	0.128	31%	0.312	C	S	.	.	H	α-helix	trans	-59.4	-44	176.7	-72.1	164.2	0	0	0	109.7	N130 Q131 I137 R138 A160 Y161 A164	N130-I134 WeakPolarHBondContact O-CG1 3.45Å; N130-I134 PolarHBondContact O-N 2.97Å; Q131-I134 PolarHBondContact O-N 3.26Å; I134-I137 PolarHBondContact O-N 2.8Å; I134-R138 PolarHBondContact O-N 3.47Å; I134-R138 VanDerWaalsContact O-N 3.1Å; I134-A160 HydrophobicContact CD1-CB 3.77Å; I134-Y161 HydrophobicContact CG1-CD1 4.1Å; I134-Y161 HydrophobicContact CG1-CE1 3.91Å; I134-A164 HydrophobicContact CG2-CB 4.27Å
135	Q	83.7	Confident	74.1	Confident	86 Å²	86	57.6 Å²	57.6	40%	0.402	31%	0.307	S	S	.	.	H	α-helix	trans	-63.3	-44.6	176.7	-94.1	-62.7	41.9	0	0	111.8	Q131 A132 I133 I137 R138 D139	Q131-Q135 WeakPolarHBondContact O-CB 3.43Å; Q131-Q135 PolarHBondContact O-N 2.93Å; A132-Q135 PolarHBondContact O-N 3.31Å; I133-Q135 VanDerWaalsContact C-N 3.26Å; I133-Q135 PolarHBondContact O-N 3.46Å; Q135-I137 PolarHBondContact O-N 2.93Å; Q135-I137 VanDerWaalsContact O-N 3.17Å; Q135-R138 CarbonylContact O-C 3.4Å; Q135-R138 PolarHBondContact O-N 3.43Å; Q135-D139 VanDerWaalsContact CD-CG 3.44Å; Q135-D139 PolarHBondContact NE2-OD2 3.38Å; Q135-D139 WeakPolarHBondContact O-CA 3.43Å; Q135-D139 WeakPolarHBondContact O-CB 3.42Å; Q135-D139 PolarHBondContact O-N 2.98Å; Q135-D139 PolarHBondContact OE1-OD1 3.18Å; Q135-D139 VanDerWaalsContact OE1-OD1 3.09Å; Q135-D139 PolarHBondContact OE1-OD2 3.48Å
136	F	82.6	Confident	75	Confident	20 Å²	20	56.3 Å²	56.3	9%	0.088	29%	0.288	C	S	.	.	H	α-helix	trans	-58.7	-31.8	177.3	179.9	-107.4	0	0	0	113.9	A132 I133 I235 L237 Y247 I249 F268	A132-F136 WeakPolarHBondContact O-CB 3.43Å; A132-F136 PolarHBondContact O-N 3.45Å; I133-F136 WeakPolarHBondContact O-CB 3.48Å; I133-F136 PolarHBondContact O-N 2.99Å; F136-I235 HydrophobicContact CD1-CG2 4.31Å; F136-I235 HydrophobicContact CE1-CG2 3.98Å; F136-L237 HydrophobicContact CD1-CD1 4.3Å; F136-L237 HydrophobicContact CD1-CG 4.39Å; F136-L237 HydrophobicContact CD2-CD1 3.81Å; F136-L237 HydrophobicContact CE1-CD1 3.86Å; F136-L237 HydrophobicContact CE1-CD2 4.46Å; F136-L237 HydrophobicContact CE1-CG 3.61Å; F136-L237 HydrophobicContact CE2-CD1 3.28Å; F136-L237 HydrophobicContact CE2-CG 3.84Å; F136-L237 HydrophobicContact CG-CD1 4.32Å; F136-L237 HydrophobicContact CZ-CB 3.98Å; F136-L237 HydrophobicContact CZ-CD1 3.36Å; F136-L237 HydrophobicContact CZ-CG 3.32Å; F136-Y247 VanDerWaalsContact CE2-CB 3.41Å; F136-Y247 HydrophobicContact CE2-CD1 4.32Å; F136-Y247 HydrophobicContact CE2-CD2 4.48Å; F136-Y247 AromaticContact CE2-CG 3.86Å; F136-Y247 HydrophobicContact CE2-CG 3.86Å; F136-Y247 HydrophobicContact CZ-CG 4.23Å; F136-I249 HydrophobicContact CB-CD1 4.23Å; F136-I249 HydrophobicContact CD1-CD1 3.29Å; F136-I249 HydrophobicContact CD1-CG1 4.05Å; F136-I249 HydrophobicContact CE1-CD1 3.59Å; F136-I249 HydrophobicContact CE1-CG1 3.79Å; F136-I249 HydrophobicContact CG-CD1 3.83Å; F136-I249 HydrophobicContact CZ-CD1 4.35Å; F136-I249 HydrophobicContact CZ-CG1 4.32Å; F136-F268 AromaticContact CD2-CE2 3.43Å; F136-F268 HydrophobicContact CD2-CE2 3.43Å; F136-F268 VanDerWaalsContact CD2-CE2 3.43Å; F136-F268 HydrophobicContact CD2-CZ 4.03Å; F136-F268 HydrophobicContact CE2-CD2 4.42Å; F136-F268 AromaticContact CE2-CE2 3.28Å; F136-F268 HydrophobicContact CE2-CE2 3.28Å; F136-F268 AromaticContact CE2-CZ 3.7Å; F136-F268 HydrophobicContact CE2-CZ 3.7Å; F136-F268 HydrophobicContact CG-CE2 4.09Å; F136-F268 AromaticContact CZ-CE2 3.83Å; F136-F268 HydrophobicContact CZ-CE2 3.83Å; F136-F268 HydrophobicContact CZ-CZ 4.48Å
137	I	87.7	Confident	75.9	Confident	0 Å²	0	57 Å²	57	0%	0	29%	0.292	C	S	.	.	H	α-helix	trans	-71.2	-45.5	173.7	-64.9	166	0	0	0	110.6	I133 I134 Q135 L148 Y161 A164 L165 T168 K170 I235	I133-I137 HydrophobicContact CG2-CD1 4.2Å; I133-I137 WeakPolarHBondContact O-CG1 3.49Å; I133-I137 PolarHBondContact O-N 3.16Å; I134-I137 PolarHBondContact O-N 2.8Å; Q135-I137 PolarHBondContact O-N 2.93Å; Q135-I137 VanDerWaalsContact O-N 3.17Å; I137-L148 HydrophobicContact CB-CD1 4.28Å; I137-L148 HydrophobicContact CG1-CD1 4.14Å; I137-L148 HydrophobicContact CG2-CD1 3.93Å; I137-Y161 HydrophobicContact CD1-CD1 3.87Å; I137-Y161 HydrophobicContact CD1-CE1 4.29Å; I137-A164 HydrophobicContact CB-CB 4.08Å; I137-A164 HydrophobicContact CD1-CB 4.46Å; I137-A164 HydrophobicContact CG2-CB 3.72Å; I137-A164 WeakPolarHBondContact CG2-O 2.79Å; I137-L165 HydrophobicContact CG2-CD2 4.03Å; I137-L165 HydrophobicContact CG2-CG 4.39Å; I137-T168 HydrophobicContact CG2-CG2 4.31Å; I137-T168 WeakPolarHBondContact O-CB 3.35Å; I137-T168 PolarHBondContact O-OG1 3.31Å; I137-K170 PolarHBondContact O-NZ 3.13Å; I137-I235 HydrophobicContact CD1-CD1 4.16Å; I137-I235 HydrophobicContact CG1-CD1 4.42Å
138	R	85.1	Confident	76.8	Confident	107 Å²	107	53.9 Å²	53.9	40%	0.404	28%	0.278	S	S	.	.	H	α-helix	trans	-74.1	-63.8	-178.3	-70.7	179.4	170.9	176.4	-4.8	112.2	I134 Q135 T140 A164 K170	I134-R138 PolarHBondContact O-N 3.47Å; I134-R138 VanDerWaalsContact O-N 3.1Å; Q135-R138 CarbonylContact O-C 3.4Å; Q135-R138 PolarHBondContact O-N 3.43Å; R138-T140 PolarHBondContact O-N 3.41Å; R138-A164 HydrophobicContact CG-CB 4.02Å; R138-K170 PolarHBondContact O-NZ 2.78Å
139	D	69.2	Low	77.8	Confident	88 Å²	88	49.6 Å²	49.6	47%	0.471	25%	0.254	S	S	.	.			trans	-90.8	96.9	-166	-73.4	13.8	0	0	0	111.4	Q135	Q135-D139 VanDerWaalsContact CD-CG 3.44Å; Q135-D139 PolarHBondContact NE2-OD2 3.38Å; Q135-D139 WeakPolarHBondContact O-CA 3.43Å; Q135-D139 WeakPolarHBondContact O-CB 3.42Å; Q135-D139 PolarHBondContact O-N 2.98Å; Q135-D139 PolarHBondContact OE1-OD1 3.18Å; Q135-D139 VanDerWaalsContact OE1-OD1 3.09Å; Q135-D139 PolarHBondContact OE1-OD2 3.48Å
140	T	57.9	Low	78.6	Confident	32 Å²	32	49.7 Å²	49.7	20%	0.196	25%	0.254	C	S	.	.			trans	-126.2	126.2	136.6	55.3	0	0	0	0	103.6	R138 Q142 S143 Y146 K170 L237	R138-T140 PolarHBondContact O-N 3.41Å; T140-Q142 PolarHBondContact O-N 3.38Å; T140-Q142 PolarHBondContact OG1-O 2.86Å; T140-S143 PolarHBondContact O-N 3.41Å; T140-Y146 HydrophobicContact CG2-CD2 4.17Å; T140-Y146 HydrophobicContact CG2-CE2 4.5Å; T140-K170 WeakPolarHBondContact OG1-CE 3.28Å; T140-K170 PolarHBondContact OG1-NZ 3.04Å; T140-L237 HydrophobicContact CG2-CD1 3.9Å
141	D	52.9	Low	79.2	Confident	171 Å²	171	49.5 Å²	49.5	91%	0.914	25%	0.253	S	S	*	.	S	Bend	trans	-61	22.9	178.3	-67.4	-43.2	0	0	0	114
142	Q	60.6	Low	79.7	Confident	80 Å²	80	43.3 Å²	43.3	37%	0.374	22%	0.224	S	C	.	.			trans	-163.8	49.2	-156.9	-67.8	-164.5	-23.7	0	0	107.4	T140 D144 Q145	T140-Q142 PolarHBondContact O-N 3.38Å; T140-Q142 PolarHBondContact OG1-O 2.86Å; Q142-D144 PolarHBondContact O-N 3.22Å; Q142-Q145 HydrophobicContact CB-CB 3.87Å; Q142-Q145 HydrophobicContact CB-CG 3.67Å; Q142-Q145 VanDerWaalsContact CD-OE1 3.27Å; Q142-Q145 HydrophobicContact CG-CG 4.35Å; Q142-Q145 VanDerWaalsContact CG-NE2 3.27Å; Q142-Q145 VanDerWaalsContact NE2-NE2 3.2Å; Q142-Q145 WeakPolarHBondContact O-CA 3.44Å; Q142-Q145 WeakPolarHBondContact O-CB 3.21Å; Q142-Q145 PolarHBondContact O-N 3.07Å; Q142-Q145 VanDerWaalsContact OE1-CD 3.27Å
143	S	62.9	Low	80	Confident	36 Å²	36	41.3 Å²	41.3	25%	0.252	21%	0.207	S	C	.	.	G	3₁₀ helix	trans	-63.6	-24.8	-174.4	52	0	0	0	0	113.9	T140 Q145 C169	T140-S143 PolarHBondContact O-N 3.41Å; S143-Q145 PolarHBondContact O-N 3.42Å; S143-C169 WeakPolarHBondContact CB-SG 3.4Å; S143-C169 PolarHBondContact OG-SG 3.07Å
144	D	71.4	Confident	80.2	Confident	119 Å²	119	42.3 Å²	42.3	64%	0.636	21%	0.211	S	C	*	.	G	3₁₀ helix	trans	-73.3	-13	170.4	63.9	-34.4	0	0	0	113.1	Q142 T240	Q142-D144 PolarHBondContact O-N 3.22Å; D144-T240 PolarHBondContact O-OG1 3.03Å
145	Q	81.3	Confident	80.4	Confident	36 Å²	36	41.6 Å²	41.6	17%	0.168	21%	0.207	C	C	.	.	G	3₁₀ helix	trans	-94.4	-4.4	-175.9	-53.3	-169.6	36.4	0	0	113.8	Q142 S143 G239 T240 K241	Q142-Q145 HydrophobicContact CB-CB 3.87Å; Q142-Q145 HydrophobicContact CB-CG 3.67Å; Q142-Q145 VanDerWaalsContact CD-OE1 3.27Å; Q142-Q145 HydrophobicContact CG-CG 4.35Å; Q142-Q145 VanDerWaalsContact CG-NE2 3.27Å; Q142-Q145 VanDerWaalsContact NE2-NE2 3.2Å; Q142-Q145 WeakPolarHBondContact O-CA 3.44Å; Q142-Q145 WeakPolarHBondContact O-CB 3.21Å; Q142-Q145 PolarHBondContact O-N 3.07Å; Q142-Q145 VanDerWaalsContact OE1-CD 3.27Å; S143-Q145 PolarHBondContact O-N 3.42Å; Q145-G239 CarbonylContact O-C 3.55Å; Q145-G239 VanDerWaalsContact O-CA 3.26Å; Q145-G239 WeakPolarHBondContact O-CA 3.48Å; Q145-T240 VanDerWaalsContact C-OG1 3.24Å; Q145-T240 VanDerWaalsContact CA-OG1 3.22Å; Q145-T240 WeakPolarHBondContact CA-OG1 3.36Å; Q145-T240 PolarHBondContact O-N 2.89Å; Q145-T240 PolarHBondContact O-OG1 2.75Å; Q145-K241 VanDerWaalsContact CD-NZ 3.31Å
146	Y	87.7	Confident	80.7	Confident	19 Å²	19	39 Å²	39	8%	0.075	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.7	133	-175.7	-67.3	-85.6	0	0	0	114	T140 K170 L237 R238 R245 Y247	T140-Y146 HydrophobicContact CG2-CD2 4.17Å; T140-Y146 HydrophobicContact CG2-CE2 4.5Å; Y146-K170 WeakPolarHBondContact O-CB 3.46Å; Y146-L237 HydrophobicContact CD1-CB 3.89Å; Y146-L237 HydrophobicContact CG-CB 4.39Å; Y146-R238 VanDerWaalsContact CA-O 3.31Å; Y146-R238 WeakPolarHBondContact CA-O 3.48Å; Y146-R245 WeakPolarHBondContact CE1-O 3.4Å; Y146-Y247 HydrophobicContact CD1-CD2 4.46Å; Y146-Y247 AromaticContact CE1-CD2 3.87Å; Y146-Y247 HydrophobicContact CE1-CD2 3.87Å; Y146-Y247 AromaticContact CE1-CE2 3.68Å; Y146-Y247 HydrophobicContact CE1-CE2 3.68Å; Y146-Y247 AromaticContact CZ-CE2 3.82Å
147	D	89.2	Confident	80.9	Confident	26 Å²	26	39.2 Å²	39.2	14%	0.139	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89	134.9	162.7	-70.5	-30.8	0	0	0	109.9	Y149 L237 R238	D147-Y149 HydrophobicContact CB-CD2 4.4Å; D147-Y149 HydrophobicContact CB-CE2 3.59Å; D147-L237 WeakPolarHBondContact O-CA 3.37Å; D147-R238 PolarHBondContact N-O 3.41Å; D147-R238 PolarHBondContact O-N 2.88Å; D147-R238 IonicContact OD2-CZ 3.9Å; D147-R238 IonicContact OD2-NE 3.88Å; D147-R238 PolarHBondContact OD2-NE 3.36Å; D147-R238 IonicContact OD2-NH2 3.81Å; D147-R238 PolarHBondContact OD2-NH2 2.78Å
148	L	91.2	Very high	80.9	Confident	0 Å²	0	39.4 Å²	39.4	0%	0	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.1	130.2	176.3	-174.5	152	0	0	0	111.1	I137 L150 L165 K170 H171 C172 R173 I235 W236 L237	I137-L148 HydrophobicContact CB-CD1 4.28Å; I137-L148 HydrophobicContact CG1-CD1 4.14Å; I137-L148 HydrophobicContact CG2-CD1 3.93Å; L148-L150 HydrophobicContact CD2-CB 4.17Å; L148-L165 HydrophobicContact CD1-CD2 4.42Å; L148-L165 HydrophobicContact CD2-CD2 3.88Å; L148-K170 HydrophobicContact CB-CB 4.27Å; L148-K170 HydrophobicContact CB-CD 4.26Å; L148-K170 HydrophobicContact CD1-CD 4.45Å; L148-H171 PolarHBondContact N-O 3.36Å; L148-C172 HydrophobicContact CD2-CB 4.35Å; L148-C172 CarbonylContact O-C 3.57Å; L148-C172 VanDerWaalsContact O-CA 3.29Å; L148-C172 WeakPolarHBondContact O-CA 3.41Å; L148-R173 PolarHBondContact O-N 2.87Å; L148-I235 HydrophobicContact CD1-CG2 4.48Å; L148-I235 HydrophobicContact CG-CG2 4.29Å; L148-W236 CarbonylContact C-O 3.52Å; L148-W236 WeakPolarHBondContact CA-O 3.38Å; L148-L237 HydrophobicContact CB-CD2 3.7Å; L148-L237 HydrophobicContact CD1-CD2 3.92Å; L148-L237 HydrophobicContact CG-CD2 3.86Å
149	Y	91.3	Very high	81.1	Confident	15 Å²	15	41.7 Å²	41.7	6%	0.059	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	139.3	171.9	-60.3	-103.2	0	0	0	108.8	D147 R173 I235 W236 R238 V281 F285	D147-Y149 HydrophobicContact CB-CD2 4.4Å; D147-Y149 HydrophobicContact CB-CE2 3.59Å; Y149-R173 CarbonylContact C-O 3.54Å; Y149-R173 VanDerWaalsContact CA-O 3.31Å; Y149-R173 WeakPolarHBondContact CA-O 3.34Å; Y149-R173 HydrophobicContact CD1-CB 3.79Å; Y149-R173 HydrophobicContact CE1-CB 4.05Å; Y149-R173 VanDerWaalsContact CE1-CD 3.43Å; Y149-R173 HydrophobicContact CE1-CG 4.28Å; Y149-I235 CarbonylContact O-C 3.46Å; Y149-I235 VanDerWaalsContact O-CA 3.25Å; Y149-I235 WeakPolarHBondContact O-CA 3.37Å; Y149-W236 PolarHBondContact N-O 3.11Å; Y149-W236 PolarHBondContact O-N 2.95Å; Y149-R238 HydrophobicContact CE2-CB 4.12Å; Y149-R238 PolarHBondContact OH-NH2 2.73Å; Y149-V281 HydrophobicContact CD1-CG1 4.16Å; Y149-V281 HydrophobicContact CD2-CG2 4.15Å; Y149-V281 HydrophobicContact CE1-CG1 4.31Å; Y149-V281 HydrophobicContact CE2-CG2 4.23Å; Y149-V281 HydrophobicContact CG-CG1 4.35Å; Y149-F285 HydrophobicContact CD1-CB 4.05Å; Y149-F285 AromaticContact CD1-CD1 3.54Å; Y149-F285 HydrophobicContact CD1-CD1 3.54Å; Y149-F285 HydrophobicContact CD1-CD2 4.09Å; Y149-F285 AromaticContact CD1-CE1 3.91Å; Y149-F285 HydrophobicContact CD1-CE1 3.91Å; Y149-F285 HydrophobicContact CD1-CE2 4.43Å; Y149-F285 AromaticContact CD1-CG 3.62Å; Y149-F285 HydrophobicContact CD1-CG 3.62Å; Y149-F285 HydrophobicContact CD1-CZ 4.34Å; Y149-F285 HydrophobicContact CE1-CB 4.25Å; Y149-F285 HydrophobicContact CE1-CD1 4.31Å; Y149-F285 HydrophobicContact CE1-CG 4.3Å; Y149-F285 HydrophobicContact CG-CD1 4.49Å; Y149-F285 HydrophobicContact CG-CG 4.49Å
150	L	90.7	Very high	82.1	Confident	4 Å²	4	39 Å²	39	2%	0.021	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.9	133.8	177.6	-177.3	151.9	0	0	0	109.4	L148 F155 L165 R173 V174 L175 G234 I235 L255 F285	L148-L150 HydrophobicContact CD2-CB 4.17Å; L150-F155 HydrophobicContact CD2-CD2 4.42Å; L150-F155 HydrophobicContact CD2-CE2 4.34Å; L150-L165 HydrophobicContact CD1-CD1 4.11Å; L150-L165 HydrophobicContact CD1-CD2 4.25Å; L150-R173 PolarHBondContact N-O 3.02Å; L150-V174 HydrophobicContact CB-CG2 4.39Å; L150-V174 HydrophobicContact CD2-CG1 3.86Å; L150-V174 CarbonylContact O-C 3.58Å; L150-V174 VanDerWaalsContact O-CA 3.31Å; L150-V174 WeakPolarHBondContact O-CA 3.4Å; L150-L175 PolarHBondContact O-N 3.27Å; L150-G234 WeakPolarHBondContact CA-O 3.38Å; L150-I235 HydrophobicContact CD1-CG1 4.11Å; L150-I235 HydrophobicContact CG-CG1 4.22Å; L150-L255 HydrophobicContact CD1-CD1 3.85Å; L150-L255 HydrophobicContact CG-CD1 4.15Å; L150-F285 WeakPolarHBondContact O-CZ 3.37Å
151	A	89.7	Confident	83.6	Confident	0 Å²	0	37.7 Å²	37.7	0%	0	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	133.6	173.5	0	0	0	0	0	109.6	L175 F230 A232 K233 G234 W236 F285	A151-L175 CarbonylContact C-O 3.54Å; A151-L175 VanDerWaalsContact CA-O 3.3Å; A151-L175 WeakPolarHBondContact CA-O 3.45Å; A151-L175 HydrophobicContact CB-CB 4.31Å; A151-F230 HydrophobicContact CB-CZ 4.27Å; A151-A232 CarbonylContact C-O 3.58Å; A151-K233 CarbonylContact O-C 3.59Å; A151-K233 WeakPolarHBondContact O-CB 3.36Å; A151-G234 PolarHBondContact N-O 3.34Å; A151-G234 PolarHBondContact O-N 3.46Å; A151-G234 VanDerWaalsContact O-N 3.16Å; A151-W236 HydrophobicContact CB-CH2 3.81Å; A151-W236 HydrophobicContact CB-CZ3 3.72Å; A151-F285 HydrophobicContact CB-CE2 4.43Å; A151-F285 HydrophobicContact CB-CZ 4.17Å
152	S	89.5	Confident	85.5	Confident	0 Å²	0	30.2 Å²	30.2	0%	0	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.7	119.3	173.7	-170.5	0	0	0	0	111.9	Y154 L175 N254	S152-Y154 PolarHBondContact O-N 3.5Å; S152-L175 PolarHBondContact N-O 3.17Å; S152-N254 PolarHBondContact OG-O 3.24Å
153	G	86	Confident	87	Confident	2 Å²	2	27.8 Å²	27.8	2%	0.021	14%	0.142	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69.4	-17.3	174.2	0	0	0	0	0	114.9	A177	G153-A177 WeakPolarHBondContact O-CB 3.46Å
