A0A087XBW8_POEFO Loading...

Copine IVb

AlphaFold DB , UniProt , Accession A0A087XBW8, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 554 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	32.9	Very low	31.5	Very low	241 Å²	241	127.6 Å²	127.6	100%	1.187	70%	0.697	S	S	*	*				0	56	0	-70.8	177.1	-173	0	0	109.2
2	S	27.6	Very low	32.3	Very low	94 Å²	94	120.3 Å²	120.3	66%	0.657	66%	0.656	S	S	*	*			trans	-138.4	3.7	-174.3	48.6	0	0	0	0	112.5
3	N	26.4	Very low	32.2	Very low	124 Å²	124	115.8 Å²	115.8	66%	0.663	65%	0.654	S	S	*	*	S	Bend	trans	-122.2	28.1	-172.6	-70.5	23	0	0	0	112.8
4	I	31.5	Very low	32.7	Very low	134 Å²	134	114.2 Å²	114.2	69%	0.687	64%	0.637	S	S	*	*	S	Bend	trans	-111.1	-23	175.3	-58.4	176	0	0	0	111.2	S7	I4-S7 PolarHBondContact O-N 3.1Å; I4-S7 PolarHBondContact O-OG 3.23Å; I4-S7 VanDerWaalsContact O-OG 3.12Å
5	Y	29.4	Very low	33	Very low	206 Å²	206	117.4 Å²	117.4	81%	0.808	65%	0.65	S	S	*	*	S	Bend	trans	-71.1	-31.8	176.7	-78.3	-80.3	0	0	0	113.1	S7	Y5-S7 VanDerWaalsContact C-N 3.34Å; Y5-S7 PolarHBondContact O-N 2.82Å
6	E	29.8	Very low	33.4	Very low	138 Å²	138	117.2 Å²	117.2	65%	0.645	66%	0.659	S	S	*	*	H	α-helix	trans	-72.7	-20.2	176.8	-81.4	177.8	149.5	0	0	114.1	A10	E6-A10 PolarHBondContact O-N 2.8Å
7	S	33.5	Very low	34.6	Very low	69 Å²	69	112.6 Å²	112.6	48%	0.483	64%	0.636	S	S	.	*	H	α-helix	trans	-80.9	-19.4	-173.2	67.2	0	0	0	0	114.7	I4 Y5 T11	I4-S7 PolarHBondContact O-N 3.1Å; I4-S7 PolarHBondContact O-OG 3.23Å; I4-S7 VanDerWaalsContact O-OG 3.12Å; Y5-S7 VanDerWaalsContact C-N 3.34Å; Y5-S7 PolarHBondContact O-N 2.82Å; S7-T11 PolarHBondContact O-OG1 3.07Å
8	A	34.1	Very low	36.8	Very low	57 Å²	57	112.7 Å²	112.7	47%	0.471	64%	0.642	S	S	.	*	H	α-helix	trans	-83.7	-41.4	177	0	0	0	0	0	111.8	A10 T11 L12	A8-A10 VanDerWaalsContact C-N 3.35Å; A8-A10 PolarHBondContact O-N 3.47Å; A8-T11 PolarHBondContact O-N 3.23Å; A8-L12 PolarHBondContact O-N 3.1Å
9	E	35.8	Very low	39	Very low	143 Å²	143	108.5 Å²	108.5	67%	0.668	62%	0.62	S	S	*	*	H	α-helix	trans	-60.8	-42.4	175.3	-76.3	-179	155.9	0	0	111.8	T11	E9-T11 VanDerWaalsContact C-N 3.34Å; E9-T11 PolarHBondContact O-N 2.95Å
10	A	30.8	Very low	41.3	Very low	86 Å²	86	106.9 Å²	106.9	71%	0.711	61%	0.609	S	S	*	*	H	α-helix	trans	-72.7	-21.8	-178.4	0	0	0	0	0	114.3	E6 A8	E6-A10 PolarHBondContact O-N 2.8Å; A8-A10 VanDerWaalsContact C-N 3.35Å; A8-A10 PolarHBondContact O-N 3.47Å
11	T	34.6	Very low	43.6	Very low	112 Å²	112	102.5 Å²	102.5	69%	0.687	59%	0.585	S	S	*	*	H	α-helix	trans	-91.3	-22.3	-176.5	-51.1	0	0	0	0	112.6	S7 A8 E9	S7-T11 PolarHBondContact O-OG1 3.07Å; A8-T11 PolarHBondContact O-N 3.23Å; E9-T11 VanDerWaalsContact C-N 3.34Å; E9-T11 PolarHBondContact O-N 2.95Å