154	Y	86.7	Confident	88.4	Confident	22 Å²	22	26 Å²	26	9%	0.086	13%	0.13	C	C	.	.	T	Hydrogen-bonded Turn	trans	-140	65.6	-178.7	-62.4	-68	0	0	0	109.6	R52 S152 N156 F184 Y198 H231 N254	R52-Y154 PolarHBondContact NH2-OH 2.84Å; S152-Y154 PolarHBondContact O-N 3.5Å; Y154-N156 PolarHBondContact O-N 3.01Å; Y154-N156 VanDerWaalsContact O-N 3.1Å; Y154-F184 HydrophobicContact CE1-CD2 4.16Å; Y154-F184 HydrophobicContact CE1-CE2 4.19Å; Y154-Y198 AromaticContact CD1-CD2 3.8Å; Y154-Y198 HydrophobicContact CD1-CD2 3.8Å; Y154-Y198 HydrophobicContact CD1-CE1 4.48Å; Y154-Y198 AromaticContact CD1-CE2 3.31Å; Y154-Y198 HydrophobicContact CD1-CE2 3.31Å; Y154-Y198 AromaticContact CD1-CZ 3.72Å; Y154-Y198 HydrophobicContact CE1-CE2 4.07Å; Y154-Y198 HydrophobicContact CG-CE2 4.1Å; Y154-H231 AromaticContact CE2-CD2 3.52Å; Y154-H231 AromaticContact CE2-NE2 3.8Å; Y154-N254 WeakPolarHBondContact CD2-OD1 3.04Å
155	F	90.7	Very high	89.4	Confident	10 Å²	10	20.5 Å²	20.5	4%	0.044	10%	0.101	C	C	.	.			trans	-63.1	113	-174.6	-171.4	-101.2	0	0	0	111.6	L150 P157 V174 L176 V202 F205	L150-F155 HydrophobicContact CD2-CD2 4.42Å; L150-F155 HydrophobicContact CD2-CE2 4.34Å; F155-P157 HydrophobicContact CD1-CG 4.31Å; F155-P157 VanDerWaalsContact CE1-CD 3.43Å; F155-P157 HydrophobicContact CE1-CG 3.65Å; F155-P157 HydrophobicContact CE2-CB 4.4Å; F155-P157 HydrophobicContact CE2-CG 4.1Å; F155-P157 HydrophobicContact CZ-CB 4.25Å; F155-P157 HydrophobicContact CZ-CG 3.53Å; F155-V174 HydrophobicContact CE2-CG1 4.23Å; F155-L176 HydrophobicContact CB-CD1 4.42Å; F155-L176 HydrophobicContact CB-CD2 3.57Å; F155-L176 HydrophobicContact CD1-CD1 4.41Å; F155-L176 HydrophobicContact CD1-CD2 4.44Å; F155-L176 HydrophobicContact CD2-CD2 3.6Å; F155-L176 HydrophobicContact CE2-CD2 4.37Å; F155-L176 HydrophobicContact CG-CD1 4.35Å; F155-L176 HydrophobicContact CG-CD2 3.63Å; F155-V202 HydrophobicContact CB-CG2 4.33Å; F155-V202 HydrophobicContact CD1-CG2 3.85Å; F155-V202 HydrophobicContact CG-CG2 4.49Å; F155-F205 HydrophobicContact CE1-CB 3.94Å; F155-F205 AromaticContact CE1-CD1 3.78Å; F155-F205 HydrophobicContact CE1-CD1 3.78Å; F155-F205 HydrophobicContact CE1-CE1 4.5Å; F155-F205 AromaticContact CE1-CG 3.9Å; F155-F205 HydrophobicContact CE1-CG 3.9Å; F155-F205 AromaticContact CZ-CD1 3.66Å; F155-F205 HydrophobicContact CZ-CD1 3.66Å; F155-F205 AromaticContact CZ-CE1 3.92Å; F155-F205 HydrophobicContact CZ-CE1 3.92Å; F155-F205 HydrophobicContact CZ-CG 4.01Å; F155-F205 HydrophobicContact CZ-CZ 4.49Å
156	N	89.7	Confident	90	Very high	32 Å²	32	19.1 Å²	19.1	17%	0.171	9%	0.094	C	C	.	.			trans	-154	66.4	176.4	177.2	13.8	0	0	0	107	Y154 Y198 Y201 G256	Y154-N156 PolarHBondContact O-N 3.01Å; Y154-N156 VanDerWaalsContact O-N 3.1Å; N156-Y198 HydrophobicContact CB-CD1 4.25Å; N156-Y198 HydrophobicContact CB-CE1 4.05Å; N156-Y201 HydrophobicContact CB-CD2 3.79Å; N156-Y201 HydrophobicContact CB-CE2 4.12Å; N156-Y201 HydrophobicContact CB-CG 4.4Å; N156-G256 WeakPolarHBondContact O-CA 3.26Å
157	P	88.6	Confident	90.1	Very high	24 Å²	24	22.5 Å²	22.5	16%	0.156	11%	0.113	C	C	.	.	B	Isolated β-bridge	trans	-61.9	144.4	-173.3	29.2	-37.2	0	0	0	110.3	F155 A162	F155-P157 HydrophobicContact CD1-CG 4.31Å; F155-P157 VanDerWaalsContact CE1-CD 3.43Å; F155-P157 HydrophobicContact CE1-CG 3.65Å; F155-P157 HydrophobicContact CE2-CB 4.4Å; F155-P157 HydrophobicContact CE2-CG 4.1Å; F155-P157 HydrophobicContact CZ-CB 4.25Å; F155-P157 HydrophobicContact CZ-CG 3.53Å; P157-A162 HydrophobicContact CB-CB 4.31Å; P157-A162 HydrophobicContact CG-CB 4.2Å
158	T	87.4	Confident	90.2	Very high	4 Å²	4	21.5 Å²	21.5	3%	0.025	11%	0.108	C	C	.	.			trans	-64.1	160.7	166.8	80.5	0	0	0	0	108.8	A160 Y161 A162 N257 I259 Y260	T158-A160 PolarHBondContact O-N 3.08Å; T158-A160 PolarHBondContact OG1-N 2.84Å; T158-Y161 HydrophobicContact CG2-CD2 3.73Å; T158-Y161 HydrophobicContact CG2-CE2 4.19Å; T158-Y161 PolarHBondContact O-N 3.25Å; T158-Y161 VanDerWaalsContact O-N 3.08Å; T158-Y161 WeakPolarHBondContact OG1-CD2 3.35Å; T158-Y161 PolarHBondContact OG1-N 2.74Å; T158-A162 PolarHBondContact O-N 3.14Å; T158-N257 WeakPolarHBondContact CA-OD1 3.01Å; T158-N257 WeakPolarHBondContact CG2-OD1 3.3Å; T158-I259 HydrophobicContact CG2-CG2 4.38Å; T158-Y260 HydrophobicContact CG2-CD2 4.26Å; T158-Y260 HydrophobicContact CG2-CE2 3.42Å; T158-Y260 VanDerWaalsContact CG2-CE2 3.42Å
159	R	89.7	Confident	90	Very high	156 Å²	156	25.5 Å²	25.5	59%	0.589	14%	0.135	S	C	*	.	H	α-helix	trans	-55.1	-40.5	176.3	-176.9	61.6	-172.7	-145.5	4	112	Y161 A162 D163	R159-Y161 PolarHBondContact O-N 3.29Å; R159-A162 PolarHBondContact O-N 3.42Å; R159-D163 WeakPolarHBondContact CD-OD2 2.75Å; R159-D163 WeakPolarHBondContact CG-OD2 3.31Å; R159-D163 IonicContact CZ-OD1 3.78Å; R159-D163 IonicContact CZ-OD2 2.87Å; R159-D163 VanDerWaalsContact NE-CG 3.35Å; R159-D163 IonicContact NE-OD1 3.64Å; R159-D163 PolarHBondContact NE-OD1 3.16Å; R159-D163 VanDerWaalsContact NE-OD1 3.15Å; R159-D163 IonicContact NE-OD2 2.64Å; R159-D163 PolarHBondContact NE-OD2 3.11Å; R159-D163 IonicContact NH2-OD1 3.85Å; R159-D163 PolarHBondContact NH2-OD1 2.94Å; R159-D163 IonicContact NH2-OD2 2.75Å; R159-D163 WeakPolarHBondContact O-CB 3.42Å; R159-D163 PolarHBondContact O-N 3.03Å
160	A	89.1	Confident	89.9	Confident	32 Å²	32	24.8 Å²	24.8	26%	0.264	13%	0.133	S	C	.	.	H	α-helix	trans	-63.7	-40.3	177.6	0	0	0	0	0	113	I134 T158 A164	I134-A160 HydrophobicContact CD1-CB 3.77Å; T158-A160 PolarHBondContact O-N 3.08Å; T158-A160 PolarHBondContact OG1-N 2.84Å; A160-A164 VanDerWaalsContact O-CB 3.29Å; A160-A164 WeakPolarHBondContact O-CB 3.22Å; A160-A164 PolarHBondContact O-N 2.72Å
161	Y	89.4	Confident	89.9	Confident	4 Å²	4	29.8 Å²	29.8	2%	0.016	16%	0.155	C	C	.	.	H	α-helix	trans	-69	-42	174.9	-79.3	-67.4	0	0	0	112.1	N130 I133 I134 I137 T158 R159 A164 L165 L255 I259	N130-Y161 PolarHBondContact OD1-OH 3.38Å; I133-Y161 HydrophobicContact CB-CE1 4.09Å; I133-Y161 HydrophobicContact CG2-CE1 3.62Å; I134-Y161 HydrophobicContact CG1-CD1 4.1Å; I134-Y161 HydrophobicContact CG1-CE1 3.91Å; I137-Y161 HydrophobicContact CD1-CD1 3.87Å; I137-Y161 HydrophobicContact CD1-CE1 4.29Å; T158-Y161 HydrophobicContact CG2-CD2 3.73Å; T158-Y161 HydrophobicContact CG2-CE2 4.19Å; T158-Y161 PolarHBondContact O-N 3.25Å; T158-Y161 VanDerWaalsContact O-N 3.08Å; T158-Y161 WeakPolarHBondContact OG1-CD2 3.35Å; T158-Y161 PolarHBondContact OG1-N 2.74Å; R159-Y161 PolarHBondContact O-N 3.29Å; Y161-A164 PolarHBondContact O-N 3.27Å; Y161-L165 WeakPolarHBondContact O-CG 3.36Å; Y161-L165 PolarHBondContact O-N 3.05Å; Y161-L255 WeakPolarHBondContact CD2-O 3.49Å; Y161-L255 HydrophobicContact CE1-CD2 4.26Å; Y161-I259 HydrophobicContact CE2-CD1 4.49Å; Y161-I259 HydrophobicContact CE2-CG2 4.34Å
162	A	92.6	Very high	90.1	Very high	13 Å²	13	29.8 Å²	29.8	11%	0.107	16%	0.156	C	C	.	.	H	α-helix	trans	-61.9	-48.9	177.2	0	0	0	0	0	111	P157 T158 R159 A164 L165 L166 F205	P157-A162 HydrophobicContact CB-CB 4.31Å; P157-A162 HydrophobicContact CG-CB 4.2Å; T158-A162 PolarHBondContact O-N 3.14Å; R159-A162 PolarHBondContact O-N 3.42Å; A162-A164 PolarHBondContact O-N 2.75Å; A162-L165 PolarHBondContact O-N 3.42Å; A162-L166 WeakPolarHBondContact O-CB 3.23Å; A162-L166 WeakPolarHBondContact O-CD1 3.42Å; A162-L166 VanDerWaalsContact O-CG 3.23Å; A162-L166 WeakPolarHBondContact O-CG 3.42Å; A162-L166 PolarHBondContact O-N 3.1Å; A162-F205 HydrophobicContact CB-CD2 4.08Å; A162-F205 HydrophobicContact CB-CE2 3.95Å
163	D	92.7	Very high	90.2	Very high	29 Å²	29	33.5 Å²	33.5	16%	0.155	17%	0.17	C	C	.	.	H	α-helix	trans	-63	-41	176.7	-71.5	-31.6	0	0	0	110.8	R159 L165 L166 D167 R212	R159-D163 WeakPolarHBondContact CD-OD2 2.75Å; R159-D163 WeakPolarHBondContact CG-OD2 3.31Å; R159-D163 IonicContact CZ-OD1 3.78Å; R159-D163 IonicContact CZ-OD2 2.87Å; R159-D163 VanDerWaalsContact NE-CG 3.35Å; R159-D163 IonicContact NE-OD1 3.64Å; R159-D163 PolarHBondContact NE-OD1 3.16Å; R159-D163 VanDerWaalsContact NE-OD1 3.15Å; R159-D163 IonicContact NE-OD2 2.64Å; R159-D163 PolarHBondContact NE-OD2 3.11Å; R159-D163 IonicContact NH2-OD1 3.85Å; R159-D163 PolarHBondContact NH2-OD1 2.94Å; R159-D163 IonicContact NH2-OD2 2.75Å; R159-D163 WeakPolarHBondContact O-CB 3.42Å; R159-D163 PolarHBondContact O-N 3.03Å; D163-L165 VanDerWaalsContact C-N 3.33Å; D163-L165 PolarHBondContact O-N 2.81Å; D163-L166 CarbonylContact O-C 3.52Å; D163-L166 PolarHBondContact O-N 2.85Å; D163-L166 VanDerWaalsContact O-N 3.11Å; D163-D167 WeakPolarHBondContact O-CB 3.45Å; D163-D167 PolarHBondContact O-N 3.17Å; D163-R212 IonicContact OD1-CZ 3.61Å; D163-R212 IonicContact OD1-NH1 2.67Å; D163-R212 IonicContact OD1-NH2 3.5Å; D163-R212 PolarHBondContact OD1-NH2 3.22Å
164	A	92	Very high	90.5	Very high	0 Å²	0	33.4 Å²	33.4	0%	0	17%	0.169	C	C	.	.	H	α-helix	trans	-57.5	-41.8	174.6	0	0	0	0	0	113.4	I134 I137 R138 A160 Y161 A162 T168	I134-A164 HydrophobicContact CG2-CB 4.27Å; I137-A164 HydrophobicContact CB-CB 4.08Å; I137-A164 HydrophobicContact CD1-CB 4.46Å; I137-A164 HydrophobicContact CG2-CB 3.72Å; I137-A164 WeakPolarHBondContact CG2-O 2.79Å; R138-A164 HydrophobicContact CG-CB 4.02Å; A160-A164 VanDerWaalsContact O-CB 3.29Å; A160-A164 WeakPolarHBondContact O-CB 3.22Å; A160-A164 PolarHBondContact O-N 2.72Å; Y161-A164 PolarHBondContact O-N 3.27Å; A162-A164 PolarHBondContact O-N 2.75Å; A164-T168 WeakPolarHBondContact O-CB 3.4Å; A164-T168 WeakPolarHBondContact O-CG2 3.39Å; A164-T168 PolarHBondContact O-N 3.25Å; A164-T168 VanDerWaalsContact O-N 3.13Å
165	L	92.4	Very high	90.7	Very high	3 Å²	3	32.4 Å²	32.4	2%	0.016	17%	0.165	C	C	.	.	H	α-helix	trans	-70.4	-34.7	175.4	-69.2	168.5	0	0	0	112.7	I137 L148 L150 Y161 A162 D163 T168 F205 R217 I218	I137-L165 HydrophobicContact CG2-CD2 4.03Å; I137-L165 HydrophobicContact CG2-CG 4.39Å; L148-L165 HydrophobicContact CD1-CD2 4.42Å; L148-L165 HydrophobicContact CD2-CD2 3.88Å; L150-L165 HydrophobicContact CD1-CD1 4.11Å; L150-L165 HydrophobicContact CD1-CD2 4.25Å; Y161-L165 WeakPolarHBondContact O-CG 3.36Å; Y161-L165 PolarHBondContact O-N 3.05Å; A162-L165 PolarHBondContact O-N 3.42Å; D163-L165 VanDerWaalsContact C-N 3.33Å; D163-L165 PolarHBondContact O-N 2.81Å; L165-T168 WeakPolarHBondContact O-CG2 3.22Å; L165-F205 HydrophobicContact CB-CE2 4.49Å; L165-F205 HydrophobicContact CB-CZ 3.9Å; L165-F205 HydrophobicContact CD1-CZ 3.97Å; L165-R217 PolarHBondContact O-NH1 3.22Å; L165-R217 PolarHBondContact O-NH2 3.46Å; L165-I218 WeakPolarHBondContact O-CD1 3.43Å
166	L	93	Very high	90.8	Very high	6 Å²	6	32 Å²	32	3%	0.031	16%	0.163	C	C	.	.	H	α-helix	trans	-78.6	-23.2	179.7	-69.9	166.1	0	0	0	113.2	A162 D163 F205 E208 I209 R217 I218	A162-L166 WeakPolarHBondContact O-CB 3.23Å; A162-L166 WeakPolarHBondContact O-CD1 3.42Å; A162-L166 VanDerWaalsContact O-CG 3.23Å; A162-L166 WeakPolarHBondContact O-CG 3.42Å; A162-L166 PolarHBondContact O-N 3.1Å; D163-L166 CarbonylContact O-C 3.52Å; D163-L166 PolarHBondContact O-N 2.85Å; D163-L166 VanDerWaalsContact O-N 3.11Å; L166-F205 HydrophobicContact CD1-CD2 4.4Å; L166-F205 HydrophobicContact CD1-CE2 3.94Å; L166-F205 HydrophobicContact CD2-CE2 4.12Å; L166-F205 HydrophobicContact CD2-CZ 4.39Å; L166-F205 HydrophobicContact CG-CE2 3.78Å; L166-F205 HydrophobicContact CG-CZ 4.3Å; L166-E208 HydrophobicContact CD1-CB 3.88Å; L166-E208 HydrophobicContact CD2-CB 4.37Å; L166-I209 HydrophobicContact CD2-CG1 3.85Å; L166-R217 PolarHBondContact O-NH2 3.35Å; L166-I218 HydrophobicContact CD2-CD1 4.08Å
167	D	90.9	Very high	90.8	Very high	90 Å²	90	31.3 Å²	31.3	48%	0.481	16%	0.162	S	C	.	.	H	α-helix	trans	-102.5	-18.2	-175.7	-57.9	-19.8	0	0	0	112.6	D163 R212	D163-D167 WeakPolarHBondContact O-CB 3.45Å; D163-D167 PolarHBondContact O-N 3.17Å; D167-R212 IonicContact OD1-NH1 3.88Å; D167-R212 PolarHBondContact OD1-NH1 3.38Å
168	T	89.9	Confident	90.8	Very high	5 Å²	5	30.2 Å²	30.2	3%	0.031	16%	0.155	C	C	.	.			trans	-69.2	143.7	175.5	-168.2	0	0	0	0	111.7	I137 A164 L165 K170 R217	I137-T168 HydrophobicContact CG2-CG2 4.31Å; I137-T168 WeakPolarHBondContact O-CB 3.35Å; I137-T168 PolarHBondContact O-OG1 3.31Å; A164-T168 WeakPolarHBondContact O-CB 3.4Å; A164-T168 WeakPolarHBondContact O-CG2 3.39Å; A164-T168 PolarHBondContact O-N 3.25Å; A164-T168 VanDerWaalsContact O-N 3.13Å; L165-T168 WeakPolarHBondContact O-CG2 3.22Å; T168-K170 VanDerWaalsContact C-N 3.34Å; T168-K170 HydrophobicContact CG2-CB 4.43Å; T168-R217 PolarHBondContact O-NE 2.91Å; T168-R217 VanDerWaalsContact O-NE 3.17Å; T168-R217 PolarHBondContact O-NH1 2.9Å; T168-R217 PolarHBondContact O-NH2 2.82Å
169	C	88.1	Confident	91	Very high	84 Å²	84	34.1 Å²	34.1	57%	0.568	17%	0.169	S	C	*	.			trans	-88.3	1.1	177.1	26.4	0	0	0	0	114.1	S143	S143-C169 WeakPolarHBondContact CB-SG 3.4Å; S143-C169 PolarHBondContact OG-SG 3.07Å
170	K	90	Very high	91	Very high	1 Å²	1	30.5 Å²	30.5	0%	0.004	16%	0.159	C	C	.	.	S	Bend	trans	-70.1	147.5	177.4	-59.3	177	-178	75.3	0	111.6	I137 R138 T140 Y146 L148 T168 C172 R217 L237	I137-K170 PolarHBondContact O-NZ 3.13Å; R138-K170 PolarHBondContact O-NZ 2.78Å; T140-K170 WeakPolarHBondContact OG1-CE 3.28Å; T140-K170 PolarHBondContact OG1-NZ 3.04Å; Y146-K170 WeakPolarHBondContact O-CB 3.46Å; L148-K170 HydrophobicContact CB-CB 4.27Å; L148-K170 HydrophobicContact CB-CD 4.26Å; L148-K170 HydrophobicContact CD1-CD 4.45Å; T168-K170 VanDerWaalsContact C-N 3.34Å; T168-K170 HydrophobicContact CG2-CB 4.43Å; K170-C172 PolarHBondContact O-N 3.12Å; K170-C172 PolarHBondContact O-SG 2.77Å; K170-R217 PolarHBondContact O-NH1 3.46Å; K170-L237 HydrophobicContact CD-CD2 3.81Å
171	H	90.7	Very high	91.1	Very high	108 Å²	108	29 Å²	29	50%	0.5	15%	0.146	S	C	.	.			trans	-66.7	123.7	163.4	-73.9	-82.4	0	0	0	109.4	L148	L148-H171 PolarHBondContact N-O 3.36Å
172	C	92.2	Very high	91.2	Very high	1 Å²	1	29.1 Å²	29.1	1%	0.007	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	125.5	-172.6	-65.6	0	0	0	0	110.6	L148 K170 R217 I218 L219	L148-C172 HydrophobicContact CD2-CB 4.35Å; L148-C172 CarbonylContact O-C 3.57Å; L148-C172 VanDerWaalsContact O-CA 3.29Å; L148-C172 WeakPolarHBondContact O-CA 3.41Å; K170-C172 PolarHBondContact O-N 3.12Å; K170-C172 PolarHBondContact O-SG 2.77Å; C172-R217 PolarHBondContact N-O 3.45Å; C172-I218 HydrophobicContact CB-CB 4.46Å; C172-I218 HydrophobicContact CB-CG1 4.19Å; C172-I218 HydrophobicContact CB-CG2 4.25Å; C172-I218 WeakPolarHBondContact O-CA 3.38Å; C172-L219 PolarHBondContact O-N 3.41Å
173	R	92.3	Very high	90.9	Very high	77 Å²	77	30.2 Å²	30.2	29%	0.291	16%	0.16	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-115	110.6	171.7	-71.1	177.5	179.2	-104.9	2.9	109.6	L148 Y149 L150 L219 F285 Y289	L148-R173 PolarHBondContact O-N 2.87Å; Y149-R173 CarbonylContact C-O 3.54Å; Y149-R173 VanDerWaalsContact CA-O 3.31Å; Y149-R173 WeakPolarHBondContact CA-O 3.34Å; Y149-R173 HydrophobicContact CD1-CB 3.79Å; Y149-R173 HydrophobicContact CE1-CB 4.05Å; Y149-R173 VanDerWaalsContact CE1-CD 3.43Å; Y149-R173 HydrophobicContact CE1-CG 4.28Å; L150-R173 PolarHBondContact N-O 3.02Å; R173-L219 HydrophobicContact CG-CB 4.49Å; R173-F285 HydrophobicContact CB-CE1 4.47Å; R173-F285 WeakPolarHBondContact O-CE1 2.89Å; R173-Y289 PolarHBondContact NH2-OH 2.95Å
174	V	92.1	Very high	90.8	Very high	0 Å²	0	32.6 Å²	32.6	0%	0	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	126.1	-177.8	-179.6	0	0	0	0	109	L150 F155 L176 L219 L220 N221	L150-V174 HydrophobicContact CB-CG2 4.39Å; L150-V174 HydrophobicContact CD2-CG1 3.86Å; L150-V174 CarbonylContact O-C 3.58Å; L150-V174 VanDerWaalsContact O-CA 3.31Å; L150-V174 WeakPolarHBondContact O-CA 3.4Å; F155-V174 HydrophobicContact CE2-CG1 4.23Å; V174-L176 HydrophobicContact CG1-CD1 4.47Å; V174-L176 HydrophobicContact CG1-CD2 3.42Å; V174-L176 VanDerWaalsContact CG1-CD2 3.42Å; V174-L176 HydrophobicContact CG1-CG 3.94Å; V174-L219 PolarHBondContact N-O 2.9Å; V174-L220 HydrophobicContact CB-CD2 3.59Å; V174-L220 HydrophobicContact CG1-CD2 4.01Å; V174-L220 HydrophobicContact CG2-CD2 3.88Å; V174-L220 CarbonylContact O-C 3.53Å; V174-N221 PolarHBondContact O-N 3.03Å
175	L	92.1	Very high	90.6	Very high	1 Å²	1	37.8 Å²	37.8	1%	0.005	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	119.4	177.6	173.5	51.4	0	0	0	110.6	L150 A151 S152 N221 F230 L284 F285 L288	L150-L175 PolarHBondContact O-N 3.27Å; A151-L175 CarbonylContact C-O 3.54Å; A151-L175 VanDerWaalsContact CA-O 3.3Å; A151-L175 WeakPolarHBondContact CA-O 3.45Å; A151-L175 HydrophobicContact CB-CB 4.31Å; S152-L175 PolarHBondContact N-O 3.17Å; L175-N221 CarbonylContact C-O 3.57Å; L175-N221 WeakPolarHBondContact CA-O 2.94Å; L175-F230 HydrophobicContact CD1-CZ 4.5Å; L175-F230 HydrophobicContact CD2-CE2 3.96Å; L175-F230 HydrophobicContact CD2-CZ 3.68Å; L175-F230 HydrophobicContact CG-CE1 4.2Å; L175-F230 HydrophobicContact CG-CE2 4.32Å; L175-F230 HydrophobicContact CG-CZ 3.68Å; L175-L284 HydrophobicContact CD2-CB 4.15Å; L175-F285 HydrophobicContact CB-CD1 4.35Å; L175-F285 HydrophobicContact CB-CE1 3.57Å; L175-F285 HydrophobicContact CB-CZ 3.84Å; L175-L288 HydrophobicContact CB-CD1 3.79Å; L175-L288 HydrophobicContact CD1-CD1 3.5Å; L175-L288 HydrophobicContact CD1-CD2 3.37Å; L175-L288 HydrophobicContact CD1-CG 3.95Å; L175-L288 HydrophobicContact CD2-CD1 3.34Å; L175-L288 HydrophobicContact CD2-CD2 4.4Å; L175-L288 HydrophobicContact CD2-CG 4.14Å; L175-L288 HydrophobicContact CG-CD1 3.66Å; L175-L288 HydrophobicContact CG-CD2 4.41Å
176	L	91.4	Very high	90.4	Very high	3 Å²	3	41 Å²	41	2%	0.016	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	158.8	-174.5	-52.9	-173.9	0	0	0	110.9	F155 V174 S178 V202 N221 E222 Y223	F155-L176 HydrophobicContact CB-CD1 4.42Å; F155-L176 HydrophobicContact CB-CD2 3.57Å; F155-L176 HydrophobicContact CD1-CD1 4.41Å; F155-L176 HydrophobicContact CD1-CD2 4.44Å; F155-L176 HydrophobicContact CD2-CD2 3.6Å; F155-L176 HydrophobicContact CE2-CD2 4.37Å; F155-L176 HydrophobicContact CG-CD1 4.35Å; F155-L176 HydrophobicContact CG-CD2 3.63Å; V174-L176 HydrophobicContact CG1-CD1 4.47Å; V174-L176 HydrophobicContact CG1-CD2 3.42Å; V174-L176 VanDerWaalsContact CG1-CD2 3.42Å; V174-L176 HydrophobicContact CG1-CG 3.94Å; L176-S178 PolarHBondContact O-N 3.42Å; L176-V202 HydrophobicContact CD1-CB 4.33Å; L176-V202 HydrophobicContact CD1-CG1 3.76Å; L176-V202 HydrophobicContact CD1-CG2 3.55Å; L176-N221 PolarHBondContact N-O 3.37Å; L176-E222 CarbonylContact O-C 3.49Å; L176-E222 WeakPolarHBondContact O-CA 3.49Å; L176-Y223 WeakPolarHBondContact O-CB 3.48Å; L176-Y223 PolarHBondContact O-N 3.39Å
177	A	89.6	Confident	90.3	Very high	16 Å²	16	42.1 Å²	42.1	13%	0.132	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.1	131	164.7	0	0	0	0	0	108.9	G153 F230	G153-A177 WeakPolarHBondContact O-CB 3.46Å; A177-F230 HydrophobicContact CB-CB 3.92Å; A177-F230 HydrophobicContact CB-CD1 3.85Å; A177-F230 HydrophobicContact CB-CG 4.37Å
178	S	90.1	Very high	90	Very high	2 Å²	2	47.1 Å²	47.1	1%	0.014	25%	0.251	C	S	.	.			trans	-59.6	164.4	159.9	62.8	0	0	0	0	110.1	L176 E180 S181 N182 Y223	L176-S178 PolarHBondContact O-N 3.42Å; S178-E180 PolarHBondContact O-N 3.1Å; S178-S181 PolarHBondContact O-N 3.46Å; S178-S181 WeakPolarHBondContact OG-CB 2.93Å; S178-S181 PolarHBondContact OG-N 3.26Å; S178-S181 VanDerWaalsContact OG-N 3.07Å; S178-S181 PolarHBondContact OG-OG 2.95Å; S178-N182 PolarHBondContact O-N 3.22Å; S178-Y223 WeakPolarHBondContact CB-O 3.46Å; S178-Y223 PolarHBondContact N-O 3.15Å; S178-Y223 PolarHBondContact OG-O 2.8Å
179	R	90.5	Very high	90	Very high	86 Å²	86	49.2 Å²	49.2	33%	0.325	27%	0.273	S	S	.	.	S	Bend	trans	-56.4	-43.6	174.9	-172.9	-175.1	66.8	117.4	-1.6	111.1	N182 Y185 P195	R179-N182 VanDerWaalsContact O-CB 3.3Å; R179-N182 WeakPolarHBondContact O-CB 2.82Å; R179-N182 PolarHBondContact O-N 3.37Å; R179-Y185 HydrophobicContact CG-CD2 4.17Å; R179-Y185 HydrophobicContact CG-CE2 4.21Å; R179-Y185 WeakPolarHBondContact O-CB 3.49Å; R179-Y185 WeakPolarHBondContact O-CD2 3.34Å; R179-P195 HydrophobicContact CG-CB 3.8Å
180	E	90.4	Very high	89.9	Confident	79 Å²	79	53.2 Å²	53.2	37%	0.369	28%	0.281	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.7	-35	-178.8	-69.4	67.9	-154	0	0	112.7	S178 N182 Y185	S178-E180 PolarHBondContact O-N 3.1Å; E180-N182 VanDerWaalsContact C-N 3.29Å; E180-N182 PolarHBondContact O-N 3.04Å; E180-Y185 HydrophobicContact CB-CE1 4.49Å; E180-Y185 HydrophobicContact CB-CE2 4.44Å; E180-Y185 HydrophobicContact CG-CE1 4.32Å; E180-Y185 HydrophobicContact CG-CE2 4.01Å
181	S	91.5	Very high	89.8	Confident	1 Å²	1	55.1 Å²	55.1	1%	0.007	29%	0.294	C	S	.	.	T	Hydrogen-bonded Turn	trans	-87.3	9	175.3	-66.7	0	0	0	0	113.7	S178 Y223 R225 W228 T229 F230	S178-S181 PolarHBondContact O-N 3.46Å; S178-S181 WeakPolarHBondContact OG-CB 2.93Å; S178-S181 PolarHBondContact OG-N 3.26Å; S178-S181 VanDerWaalsContact OG-N 3.07Å; S178-S181 PolarHBondContact OG-OG 2.95Å; S181-Y223 WeakPolarHBondContact CB-O 3.34Å; S181-Y223 PolarHBondContact OG-O 2.75Å; S181-R225 PolarHBondContact OG-N 2.98Å; S181-W228 WeakPolarHBondContact CA-O 3.29Å; S181-W228 WeakPolarHBondContact CB-O 3.44Å; S181-W228 PolarHBondContact OG-O 3.38Å; S181-T229 CarbonylContact O-C 3.53Å; S181-T229 WeakPolarHBondContact O-CA 3.31Å; S181-F230 PolarHBondContact O-N 3.24Å
182	N	90.3	Very high	89.7	Confident	7 Å²	7	57.2 Å²	57.2	4%	0.037	30%	0.298	C	S	.	.	S	Bend	trans	-75.4	136.5	173.1	-166.9	-69.7	0	0	0	110.7	S178 R179 E180 F184 Y185 P195	S178-N182 PolarHBondContact O-N 3.22Å; R179-N182 VanDerWaalsContact O-CB 3.3Å; R179-N182 WeakPolarHBondContact O-CB 2.82Å; R179-N182 PolarHBondContact O-N 3.37Å; E180-N182 VanDerWaalsContact C-N 3.29Å; E180-N182 PolarHBondContact O-N 3.04Å; N182-F184 PolarHBondContact O-N 2.84Å; N182-F184 PolarHBondContact OD1-N 2.88Å; N182-Y185 WeakPolarHBondContact O-CB 2.92Å; N182-Y185 PolarHBondContact O-N 2.65Å; N182-P195 HydrophobicContact CB-CB 3.94Å; N182-P195 HydrophobicContact CB-CG 3.87Å
183	G	87.1	Confident	89.6	Confident	35 Å²	35	60.5 Å²	60.5	36%	0.361	31%	0.313	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.9	-11.6	178.9	0	0	0	0	0	116
184	F	89.5	Confident	89.5	Confident	80 Å²	80	58.1 Å²	58.1	35%	0.351	31%	0.307	S	S	.	.	T	Hydrogen-bonded Turn	trans	-105	5.3	174.1	-64.2	-81	0	0	0	113.4	Y154 N182 G186 A187 V194 P195	Y154-F184 HydrophobicContact CE1-CD2 4.16Å; Y154-F184 HydrophobicContact CE1-CE2 4.19Å; N182-F184 PolarHBondContact O-N 2.84Å; N182-F184 PolarHBondContact OD1-N 2.88Å; F184-G186 PolarHBondContact O-N 3.09Å; F184-A187 HydrophobicContact CB-CB 4.48Å; F184-A187 WeakPolarHBondContact O-CB 3.34Å; F184-A187 PolarHBondContact O-N 3.28Å; F184-A187 VanDerWaalsContact O-N 3.11Å; F184-V194 HydrophobicContact CB-CB 3.92Å; F184-V194 HydrophobicContact CB-CG1 4.22Å; F184-V194 HydrophobicContact CD2-CB 4.02Å; F184-V194 HydrophobicContact CD2-CG1 3.47Å; F184-V194 VanDerWaalsContact CD2-CG1 3.47Å; F184-V194 HydrophobicContact CE2-CG1 4.02Å; F184-V194 HydrophobicContact CG-CB 3.98Å; F184-V194 HydrophobicContact CG-CG1 3.98Å; F184-V194 HydrophobicContact CG-CG2 4.37Å; F184-P195 HydrophobicContact CB-CG 4.23Å
185	Y	88.8	Confident	89.5	Confident	108 Å²	108	58.3 Å²	58.3	42%	0.424	31%	0.309	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.9	131.4	175.3	-171.4	-103	0	0	0	110.4	R179 E180 N182 A187	R179-Y185 HydrophobicContact CG-CD2 4.17Å; R179-Y185 HydrophobicContact CG-CE2 4.21Å; R179-Y185 WeakPolarHBondContact O-CB 3.49Å; R179-Y185 WeakPolarHBondContact O-CD2 3.34Å; E180-Y185 HydrophobicContact CB-CE1 4.49Å; E180-Y185 HydrophobicContact CB-CE2 4.44Å; E180-Y185 HydrophobicContact CG-CE1 4.32Å; E180-Y185 HydrophobicContact CG-CE2 4.01Å; N182-Y185 WeakPolarHBondContact O-CB 2.92Å; N182-Y185 PolarHBondContact O-N 2.65Å; Y185-A187 PolarHBondContact O-N 2.66Å
186	G	88.8	Confident	89.4	Confident	70 Å²	70	62.4 Å²	62.4	72%	0.722	33%	0.327	S	S	*	.	T	Hydrogen-bonded Turn	trans	71.7	4	-175.9	0	0	0	0	0	115.6	F184	F184-G186 PolarHBondContact O-N 3.09Å
187	A	89.5	Confident	89.4	Confident	31 Å²	31	65.1 Å²	65.1	26%	0.256	34%	0.341	S	S	.	.			trans	-61.9	156.4	176.8	0	0	0	0	0	112.1	F184 Y185 S191 R192	F184-A187 HydrophobicContact CB-CB 4.48Å; F184-A187 WeakPolarHBondContact O-CB 3.34Å; F184-A187 PolarHBondContact O-N 3.28Å; F184-A187 VanDerWaalsContact O-N 3.11Å; Y185-A187 PolarHBondContact O-N 2.66Å; A187-S191 WeakPolarHBondContact CB-OG 3.48Å; A187-R192 WeakPolarHBondContact O-CB 3.44Å
188	K	84.6	Confident	89.5	Confident	195 Å²	195	67 Å²	67	85%	0.848	35%	0.345	S	S	*	.	S	Bend	trans	-92.6	151.6	178.1	-64.7	-177.6	-179.3	178.9	0	111.6	S191	K188-S191 PolarHBondContact O-OG 3.35Å
189	G	90.8	Very high	89.5	Confident	48 Å²	48	69.5 Å²	69.5	50%	0.495	36%	0.358	S	S	.	.	G	3₁₀ helix	trans	72.7	-150.2	178.8	0	0	0	0	0	112.9	S191 R192	G189-S191 VanDerWaalsContact C-N 3.3Å; G189-S191 PolarHBondContact O-N 2.94Å; G189-R192 WeakPolarHBondContact O-CB 3.18Å; G189-R192 WeakPolarHBondContact O-CD 3.37Å; G189-R192 WeakPolarHBondContact O-CG 3.44Å; G189-R192 PolarHBondContact O-N 3.1Å
190	F	85.6	Confident	89.6	Confident	169 Å²	169	68.1 Å²	68.1	74%	0.741	36%	0.362	S	S	*	.	G	3₁₀ helix	trans	-67	-27.8	-174.5	-171.7	-100.6	0	0	0	113.6	R192 Q193	F190-R192 PolarHBondContact O-N 3.15Å; F190-R192 VanDerWaalsContact O-N 3.11Å; F190-Q193 WeakPolarHBondContact O-CB 3.45Å; F190-Q193 PolarHBondContact O-N 2.89Å
191	S	87.6	Confident	89.7	Confident	40 Å²	40	68.9 Å²	68.9	28%	0.28	36%	0.362	S	S	.	.	G	3₁₀ helix	trans	-61.9	-21.7	179.9	54.5	0	0	0	0	113.2	A187 K188 G189 Q193 V194	A187-S191 WeakPolarHBondContact CB-OG 3.48Å; K188-S191 PolarHBondContact O-OG 3.35Å; G189-S191 VanDerWaalsContact C-N 3.3Å; G189-S191 PolarHBondContact O-N 2.94Å; S191-Q193 PolarHBondContact O-N 3.22Å; S191-Q193 VanDerWaalsContact O-N 3.12Å; S191-V194 VanDerWaalsContact O-CB 3.25Å; S191-V194 WeakPolarHBondContact O-CB 3.44Å; S191-V194 VanDerWaalsContact O-CG2 3.25Å; S191-V194 WeakPolarHBondContact O-CG2 3.36Å; S191-V194 PolarHBondContact O-N 3.39Å
192	R	89	Confident	89.8	Confident	152 Å²	152	69.6 Å²	69.6	57%	0.574	37%	0.366	S	S	*	.	G	3₁₀ helix	trans	-59.1	-21.8	172.7	87.8	-171.7	176.9	-170	-4.3	113.8	A187 G189 F190 P195	A187-R192 WeakPolarHBondContact O-CB 3.44Å; G189-R192 WeakPolarHBondContact O-CB 3.18Å; G189-R192 WeakPolarHBondContact O-CD 3.37Å; G189-R192 WeakPolarHBondContact O-CG 3.44Å; G189-R192 PolarHBondContact O-N 3.1Å; F190-R192 PolarHBondContact O-N 3.15Å; F190-R192 VanDerWaalsContact O-N 3.11Å; R192-P195 WeakPolarHBondContact O-CD 3.15Å
193	Q	90.6	Very high	90	Very high	70 Å²	70	73 Å²	73	33%	0.327	38%	0.384	S	S	.	.	G	3₁₀ helix	trans	-82.5	-15.2	178.6	-58.3	-59.1	-14.6	0	0	112.6	F190 S191 H196 I197	F190-Q193 WeakPolarHBondContact O-CB 3.45Å; F190-Q193 PolarHBondContact O-N 2.89Å; S191-Q193 PolarHBondContact O-N 3.22Å; S191-Q193 VanDerWaalsContact O-N 3.12Å; Q193-H196 WeakPolarHBondContact O-CA 3.47Å; Q193-H196 WeakPolarHBondContact O-CB 3.31Å; Q193-H196 PolarHBondContact O-N 3.01Å; Q193-I197 HydrophobicContact CB-CD1 4.42Å; Q193-I197 WeakPolarHBondContact O-CG1 3.43Å; Q193-I197 PolarHBondContact O-N 3.01Å
194	V	90.8	Very high	90.3	Very high	27 Å²	27	75.8 Å²	75.8	16%	0.164	39%	0.394	C	S	.	.	H	α-helix	trans	-56.4	-44.6	-176.4	174.6	0	0	0	0	112.7	F184 S191 H196 I197 Y198	F184-V194 HydrophobicContact CB-CB 3.92Å; F184-V194 HydrophobicContact CB-CG1 4.22Å; F184-V194 HydrophobicContact CD2-CB 4.02Å; F184-V194 HydrophobicContact CD2-CG1 3.47Å; F184-V194 VanDerWaalsContact CD2-CG1 3.47Å; F184-V194 HydrophobicContact CE2-CG1 4.02Å; F184-V194 HydrophobicContact CG-CB 3.98Å; F184-V194 HydrophobicContact CG-CG1 3.98Å; F184-V194 HydrophobicContact CG-CG2 4.37Å; S191-V194 VanDerWaalsContact O-CB 3.25Å; S191-V194 WeakPolarHBondContact O-CB 3.44Å; S191-V194 VanDerWaalsContact O-CG2 3.25Å; S191-V194 WeakPolarHBondContact O-CG2 3.36Å; S191-V194 PolarHBondContact O-N 3.39Å; V194-H196 VanDerWaalsContact C-N 3.31Å; V194-H196 PolarHBondContact O-N 3.18Å; V194-I197 PolarHBondContact O-N 3.12Å; V194-Y198 HydrophobicContact CG1-CD2 3.7Å; V194-Y198 HydrophobicContact CG1-CE2 3.33Å; V194-Y198 WeakPolarHBondContact O-CD2 3.45Å; V194-Y198 PolarHBondContact O-N 3.39Å; V194-Y198 VanDerWaalsContact O-N 3.08Å
195	P	90.4	Very high	90.5	Very high	5 Å²	5	72.3 Å²	72.3	3%	0.032	38%	0.379	C	S	.	.	H	α-helix	trans	-60.2	-39	174.6	-22.8	34.5	0	0	0	113	R179 N182 F184 R192 Y198 L199	R179-P195 HydrophobicContact CG-CB 3.8Å; N182-P195 HydrophobicContact CB-CB 3.94Å; N182-P195 HydrophobicContact CB-CG 3.87Å; F184-P195 HydrophobicContact CB-CG 4.23Å; R192-P195 WeakPolarHBondContact O-CD 3.15Å; P195-Y198 PolarHBondContact O-N 2.83Å; P195-L199 WeakPolarHBondContact O-CB 3.37Å; P195-L199 PolarHBondContact O-N 3.4Å
196	H	90.5	Very high	90.8	Very high	86 Å²	86	70.6 Å²	70.6	40%	0.398	38%	0.377	S	S	.	.	H	α-helix	trans	-67.4	-35.7	177.5	-66.5	-79.1	0	0	0	112.5	Q193 V194 L199 S200	Q193-H196 WeakPolarHBondContact O-CA 3.47Å; Q193-H196 WeakPolarHBondContact O-CB 3.31Å; Q193-H196 PolarHBondContact O-N 3.01Å; V194-H196 VanDerWaalsContact C-N 3.31Å; V194-H196 PolarHBondContact O-N 3.18Å; H196-L199 PolarHBondContact O-N 3.11Å; H196-S200 PolarHBondContact O-N 3.11Å
197	I	91.6	Very high	91.1	Very high	60 Å²	60	72.4 Å²	72.4	31%	0.308	37%	0.37	S	S	.	.	H	α-helix	trans	-65	-45	174.9	-67.1	166.1	0	0	0	110.5	Q193 V194 S200 Y201	Q193-I197 HydrophobicContact CB-CD1 4.42Å; Q193-I197 WeakPolarHBondContact O-CG1 3.43Å; Q193-I197 PolarHBondContact O-N 3.01Å; V194-I197 PolarHBondContact O-N 3.12Å; I197-S200 PolarHBondContact O-N 3.23Å; I197-S200 PolarHBondContact O-OG 3.38Å; I197-Y201 HydrophobicContact CG2-CD2 4.33Å; I197-Y201 HydrophobicContact CG2-CE2 3.62Å; I197-Y201 WeakPolarHBondContact O-CD2 3.48Å; I197-Y201 PolarHBondContact O-N 2.99Å
198	Y	91.5	Very high	91.4	Very high	57 Å²	57	72.7 Å²	72.7	22%	0.224	37%	0.366	C	S	.	.	H	α-helix	trans	-66.4	-39.2	176.8	-71.9	-63.6	0	0	0	112.2	Y154 N156 V194 P195 S200 Y201 V202	Y154-Y198 AromaticContact CD1-CD2 3.8Å; Y154-Y198 HydrophobicContact CD1-CD2 3.8Å; Y154-Y198 HydrophobicContact CD1-CE1 4.48Å; Y154-Y198 AromaticContact CD1-CE2 3.31Å; Y154-Y198 HydrophobicContact CD1-CE2 3.31Å; Y154-Y198 AromaticContact CD1-CZ 3.72Å; Y154-Y198 HydrophobicContact CE1-CE2 4.07Å; Y154-Y198 HydrophobicContact CG-CE2 4.1Å; N156-Y198 HydrophobicContact CB-CD1 4.25Å; N156-Y198 HydrophobicContact CB-CE1 4.05Å; V194-Y198 HydrophobicContact CG1-CD2 3.7Å; V194-Y198 HydrophobicContact CG1-CE2 3.33Å; V194-Y198 WeakPolarHBondContact O-CD2 3.45Å; V194-Y198 PolarHBondContact O-N 3.39Å; V194-Y198 VanDerWaalsContact O-N 3.08Å; P195-Y198 PolarHBondContact O-N 2.83Å; Y198-S200 VanDerWaalsContact C-N 3.26Å; Y198-S200 PolarHBondContact O-N 3.01Å; Y198-Y201 HydrophobicContact CD1-CD2 4.1Å; Y198-Y201 PolarHBondContact O-N 3.45Å; Y198-Y201 VanDerWaalsContact O-N 3.16Å; Y198-V202 WeakPolarHBondContact O-CG2 3.37Å; Y198-V202 PolarHBondContact O-N 3.01Å; Y198-V202 VanDerWaalsContact O-N 3.07Å