12	L	41.3	Very low	46.3	Very low	40 Å²	40	95.5 Å²	95.5	21%	0.209	55%	0.547	C	S	.	.	H	α-helix	trans	-96.4	-3	-175.4	-72.2	163.5	0	0	0	114.7	A8 F14 F56	A8-L12 PolarHBondContact O-N 3.1Å; L12-F14 HydrophobicContact CB-CD2 3.56Å; L12-F14 HydrophobicContact CB-CE2 3.42Å; L12-F14 VanDerWaalsContact CB-CE2 3.42Å; L12-F14 HydrophobicContact CB-CZ 4.44Å; L12-F14 HydrophobicContact CD1-CE2 3.89Å; L12-F14 HydrophobicContact CG-CE2 4.17Å; L12-F14 PolarHBondContact O-N 2.89Å; L12-F14 VanDerWaalsContact O-N 3.15Å; L12-F56 HydrophobicContact CD2-CB 4.37Å; L12-F56 HydrophobicContact CD2-CD1 4.44Å; L12-F56 HydrophobicContact CD2-CD2 4.04Å; L12-F56 HydrophobicContact CD2-CE2 4.48Å; L12-F56 HydrophobicContact CD2-CG 4.02Å
13	G	31.1	Very low	49.5	Very low	61 Å²	61	91 Å²	91	63%	0.629	52%	0.516	S	S	*	.	T	Hydrogen-bonded Turn	trans	61.3	25.7	170.5	0	0	0	0	0	114.6	I15	G13-I15 PolarHBondContact O-N 3.23Å; G13-I15 VanDerWaalsContact O-N 3.08Å
14	F	39.6	Very low	52.7	Low	94 Å²	94	86.9 Å²	86.9	41%	0.412	49%	0.493	S	S	.	.			trans	-67.6	107.2	171.2	-67.7	-73.4	0	0	0	108.4	L12 S16 M49	L12-F14 HydrophobicContact CB-CD2 3.56Å; L12-F14 HydrophobicContact CB-CE2 3.42Å; L12-F14 VanDerWaalsContact CB-CE2 3.42Å; L12-F14 HydrophobicContact CB-CZ 4.44Å; L12-F14 HydrophobicContact CD1-CE2 3.89Å; L12-F14 HydrophobicContact CG-CE2 4.17Å; L12-F14 PolarHBondContact O-N 2.89Å; L12-F14 VanDerWaalsContact O-N 3.15Å; F14-S16 PolarHBondContact O-N 3.08Å; F14-M49 HydrophobicContact CZ-CE 4.18Å
15	I	36.9	Very low	55.7	Low	162 Å²	162	80.5 Å²	80.5	83%	0.831	46%	0.46	S	S	*	.			trans	-56.7	123	157.1	-63.9	172	0	0	0	105.4	G13 S17	G13-I15 PolarHBondContact O-N 3.23Å; G13-I15 VanDerWaalsContact O-N 3.08Å; I15-S17 VanDerWaalsContact C-N 3.29Å; I15-S17 PolarHBondContact O-N 3.25Å
16	S	40.1	Very low	58.9	Low	114 Å²	114	75.1 Å²	75.1	80%	0.797	44%	0.439	S	S	*	.			trans	-65.9	81.9	-169.7	65.9	0	0	0	0	112	F14	F14-S16 PolarHBondContact O-N 3.08Å
17	S	53	Low	62	Low	39 Å²	39	68.8 Å²	68.8	27%	0.273	41%	0.409	S	S	.	.	P	Polyproline II helix	trans	-84.4	132.6	156.6	-168	0	0	0	0	107.1	I15 C19 K519	I15-S17 VanDerWaalsContact C-N 3.29Å; I15-S17 PolarHBondContact O-N 3.25Å; S17-C19 PolarHBondContact O-N 3.2Å; S17-K519 WeakPolarHBondContact OG-CE 3.24Å; S17-K519 PolarHBondContact OG-NZ 3.14Å
18	P	74.1	Confident	64.9	Low	114 Å²	114	66.2 Å²	66.2	74%	0.74	39%	0.392	S	S	*	.	P	Polyproline II helix	trans	-59.4	133.4	170.6	26.2	-31.9	0	0	0	108.7
19	C	78.4	Confident	67.7	Low	34 Å²	34	63.6 Å²	63.6	23%	0.23	37%	0.37	C	S	.	.	P	Polyproline II helix	trans	-66.7	154.2	168	63.1	0	0	0	0	109.8	S17 T21 D79 Y81	S17-C19 PolarHBondContact O-N 3.2Å; C19-T21 VanDerWaalsContact C-N 3.3Å; C19-T21 PolarHBondContact O-N 3.22Å; C19-T21 PolarHBondContact SG-O 2.91Å; C19-D79 HydrophobicContact CB-CB 3.82Å; C19-Y81 HydrophobicContact CB-CD1 4.18Å; C19-Y81 HydrophobicContact CB-CD2 4.5Å; C19-Y81 HydrophobicContact CB-CE1 3.64Å; C19-Y81 HydrophobicContact CB-CE2 3.99Å
20	L	85	Confident	70.4	Confident	75 Å²	75	64.2 Å²	64.2	39%	0.393	37%	0.367	S	S	.	.	S	Bend	trans	-61.5	-44.2	175.8	-173.8	72.6	0	0	0	110.5	Y80 F82 F294 P526	L20-Y80 HydrophobicContact CB-CD1 4.13Å; L20-Y80 HydrophobicContact CD2-CD1 3.92Å; L20-Y80 HydrophobicContact CD2-CE1 3.67Å; L20-Y80 PolarHBondContact N-O 3.19Å; L20-F82 HydrophobicContact CD2-CB 4.5Å; L20-F294 HydrophobicContact CD2-CB 4.11Å; L20-F294 HydrophobicContact CD2-CD1 3.78Å; L20-F294 HydrophobicContact CD2-CG 4.3Å; L20-P526 HydrophobicContact CD1-CB 3.94Å; L20-P526 HydrophobicContact CD1-CG 4.4Å; L20-P526 HydrophobicContact CD2-CB 4Å; L20-P526 HydrophobicContact CD2-CG 4.21Å
21	T	89.8	Confident	73.1	Confident	16 Å²	16	61.9 Å²	61.9	10%	0.098	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-163.9	176.7	178.9	-169.6	0	0	0	0	110.3	C19 Y80 E146 L295	C19-T21 VanDerWaalsContact C-N 3.3Å; C19-T21 PolarHBondContact O-N 3.22Å; C19-T21 PolarHBondContact SG-O 2.91Å; T21-Y80 HydrophobicContact CG2-CD1 3.97Å; T21-Y80 HydrophobicContact CG2-CG 4.43Å; T21-Y80 PolarHBondContact O-N 3.42Å; T21-E146 VanDerWaalsContact CB-OE1 3.25Å; T21-E146 WeakPolarHBondContact CB-OE1 3.31Å; T21-E146 HydrophobicContact CG2-CG 3.83Å; T21-E146 WeakPolarHBondContact CG2-OE1 3.32Å; T21-E146 WeakPolarHBondContact OG1-CG 3.46Å; T21-E146 PolarHBondContact OG1-OE1 3.28Å; T21-L295 HydrophobicContact CG2-CD1 3.38Å; T21-L295 HydrophobicContact CG2-CG 4.09Å
22	K	90.5	Very high	75.8	Confident	93 Å²	93	57 Å²	57	40%	0.404	32%	0.321	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	144.8	170.7	-68.1	-175.9	-174.1	-76.4	0	109.9	D79 L147	K22-D79 IonicContact NZ-OD1 2.8Å; K22-D79 PolarHBondContact NZ-OD1 3.01Å; K22-D79 IonicContact NZ-OD2 3.56Å; K22-L147 HydrophobicContact CB-CB 4.16Å; K22-L147 HydrophobicContact CB-CD1 4.12Å; K22-L147 WeakPolarHBondContact O-CB 3.48Å; K22-L147 PolarHBondContact O-N 2.86Å
23	V	93.4	Very high	77.9	Confident	0 Å²	0	58.2 Å²	58.2	0%	0	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	129.7	179.2	-179.5	0	0	0	0	109.7	L25 V78 Y80 L115 V119 A144 E145 L295	V23-L25 HydrophobicContact CG1-CD2 3.68Å; V23-L25 HydrophobicContact CG1-CG 4.45Å; V23-V78 PolarHBondContact N-O 3.48Å; V23-V78 PolarHBondContact O-N 2.84Å; V23-Y80 HydrophobicContact CG2-CG 4.39Å; V23-L115 HydrophobicContact CG1-CD1 4.42Å; V23-V119 HydrophobicContact CG1-CG1 4.14Å; V23-V119 HydrophobicContact CG2-CG1 4.08Å; V23-A144 HydrophobicContact CG1-CB 3.78Å; V23-E145 WeakPolarHBondContact CA-O 3.25Å; V23-L295 HydrophobicContact CG2-CD1 3.7Å