199	L	90.4	Very high	92	Very high	54 Å²	54	63.5 Å²	63.5	28%	0.283	33%	0.326	S	S	.	.	H	α-helix	trans	-60.3	-35.4	174	-176.6	60.1	0	0	0	112.2	P195 H196 V202 N203	P195-L199 WeakPolarHBondContact O-CB 3.37Å; P195-L199 PolarHBondContact O-N 3.4Å; H196-L199 PolarHBondContact O-N 3.11Å; L199-V202 WeakPolarHBondContact O-CB 3.2Å; L199-V202 PolarHBondContact O-N 3.11Å; L199-N203 VanDerWaalsContact O-CG 3.32Å; L199-N203 PolarHBondContact O-N 2.93Å; L199-N203 PolarHBondContact O-ND2 3.07Å
200	S	92.5	Very high	92.2	Very high	57 Å²	57	64.8 Å²	64.8	40%	0.399	32%	0.324	S	S	.	.	H	α-helix	trans	-66.2	-37.7	175.9	79.6	0	0	0	0	112.3	H196 I197 Y198 V202 N203 V204	H196-S200 PolarHBondContact O-N 3.11Å; I197-S200 PolarHBondContact O-N 3.23Å; I197-S200 PolarHBondContact O-OG 3.38Å; Y198-S200 VanDerWaalsContact C-N 3.26Å; Y198-S200 PolarHBondContact O-N 3.01Å; S200-V202 VanDerWaalsContact C-N 3.34Å; S200-N203 PolarHBondContact O-N 3.28Å; S200-V204 WeakPolarHBondContact O-CG2 3.42Å; S200-V204 PolarHBondContact O-N 2.99Å
201	Y	93.4	Very high	92.7	Very high	94 Å²	94	64.3 Å²	64.3	37%	0.369	32%	0.317	S	S	.	.	H	α-helix	trans	-64.1	-38.7	172.5	-63.3	-48.3	0	0	0	112.4	N156 I197 Y198 V204 F205	N156-Y201 HydrophobicContact CB-CD2 3.79Å; N156-Y201 HydrophobicContact CB-CE2 4.12Å; N156-Y201 HydrophobicContact CB-CG 4.4Å; I197-Y201 HydrophobicContact CG2-CD2 4.33Å; I197-Y201 HydrophobicContact CG2-CE2 3.62Å; I197-Y201 WeakPolarHBondContact O-CD2 3.48Å; I197-Y201 PolarHBondContact O-N 2.99Å; Y198-Y201 HydrophobicContact CD1-CD2 4.1Å; Y198-Y201 PolarHBondContact O-N 3.45Å; Y198-Y201 VanDerWaalsContact O-N 3.16Å; Y201-V204 PolarHBondContact O-N 3.45Å; Y201-F205 PolarHBondContact O-N 2.98Å
202	V	93	Very high	93.1	Very high	17 Å²	17	65 Å²	65	10%	0.103	31%	0.314	C	S	.	.	H	α-helix	trans	-61.8	-46.1	173.6	177.5	0	0	0	0	110.8	F155 L176 Y198 L199 S200 V204 F205 L206 L220	F155-V202 HydrophobicContact CB-CG2 4.33Å; F155-V202 HydrophobicContact CD1-CG2 3.85Å; F155-V202 HydrophobicContact CG-CG2 4.49Å; L176-V202 HydrophobicContact CD1-CB 4.33Å; L176-V202 HydrophobicContact CD1-CG1 3.76Å; L176-V202 HydrophobicContact CD1-CG2 3.55Å; Y198-V202 WeakPolarHBondContact O-CG2 3.37Å; Y198-V202 PolarHBondContact O-N 3.01Å; Y198-V202 VanDerWaalsContact O-N 3.07Å; L199-V202 WeakPolarHBondContact O-CB 3.2Å; L199-V202 PolarHBondContact O-N 3.11Å; S200-V202 VanDerWaalsContact C-N 3.34Å; V202-V204 PolarHBondContact O-N 3.39Å; V202-F205 PolarHBondContact O-N 3.08Å; V202-F205 VanDerWaalsContact O-N 3.16Å; V202-L206 WeakPolarHBondContact O-CB 3.12Å; V202-L206 PolarHBondContact O-N 3.16Å; V202-L220 HydrophobicContact CG1-CD1 4.15Å
203	N	93.2	Very high	93.3	Very high	77 Å²	77	63 Å²	63	41%	0.412	31%	0.314	S	S	.	.	H	α-helix	trans	-62.4	-41	178.7	-71.2	-20.9	0	0	0	112.5	L199 S200 F205 L206 N207	L199-N203 VanDerWaalsContact O-CG 3.32Å; L199-N203 PolarHBondContact O-N 2.93Å; L199-N203 PolarHBondContact O-ND2 3.07Å; S200-N203 PolarHBondContact O-N 3.28Å; N203-F205 VanDerWaalsContact C-N 3.32Å; N203-F205 PolarHBondContact O-N 2.82Å; N203-L206 PolarHBondContact O-N 3.34Å; N203-N207 WeakPolarHBondContact O-CB 3.18Å; N203-N207 VanDerWaalsContact O-CG 3.22Å; N203-N207 PolarHBondContact O-N 2.79Å; N203-N207 PolarHBondContact O-ND2 3.25Å
204	V	94	Very high	93.5	Very high	94 Å²	94	61.5 Å²	61.5	57%	0.57	31%	0.307	S	S	*	.	H	α-helix	trans	-60.1	-44.6	173.9	170.1	0	0	0	0	110.7	S200 Y201 V202 N207 E208	S200-V204 WeakPolarHBondContact O-CG2 3.42Å; S200-V204 PolarHBondContact O-N 2.99Å; Y201-V204 PolarHBondContact O-N 3.45Å; V202-V204 PolarHBondContact O-N 3.39Å; V204-N207 PolarHBondContact O-N 3.03Å; V204-E208 PolarHBondContact O-N 3.16Å; V204-E208 VanDerWaalsContact O-N 3.16Å
205	F	94.7	Very high	93.6	Very high	7 Å²	7	64.6 Å²	64.6	3%	0.031	32%	0.32	C	S	.	.	H	α-helix	trans	-66.7	-42.7	178	-172	-115.3	0	0	0	112.2	F155 A162 L165 L166 Y201 V202 N203 N207 E208 I209 L220	F155-F205 HydrophobicContact CE1-CB 3.94Å; F155-F205 AromaticContact CE1-CD1 3.78Å; F155-F205 HydrophobicContact CE1-CD1 3.78Å; F155-F205 HydrophobicContact CE1-CE1 4.5Å; F155-F205 AromaticContact CE1-CG 3.9Å; F155-F205 HydrophobicContact CE1-CG 3.9Å; F155-F205 AromaticContact CZ-CD1 3.66Å; F155-F205 HydrophobicContact CZ-CD1 3.66Å; F155-F205 AromaticContact CZ-CE1 3.92Å; F155-F205 HydrophobicContact CZ-CE1 3.92Å; F155-F205 HydrophobicContact CZ-CG 4.01Å; F155-F205 HydrophobicContact CZ-CZ 4.49Å; A162-F205 HydrophobicContact CB-CD2 4.08Å; A162-F205 HydrophobicContact CB-CE2 3.95Å; L165-F205 HydrophobicContact CB-CE2 4.49Å; L165-F205 HydrophobicContact CB-CZ 3.9Å; L165-F205 HydrophobicContact CD1-CZ 3.97Å; L166-F205 HydrophobicContact CD1-CD2 4.4Å; L166-F205 HydrophobicContact CD1-CE2 3.94Å; L166-F205 HydrophobicContact CD2-CE2 4.12Å; L166-F205 HydrophobicContact CD2-CZ 4.39Å; L166-F205 HydrophobicContact CG-CE2 3.78Å; L166-F205 HydrophobicContact CG-CZ 4.3Å; Y201-F205 PolarHBondContact O-N 2.98Å; V202-F205 PolarHBondContact O-N 3.08Å; V202-F205 VanDerWaalsContact O-N 3.16Å; N203-F205 VanDerWaalsContact C-N 3.32Å; N203-F205 PolarHBondContact O-N 2.82Å; F205-N207 VanDerWaalsContact C-N 3.33Å; F205-N207 PolarHBondContact O-N 3.2Å; F205-E208 WeakPolarHBondContact O-CB 3.25Å; F205-E208 PolarHBondContact O-N 2.76Å; F205-E208 VanDerWaalsContact O-N 3.11Å; F205-I209 HydrophobicContact CD1-CD1 3.86Å; F205-I209 HydrophobicContact CD1-CG1 4.38Å; F205-I209 HydrophobicContact CE1-CD1 3.73Å; F205-I209 HydrophobicContact CE1-CG1 4.2Å; F205-I209 HydrophobicContact CZ-CD1 4.43Å; F205-I209 HydrophobicContact CZ-CG1 4.46Å; F205-I209 WeakPolarHBondContact O-CG1 3.48Å; F205-I209 PolarHBondContact O-N 3.1Å; F205-L220 HydrophobicContact CD1-CD1 4.28Å; F205-L220 HydrophobicContact CD1-CD2 4.22Å; F205-L220 HydrophobicContact CE1-CD2 4.08Å
206	L	94.3	Very high	93.7	Very high	72 Å²	72	70.4 Å²	70.4	38%	0.377	35%	0.347	S	S	.	.	H	α-helix	trans	-60.2	-42.2	176.2	-178	62.8	0	0	0	111.8	V202 N203 E208 I209 V210 L220	V202-L206 WeakPolarHBondContact O-CB 3.12Å; V202-L206 PolarHBondContact O-N 3.16Å; N203-L206 PolarHBondContact O-N 3.34Å; L206-E208 VanDerWaalsContact C-N 3.29Å; L206-E208 PolarHBondContact O-N 3.06Å; L206-I209 WeakPolarHBondContact O-CB 3.25Å; L206-I209 PolarHBondContact O-N 2.79Å; L206-V210 WeakPolarHBondContact O-CG2 3.4Å; L206-V210 PolarHBondContact O-N 3.08Å; L206-L220 HydrophobicContact CB-CD1 4.21Å; L206-L220 HydrophobicContact CD1-CD1 4.12Å
207	N	95.3	Very high	93.8	Very high	109 Å²	109	67 Å²	67	58%	0.583	33%	0.331	S	S	*	.	H	α-helix	trans	-61.8	-37.7	174.8	-72.5	-18.7	0	0	0	111.9	N203 V204 F205 V210 R211	N203-N207 WeakPolarHBondContact O-CB 3.18Å; N203-N207 VanDerWaalsContact O-CG 3.22Å; N203-N207 PolarHBondContact O-N 2.79Å; N203-N207 PolarHBondContact O-ND2 3.25Å; V204-N207 PolarHBondContact O-N 3.03Å; F205-N207 VanDerWaalsContact C-N 3.33Å; F205-N207 PolarHBondContact O-N 3.2Å; N207-V210 PolarHBondContact O-N 3.39Å; N207-R211 WeakPolarHBondContact O-CB 3.4Å; N207-R211 PolarHBondContact O-N 2.95Å
208	E	96.1	Very high	93.9	Very high	37 Å²	37	64.6 Å²	64.6	17%	0.173	32%	0.318	C	S	.	.	H	α-helix	trans	-66.5	-40	173.2	-77.2	-70.9	111.1	0	0	112.4	L166 V204 F205 L206 V210 R211 R212	L166-E208 HydrophobicContact CD1-CB 3.88Å; L166-E208 HydrophobicContact CD2-CB 4.37Å; V204-E208 PolarHBondContact O-N 3.16Å; V204-E208 VanDerWaalsContact O-N 3.16Å; F205-E208 WeakPolarHBondContact O-CB 3.25Å; F205-E208 PolarHBondContact O-N 2.76Å; F205-E208 VanDerWaalsContact O-N 3.11Å; L206-E208 VanDerWaalsContact C-N 3.29Å; L206-E208 PolarHBondContact O-N 3.06Å; E208-V210 VanDerWaalsContact C-N 3.31Å; E208-V210 PolarHBondContact O-N 3.25Å; E208-R211 VanDerWaalsContact CD-NH2 3.32Å; E208-R211 PolarHBondContact O-N 3Å; E208-R211 IonicContact OE1-CZ 2.83Å; E208-R211 IonicContact OE1-NE 3.46Å; E208-R211 PolarHBondContact OE1-NE 3.3Å; E208-R211 IonicContact OE1-NH2 3.5Å; E208-R211 PolarHBondContact OE1-NH2 3.15Å; E208-R211 VanDerWaalsContact OE1-NH2 3.08Å; E208-R211 IonicContact OE2-CZ 3.15Å; E208-R211 IonicContact OE2-NE 2.71Å; E208-R211 IonicContact OE2-NH2 3.44Å; E208-R211 PolarHBondContact OE2-NH2 2.98Å; E208-R212 WeakPolarHBondContact O-CB 3.2Å; E208-R212 WeakPolarHBondContact O-CG 3.34Å; E208-R212 PolarHBondContact O-N 3.28Å; E208-R212 IonicContact OE2-CZ 3Å; E208-R212 IonicContact OE2-NE 3.3Å; E208-R212 PolarHBondContact OE2-NE 2.9Å; E208-R212 IonicContact OE2-NH2 3.51Å; E208-R212 PolarHBondContact OE2-NH2 3.34Å
209	I	95.7	Very high	93.9	Very high	2 Å²	2	65.6 Å²	65.6	1%	0.01	33%	0.327	C	S	.	.	H	α-helix	trans	-57.4	-47.8	173.8	-64	170.9	0	0	0	109.7	L166 F205 L206 R212 D213 Q214 Q215 I218 L220	L166-I209 HydrophobicContact CD2-CG1 3.85Å; F205-I209 HydrophobicContact CD1-CD1 3.86Å; F205-I209 HydrophobicContact CD1-CG1 4.38Å; F205-I209 HydrophobicContact CE1-CD1 3.73Å; F205-I209 HydrophobicContact CE1-CG1 4.2Å; F205-I209 HydrophobicContact CZ-CD1 4.43Å; F205-I209 HydrophobicContact CZ-CG1 4.46Å; F205-I209 WeakPolarHBondContact O-CG1 3.48Å; F205-I209 PolarHBondContact O-N 3.1Å; L206-I209 WeakPolarHBondContact O-CB 3.25Å; L206-I209 PolarHBondContact O-N 2.79Å; I209-R212 PolarHBondContact O-N 2.85Å; I209-D213 PolarHBondContact O-N 3.48Å; I209-Q214 HydrophobicContact CG2-CB 3.91Å; I209-Q214 PolarHBondContact O-N 3.47Å; I209-Q215 HydrophobicContact CG2-CB 4.45Å; I209-Q215 HydrophobicContact CG2-CG 4.14Å; I209-I218 HydrophobicContact CD1-CB 4.08Å; I209-I218 HydrophobicContact CD1-CD1 4.42Å; I209-I218 HydrophobicContact CD1-CG2 3.58Å; I209-I218 HydrophobicContact CG1-CB 4.44Å; I209-I218 HydrophobicContact CG1-CD1 4.03Å; I209-I218 HydrophobicContact CG1-CG2 4.32Å; I209-I218 HydrophobicContact CG2-CB 4.2Å; I209-L220 HydrophobicContact CD1-CD1 4Å; I209-L220 HydrophobicContact CD1-CD2 4.04Å; I209-L220 HydrophobicContact CD1-CG 4.01Å
210	V	95.3	Very high	94	Very high	75 Å²	75	64.9 Å²	64.9	46%	0.455	32%	0.323	S	S	.	.	H	α-helix	trans	-65.3	-47.6	179.7	172	0	0	0	0	111.4	L206 N207 E208 R212 D213 Q215	L206-V210 WeakPolarHBondContact O-CG2 3.4Å; L206-V210 PolarHBondContact O-N 3.08Å; N207-V210 PolarHBondContact O-N 3.39Å; E208-V210 VanDerWaalsContact C-N 3.31Å; E208-V210 PolarHBondContact O-N 3.25Å; V210-R212 PolarHBondContact O-N 3.43Å; V210-D213 PolarHBondContact O-N 2.95Å; V210-D213 VanDerWaalsContact O-N 3.08Å; V210-Q215 HydrophobicContact CG2-CG 3.99Å
211	R	96.5	Very high	93.9	Very high	158 Å²	158	63.9 Å²	63.9	60%	0.596	31%	0.313	S	S	*	.	H	α-helix	trans	-61.9	-30.2	-178.4	-170.4	-175.7	67.3	72.6	1	112.7	N207 E208	N207-R211 WeakPolarHBondContact O-CB 3.4Å; N207-R211 PolarHBondContact O-N 2.95Å; E208-R211 VanDerWaalsContact CD-NH2 3.32Å; E208-R211 PolarHBondContact O-N 3Å; E208-R211 IonicContact OE1-CZ 2.83Å; E208-R211 IonicContact OE1-NE 3.46Å; E208-R211 PolarHBondContact OE1-NE 3.3Å; E208-R211 IonicContact OE1-NH2 3.5Å; E208-R211 PolarHBondContact OE1-NH2 3.15Å; E208-R211 VanDerWaalsContact OE1-NH2 3.08Å; E208-R211 IonicContact OE2-CZ 3.15Å; E208-R211 IonicContact OE2-NE 2.71Å; E208-R211 IonicContact OE2-NH2 3.44Å; E208-R211 PolarHBondContact OE2-NH2 2.98Å
212	R	95.4	Very high	93.8	Very high	55 Å²	55	63.6 Å²	63.6	21%	0.208	32%	0.315	C	S	.	.	T	Hydrogen-bonded Turn	trans	-96.3	7.2	178.6	-61.7	-171.5	-164.2	-164.8	10.4	113.4	D163 D167 E208 I209 V210 Q214	D163-R212 IonicContact OD1-CZ 3.61Å; D163-R212 IonicContact OD1-NH1 2.67Å; D163-R212 IonicContact OD1-NH2 3.5Å; D163-R212 PolarHBondContact OD1-NH2 3.22Å; D167-R212 IonicContact OD1-NH1 3.88Å; D167-R212 PolarHBondContact OD1-NH1 3.38Å; E208-R212 WeakPolarHBondContact O-CB 3.2Å; E208-R212 WeakPolarHBondContact O-CG 3.34Å; E208-R212 PolarHBondContact O-N 3.28Å; E208-R212 IonicContact OE2-CZ 3Å; E208-R212 IonicContact OE2-NE 3.3Å; E208-R212 PolarHBondContact OE2-NE 2.9Å; E208-R212 IonicContact OE2-NH2 3.51Å; E208-R212 PolarHBondContact OE2-NH2 3.34Å; I209-R212 PolarHBondContact O-N 2.85Å; V210-R212 PolarHBondContact O-N 3.43Å; R212-Q214 VanDerWaalsContact C-N 3.34Å; R212-Q214 HydrophobicContact CB-CG 3.71Å; R212-Q214 WeakPolarHBondContact O-CG 3.37Å; R212-Q214 PolarHBondContact O-N 2.84Å; R212-Q214 PolarHBondContact O-NE2 2.94Å
213	D	94.5	Very high	93.6	Very high	109 Å²	109	63.8 Å²	63.8	58%	0.583	31%	0.314	S	S	*	.	T	Hydrogen-bonded Turn	trans	55.7	43.4	-177.8	-168.2	36.2	0	0	0	113.7	I209 V210 Q215 H216	I209-D213 PolarHBondContact O-N 3.48Å; V210-D213 PolarHBondContact O-N 2.95Å; V210-D213 VanDerWaalsContact O-N 3.08Å; D213-Q215 PolarHBondContact OD1-OE1 3.32Å; D213-H216 PolarHBondContact O-CE1 2.74Å; D213-H216 PolarHBondContact O-ND1 3.39Å
214	Q	94.2	Very high	93.4	Very high	39 Å²	39	62.1 Å²	62.1	18%	0.182	31%	0.311	C	S	.	.			trans	-103.2	5.5	-175.8	-55.2	-61.6	-43.9	0	0	113	I209 R212 H216 R217 I218	I209-Q214 HydrophobicContact CG2-CB 3.91Å; I209-Q214 PolarHBondContact O-N 3.47Å; R212-Q214 VanDerWaalsContact C-N 3.34Å; R212-Q214 HydrophobicContact CB-CG 3.71Å; R212-Q214 WeakPolarHBondContact O-CG 3.37Å; R212-Q214 PolarHBondContact O-N 2.84Å; R212-Q214 PolarHBondContact O-NE2 2.94Å; Q214-H216 PolarHBondContact O-N 2.91Å; Q214-R217 PolarHBondContact O-N 3.07Å; Q214-I218 HydrophobicContact CB-CD1 3.93Å; Q214-I218 HydrophobicContact CB-CG1 4.25Å; Q214-I218 PolarHBondContact O-N 3.25Å
215	Q	93.4	Very high	93	Very high	92 Å²	92	62.7 Å²	62.7	43%	0.43	30%	0.303	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.7	-24.2	-176	-44.7	95.8	-28.3	0	0	112.4	I209 V210 D213 R217	I209-Q215 HydrophobicContact CG2-CB 4.45Å; I209-Q215 HydrophobicContact CG2-CG 4.14Å; V210-Q215 HydrophobicContact CG2-CG 3.99Å; D213-Q215 PolarHBondContact OD1-OE1 3.32Å; Q215-R217 PolarHBondContact O-N 3.38Å
216	H	92.4	Very high	92.7	Very high	128 Å²	128	70 Å²	70	59%	0.593	34%	0.343	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.9	-21.5	178.8	66.4	-90.3	0	0	0	113.2	D213 Q214	D213-H216 PolarHBondContact O-CE1 2.74Å; D213-H216 PolarHBondContact O-ND1 3.39Å; Q214-H216 PolarHBondContact O-N 2.91Å
217	R	91.7	Very high	92.5	Very high	15 Å²	15	69.7 Å²	69.7	6%	0.057	36%	0.357	C	S	.	.	T	Hydrogen-bonded Turn	trans	-122.2	-27.1	-178.3	72.7	171.5	-176.4	75.5	10.2	114.7	L165 L166 T168 K170 C172 Q214 Q215	L165-R217 PolarHBondContact O-NH1 3.22Å; L165-R217 PolarHBondContact O-NH2 3.46Å; L166-R217 PolarHBondContact O-NH2 3.35Å; T168-R217 PolarHBondContact O-NE 2.91Å; T168-R217 VanDerWaalsContact O-NE 3.17Å; T168-R217 PolarHBondContact O-NH1 2.9Å; T168-R217 PolarHBondContact O-NH2 2.82Å; K170-R217 PolarHBondContact O-NH1 3.46Å; C172-R217 PolarHBondContact N-O 3.45Å; Q214-R217 PolarHBondContact O-N 3.07Å; Q215-R217 PolarHBondContact O-N 3.38Å
218	I	93.5	Very high	92.3	Very high	9 Å²	9	67.3 Å²	67.3	5%	0.046	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.3	114.1	179.6	-51.2	-179.5	0	0	0	109.7	L165 L166 C172 I209 Q214 L220	L165-I218 WeakPolarHBondContact O-CD1 3.43Å; L166-I218 HydrophobicContact CD2-CD1 4.08Å; C172-I218 HydrophobicContact CB-CB 4.46Å; C172-I218 HydrophobicContact CB-CG1 4.19Å; C172-I218 HydrophobicContact CB-CG2 4.25Å; C172-I218 WeakPolarHBondContact O-CA 3.38Å; I209-I218 HydrophobicContact CD1-CB 4.08Å; I209-I218 HydrophobicContact CD1-CD1 4.42Å; I209-I218 HydrophobicContact CD1-CG2 3.58Å; I209-I218 HydrophobicContact CG1-CB 4.44Å; I209-I218 HydrophobicContact CG1-CD1 4.03Å; I209-I218 HydrophobicContact CG1-CG2 4.32Å; I209-I218 HydrophobicContact CG2-CB 4.2Å; Q214-I218 HydrophobicContact CB-CD1 3.93Å; Q214-I218 HydrophobicContact CB-CG1 4.25Å; Q214-I218 PolarHBondContact O-N 3.25Å; I218-L220 HydrophobicContact CG2-CD2 4.1Å