24	E	94.8	Very high	80.2	Confident	37 Å²	37	59.4 Å²	59.4	17%	0.173	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.9	124	167.7	-63.5	-161.2	162	0	0	110	R26 I75 F76 L77 A144 E145 L147	E24-R26 IonicContact OE2-CZ 3.59Å; E24-R26 IonicContact OE2-NE 3.83Å; E24-R26 IonicContact OE2-NH2 2.64Å; E24-R26 PolarHBondContact OE2-NH2 2.93Å; E24-I75 HydrophobicContact CB-CG2 3.66Å; E24-I75 HydrophobicContact CG-CG2 3.85Å; E24-F76 WeakPolarHBondContact CA-O 3.26Å; E24-L77 HydrophobicContact CG-CD2 3.76Å; E24-A144 VanDerWaalsContact O-CA 3.29Å; E24-A144 WeakPolarHBondContact O-CA 3.3Å; E24-E145 HydrophobicContact CB-CB 4.46Å; E24-E145 PolarHBondContact N-O 2.95Å; E24-E145 PolarHBondContact O-N 3.29Å; E24-L147 HydrophobicContact CG-CD1 3.53Å; E24-L147 HydrophobicContact CG-CD2 4.38Å; E24-L147 HydrophobicContact CG-CG 3.72Å
25	L	94.8	Very high	81.7	Confident	0 Å²	0	59.2 Å²	59.2	0%	0	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	124	172	-50	177.4	0	0	0	110.2	V23 F76 V78 L88 F90 L115 I118 V142 T143 A144	V23-L25 HydrophobicContact CG1-CD2 3.68Å; V23-L25 HydrophobicContact CG1-CG 4.45Å; L25-F76 HydrophobicContact CB-CB 4.18Å; L25-F76 PolarHBondContact N-O 3.1Å; L25-F76 PolarHBondContact O-N 2.85Å; L25-V78 HydrophobicContact CD1-CG2 3.74Å; L25-V78 HydrophobicContact CG-CG2 4.33Å; L25-L88 HydrophobicContact CD1-CD1 3.98Å; L25-F90 HydrophobicContact CD1-CZ 4.21Å; L25-L115 HydrophobicContact CD1-CD1 4.23Å; L25-L115 HydrophobicContact CD2-CD1 4.06Å; L25-I118 HydrophobicContact CD1-CD1 4.37Å; L25-I118 HydrophobicContact CD2-CD1 4.48Å; L25-I118 HydrophobicContact CD2-CG2 4.06Å; L25-V142 HydrophobicContact CB-CG1 4.04Å; L25-V142 HydrophobicContact CD2-CG1 4.28Å; L25-T143 WeakPolarHBondContact CA-O 3.41Å; L25-A144 HydrophobicContact CD2-CB 3.85Å
26	R	94.9	Very high	83.4	Confident	94 Å²	94	55.9 Å²	55.9	36%	0.355	31%	0.305	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	136.9	176.3	-61.8	174.7	-176.8	-77	-9.8	109.4	E24 I75 V142 T143 E145	E24-R26 IonicContact OE2-CZ 3.59Å; E24-R26 IonicContact OE2-NE 3.83Å; E24-R26 IonicContact OE2-NH2 2.64Å; E24-R26 PolarHBondContact OE2-NH2 2.93Å; R26-I75 HydrophobicContact CG-CG1 4.47Å; R26-V142 CarbonylContact O-C 3.52Å; R26-V142 WeakPolarHBondContact O-CA 3.37Å; R26-T143 PolarHBondContact N-O 3.16Å; R26-T143 PolarHBondContact O-N 3.07Å; R26-E145 IonicContact NE-OE2 3.11Å