219	L	92.6	Very high	92	Very high	77 Å²	77	67 Å²	67	40%	0.403	34%	0.34	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109	119.8	174.4	-177.9	65.8	0	0	0	110.6	C172 R173 V174	C172-L219 PolarHBondContact O-N 3.41Å; R173-L219 HydrophobicContact CG-CB 4.49Å; V174-L219 PolarHBondContact N-O 2.9Å
220	L	92.8	Very high	91.7	Very high	40 Å²	40	66.9 Å²	66.9	21%	0.209	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.7	128.2	170.6	-51.9	-172.4	0	0	0	109.5	V174 V202 F205 L206 I209 I218	V174-L220 HydrophobicContact CB-CD2 3.59Å; V174-L220 HydrophobicContact CG1-CD2 4.01Å; V174-L220 HydrophobicContact CG2-CD2 3.88Å; V174-L220 CarbonylContact O-C 3.53Å; V202-L220 HydrophobicContact CG1-CD1 4.15Å; F205-L220 HydrophobicContact CD1-CD1 4.28Å; F205-L220 HydrophobicContact CD1-CD2 4.22Å; F205-L220 HydrophobicContact CE1-CD2 4.08Å; L206-L220 HydrophobicContact CB-CD1 4.21Å; L206-L220 HydrophobicContact CD1-CD1 4.12Å; I209-L220 HydrophobicContact CD1-CD1 4Å; I209-L220 HydrophobicContact CD1-CD2 4.04Å; I209-L220 HydrophobicContact CD1-CG 4.01Å; I218-L220 HydrophobicContact CG2-CD2 4.1Å
221	N	90.4	Very high	91.2	Very high	36 Å²	36	64.1 Å²	64.1	19%	0.193	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	146.9	176.2	-57.8	-81.7	0	0	0	109.5	V174 L175 L176 L288	V174-N221 PolarHBondContact O-N 3.03Å; L175-N221 CarbonylContact C-O 3.57Å; L175-N221 WeakPolarHBondContact CA-O 2.94Å; L176-N221 PolarHBondContact N-O 3.37Å; N221-L288 HydrophobicContact CB-CD1 4.47Å; N221-L288 HydrophobicContact CB-CD2 4.21Å
222	E	90.4	Very high	90.6	Very high	88 Å²	88	56.6 Å²	56.6	41%	0.411	29%	0.293	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	136.3	173.5	-63.3	-169.8	146.3	0	0	110.5	L176	L176-E222 CarbonylContact O-C 3.49Å; L176-E222 WeakPolarHBondContact O-CA 3.49Å
223	Y	90	Very high	90.1	Very high	21 Å²	21	54.4 Å²	54.4	8%	0.082	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80	121.8	166.4	179.5	-85.5	0	0	0	108.5	Q53 L176 S178 S181 R225 W228 F230 L284	Q53-Y223 HydrophobicContact CB-CE1 4.43Å; Q53-Y223 HydrophobicContact CB-CE2 4.48Å; Q53-Y223 HydrophobicContact CG-CE2 4.09Å; L176-Y223 WeakPolarHBondContact O-CB 3.48Å; L176-Y223 PolarHBondContact O-N 3.39Å; S178-Y223 WeakPolarHBondContact CB-O 3.46Å; S178-Y223 PolarHBondContact N-O 3.15Å; S178-Y223 PolarHBondContact OG-O 2.8Å; S181-Y223 WeakPolarHBondContact CB-O 3.34Å; S181-Y223 PolarHBondContact OG-O 2.75Å; Y223-R225 HydrophobicContact CE1-CB 3.81Å; Y223-R225 WeakPolarHBondContact OH-CD 3.32Å; Y223-W228 HydrophobicContact CE1-CB 4.44Å; Y223-F230 HydrophobicContact CD1-CB 3.54Å; Y223-F230 AromaticContact CD1-CD2 3.78Å; Y223-F230 HydrophobicContact CD1-CD2 3.78Å; Y223-F230 AromaticContact CD1-CG 3.92Å; Y223-F230 HydrophobicContact CD1-CG 3.92Å; Y223-F230 AromaticContact CD2-CD2 3.7Å; Y223-F230 HydrophobicContact CD2-CD2 3.7Å; Y223-F230 HydrophobicContact CD2-CE2 4.05Å; Y223-F230 HydrophobicContact CE1-CB 4.11Å; Y223-F230 HydrophobicContact CE1-CD2 4.27Å; Y223-F230 HydrophobicContact CE2-CD2 4.21Å; Y223-F230 HydrophobicContact CG-CB 3.99Å; Y223-F230 AromaticContact CG-CD2 3.44Å; Y223-F230 HydrophobicContact CG-CD2 3.44Å; Y223-F230 VanDerWaalsContact CG-CD2 3.44Å; Y223-F230 HydrophobicContact CG-CE2 4.1Å; Y223-F230 AromaticContact CG-CG 3.82Å; Y223-F230 HydrophobicContact CG-CG 3.82Å; Y223-L284 HydrophobicContact CE2-CD2 4.31Å
224	A	87.3	Confident	89.7	Confident	42 Å²	42	49.5 Å²	49.5	35%	0.347	26%	0.26	S	S	.	.			trans	-132.5	124.8	170.3	0	0	0	0	0	108.9	L291	A224-L291 HydrophobicContact CB-CD1 4.43Å; A224-L291 HydrophobicContact CB-CD2 4.24Å
225	R	87.3	Confident	89.3	Confident	106 Å²	106	47.6 Å²	47.6	40%	0.4	25%	0.252	S	S	.	.			trans	-147.7	124.8	170.4	179.4	-179.7	-176.4	-168.1	1.5	108.1	S181 Y223 G227 W228	S181-R225 PolarHBondContact OG-N 2.98Å; Y223-R225 HydrophobicContact CE1-CB 3.81Å; Y223-R225 WeakPolarHBondContact OH-CD 3.32Å; R225-G227 PolarHBondContact O-N 2.86Å; R225-W228 HydrophobicContact CB-CB 3.94Å; R225-W228 HydrophobicContact CB-CG 4.38Å; R225-W228 HydrophobicContact CG-CB 3.96Å; R225-W228 HydrophobicContact CG-CG 3.86Å; R225-W228 VanDerWaalsContact CZ-NE1 3.34Å; R225-W228 VanDerWaalsContact NH1-CZ2 3.3Å; R225-W228 PolarHBondContact O-N 3.39Å
226	D	88	Confident	89.1	Confident	160 Å²	160	43.3 Å²	43.3	86%	0.856	23%	0.231	S	C	*	.	T	Hydrogen-bonded Turn	trans	-59.3	129.7	-175.2	-70.4	-12.2	0	0	0	111.6	W228	D226-W228 PolarHBondContact O-N 3.36Å
227	G	89.3	Confident	88.8	Confident	66 Å²	66	37.2 Å²	37.2	68%	0.68	20%	0.203	S	C	*	.	T	Hydrogen-bonded Turn	trans	74.5	-1.2	-177.2	0	0	0	0	0	115.1	N51 R225	N51-G227 WeakPolarHBondContact CB-O 3.5Å; R225-G227 PolarHBondContact O-N 2.86Å
228	W	91.5	Very high	88.5	Confident	59 Å²	59	40.8 Å²	40.8	22%	0.223	22%	0.217	C	C	.	.			trans	-110	139.7	-179.7	-74.3	70.5	0	0	0	112.8	T50 N51 Q53 S181 Y223 R225 D226	T50-W228 WeakPolarHBondContact O-CH2 3.24Å; T50-W228 VanDerWaalsContact O-CZ2 3.24Å; T50-W228 WeakPolarHBondContact O-CZ2 3.12Å; N51-W228 VanDerWaalsContact C-CE3 3.49Å; N51-W228 HydrophobicContact CB-CD2 4.4Å; N51-W228 CarbonylContact O-C 3.52Å; N51-W228 VanDerWaalsContact O-CA 3.25Å; N51-W228 WeakPolarHBondContact O-CA 3.18Å; Q53-W228 HydrophobicContact CB-CE3 4.35Å; S181-W228 WeakPolarHBondContact CA-O 3.29Å; S181-W228 WeakPolarHBondContact CB-O 3.44Å; S181-W228 PolarHBondContact OG-O 3.38Å; Y223-W228 HydrophobicContact CE1-CB 4.44Å; R225-W228 HydrophobicContact CB-CB 3.94Å; R225-W228 HydrophobicContact CB-CG 4.38Å; R225-W228 HydrophobicContact CG-CB 3.96Å; R225-W228 HydrophobicContact CG-CG 3.86Å; R225-W228 VanDerWaalsContact CZ-NE1 3.34Å; R225-W228 VanDerWaalsContact NH1-CZ2 3.3Å; R225-W228 PolarHBondContact O-N 3.39Å; D226-W228 PolarHBondContact O-N 3.36Å
229	T	89.9	Confident	88.2	Confident	29 Å²	29	40.7 Å²	40.7	18%	0.178	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.2	147.3	171.6	63	0	0	0	0	111.3	N51 R52 Q53 S181	N51-T229 PolarHBondContact O-N 2.98Å; R52-T229 CarbonylContact C-O 3.58Å; R52-T229 WeakPolarHBondContact CA-O 3.45Å; R52-T229 WeakPolarHBondContact CB-OG1 3.37Å; R52-T229 WeakPolarHBondContact CG-OG1 2.86Å; R52-T229 PolarHBondContact NH1-OG1 2.93Å; Q53-T229 PolarHBondContact N-O 3.2Å; S181-T229 CarbonylContact O-C 3.53Å; S181-T229 WeakPolarHBondContact O-CA 3.31Å
230	F	88.4	Confident	87.8	Confident	0 Å²	0	40.2 Å²	40.2	0%	0	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	127.4	-178.8	-175.2	-109.8	0	0	0	111.7	Q53 A151 L175 A177 S181 Y223 A232 L284	Q53-F230 HydrophobicContact CB-CD2 4.29Å; Q53-F230 HydrophobicContact CG-CD2 4.14Å; Q53-F230 HydrophobicContact CG-CE2 4.47Å; A151-F230 HydrophobicContact CB-CZ 4.27Å; L175-F230 HydrophobicContact CD1-CZ 4.5Å; L175-F230 HydrophobicContact CD2-CE2 3.96Å; L175-F230 HydrophobicContact CD2-CZ 3.68Å; L175-F230 HydrophobicContact CG-CE1 4.2Å; L175-F230 HydrophobicContact CG-CE2 4.32Å; L175-F230 HydrophobicContact CG-CZ 3.68Å; A177-F230 HydrophobicContact CB-CB 3.92Å; A177-F230 HydrophobicContact CB-CD1 3.85Å; A177-F230 HydrophobicContact CB-CG 4.37Å; S181-F230 PolarHBondContact O-N 3.24Å; Y223-F230 HydrophobicContact CD1-CB 3.54Å; Y223-F230 AromaticContact CD1-CD2 3.78Å; Y223-F230 HydrophobicContact CD1-CD2 3.78Å; Y223-F230 AromaticContact CD1-CG 3.92Å; Y223-F230 HydrophobicContact CD1-CG 3.92Å; Y223-F230 AromaticContact CD2-CD2 3.7Å; Y223-F230 HydrophobicContact CD2-CD2 3.7Å; Y223-F230 HydrophobicContact CD2-CE2 4.05Å; Y223-F230 HydrophobicContact CE1-CB 4.11Å; Y223-F230 HydrophobicContact CE1-CD2 4.27Å; Y223-F230 HydrophobicContact CE2-CD2 4.21Å; Y223-F230 HydrophobicContact CG-CB 3.99Å; Y223-F230 AromaticContact CG-CD2 3.44Å; Y223-F230 HydrophobicContact CG-CD2 3.44Å; Y223-F230 VanDerWaalsContact CG-CD2 3.44Å; Y223-F230 HydrophobicContact CG-CE2 4.1Å; Y223-F230 AromaticContact CG-CG 3.82Å; Y223-F230 HydrophobicContact CG-CG 3.82Å; F230-A232 HydrophobicContact CD2-CB 4.39Å; F230-A232 HydrophobicContact CE2-CB 3.57Å; F230-A232 HydrophobicContact CZ-CB 3.66Å; F230-L284 HydrophobicContact CE2-CD2 4.22Å
231	H	86.4	Confident	87.4	Confident	17 Å²	17	42.8 Å²	42.8	8%	0.079	23%	0.228	C	C	.	.			trans	-137.6	3.1	-178.7	-163.5	-112.8	0	0	0	113.9	R41 Y48 R52 Q53 D54 Y154 K233	R41-H231 PolarHBondContact NH1-O 3.22Å; Y48-H231 AromaticContact CE1-ND1 3.7Å; Y48-H231 PolarHBondContact OH-CE1 3.47Å; Y48-H231 VanDerWaalsContact OH-CE1 3.27Å; Y48-H231 PolarHBondContact OH-ND1 2.77Å; R52-H231 HydrophobicContact CG-CB 4.03Å; R52-H231 PolarHBondContact NH2-CD2 3.18Å; Q53-H231 WeakPolarHBondContact O-CA 3.5Å; Q53-H231 PolarHBondContact O-N 3.08Å; D54-H231 IonicContact OD2-CE1 3.76Å; D54-H231 IonicContact OD2-CG 3.68Å; D54-H231 IonicContact OD2-ND1 2.95Å; D54-H231 PolarHBondContact OD2-ND1 3.41Å; Y154-H231 AromaticContact CE2-CD2 3.52Å; Y154-H231 AromaticContact CE2-NE2 3.8Å; H231-K233 PolarHBondContact CE1-NZ 3.5Å; H231-K233 WeakPolarHBondContact NE2-CE 3.36Å; H231-K233 PolarHBondContact NE2-NZ 3.47Å; H231-K233 VanDerWaalsContact NE2-NZ 3.14Å; H231-K233 VanDerWaalsContact O-CE 3.31Å; H231-K233 WeakPolarHBondContact O-CE 3.37Å; H231-K233 VanDerWaalsContact O-CG 3.22Å; H231-K233 WeakPolarHBondContact O-CG 3.41Å; H231-K233 PolarHBondContact O-N 2.83Å
232	A	83.2	Confident	86.9	Confident	0 Å²	0	47.3 Å²	47.3	0%	0	26%	0.259	C	S	.	.			trans	-64.3	128.6	-177	0	0	0	0	0	113	Q53 R55 A151 F230 L284	Q53-A232 PolarHBondContact O-N 3.47Å; R55-A232 HydrophobicContact CG-CB 3.86Å; A151-A232 CarbonylContact C-O 3.58Å; F230-A232 HydrophobicContact CD2-CB 4.39Å; F230-A232 HydrophobicContact CE2-CB 3.57Å; F230-A232 HydrophobicContact CZ-CB 3.66Å; A232-L284 HydrophobicContact CB-CD1 3.85Å
233	K	84.2	Confident	86.5	Confident	10 Å²	10	48.9 Å²	48.9	4%	0.043	27%	0.27	C	S	.	.			trans	-83.2	-179.9	-179.2	18.9	148.6	-154.8	147.9	0	114.3	R41 R55 A151 H231 W236 S252 N254	R41-K233 VanDerWaalsContact CZ-CG 3.49Å; R41-K233 VanDerWaalsContact NH2-CB 3.34Å; R55-K233 PolarHBondContact NE-O 2.95Å; R55-K233 PolarHBondContact NH1-O 3.1Å; R55-K233 PolarHBondContact NH2-O 2.92Å; A151-K233 CarbonylContact O-C 3.59Å; A151-K233 WeakPolarHBondContact O-CB 3.36Å; H231-K233 PolarHBondContact CE1-NZ 3.5Å; H231-K233 WeakPolarHBondContact NE2-CE 3.36Å; H231-K233 PolarHBondContact NE2-NZ 3.47Å; H231-K233 VanDerWaalsContact NE2-NZ 3.14Å; H231-K233 VanDerWaalsContact O-CE 3.31Å; H231-K233 WeakPolarHBondContact O-CE 3.37Å; H231-K233 VanDerWaalsContact O-CG 3.22Å; H231-K233 WeakPolarHBondContact O-CG 3.41Å; H231-K233 PolarHBondContact O-N 2.83Å; K233-W236 WeakPolarHBondContact O-CH2 3.46Å; K233-S252 PolarHBondContact NZ-O 3.14Å; K233-N254 HydrophobicContact CD-CB 4.12Å; K233-N254 WeakPolarHBondContact CD-OD1 3.19Å; K233-N254 WeakPolarHBondContact CE-OD1 3.14Å; K233-N254 PolarHBondContact NZ-OD1 3.11Å
234	G	85.9	Confident	86.1	Confident	5 Å²	5	48.3 Å²	48.3	5%	0.052	27%	0.271	C	S	.	.			trans	100.3	171.3	145.9	0	0	0	0	0	118.3	L150 A151 W236 I249	L150-G234 WeakPolarHBondContact CA-O 3.38Å; A151-G234 PolarHBondContact N-O 3.34Å; A151-G234 PolarHBondContact O-N 3.46Å; A151-G234 VanDerWaalsContact O-N 3.16Å; G234-W236 VanDerWaalsContact C-CZ3 3.44Å; G234-W236 VanDerWaalsContact O-CZ3 3.25Å; G234-W236 WeakPolarHBondContact O-CZ3 3.39Å; G234-I249 WeakPolarHBondContact CA-O 3.43Å
235	I	87.3	Confident	85.9	Confident	0 Å²	0	50.7 Å²	50.7	0%	0	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.3	143.3	-175.5	-54.2	164.4	0	0	0	108	I133 F136 I137 L148 Y149 L150 I249 L255	I133-I235 HydrophobicContact CG2-CD1 3.29Å; F136-I235 HydrophobicContact CD1-CG2 4.31Å; F136-I235 HydrophobicContact CE1-CG2 3.98Å; I137-I235 HydrophobicContact CD1-CD1 4.16Å; I137-I235 HydrophobicContact CG1-CD1 4.42Å; L148-I235 HydrophobicContact CD1-CG2 4.48Å; L148-I235 HydrophobicContact CG-CG2 4.29Å; Y149-I235 CarbonylContact O-C 3.46Å; Y149-I235 VanDerWaalsContact O-CA 3.25Å; Y149-I235 WeakPolarHBondContact O-CA 3.37Å; L150-I235 HydrophobicContact CD1-CG1 4.11Å; L150-I235 HydrophobicContact CG-CG1 4.22Å; I235-I249 HydrophobicContact CB-CB 4.16Å; I235-I249 PolarHBondContact N-O 3.37Å; I235-I249 VanDerWaalsContact N-O 3.09Å; I235-I249 PolarHBondContact O-N 3.22Å; I235-L255 HydrophobicContact CD1-CD1 3.67Å; I235-L255 HydrophobicContact CD1-CD2 4.17Å; I235-L255 HydrophobicContact CG1-CD1 3.69Å
236	W	87.8	Confident	85.7	Confident	1 Å²	1	48.2 Å²	48.2	0%	0.004	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.8	140.4	176.4	-53.4	-103.4	0	0	0	110	L148 Y149 A151 K233 G234 Y247 T248 I279 P282 F285	L148-W236 CarbonylContact C-O 3.52Å; L148-W236 WeakPolarHBondContact CA-O 3.38Å; Y149-W236 PolarHBondContact N-O 3.11Å; Y149-W236 PolarHBondContact O-N 2.95Å; A151-W236 HydrophobicContact CB-CH2 3.81Å; A151-W236 HydrophobicContact CB-CZ3 3.72Å; K233-W236 WeakPolarHBondContact O-CH2 3.46Å; G234-W236 VanDerWaalsContact C-CZ3 3.44Å; G234-W236 VanDerWaalsContact O-CZ3 3.25Å; G234-W236 WeakPolarHBondContact O-CZ3 3.39Å; W236-Y247 CarbonylContact C-O 3.59Å; W236-Y247 VanDerWaalsContact CA-O 3.25Å; W236-Y247 WeakPolarHBondContact CA-O 3.45Å; W236-T248 VanDerWaalsContact CD1-CG2 3.47Å; W236-T248 VanDerWaalsContact CD1-OG1 3.23Å; W236-T248 HydrophobicContact CG-CG2 4.46Å; W236-I279 PolarHBondContact NE1-O 3.1Å; W236-P282 HydrophobicContact CD2-CG 4.46Å; W236-P282 HydrophobicContact CH2-CG 3.73Å; W236-P282 HydrophobicContact CZ2-CB 4.47Å; W236-P282 HydrophobicContact CZ2-CG 3Å; W236-F285 AromaticContact CE3-CE2 3.77Å; W236-F285 HydrophobicContact CE3-CE2 3.77Å; W236-F285 HydrophobicContact CE3-CZ 4.28Å; W236-F285 AromaticContact CH2-CE2 4Å; W236-F285 HydrophobicContact CH2-CE2 4Å; W236-F285 AromaticContact CZ3-CE2 3.5Å; W236-F285 HydrophobicContact CZ3-CE2 3.5Å; W236-F285 VanDerWaalsContact CZ3-CE2 3.5Å; W236-F285 AromaticContact CZ3-CZ 3.96Å; W236-F285 HydrophobicContact CZ3-CZ 3.96Å
237	L	87	Confident	85.6	Confident	0 Å²	0	42.3 Å²	42.3	0%	0	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	127.8	161.9	-60.1	179.5	0	0	0	108.3	F136 T140 Y146 D147 L148 K170 Y246 Y247	F136-L237 HydrophobicContact CD1-CD1 4.3Å; F136-L237 HydrophobicContact CD1-CG 4.39Å; F136-L237 HydrophobicContact CD2-CD1 3.81Å; F136-L237 HydrophobicContact CE1-CD1 3.86Å; F136-L237 HydrophobicContact CE1-CD2 4.46Å; F136-L237 HydrophobicContact CE1-CG 3.61Å; F136-L237 HydrophobicContact CE2-CD1 3.28Å; F136-L237 HydrophobicContact CE2-CG 3.84Å; F136-L237 HydrophobicContact CG-CD1 4.32Å; F136-L237 HydrophobicContact CZ-CB 3.98Å; F136-L237 HydrophobicContact CZ-CD1 3.36Å; F136-L237 HydrophobicContact CZ-CG 3.32Å; T140-L237 HydrophobicContact CG2-CD1 3.9Å; Y146-L237 HydrophobicContact CD1-CB 3.89Å; Y146-L237 HydrophobicContact CG-CB 4.39Å; D147-L237 WeakPolarHBondContact O-CA 3.37Å; L148-L237 HydrophobicContact CB-CD2 3.7Å; L148-L237 HydrophobicContact CD1-CD2 3.92Å; L148-L237 HydrophobicContact CG-CD2 3.86Å; K170-L237 HydrophobicContact CD-CD2 3.81Å; L237-Y246 WeakPolarHBondContact O-CA 3.17Å; L237-Y247 HydrophobicContact CB-CD2 4.25Å; L237-Y247 PolarHBondContact N-O 3.41Å; L237-Y247 PolarHBondContact O-N 2.77Å
238	R	85.9	Confident	85.3	Confident	91 Å²	91	39.2 Å²	39.2	34%	0.343	20%	0.196	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	123.6	172.7	167.4	177	82.9	161.6	9.9	108.5	Y146 D147 Y149 T240 Y246 V281	Y146-R238 VanDerWaalsContact CA-O 3.31Å; Y146-R238 WeakPolarHBondContact CA-O 3.48Å; D147-R238 PolarHBondContact N-O 3.41Å; D147-R238 PolarHBondContact O-N 2.88Å; D147-R238 IonicContact OD2-CZ 3.9Å; D147-R238 IonicContact OD2-NE 3.88Å; D147-R238 PolarHBondContact OD2-NE 3.36Å; D147-R238 IonicContact OD2-NH2 3.81Å; D147-R238 PolarHBondContact OD2-NH2 2.78Å; Y149-R238 HydrophobicContact CE2-CB 4.12Å; Y149-R238 PolarHBondContact OH-NH2 2.73Å; R238-T240 PolarHBondContact O-N 3.35Å; R238-Y246 HydrophobicContact CB-CD1 4.07Å; R238-Y246 HydrophobicContact CB-CE1 3.93Å; R238-Y246 HydrophobicContact CG-CD1 4.09Å; R238-Y246 HydrophobicContact CG-CE1 3.46Å; R238-Y246 VanDerWaalsContact CG-CE1 3.46Å; R238-V281 HydrophobicContact CB-CG2 4.21Å
239	G	85.6	Confident	84.9	Confident	7 Å²	7	36.6 Å²	36.6	7%	0.072	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-57	133.3	169.6	0	0	0	0	0	112	Q145 R245	Q145-G239 CarbonylContact O-C 3.55Å; Q145-G239 VanDerWaalsContact O-CA 3.26Å; Q145-G239 WeakPolarHBondContact O-CA 3.48Å; G239-R245 PolarHBondContact N-O 3.16Å
240	T	84.4	Confident	84.2	Confident	67 Å²	67	36.4 Å²	36.4	41%	0.411	18%	0.183	S	C	.	.	S	Bend	trans	-82.9	-17.6	179.7	59.1	0	0	0	0	112.4	D144 Q145 R238	D144-T240 PolarHBondContact O-OG1 3.03Å; Q145-T240 VanDerWaalsContact C-OG1 3.24Å; Q145-T240 VanDerWaalsContact CA-OG1 3.22Å; Q145-T240 WeakPolarHBondContact CA-OG1 3.36Å; Q145-T240 PolarHBondContact O-N 2.89Å; Q145-T240 PolarHBondContact O-OG1 2.75Å; R238-T240 PolarHBondContact O-N 3.35Å
241	K	85	Confident	83.3	Confident	94 Å²	94	36.8 Å²	36.8	41%	0.409	19%	0.188	S	C	.	.	S	Bend	trans	-93.4	156.3	175.9	-62.8	177.6	-177.4	167.7	0	111.5	Q145 D243 G244	Q145-K241 VanDerWaalsContact CD-NZ 3.31Å; K241-D243 VanDerWaalsContact CB-OD1 3.24Å; K241-D243 WeakPolarHBondContact CB-OD1 3.42Å; K241-D243 PolarHBondContact O-N 3.28Å; K241-G244 WeakPolarHBondContact O-CA 3.35Å; K241-G244 PolarHBondContact O-N 3.18Å
242	P	80.2	Confident	82.3	Confident	131 Å²	131	37.1 Å²	37.1	85%	0.851	19%	0.192	S	C	*	.	T	Hydrogen-bonded Turn	trans	-57.7	-29.4	179.3	-26	35.2	0	0	0	114.9
243	D	81.8	Confident	81.5	Confident	121 Å²	121	37.5 Å²	37.5	65%	0.647	20%	0.195	S	C	*	.	T	Hydrogen-bonded Turn	trans	-94.6	3.5	176.6	64.8	-26.3	0	0	0	113.2	K241 P273	K241-D243 VanDerWaalsContact CB-OD1 3.24Å; K241-D243 WeakPolarHBondContact CB-OD1 3.42Å; K241-D243 PolarHBondContact O-N 3.28Å; D243-P273 VanDerWaalsContact O-CG 3.27Å; D243-P273 WeakPolarHBondContact O-CG 3.39Å
244	G	81.1	Confident	80.5	Confident	9 Å²	9	38.5 Å²	38.5	9%	0.093	20%	0.2	C	C	.	.			trans	-69.1	129.2	-176.5	0	0	0	0	0	112.4	K241 P273	K241-G244 WeakPolarHBondContact O-CA 3.35Å; K241-G244 PolarHBondContact O-N 3.18Å; G244-P273 WeakPolarHBondContact O-CG 3.48Å
245	R	83.1	Confident	79.5	Confident	92 Å²	92	39 Å²	39	35%	0.347	20%	0.202	S	C	.	.			trans	-71	161.8	-178.1	-64.4	-174.3	-178.4	166.8	3	111.7	Y146 G239 Y247 E270	Y146-R245 WeakPolarHBondContact CE1-O 3.4Å; G239-R245 PolarHBondContact N-O 3.16Å; R245-Y247 HydrophobicContact CB-CE2 3.82Å; R245-E270 WeakPolarHBondContact CD-OE1 3.23Å; R245-E270 IonicContact CZ-OE1 3.57Å; R245-E270 IonicContact NE-OE1 2.79Å; R245-E270 IonicContact NH1-OE1 3.03Å; R245-E270 PolarHBondContact NH1-OE1 3.36Å
246	Y	83.9	Confident	78.3	Confident	54 Å²	54	39.1 Å²	39.1	21%	0.212	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	130.1	172.1	-67.3	-87.9	0	0	0	109.7	L237 R238 E270 A271 A280	L237-Y246 WeakPolarHBondContact O-CA 3.17Å; R238-Y246 HydrophobicContact CB-CD1 4.07Å; R238-Y246 HydrophobicContact CB-CE1 3.93Å; R238-Y246 HydrophobicContact CG-CD1 4.09Å; R238-Y246 HydrophobicContact CG-CE1 3.46Å; R238-Y246 VanDerWaalsContact CG-CE1 3.46Å; Y246-E270 CarbonylContact O-C 3.49Å; Y246-E270 WeakPolarHBondContact O-CA 3.35Å; Y246-A271 PolarHBondContact N-O 3.06Å; Y246-A271 PolarHBondContact O-N 3.18Å; Y246-A280 HydrophobicContact CD1-CB 3.56Å; Y246-A280 HydrophobicContact CD2-CB 4.43Å; Y246-A280 HydrophobicContact CE1-CB 4.05Å; Y246-A280 HydrophobicContact CG-CB 3.75Å
247	Y	85.9	Confident	76.8	Confident	36 Å²	36	43.2 Å²	43.2	14%	0.141	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	136.7	175.4	-60	-86.6	0	0	0	109.8	F136 Y146 W236 L237 R245 F268 T269 E270	F136-Y247 VanDerWaalsContact CE2-CB 3.41Å; F136-Y247 HydrophobicContact CE2-CD1 4.32Å; F136-Y247 HydrophobicContact CE2-CD2 4.48Å; F136-Y247 AromaticContact CE2-CG 3.86Å; F136-Y247 HydrophobicContact CE2-CG 3.86Å; F136-Y247 HydrophobicContact CZ-CG 4.23Å; Y146-Y247 HydrophobicContact CD1-CD2 4.46Å; Y146-Y247 AromaticContact CE1-CD2 3.87Å; Y146-Y247 HydrophobicContact CE1-CD2 3.87Å; Y146-Y247 AromaticContact CE1-CE2 3.68Å; Y146-Y247 HydrophobicContact CE1-CE2 3.68Å; Y146-Y247 AromaticContact CZ-CE2 3.82Å; W236-Y247 CarbonylContact C-O 3.59Å; W236-Y247 VanDerWaalsContact CA-O 3.25Å; W236-Y247 WeakPolarHBondContact CA-O 3.45Å; L237-Y247 HydrophobicContact CB-CD2 4.25Å; L237-Y247 PolarHBondContact N-O 3.41Å; L237-Y247 PolarHBondContact O-N 2.77Å; R245-Y247 HydrophobicContact CB-CE2 3.82Å; Y247-F268 AromaticContact CD1-CE1 3.75Å; Y247-F268 HydrophobicContact CD1-CE1 3.75Å; Y247-F268 HydrophobicContact CD1-CE2 4.39Å; Y247-F268 AromaticContact CD1-CZ 3.38Å; Y247-F268 HydrophobicContact CD1-CZ 3.38Å; Y247-F268 HydrophobicContact CE1-CE1 4.32Å; Y247-F268 HydrophobicContact CE1-CZ 4.11Å; Y247-F268 HydrophobicContact CG-CZ 4.15Å; Y247-T269 CarbonylContact C-O 3.55Å; Y247-T269 WeakPolarHBondContact CA-O 3.49Å; Y247-E270 HydrophobicContact CD1-CB 3.78Å; Y247-E270 HydrophobicContact CD1-CG 3.92Å; Y247-E270 HydrophobicContact CE1-CB 3.67Å; Y247-E270 HydrophobicContact CE1-CG 3.37Å; Y247-E270 WeakPolarHBondContact CE1-OE1 3.48Å; Y247-E270 PolarHBondContact OH-OE1 3.34Å
248	T	83.3	Confident	75.4	Confident	1 Å²	1	45.5 Å²	45.5	1%	0.006	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.3	128.3	-174.4	-62	0	0	0	0	111	W236 I250 F268 T269 I279	W236-T248 VanDerWaalsContact CD1-CG2 3.47Å; W236-T248 VanDerWaalsContact CD1-OG1 3.23Å; W236-T248 HydrophobicContact CG-CG2 4.46Å; T248-I250 HydrophobicContact CG2-CD1 3.81Å; T248-I250 HydrophobicContact CG2-CG1 3.65Å; T248-F268 CarbonylContact O-C 3.56Å; T248-F268 WeakPolarHBondContact O-CA 3.39Å; T248-T269 WeakPolarHBondContact CB-OG1 3Å; T248-T269 PolarHBondContact N-O 3.3Å; T248-T269 PolarHBondContact O-N 3.02Å; T248-I279 HydrophobicContact CG2-CG2 3.64Å; T248-I279 WeakPolarHBondContact CG2-O 3.47Å; T248-I279 PolarHBondContact OG1-O 3.38Å; T248-I279 VanDerWaalsContact OG1-O 3.06Å
249	I	83.5	Confident	74	Confident	4 Å²	4	41.2 Å²	41.2	2%	0.021	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	116.5	175.2	-55.9	-167.6	0	0	0	109.1	I133 F136 G234 I235 T266 Y267 F268	I133-I249 HydrophobicContact CB-CD1 4.46Å; I133-I249 HydrophobicContact CD1-CG2 4.42Å; I133-I249 HydrophobicContact CG1-CD1 3.99Å; I133-I249 HydrophobicContact CG1-CG2 4.23Å; I133-I249 HydrophobicContact CG2-CD1 4.24Å; F136-I249 HydrophobicContact CB-CD1 4.23Å; F136-I249 HydrophobicContact CD1-CD1 3.29Å; F136-I249 HydrophobicContact CD1-CG1 4.05Å; F136-I249 HydrophobicContact CE1-CD1 3.59Å; F136-I249 HydrophobicContact CE1-CG1 3.79Å; F136-I249 HydrophobicContact CG-CD1 3.83Å; F136-I249 HydrophobicContact CZ-CD1 4.35Å; F136-I249 HydrophobicContact CZ-CG1 4.32Å; G234-I249 WeakPolarHBondContact CA-O 3.43Å; I235-I249 HydrophobicContact CB-CB 4.16Å; I235-I249 PolarHBondContact N-O 3.37Å; I235-I249 VanDerWaalsContact N-O 3.09Å; I235-I249 PolarHBondContact O-N 3.22Å; I249-T266 HydrophobicContact CG2-CG2 3.32Å; I249-Y267 CarbonylContact C-O 3.12Å; I249-Y267 VanDerWaalsContact CA-O 3.28Å; I249-Y267 WeakPolarHBondContact CA-O 3.39Å; I249-F268 HydrophobicContact CD1-CD2 3.87Å; I249-F268 HydrophobicContact CD1-CE2 4.31Å; I249-F268 HydrophobicContact CG1-CD2 3.69Å; I249-F268 HydrophobicContact CG1-CE2 4.29Å
250	I	74.6	Confident	72.6	Confident	24 Å²	24	45.4 Å²	45.4	12%	0.123	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	110	178.3	-60.9	172	0	0	0	107.7	V57 T248 T266 Y267	V57-I250 HydrophobicContact CB-CD1 4.35Å; V57-I250 HydrophobicContact CG2-CD1 3.55Å; T248-I250 HydrophobicContact CG2-CD1 3.81Å; T248-I250 HydrophobicContact CG2-CG1 3.65Å; I250-T266 CarbonylContact O-C 3.52Å; I250-T266 VanDerWaalsContact O-CA 3.28Å; I250-T266 WeakPolarHBondContact O-CA 3.39Å; I250-Y267 HydrophobicContact CB-CD2 4.4Å; I250-Y267 HydrophobicContact CG2-CD2 4.46Å; I250-Y267 PolarHBondContact N-O 3.41Å; I250-Y267 WeakPolarHBondContact O-CD2 3.21Å; I250-Y267 PolarHBondContact O-N 3.04Å
251	G	69.9	Low	71.1	Confident	9 Å²	9	46 Å²	46	9%	0.093	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.6	162.7	176	0	0	0	0	0	113	R41 S253 V265	R41-G251 PolarHBondContact NE-O 2.91Å; R41-G251 PolarHBondContact NH2-O 3.42Å; R41-G251 VanDerWaalsContact NH2-O 3.1Å; G251-S253 VanDerWaalsContact C-N 3.25Å; G251-V265 WeakPolarHBondContact CA-O 3.33Å
252	S	63.8	Low	69.9	Low	23 Å²	23	43.3 Å²	43.3	16%	0.161	23%	0.233	C	C	.	.	S	Bend	trans	-70.7	-23.3	172.1	60	0	0	0	0	112.5	R41 K233 V265	R41-S252 PolarHBondContact NH2-O 2.81Å; K233-S252 PolarHBondContact NZ-O 3.14Å; S252-V265 PolarHBondContact N-O 2.64Å
253	S	68.2	Low	68.8	Low	9 Å²	9	37.6 Å²	37.6	6%	0.063	20%	0.196	C	C	.	.			trans	-65.3	145.2	-178.6	-172.6	0	0	0	0	113.5	G251 L255 I259	G251-S253 VanDerWaalsContact C-N 3.25Å; S253-L255 PolarHBondContact O-N 3.49Å; S253-L255 PolarHBondContact OG-N 3.26Å; S253-I259 VanDerWaalsContact OG-CD1 3.32Å; S253-I259 WeakPolarHBondContact OG-CD1 3.21Å
254	N	63.3	Low	68	Low	30 Å²	30	32 Å²	32	16%	0.16	17%	0.167	C	C	.	.			trans	-75.9	1.2	165.9	-67.2	-54.3	0	0	0	113.1	S152 Y154 K233 G256	S152-N254 PolarHBondContact OG-O 3.24Å; Y154-N254 WeakPolarHBondContact CD2-OD1 3.04Å; K233-N254 HydrophobicContact CD-CB 4.12Å; K233-N254 WeakPolarHBondContact CD-OD1 3.19Å; K233-N254 WeakPolarHBondContact CE-OD1 3.14Å; K233-N254 PolarHBondContact NZ-OD1 3.11Å; N254-G256 PolarHBondContact O-N 3.41Å
255	L	65.1	Low	67.3	Low	17 Å²	17	31.8 Å²	31.8	9%	0.089	16%	0.163	C	C	.	.	S	Bend	trans	59.3	25	-168.8	-53.1	167.4	0	0	0	112.6	I133 L150 Y161 I235 S253	I133-L255 HydrophobicContact CD1-CD2 4.28Å; I133-L255 HydrophobicContact CG2-CD2 4.39Å; L150-L255 HydrophobicContact CD1-CD1 3.85Å; L150-L255 HydrophobicContact CG-CD1 4.15Å; Y161-L255 WeakPolarHBondContact CD2-O 3.49Å; Y161-L255 HydrophobicContact CE1-CD2 4.26Å; I235-L255 HydrophobicContact CD1-CD1 3.67Å; I235-L255 HydrophobicContact CD1-CD2 4.17Å; I235-L255 HydrophobicContact CG1-CD1 3.69Å; S253-L255 PolarHBondContact O-N 3.49Å; S253-L255 PolarHBondContact OG-N 3.26Å
256	G	61.3	Low	66.7	Low	2 Å²	2	27.6 Å²	27.6	2%	0.021	15%	0.148	C	C	.	.	B	Isolated β-bridge	trans	-110.2	-178.9	177.6	0	0	0	0	0	113.5	N156 N254 C258 I259	N156-G256 WeakPolarHBondContact O-CA 3.26Å; N254-G256 PolarHBondContact O-N 3.41Å; G256-C258 PolarHBondContact O-N 2.91Å; G256-I259 WeakPolarHBondContact O-CB 3.26Å; G256-I259 WeakPolarHBondContact O-CG2 3.19Å; G256-I259 PolarHBondContact O-N 3.33Å
257	N	56.8	Low	66.2	Low	86 Å²	86	25.7 Å²	25.7	46%	0.46	14%	0.14	S	C	.	.	G	3₁₀ helix	trans	-52.1	-27.2	-169.9	-68.3	-29	0	0	0	115.6	T158 I259 Y260	T158-N257 WeakPolarHBondContact CA-OD1 3.01Å; T158-N257 WeakPolarHBondContact CG2-OD1 3.3Å; N257-I259 PolarHBondContact O-N 3.35Å; N257-I259 VanDerWaalsContact O-N 3.1Å; N257-Y260 PolarHBondContact O-N 3.25Å
258	C	57	Low	65.6	Low	49 Å²	49	25.8 Å²	25.8	33%	0.331	14%	0.142	S	C	.	.	G	3₁₀ helix	trans	-64.1	-13.1	176.1	63.4	0	0	0	0	114.3	G256 Y260 T261 N262	G256-C258 PolarHBondContact O-N 2.91Å; C258-Y260 PolarHBondContact O-N 2.72Å; C258-T261 PolarHBondContact O-N 3.06Å; C258-T261 PolarHBondContact O-OG1 3.26Å; C258-T261 VanDerWaalsContact O-OG1 3.11Å; C258-N262 WeakPolarHBondContact O-CB 3.44Å; C258-N262 VanDerWaalsContact O-CG 3.27Å; C258-N262 PolarHBondContact O-N 3.43Å; C258-N262 VanDerWaalsContact O-N 3.14Å
259	I	56.2	Low	65.1	Low	1 Å²	1	26 Å²	26	1%	0.005	14%	0.143	C	C	.	.	G	3₁₀ helix	trans	-63.6	-31.6	178.6	-160.7	161.6	0	0	0	111.7	Q120 N130 T158 Y161 S253 G256 N257 T261 V264	Q120-I259 PolarHBondContact NE2-O 2.69Å; N130-I259 WeakPolarHBondContact OD1-CD1 3.36Å; N130-I259 WeakPolarHBondContact OD1-CG1 3.38Å; N130-I259 WeakPolarHBondContact OD1-CG2 3.16Å; T158-I259 HydrophobicContact CG2-CG2 4.38Å; Y161-I259 HydrophobicContact CE2-CD1 4.49Å; Y161-I259 HydrophobicContact CE2-CG2 4.34Å; S253-I259 VanDerWaalsContact OG-CD1 3.32Å; S253-I259 WeakPolarHBondContact OG-CD1 3.21Å; G256-I259 WeakPolarHBondContact O-CB 3.26Å; G256-I259 WeakPolarHBondContact O-CG2 3.19Å; G256-I259 PolarHBondContact O-N 3.33Å; N257-I259 PolarHBondContact O-N 3.35Å; N257-I259 VanDerWaalsContact O-N 3.1Å; I259-T261 PolarHBondContact O-N 2.75Å; I259-V264 HydrophobicContact CG1-CG2 4.37Å
260	Y	55.4	Low	64.8	Low	95 Å²	95	26.8 Å²	26.8	37%	0.373	15%	0.147	S	C	.	.	G	3₁₀ helix	trans	-72.9	-15.3	-178.3	-66.4	-72.3	0	0	0	113.9	G122 N130 T158 N257 C258	G122-Y260 VanDerWaalsContact CA-O 3.27Å; G122-Y260 WeakPolarHBondContact CA-O 3.35Å; N130-Y260 VanDerWaalsContact ND2-CE1 3.34Å; N130-Y260 WeakPolarHBondContact ND2-CE1 3.42Å; T158-Y260 HydrophobicContact CG2-CD2 4.26Å; T158-Y260 HydrophobicContact CG2-CE2 3.42Å; T158-Y260 VanDerWaalsContact CG2-CE2 3.42Å; N257-Y260 PolarHBondContact O-N 3.25Å; C258-Y260 PolarHBondContact O-N 2.72Å
261	T	52.8	Low	64.7	Low	78 Å²	78	26.1 Å²	26.1	48%	0.479	14%	0.144	S	C	.	.	T	Hydrogen-bonded Turn	trans	-109.7	-34.6	-177.4	55.2	0	0	0	0	112.2	C258 I259	C258-T261 PolarHBondContact O-N 3.06Å; C258-T261 PolarHBondContact O-OG1 3.26Å; C258-T261 VanDerWaalsContact O-OG1 3.11Å; I259-T261 PolarHBondContact O-N 2.75Å
262	N	59.8	Low	64.8	Low	39 Å²	39	29.1 Å²	29.1	21%	0.209	16%	0.156	C	C	.	.	S	Bend	trans	-90	153.9	-166.5	-63.7	-3.3	0	0	0	112.5	C258 V264	C258-N262 WeakPolarHBondContact O-CB 3.44Å; C258-N262 VanDerWaalsContact O-CG 3.27Å; C258-N262 PolarHBondContact O-N 3.43Å; C258-N262 VanDerWaalsContact O-N 3.14Å; N262-V264 HydrophobicContact CB-CG2 4.39Å; N262-V264 PolarHBondContact O-N 3.33Å
263	A	58.4	Low	64.9	Low	10 Å²	10	30 Å²	30	8%	0.083	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.9	120.2	163.2	0	0	0	0	0	108.9	Y24 L25 Q120 F121	Y24-A263 VanDerWaalsContact O-CB 3.3Å; Y24-A263 WeakPolarHBondContact O-CB 3.39Å; L25-A263 HydrophobicContact CD1-CB 4.03Å; Q120-A263 CarbonylContact O-C 3.6Å; Q120-A263 VanDerWaalsContact O-CA 3.26Å; Q120-A263 WeakPolarHBondContact O-CA 3.33Å; F121-A263 HydrophobicContact CB-CB 4.5Å; F121-A263 HydrophobicContact CD2-CB 3.61Å; F121-A263 HydrophobicContact CE2-CB 3.96Å; F121-A263 HydrophobicContact CG-CB 4.09Å
264	V	64.2	Low	64.7	Low	5 Å²	5	33.9 Å²	33.9	3%	0.03	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	125	179.5	176.7	0	0	0	0	107.7	Q120 I259 N262	Q120-V264 HydrophobicContact CB-CB 4.27Å; Q120-V264 PolarHBondContact N-O 3.24Å; Q120-V264 PolarHBondContact O-N 3.21Å; I259-V264 HydrophobicContact CG1-CG2 4.37Å; N262-V264 HydrophobicContact CB-CG2 4.39Å; N262-V264 PolarHBondContact O-N 3.33Å
265	V	66.3	Low	64.5	Low	3 Å²	3	33 Å²	33	2%	0.018	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.7	128.8	167	173.4	0	0	0	0	107.7	L25 V27 F29 Y68 L71 G251 S252 Y267	L25-V265 HydrophobicContact CD1-CG2 4.24Å; V27-V265 HydrophobicContact CG2-CB 4.33Å; F29-V265 HydrophobicContact CZ-CG1 4.42Å; F29-V265 HydrophobicContact CZ-CG2 4.41Å; Y68-V265 HydrophobicContact CD1-CG1 4.38Å; Y68-V265 HydrophobicContact CE1-CB 4.38Å; Y68-V265 HydrophobicContact CE1-CG1 3.29Å; Y68-V265 HydrophobicContact CE1-CG2 4.2Å; Y68-V265 WeakPolarHBondContact OH-CG1 3.49Å; L71-V265 HydrophobicContact CD2-CG2 3.9Å; G251-V265 WeakPolarHBondContact CA-O 3.33Å; S252-V265 PolarHBondContact N-O 2.64Å; V265-Y267 HydrophobicContact CG1-CE2 3.97Å
266	T	70.9	Confident	63.9	Low	5 Å²	5	39.8 Å²	39.8	3%	0.031	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	140	177.8	-63	0	0	0	0	109	L118 I249 I250	L118-T266 WeakPolarHBondContact CA-O 3.3Å; L118-T266 WeakPolarHBondContact CB-O 3.14Å; L118-T266 HydrophobicContact CD1-CG2 4.32Å; L118-T266 PolarHBondContact N-O 2.88Å; L118-T266 PolarHBondContact O-N 2.75Å; L118-T266 VanDerWaalsContact O-O 3.1Å; I249-T266 HydrophobicContact CG2-CG2 3.32Å; I250-T266 CarbonylContact O-C 3.52Å; I250-T266 VanDerWaalsContact O-CA 3.28Å; I250-T266 WeakPolarHBondContact O-CA 3.39Å
267	Y	72.8	Confident	63.3	Low	13 Å²	13	43.8 Å²	43.8	5%	0.051	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105	131.8	169.2	-53.8	-94.2	0	0	0	107.3	F29 F39 L59 L64 Y68 V115 I249 I250 V265	F29-Y267 WeakPolarHBondContact CE1-OH 3.29Å; F39-Y267 HydrophobicContact CD1-CE1 4.27Å; F39-Y267 HydrophobicContact CD1-CE2 4.29Å; F39-Y267 AromaticContact CD1-CZ 3.6Å; F39-Y267 WeakPolarHBondContact CD1-OH 3.45Å; F39-Y267 HydrophobicContact CD2-CE1 4.2Å; F39-Y267 AromaticContact CE1-CE1 3.83Å; F39-Y267 HydrophobicContact CE1-CE1 3.83Å; F39-Y267 AromaticContact CE1-CZ 3.53Å; F39-Y267 WeakPolarHBondContact CE1-OH 3.36Å; F39-Y267 AromaticContact CE2-CE1 3.72Å; F39-Y267 HydrophobicContact CE2-CE1 3.72Å; F39-Y267 AromaticContact CE2-CZ 4Å; F39-Y267 HydrophobicContact CG-CE1 4.44Å; F39-Y267 HydrophobicContact CG-CE2 4.28Å; F39-Y267 AromaticContact CG-CZ 3.88Å; F39-Y267 AromaticContact CZ-CE1 3.51Å; F39-Y267 HydrophobicContact CZ-CE1 3.51Å; F39-Y267 AromaticContact CZ-CZ 3.71Å; F39-Y267 WeakPolarHBondContact CZ-OH 2.87Å; L59-Y267 HydrophobicContact CD1-CD1 4.45Å; L64-Y267 HydrophobicContact CD2-CE1 4.48Å; Y68-Y267 HydrophobicContact CD2-CE1 4.47Å; Y68-Y267 WeakPolarHBondContact CE1-OH 3.05Å; Y68-Y267 HydrophobicContact CE2-CD1 4.44Å; Y68-Y267 AromaticContact CE2-CE1 3.35Å; Y68-Y267 HydrophobicContact CE2-CE1 3.35Å; Y68-Y267 AromaticContact CE2-CZ 3.75Å; Y68-Y267 VanDerWaalsContact CE2-OH 3.31Å; Y68-Y267 WeakPolarHBondContact CE2-OH 3.34Å; Y68-Y267 AromaticContact CZ-CE1 3.37Å; Y68-Y267 AromaticContact CZ-CZ 3.46Å; Y68-Y267 VanDerWaalsContact CZ-CZ 3.46Å; Y68-Y267 WeakPolarHBondContact OH-CE1 3.47Å; Y68-Y267 PolarHBondContact OH-OH 2.98Å; V115-Y267 HydrophobicContact CG1-CD1 4Å; I249-Y267 CarbonylContact C-O 3.12Å; I249-Y267 VanDerWaalsContact CA-O 3.28Å; I249-Y267 WeakPolarHBondContact CA-O 3.39Å; I250-Y267 HydrophobicContact CB-CD2 4.4Å; I250-Y267 HydrophobicContact CG2-CD2 4.46Å; I250-Y267 PolarHBondContact N-O 3.41Å; I250-Y267 WeakPolarHBondContact O-CD2 3.21Å; I250-Y267 PolarHBondContact O-N 3.04Å; V265-Y267 HydrophobicContact CG1-CE2 3.97Å
268	F	73.3	Confident	62.9	Low	39 Å²	39	45.2 Å²	45.2	17%	0.171	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.5	128.3	162.5	178.7	-83.1	0	0	0	107.5	V115 Y116 L118 F136 Y247 T248 I249 E270	V115-F268 CarbonylContact C-O 3.6Å; V115-F268 WeakPolarHBondContact CA-O 3.27Å; Y116-F268 AromaticContact CD2-CD1 3.56Å; Y116-F268 HydrophobicContact CD2-CD1 3.56Å; Y116-F268 HydrophobicContact CD2-CE1 4.24Å; Y116-F268 HydrophobicContact CE2-CD1 4.06Å; Y116-F268 HydrophobicContact CE2-CE1 4.29Å; Y116-F268 HydrophobicContact CG-CD1 4.28Å; Y116-F268 PolarHBondContact N-O 3.38Å; Y116-F268 PolarHBondContact O-N 3.37Å; L118-F268 HydrophobicContact CD1-CB 4.16Å; F136-F268 AromaticContact CD2-CE2 3.43Å; F136-F268 HydrophobicContact CD2-CE2 3.43Å; F136-F268 VanDerWaalsContact CD2-CE2 3.43Å; F136-F268 HydrophobicContact CD2-CZ 4.03Å; F136-F268 HydrophobicContact CE2-CD2 4.42Å; F136-F268 AromaticContact CE2-CE2 3.28Å; F136-F268 HydrophobicContact CE2-CE2 3.28Å; F136-F268 AromaticContact CE2-CZ 3.7Å; F136-F268 HydrophobicContact CE2-CZ 3.7Å; F136-F268 HydrophobicContact CG-CE2 4.09Å; F136-F268 AromaticContact CZ-CE2 3.83Å; F136-F268 HydrophobicContact CZ-CE2 3.83Å; F136-F268 HydrophobicContact CZ-CZ 4.48Å; Y247-F268 AromaticContact CD1-CE1 3.75Å; Y247-F268 HydrophobicContact CD1-CE1 3.75Å; Y247-F268 HydrophobicContact CD1-CE2 4.39Å; Y247-F268 AromaticContact CD1-CZ 3.38Å; Y247-F268 HydrophobicContact CD1-CZ 3.38Å; Y247-F268 HydrophobicContact CE1-CE1 4.32Å; Y247-F268 HydrophobicContact CE1-CZ 4.11Å; Y247-F268 HydrophobicContact CG-CZ 4.15Å; T248-F268 CarbonylContact O-C 3.56Å; T248-F268 WeakPolarHBondContact O-CA 3.39Å; I249-F268 HydrophobicContact CD1-CD2 3.87Å; I249-F268 HydrophobicContact CD1-CE2 4.31Å; I249-F268 HydrophobicContact CG1-CD2 3.69Å; I249-F268 HydrophobicContact CG1-CE2 4.29Å; F268-E270 HydrophobicContact CE1-CB 4.37Å
269	T	74.3	Confident	62.6	Low	4 Å²	4	44.2 Å²	44.2	3%	0.025	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	139.6	173.6	73.4	0	0	0	0	110.5	V114 V115 Y247 T248	V114-T269 CarbonylContact O-C 3.48Å; V114-T269 WeakPolarHBondContact O-CA 3.34Å; V115-T269 HydrophobicContact CB-CG2 4.44Å; V115-T269 HydrophobicContact CG1-CG2 4.27Å; V115-T269 HydrophobicContact CG2-CG2 3.91Å; Y247-T269 CarbonylContact C-O 3.55Å; Y247-T269 WeakPolarHBondContact CA-O 3.49Å; T248-T269 WeakPolarHBondContact CB-OG1 3Å; T248-T269 PolarHBondContact N-O 3.3Å; T248-T269 PolarHBondContact O-N 3.02Å
270	E	75.9	Confident	62	Low	22 Å²	22	44.7 Å²	44.7	10%	0.103	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	123.1	167.6	173.8	171.6	-161.7	0	0	107.7	T113 V114 R245 Y246 Y247 F268	T113-E270 CarbonylContact C-O 3.49Å; T113-E270 VanDerWaalsContact CA-O 3.28Å; T113-E270 WeakPolarHBondContact CA-O 3.37Å; V114-E270 PolarHBondContact N-O 2.89Å; V114-E270 PolarHBondContact O-N 3.33Å; R245-E270 WeakPolarHBondContact CD-OE1 3.23Å; R245-E270 IonicContact CZ-OE1 3.57Å; R245-E270 IonicContact NE-OE1 2.79Å; R245-E270 IonicContact NH1-OE1 3.03Å; R245-E270 PolarHBondContact NH1-OE1 3.36Å; Y246-E270 CarbonylContact O-C 3.49Å; Y246-E270 WeakPolarHBondContact O-CA 3.35Å; Y247-E270 HydrophobicContact CD1-CB 3.78Å; Y247-E270 HydrophobicContact CD1-CG 3.92Å; Y247-E270 HydrophobicContact CE1-CB 3.67Å; Y247-E270 HydrophobicContact CE1-CG 3.37Å; Y247-E270 WeakPolarHBondContact CE1-OE1 3.48Å; Y247-E270 PolarHBondContact OH-OE1 3.34Å; F268-E270 HydrophobicContact CE1-CB 4.37Å
271	A	73.2	Confident	62	Low	9 Å²	9	41.6 Å²	41.6	7%	0.074	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	141.5	-178	0	0	0	0	0	111.1	D112 T113 Y246 V275	D112-A271 CarbonylContact O-C 3.46Å; D112-A271 WeakPolarHBondContact O-CA 3.39Å; T113-A271 HydrophobicContact CG2-CB 4.33Å; Y246-A271 PolarHBondContact N-O 3.06Å; Y246-A271 PolarHBondContact O-N 3.18Å; A271-V275 HydrophobicContact CB-CB 4.28Å; A271-V275 HydrophobicContact CB-CG1 4.45Å
272	Q	72.5	Confident	62.1	Low	72 Å²	72	38.3 Å²	38.3	34%	0.336	21%	0.209	S	C	.	.			trans	-68.4	155.3	173.9	-67.1	-173.8	22.4	0	0	111.2	Y111 D112 S274 V275	Y111-Q272 PolarHBondContact O-NE2 3.32Å; D112-Q272 PolarHBondContact O-N 3.35Å; Q272-S274 PolarHBondContact O-N 3.23Å; Q272-S274 VanDerWaalsContact O-N 3.14Å; Q272-V275 HydrophobicContact CB-CG2 4.48Å; Q272-V275 WeakPolarHBondContact O-CB 3.44Å; Q272-V275 PolarHBondContact O-N 3.27Å
273	P	65.6	Low	61.8	Low	41 Å²	41	38.5 Å²	38.5	27%	0.266	21%	0.213	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58.2	-29.5	-179.2	-20.2	27.7	0	0	0	114.3	D243 G244 V275	D243-P273 VanDerWaalsContact O-CG 3.27Å; D243-P273 WeakPolarHBondContact O-CG 3.39Å; G244-P273 WeakPolarHBondContact O-CG 3.48Å; P273-V275 PolarHBondContact O-N 3.18Å
274	S	62.9	Low	61.7	Low	91 Å²	91	38.7 Å²	38.7	64%	0.636	21%	0.212	S	C	*	.	T	Hydrogen-bonded Turn	trans	-64.3	-19.4	176.8	52	0	0	0	0	113.3	Q272 I276	Q272-S274 PolarHBondContact O-N 3.23Å; Q272-S274 VanDerWaalsContact O-N 3.14Å; S274-I276 PolarHBondContact O-N 3.43Å
275	V	60.5	Low	61.3	Low	11 Å²	11	39.1 Å²	39.1	7%	0.067	21%	0.214	C	C	.	.			trans	-89	82.4	-180	-172.9	0	0	0	0	109.2	D112 A271 Q272 P273 N277	D112-V275 HydrophobicContact CB-CG2 3.59Å; A271-V275 HydrophobicContact CB-CB 4.28Å; A271-V275 HydrophobicContact CB-CG1 4.45Å; Q272-V275 HydrophobicContact CB-CG2 4.48Å; Q272-V275 WeakPolarHBondContact O-CB 3.44Å; Q272-V275 PolarHBondContact O-N 3.27Å; P273-V275 PolarHBondContact O-N 3.18Å; V275-N277 VanDerWaalsContact C-N 3.3Å; V275-N277 HydrophobicContact CG1-CB 3.96Å; V275-N277 WeakPolarHBondContact CG1-ND2 3.31Å; V275-N277 PolarHBondContact O-N 3.28Å
276	I	51.3	Low	60.3	Low	161 Å²	161	43.8 Å²	43.8	83%	0.826	24%	0.242	S	C	*	.			trans	-75.6	86.9	168.2	-58.4	176.1	0	0	0	107.7	S274	S274-I276 PolarHBondContact O-N 3.43Å
277	N	50.3	Low	58.8	Low	85 Å²	85	46.3 Å²	46.3	46%	0.455	26%	0.255	S	S	.	.			trans	-118.6	148.8	178.4	-95.3	-36.4	0	0	0	111.5	V275 I279 A280	V275-N277 VanDerWaalsContact C-N 3.3Å; V275-N277 HydrophobicContact CG1-CB 3.96Å; V275-N277 WeakPolarHBondContact CG1-ND2 3.31Å; V275-N277 PolarHBondContact O-N 3.28Å; N277-I279 HydrophobicContact CB-CB 4.31Å; N277-I279 HydrophobicContact CB-CD1 4.43Å; N277-I279 HydrophobicContact CB-CG1 4.28Å; N277-I279 PolarHBondContact O-N 2.96Å; N277-A280 WeakPolarHBondContact O-CB 3.34Å; N277-A280 PolarHBondContact O-N 2.89Å
278	Q	48	Very low	57.3	Low	116 Å²	116	46.5 Å²	46.5	54%	0.542	26%	0.257	S	S	.	.	T	Hydrogen-bonded Turn	trans	-51.1	-10.9	171.7	-62.6	176.9	1.7	0	0	113.9
279	I	50.1	Low	55.3	Low	29 Å²	29	52.6 Å²	52.6	15%	0.149	28%	0.28	C	S	.	.	T	Hydrogen-bonded Turn	trans	-72	-43.8	173.2	-55.9	175.1	0	0	0	111	V57 L59 W236 T248 N277	V57-I279 HydrophobicContact CG1-CD1 4.23Å; V57-I279 HydrophobicContact CG1-CG1 4.31Å; L59-I279 HydrophobicContact CD2-CD1 4.48Å; W236-I279 PolarHBondContact NE1-O 3.1Å; T248-I279 HydrophobicContact CG2-CG2 3.64Å; T248-I279 WeakPolarHBondContact CG2-O 3.47Å; T248-I279 PolarHBondContact OG1-O 3.38Å; T248-I279 VanDerWaalsContact OG1-O 3.06Å; N277-I279 HydrophobicContact CB-CB 4.31Å; N277-I279 HydrophobicContact CB-CD1 4.43Å; N277-I279 HydrophobicContact CB-CG1 4.28Å; N277-I279 PolarHBondContact O-N 2.96Å
280	A	44.7	Very low	53.3	Low	11 Å²	11	56.7 Å²	56.7	9%	0.091	30%	0.295	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.9	-46.2	-162.9	0	0	0	0	0	114.8	Y246 N277	Y246-A280 HydrophobicContact CD1-CB 3.56Å; Y246-A280 HydrophobicContact CD2-CB 4.43Å; Y246-A280 HydrophobicContact CE1-CB 4.05Å; Y246-A280 HydrophobicContact CG-CB 3.75Å; N277-A280 WeakPolarHBondContact O-CB 3.34Å; N277-A280 PolarHBondContact O-N 2.89Å
281	V	54.6	Low	51.3	Low	30 Å²	30	59.8 Å²	59.8	18%	0.182	31%	0.312	C	S	.	.	S	Bend	trans	-150.3	117.4	164.1	177.9	0	0	0	0	103.8	Y149 R238 F285	Y149-V281 HydrophobicContact CD1-CG1 4.16Å; Y149-V281 HydrophobicContact CD2-CG2 4.15Å; Y149-V281 HydrophobicContact CE1-CG1 4.31Å; Y149-V281 HydrophobicContact CE2-CG2 4.23Å; Y149-V281 HydrophobicContact CG-CG1 4.35Å; R238-V281 HydrophobicContact CB-CG2 4.21Å; V281-F285 HydrophobicContact CG1-CB 3.71Å; V281-F285 HydrophobicContact CG1-CD2 3.79Å; V281-F285 HydrophobicContact CG1-CG 4.07Å
282	P	55	Low	49.4	Very low	8 Å²	8	64.7 Å²	64.7	5%	0.052	34%	0.337	C	S	.	.			trans	-61.6	149.6	-174.2	-16.9	25.2	0	0	0	108.9	W236 L284 F285	W236-P282 HydrophobicContact CD2-CG 4.46Å; W236-P282 HydrophobicContact CH2-CG 3.73Å; W236-P282 HydrophobicContact CZ2-CB 4.47Å; W236-P282 HydrophobicContact CZ2-CG 3Å; P282-L284 HydrophobicContact CB-CB 4.06Å; P282-L284 HydrophobicContact CB-CD1 3.93Å; P282-L284 HydrophobicContact CB-CG 4.26Å; P282-L284 HydrophobicContact CG-CD1 4.5Å; P282-L284 PolarHBondContact O-N 3.35Å; P282-F285 PolarHBondContact O-N 2.95Å
283	P	53.2	Low	47.5	Very low	43 Å²	43	67.7 Å²	67.7	28%	0.279	35%	0.345	S	S	.	.	H	α-helix	trans	-45.6	-26.4	170.7	-29.1	34.6	0	0	0	112.9	F285 T286 L287 L310	P283-F285 VanDerWaalsContact C-N 3.25Å; P283-F285 PolarHBondContact O-N 3.48Å; P283-T286 CarbonylContact O-C 3.46Å; P283-T286 WeakPolarHBondContact O-CA 3.49Å; P283-T286 WeakPolarHBondContact O-CB 3.4Å; P283-T286 PolarHBondContact O-N 3.22Å; P283-L287 HydrophobicContact CB-CD1 4.12Å; P283-L287 WeakPolarHBondContact O-CB 3.31Å; P283-L287 WeakPolarHBondContact O-CD1 3.41Å; P283-L287 PolarHBondContact O-N 3.1Å; P283-L310 HydrophobicContact CB-CD2 4.34Å; P283-L310 HydrophobicContact CG-CD2 4.2Å
284	L	56.6	Low	45.7	Very low	14 Å²	14	75 Å²	75	7%	0.073	37%	0.368	C	S	.	.	H	α-helix	trans	-44.7	-41.8	171.7	-70.6	155.8	0	0	0	114.1	Q53 R55 L175 Y223 F230 A232 P282 L287 L288	Q53-L284 HydrophobicContact CG-CD2 3.71Å; R55-L284 HydrophobicContact CG-CD1 3.99Å; L175-L284 HydrophobicContact CD2-CB 4.15Å; Y223-L284 HydrophobicContact CE2-CD2 4.31Å; F230-L284 HydrophobicContact CE2-CD2 4.22Å; A232-L284 HydrophobicContact CB-CD1 3.85Å; P282-L284 HydrophobicContact CB-CB 4.06Å; P282-L284 HydrophobicContact CB-CD1 3.93Å; P282-L284 HydrophobicContact CB-CG 4.26Å; P282-L284 HydrophobicContact CG-CD1 4.5Å; P282-L284 PolarHBondContact O-N 3.35Å; L284-L287 PolarHBondContact O-N 3.39Å; L284-L288 WeakPolarHBondContact O-CD1 2.98Å; L284-L288 VanDerWaalsContact O-CG 3.22Å; L284-L288 WeakPolarHBondContact O-CG 3.46Å; L284-L288 PolarHBondContact O-N 3.38Å
285	F	54.9	Low	44.3	Very low	14 Å²	14	79.2 Å²	79.2	6%	0.061	37%	0.374	C	S	.	.	H	α-helix	trans	-81	-27.5	177.6	-70.2	-84.8	0	0	0	113.4	Y149 L150 A151 R173 L175 W236 V281 P282 P283 L287 L288	Y149-F285 HydrophobicContact CD1-CB 4.05Å; Y149-F285 AromaticContact CD1-CD1 3.54Å; Y149-F285 HydrophobicContact CD1-CD1 3.54Å; Y149-F285 HydrophobicContact CD1-CD2 4.09Å; Y149-F285 AromaticContact CD1-CE1 3.91Å; Y149-F285 HydrophobicContact CD1-CE1 3.91Å; Y149-F285 HydrophobicContact CD1-CE2 4.43Å; Y149-F285 AromaticContact CD1-CG 3.62Å; Y149-F285 HydrophobicContact CD1-CG 3.62Å; Y149-F285 HydrophobicContact CD1-CZ 4.34Å; Y149-F285 HydrophobicContact CE1-CB 4.25Å; Y149-F285 HydrophobicContact CE1-CD1 4.31Å; Y149-F285 HydrophobicContact CE1-CG 4.3Å; Y149-F285 HydrophobicContact CG-CD1 4.49Å; Y149-F285 HydrophobicContact CG-CG 4.49Å; L150-F285 WeakPolarHBondContact O-CZ 3.37Å; A151-F285 HydrophobicContact CB-CE2 4.43Å; A151-F285 HydrophobicContact CB-CZ 4.17Å; R173-F285 HydrophobicContact CB-CE1 4.47Å; R173-F285 WeakPolarHBondContact O-CE1 2.89Å; L175-F285 HydrophobicContact CB-CD1 4.35Å; L175-F285 HydrophobicContact CB-CE1 3.57Å; L175-F285 HydrophobicContact CB-CZ 3.84Å; W236-F285 AromaticContact CE3-CE2 3.77Å; W236-F285 HydrophobicContact CE3-CE2 3.77Å; W236-F285 HydrophobicContact CE3-CZ 4.28Å; W236-F285 AromaticContact CH2-CE2 4Å; W236-F285 HydrophobicContact CH2-CE2 4Å; W236-F285 AromaticContact CZ3-CE2 3.5Å; W236-F285 HydrophobicContact CZ3-CE2 3.5Å; W236-F285 VanDerWaalsContact CZ3-CE2 3.5Å; W236-F285 AromaticContact CZ3-CZ 3.96Å; W236-F285 HydrophobicContact CZ3-CZ 3.96Å; V281-F285 HydrophobicContact CG1-CB 3.71Å; V281-F285 HydrophobicContact CG1-CD2 3.79Å; V281-F285 HydrophobicContact CG1-CG 4.07Å; P282-F285 PolarHBondContact O-N 2.95Å; P283-F285 VanDerWaalsContact C-N 3.25Å; P283-F285 PolarHBondContact O-N 3.48Å; F285-L287 VanDerWaalsContact C-N 3.27Å; F285-L288 HydrophobicContact CB-CD1 4.47Å; F285-L288 HydrophobicContact CD1-CD1 3.66Å; F285-L288 HydrophobicContact CE1-CD1 4.21Å; F285-L288 HydrophobicContact CG-CD1 4.22Å; F285-L288 PolarHBondContact O-N 3.47Å
286	T	46	Very low	43	Very low	101 Å²	101	87.6 Å²	87.6	62%	0.62	41%	0.412	S	S	*	.	H	α-helix	trans	-68.7	-31.6	170.4	-42.5	0	0	0	0	110.9	P283	P283-T286 CarbonylContact O-C 3.46Å; P283-T286 WeakPolarHBondContact O-CA 3.49Å; P283-T286 WeakPolarHBondContact O-CB 3.4Å; P283-T286 PolarHBondContact O-N 3.22Å
287	L	39.6	Very low	41.9	Very low	58 Å²	58	89.1 Å²	89.1	30%	0.304	42%	0.416	S	S	.	.	H	α-helix	trans	-72.4	-27.4	176.2	-89.1	139.7	0	0	0	113	P283 L284 F285 Y289 F307	P283-L287 HydrophobicContact CB-CD1 4.12Å; P283-L287 WeakPolarHBondContact O-CB 3.31Å; P283-L287 WeakPolarHBondContact O-CD1 3.41Å; P283-L287 PolarHBondContact O-N 3.1Å; L284-L287 PolarHBondContact O-N 3.39Å; F285-L287 VanDerWaalsContact C-N 3.27Å; L287-Y289 VanDerWaalsContact C-N 3.27Å; L287-Y289 PolarHBondContact O-N 2.81Å; L287-F307 HydrophobicContact CB-CE1 4.06Å; L287-F307 HydrophobicContact CB-CE2 4.49Å; L287-F307 HydrophobicContact CB-CZ 3.94Å; L287-F307 HydrophobicContact CD2-CB 4.23Å; L287-F307 HydrophobicContact CD2-CD1 3.12Å; L287-F307 HydrophobicContact CD2-CD2 3.68Å; L287-F307 HydrophobicContact CD2-CE1 3.22Å; L287-F307 HydrophobicContact CD2-CE2 3.76Å; L287-F307 HydrophobicContact CD2-CG 3.38Å; L287-F307 HydrophobicContact CD2-CZ 3.57Å; L287-F307 HydrophobicContact CG-CD1 3.86Å; L287-F307 HydrophobicContact CG-CE1 3.49Å; L287-F307 VanDerWaalsContact CG-CE1 3.49Å; L287-F307 HydrophobicContact CG-CE2 4.5Å; L287-F307 HydrophobicContact CG-CZ 3.88Å; L287-F307 WeakPolarHBondContact O-CE2 3.44Å; L287-F307 WeakPolarHBondContact O-CZ 3.34Å
288	L	40.3	Very low	40.8	Very low	17 Å²	17	92.9 Å²	92.9	9%	0.089	44%	0.435	C	S	.	.	G	3₁₀ helix	trans	-74.6	-10	-176.8	-76.8	160.4	0	0	0	115.4	L175 N221 L284 F285 R290 L291	L175-L288 HydrophobicContact CB-CD1 3.79Å; L175-L288 HydrophobicContact CD1-CD1 3.5Å; L175-L288 HydrophobicContact CD1-CD2 3.37Å; L175-L288 HydrophobicContact CD1-CG 3.95Å; L175-L288 HydrophobicContact CD2-CD1 3.34Å; L175-L288 HydrophobicContact CD2-CD2 4.4Å; L175-L288 HydrophobicContact CD2-CG 4.14Å; L175-L288 HydrophobicContact CG-CD1 3.66Å; L175-L288 HydrophobicContact CG-CD2 4.41Å; N221-L288 HydrophobicContact CB-CD1 4.47Å; N221-L288 HydrophobicContact CB-CD2 4.21Å; L284-L288 WeakPolarHBondContact O-CD1 2.98Å; L284-L288 VanDerWaalsContact O-CG 3.22Å; L284-L288 WeakPolarHBondContact O-CG 3.46Å; L284-L288 PolarHBondContact O-N 3.38Å; F285-L288 HydrophobicContact CB-CD1 4.47Å; F285-L288 HydrophobicContact CD1-CD1 3.66Å; F285-L288 HydrophobicContact CE1-CD1 4.21Å; F285-L288 HydrophobicContact CG-CD1 4.22Å; F285-L288 PolarHBondContact O-N 3.47Å; L288-R290 PolarHBondContact O-N 3.47Å; L288-L291 HydrophobicContact CD2-CD1 4.39Å
289	Y	32.1	Very low	39.8	Very low	167 Å²	167	92.8 Å²	92.8	66%	0.655	45%	0.446	S	S	*	.	G	3₁₀ helix	trans	-64.5	3.8	-178.3	-111.7	-82.7	0	0	0	114.2	R173 L287	R173-Y289 PolarHBondContact NH2-OH 2.95Å; L287-Y289 VanDerWaalsContact C-N 3.27Å; L287-Y289 PolarHBondContact O-N 2.81Å
290	R	32.2	Very low	38.7	Very low	90 Å²	90	95.4 Å²	95.4	34%	0.34	47%	0.472	S	S	.	.	G	3₁₀ helix	trans	-139	9.7	-165.1	-56.3	-174.3	-173.1	171	-9.9	116	L288 V305 E306 F307	L288-R290 PolarHBondContact O-N 3.47Å; R290-V305 WeakPolarHBondContact CD-O 3.14Å; R290-V305 PolarHBondContact NH1-O 3.23Å; R290-V305 VanDerWaalsContact NH2-CG1 3.25Å; R290-E306 PolarHBondContact NH1-O 3.08Å; R290-F307 HydrophobicContact CB-CE2 4.24Å; R290-F307 HydrophobicContact CG-CZ 4.42Å
291	L	33.6	Very low	38	Very low	87 Å²	87	101.6 Å²	101.6	46%	0.455	50%	0.503	S	S	.	.			trans	-92.4	135.1	178.2	-85.4	165.9	0	0	0	113.2	A224 L288	A224-L291 HydrophobicContact CB-CD1 4.43Å; A224-L291 HydrophobicContact CB-CD2 4.24Å; L288-L291 HydrophobicContact CD2-CD1 4.39Å
292	D	34.3	Very low	36.7	Very low	112 Å²	112	106.3 Å²	106.3	60%	0.599	53%	0.528	S	S	*	.			trans	-57.8	128.2	-155.4	-164.9	0.9	0	0	0	116.6	R294	D292-R294 PolarHBondContact O-N 3Å; D292-R294 IonicContact OD1-NE 3.56Å; D292-R294 PolarHBondContact OD1-NE 2.99Å; D292-R294 IonicContact OD2-NE 3.46Å
293	R	31.2	Very low	35.3	Very low	136 Å²	136	116.7 Å²	116.7	51%	0.513	57%	0.566	S	S	.	*			trans	-75.2	42	175.2	-70.1	-173.8	-172.7	-129.2	11.2	113.2	C299 A300 D301	R293-C299 PolarHBondContact NH1-O 3.47Å; R293-A300 VanDerWaalsContact NH1-CA 3.32Å; R293-A300 PolarHBondContact NH1-O 2.98Å; R293-A300 VanDerWaalsContact NH2-C 3.34Å; R293-A300 PolarHBondContact NH2-O 3.41Å; R293-D301 PolarHBondContact NE-O 3.39Å; R293-D301 PolarHBondContact NH2-O 2.93Å
294	R	28.3	Very low	34	Very low	195 Å²	195	120.6 Å²	120.6	74%	0.736	59%	0.589	S	S	*	*			trans	-128.8	70.5	-178.6	-75.1	-165.4	-94.9	-163	-10	112.7	D292	D292-R294 PolarHBondContact O-N 3Å; D292-R294 IonicContact OD1-NE 3.56Å; D292-R294 PolarHBondContact OD1-NE 2.99Å; D292-R294 IonicContact OD2-NE 3.46Å
295	K	33	Very low	32.5	Very low	178 Å²	178	123.7 Å²	123.7	77%	0.774	61%	0.608	S	S	*	*	S	Bend	trans	-178.8	121.2	145.7	-95.1	149.8	-169	-179.6	0	108.1
296	H	34.4	Very low	31	Very low	187 Å²	187	131.7 Å²	131.7	87%	0.866	65%	0.646	S	S	*	*	S	Bend	trans	84.5	105.9	-172.1	-50.7	-63.8	0	0	0	114.5	L298	H296-L298 PolarHBondContact O-N 3.18Å
297	H	26.4	Very low	30.1	Very low	194 Å²	194	131.9 Å²	131.9	90%	0.898	64%	0.638	S	S	*	*			trans	-50.4	117	170.7	-64.4	-42.1	0	0	0	110.3
298	L	27.9	Very low	29.3	Very low	164 Å²	164	134.4 Å²	134.4	86%	0.859	66%	0.66	S	S	*	*			trans	179.8	117.8	142.7	-91.9	155.5	0	0	0	109.1	H296	H296-L298 PolarHBondContact O-N 3.18Å
299	C	28	Very low	28.6	Very low	114 Å²	114	140.5 Å²	140.5	77%	0.77	69%	0.689	S	S	*	*			trans	76.2	144.1	168.3	-69.9	0	0	0	0	119.5	R293	R293-C299 PolarHBondContact NH1-O 3.47Å
300	A	25.3	Very low	28.3	Very low	84 Å²	84	138 Å²	138	69%	0.694	69%	0.686	S	S	*	*			trans	-103.7	165	-165.8	0	0	0	0	0	113.7	R293	R293-A300 VanDerWaalsContact NH1-CA 3.32Å; R293-A300 PolarHBondContact NH1-O 2.98Å; R293-A300 VanDerWaalsContact NH2-C 3.34Å; R293-A300 PolarHBondContact NH2-O 3.41Å
301	D	30.4	Very low	28.1	Very low	141 Å²	141	138.4 Å²	138.4	75%	0.754	69%	0.692	S	S	*	*			trans	115.3	96.8	173.6	-90.5	-15.5	0	0	0	117.6	R293	R293-D301 PolarHBondContact NE-O 3.39Å; R293-D301 PolarHBondContact NH2-O 2.93Å
302	D	27.2	Very low	27.8	Very low	129 Å²	129	138.6 Å²	138.6	69%	0.69	70%	0.696	S	S	*	*			trans	-69.7	148	171.8	-75.1	-41.9	0	0	0	112.9
303	R	27.1	Very low	27.3	Very low	226 Å²	226	140.5 Å²	140.5	85%	0.853	70%	0.699	S	S	*	*			trans	-169.9	102.3	139.6	-102.9	-177.6	-73.4	-173.4	-0.2	109.6
304	T	25.2	Very low	27	Very low	124 Å²	124	139.6 Å²	139.6	76%	0.761	70%	0.704	S	S	*	*			trans	-81.6	137.7	175.6	-27	0	0	0	0	110.3
305	V	25.3	Very low	26.7	Very low	80 Å²	80	140.6 Å²	140.6	49%	0.485	71%	0.709	S	S	.	*			trans	-151.9	139.3	166.2	175.2	0	0	0	0	108.9	R290	R290-V305 WeakPolarHBondContact CD-O 3.14Å; R290-V305 PolarHBondContact NH1-O 3.23Å; R290-V305 VanDerWaalsContact NH2-CG1 3.25Å
306	E	23.4	Very low	26.3	Very low	182 Å²	182	135.4 Å²	135.4	85%	0.85	69%	0.692	S	S	*	*			trans	-66.9	154.8	-177	-66.4	174.1	147.1	0	0	113.6	R290	R290-E306 PolarHBondContact NH1-O 3.08Å
307	F	26.5	Very low	25.8	Very low	105 Å²	105	135 Å²	135	46%	0.461	69%	0.691	S	S	.	*			trans	-107.8	122	171.7	-73.3	-74.2	0	0	0	110.5	L287 R290	L287-F307 HydrophobicContact CB-CE1 4.06Å; L287-F307 HydrophobicContact CB-CE2 4.49Å; L287-F307 HydrophobicContact CB-CZ 3.94Å; L287-F307 HydrophobicContact CD2-CB 4.23Å; L287-F307 HydrophobicContact CD2-CD1 3.12Å; L287-F307 HydrophobicContact CD2-CD2 3.68Å; L287-F307 HydrophobicContact CD2-CE1 3.22Å; L287-F307 HydrophobicContact CD2-CE2 3.76Å; L287-F307 HydrophobicContact CD2-CG 3.38Å; L287-F307 HydrophobicContact CD2-CZ 3.57Å; L287-F307 HydrophobicContact CG-CD1 3.86Å; L287-F307 HydrophobicContact CG-CE1 3.49Å; L287-F307 VanDerWaalsContact CG-CE1 3.49Å; L287-F307 HydrophobicContact CG-CE2 4.5Å; L287-F307 HydrophobicContact CG-CZ 3.88Å; L287-F307 WeakPolarHBondContact O-CE2 3.44Å; L287-F307 WeakPolarHBondContact O-CZ 3.34Å; R290-F307 HydrophobicContact CB-CE2 4.24Å; R290-F307 HydrophobicContact CG-CZ 4.42Å
308	S	24	Very low	25.8	Very low	110 Å²	110	135.8 Å²	135.8	77%	0.769	69%	0.686	S	S	*	*			trans	-74.1	138.4	155.6	54.9	0	0	0	0	109.4	L310	S308-L310 PolarHBondContact O-N 3.01Å
309	E	25.6	Very low	25.8	Very low	146 Å²	146	133.2 Å²	133.2	68%	0.682	68%	0.679	S	S	*	*			trans	-45.6	121.7	-175.5	-56.9	179.3	147.2	0	0	113.8	H311	E309-H311 IonicContact OE1-NE2 3.08Å; E309-H311 IonicContact OE2-CD2 2.79Å; E309-H311 IonicContact OE2-NE2 3.65Å; E309-H311 PolarHBondContact OE2-NE2 2.98Å
310	L	25.9	Very low	25.8	Very low	115 Å²	115	133 Å²	133	60%	0.602	68%	0.678	S	S	*	*			trans	-98.2	79.6	163	-143	113.6	0	0	0	108.5	P283 S308 V312	P283-L310 HydrophobicContact CB-CD2 4.34Å; P283-L310 HydrophobicContact CG-CD2 4.2Å; S308-L310 PolarHBondContact O-N 3.01Å; L310-V312 HydrophobicContact CD2-CG2 4.21Å; L310-V312 PolarHBondContact O-N 3.43Å
311	H	27.5	Very low	25.7	Very low	98 Å²	98	134.4 Å²	134.4	45%	0.454	68%	0.682	S	S	.	*			trans	-71.7	113.4	160	-72.3	-83.9	0	0	0	107.7	E309 F313	E309-H311 IonicContact OE1-NE2 3.08Å; E309-H311 IonicContact OE2-CD2 2.79Å; E309-H311 IonicContact OE2-NE2 3.65Å; E309-H311 PolarHBondContact OE2-NE2 2.98Å; H311-F313 HydrophobicContact CB-CD2 3.32Å; H311-F313 HydrophobicContact CB-CE2 3.15Å; H311-F313 HydrophobicContact CB-CG 4.29Å; H311-F313 HydrophobicContact CB-CZ 4Å; H311-F313 AromaticContact CG-CE2 3.61Å; H311-F313 PolarHBondContact O-N 3.15Å
312	V	26.4	Very low	25.5	Very low	91 Å²	91	136.1 Å²	136.1	55%	0.552	69%	0.691	S	S	*	*			trans	-72.9	83.9	164	-179.2	0	0	0	0	106.7	L310	L310-V312 HydrophobicContact CD2-CG2 4.21Å; L310-V312 PolarHBondContact O-N 3.43Å
313	F	24.4	Very low	25.4	Very low	152 Å²	152	138 Å²	138	67%	0.667	70%	0.7	S	S	*	*			trans	-74.6	126.7	168.2	-79.2	-76.6	0	0	0	109.1	H311 Y315	H311-F313 HydrophobicContact CB-CD2 3.32Å; H311-F313 HydrophobicContact CB-CE2 3.15Å; H311-F313 HydrophobicContact CB-CG 4.29Å; H311-F313 HydrophobicContact CB-CZ 4Å; H311-F313 AromaticContact CG-CE2 3.61Å; H311-F313 PolarHBondContact O-N 3.15Å; F313-Y315 VanDerWaalsContact C-N 3.33Å; F313-Y315 PolarHBondContact O-N 3.47Å
314	L	24.3	Very low	25.2	Very low	116 Å²	116	135 Å²	135	61%	0.607	70%	0.697	S	S	*	*			trans	-70	92	166.5	-134.5	117.2	0	0	0	107.4	V316	L314-V316 HydrophobicContact CD2-CG2 3.71Å; L314-V316 PolarHBondContact O-N 2.79Å
315	Y	22.2	Very low	25.1	Very low	216 Å²	216	137.2 Å²	137.2	85%	0.847	70%	0.701	S	S	*	*			trans	-75.8	102.9	167.3	-111.9	-93.9	0	0	0	108.1	F313	F313-Y315 VanDerWaalsContact C-N 3.33Å; F313-Y315 PolarHBondContact O-N 3.47Å
316	V	25.5	Very low	24.9	Very low	69 Å²	69	140.7 Å²	140.7	42%	0.418	72%	0.716	S	S	.	*			trans	-105.1	104.9	159.8	-168.4	0	0	0	0	106.5	L314 W318	L314-V316 HydrophobicContact CD2-CG2 3.71Å; L314-V316 PolarHBondContact O-N 2.79Å; V316-W318 VanDerWaalsContact CG1-CD1 3.45Å; V316-W318 HydrophobicContact CG1-CG 4.4Å; V316-W318 VanDerWaalsContact CG1-NE1 3.33Å; V316-W318 PolarHBondContact O-N 3.04Å
317	Q	22.6	Very low	24.9	Very low	180 Å²	180	137.6 Å²	137.6	84%	0.841	71%	0.713	S	S	*	*			trans	-75.3	102.3	170.4	-165.6	166.8	-5.4	0	0	107.6
318	W	26.7	Very low	24.7	Very low	210 Å²	210	137.7 Å²	137.7	80%	0.795	73%	0.727	S	S	*	*			trans	-88.6	126.4	172.8	-77.2	74.5	0	0	0	109.3	V316	V316-W318 VanDerWaalsContact CG1-CD1 3.45Å; V316-W318 HydrophobicContact CG1-CG 4.4Å; V316-W318 VanDerWaalsContact CG1-NE1 3.33Å; V316-W318 PolarHBondContact O-N 3.04Å
319	P	27.5	Very low	24.8	Very low	110 Å²	110	138.2 Å²	138.2	71%	0.714	73%	0.725	S	S	*	*			trans	-79.5	134.3	157.6	15	0.4	0	0	0	108.9
320	C	28.2	Very low	24.6	Very low	109 Å²	109	135.9 Å²	135.9	74%	0.736	73%	0.725	S	S	*	*	S	Bend	trans	81.3	92.2	167.5	-54.5	0	0	0	0	117.6	L322	C320-L322 PolarHBondContact O-N 3.31Å
321	S	24.7	Very low	24.4	Very low	113 Å²	113	136 Å²	136	79%	0.79	73%	0.73	S	S	*	*			trans	45.5	73.4	130.9	60.4	0	0	0	0	118.2
322	L	25.5	Very low	24.3	Very low	177 Å²	177	138.4 Å²	138.4	93%	0.927	75%	0.746	S	S	*	*			trans	-155.2	137.8	137.6	-140.5	81.9	0	0	0	110.9	C320	C320-L322 PolarHBondContact O-N 3.31Å
323	L	24.3	Very low	24.1	Very low	168 Å²	168	142 Å²	142	88%	0.88	76%	0.757	S	S	*	*			trans	-44.2	142.5	-168.1	-150	73.9	0	0	0	118
324	M	23.2	Very low	24	Very low	163 Å²	163	140.2 Å²	140.2	80%	0.803	76%	0.763	S	S	*	*			trans	-42.6	142.4	166.1	-69.6	-130.7	-68	0	0	116.4
325	M	22.4	Very low	24	Very low	171 Å²	171	142.2 Å²	142.2	84%	0.842	77%	0.774	S	S	*	*			trans	-152.7	75.9	139.8	-129.8	178.3	-160.6	0	0	110.7
326	L	23.1	Very low	24	Very low	153 Å²	153	142 Å²	142	80%	0.801	77%	0.773	S	S	*	*			trans	-110.9	138.5	151.9	-80	167.2	0	0	0	106
327	C	23	Very low	24	Very low	117 Å²	117	145.3 Å²	145.3	79%	0.791	79%	0.787	S	S	*	*	S	Bend	trans	91.5	131.1	-178.9	-58.7	0	0	0	0	117
328	S	22	Very low	24.1	Very low	107 Å²	107	143.5 Å²	143.5	75%	0.748	78%	0.782	S	S	*	*			trans	58.2	94.6	165.4	63.8	0	0	0	0	118.3
329	V	24.7	Very low	24.3	Very low	121 Å²	121	142.6 Å²	142.6	73%	0.733	78%	0.784	S	S	*	*			trans	-130.6	90.1	143	-173.9	0	0	0	0	108.3
330	S	22.2	Very low	24.2	Very low	97 Å²	97	146.6 Å²	146.6	68%	0.678	79%	0.79	S	S	*	*			trans	-62	145.2	151.2	51.6	0	0	0	0	110
331	V	22.9	Very low	24	Very low	118 Å²	118	147.7 Å²	147.7	72%	0.715	79%	0.789	S	S	*	*			trans	77.1	142.9	160.2	-155.4	0	0	0	0	116.2
332	L	24.8	Very low	24.2	Very low	148 Å²	148	153.8 Å²	153.8	78%	0.775	79%	0.794	S	S	*	*			trans	93.1	90	169.6	-55.8	164.5	0	0	0	113.6
333	E	22.2	Very low	24.4	Very low	167 Å²	167	155.9 Å²	155.9	78%	0.78	81%	0.806	S	S	*	*				49.7	112.6	84.4	-66.7	-164.8	157.1	0	0	113.1
334	S	22.3	Very low	24.4	Very low	115 Å²	115	155.3 Å²	155.3	80%	0.804	80%	0.803	S	S	*	*			trans	50.1	93.7	144.3	-46.5	0	0	0	0	117.6
335	L	23.1	Very low	24.5	Very low	158 Å²	158	154.8 Å²	154.8	83%	0.827	80%	0.803	S	S	*	*			trans	-146.6	110.4	158.1	-103.1	157.6	0	0	0	112.7
336	Y	22.7	Very low	24.6	Very low	212 Å²	212	153.9 Å²	153.9	83%	0.831	80%	0.801	S	S	*	*			trans	-49.7	140.3	147.5	-91.2	-109.8	0	0	0	109.7
337	L	26.9	Very low	24.7	Very low	138 Å²	138	154 Å²	154	72%	0.723	80%	0.801	S	S	*	*			trans	-122	100.1	161.4	-79.9	170.5	0	0	0	110.1	F339	L337-F339 HydrophobicContact CB-CE2 4.44Å
338	I	23.3	Very low	24.8	Very low	141 Å²	141	156.3 Å²	156.3	72%	0.723	80%	0.801	S	S	*	*			trans	-68.6	127.2	157.2	-66.4	165.5	0	0	0	107
339	F	30.7	Very low	25	Very low	191 Å²	191	159.6 Å²	159.6	84%	0.838	81%	0.805	S	S	*	*			trans	-98.9	107.8	161.1	-77.7	-79.1	0	0	0	108.5	L337	L337-F339 HydrophobicContact CB-CE2 4.44Å
340	K	25.2	Very low	25	Very low	194 Å²	194	162.4 Å²	162.4	84%	0.843	81%	0.81	S	S	*	*			trans	-86.3	136.2	169.1	-167.2	-179.9	-177	-179.1	0	108.2
341	D	24.6	Very low	25.3	Very low	133 Å²	133	167.4 Å²	167.4	71%	0.711	82%	0.82	S	S	*	*			trans	-61.3	149.6	-178.2	-143.8	-22.5	0	0	0	113.5	N343	D341-N343 PolarHBondContact OD1-N 3.41Å
342	R	29.6	Very low	25.4	Very low	240 Å²	240	171.5 Å²	171.5	91%	0.906	83%	0.829	S	S	*	*			trans	-144.8	69.5	159.4	-82.5	-163.4	-176.8	-171.1	1.8	107.7
343	N	30.1	Very low	25.5	Very low	221 Å²	221	173.6 Å²	173.6	100%	1.182	83%	0.834	S	S	*	*				-168	0	104.4	-94.4	-15.1	0	0	0	110.9	D341	D341-N343 PolarHBondContact OD1-N 3.41Å

Retrieved 343 of 343 residues in 159.8 ms (Link to these results)

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