27	V	95.6	Very high	84.8	Confident	4 Å²	4	55.5 Å²	55.5	2%	0.024	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	140.4	-171.3	-177.2	0	0	0	0	111.8	V45 F72 F76 F90 I140 M141 V142	V27-V45 HydrophobicContact CG1-CG1 4.37Å; V27-V45 HydrophobicContact CG1-CG2 4.14Å; V27-F72 HydrophobicContact CB-CD2 4.31Å; V27-F72 HydrophobicContact CG1-CD2 4.22Å; V27-F72 HydrophobicContact CG1-CE2 4.5Å; V27-F72 WeakPolarHBondContact O-CD2 3.46Å; V27-F72 PolarHBondContact O-N 2.68Å; V27-F72 VanDerWaalsContact O-N 3.13Å; V27-F76 HydrophobicContact CG2-CD2 4.02Å; V27-F76 HydrophobicContact CG2-CE2 3.76Å; V27-F90 HydrophobicContact CG2-CD1 4.15Å; V27-F90 HydrophobicContact CG2-CE1 3.89Å; V27-I140 HydrophobicContact CG1-CD1 3.6Å; V27-I140 HydrophobicContact CG1-CG1 3.68Å; V27-M141 WeakPolarHBondContact CA-O 3.48Å; V27-V142 HydrophobicContact CG2-CG1 4.44Å; V27-V142 HydrophobicContact CG2-CG2 4.3Å
28	A	93.4	Very high	85.7	Confident	16 Å²	16	61.8 Å²	61.8	13%	0.132	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.4	148.9	167.1	0	0	0	0	0	110.2	P70 V71 I140 M141	A28-P70 CarbonylContact C-O 3.55Å; A28-P70 WeakPolarHBondContact CA-O 3.37Å; A28-V71 HydrophobicContact CB-CB 4.47Å; A28-V71 HydrophobicContact CB-CG1 4.46Å; A28-V71 HydrophobicContact CB-CG2 4.07Å; A28-I140 WeakPolarHBondContact O-CA 3.46Å; A28-M141 PolarHBondContact N-O 3.4Å; A28-M141 PolarHBondContact O-N 2.92Å
29	C	93.9	Very high	86	Confident	2 Å²	2	58.2 Å²	58.2	1%	0.014	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	156.1	174.5	-61.8	0	0	0	0	110.8	I32 S69 P70 S139	C29-I32 HydrophobicContact CB-CD1 4.06Å; C29-I32 HydrophobicContact CB-CG1 4.42Å; C29-S69 CarbonylContact O-C 3.49Å; C29-S69 VanDerWaalsContact O-C 3.23Å; C29-S69 WeakPolarHBondContact O-CA 3.42Å; C29-P70 HydrophobicContact CB-CG 3.84Å; C29-P70 PolarHBondContact N-O 2.89Å; C29-S139 CarbonylContact C-O 3.49Å; C29-S139 VanDerWaalsContact CA-O 3.23Å; C29-S139 WeakPolarHBondContact CA-O 3.37Å
30	R	92.6	Very high	86.3	Confident	155 Å²	155	61.3 Å²	61.3	59%	0.585	33%	0.326	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-141.5	155	176	-64.9	-176.3	-178.8	179.4	-1	111.3	I32 S138 S139	R30-I32 VanDerWaalsContact C-N 3.32Å; R30-I32 PolarHBondContact O-N 2.65Å; R30-S138 CarbonylContact O-C 3.56Å; R30-S138 VanDerWaalsContact O-CA 3.26Å; R30-S138 WeakPolarHBondContact O-CA 3.34Å; R30-S139 PolarHBondContact N-O 3.09Å; R30-S139 PolarHBondContact O-N 2.79Å
31	G	87.9	Confident	86.5	Confident	38 Å²	38	57.8 Å²	57.8	39%	0.392	31%	0.307	S	S	.	.			trans	67.8	30.5	172.5	0	0	0	0	0	113.8	S68 S138	G31-S68 PolarHBondContact N-O 2.93Å; G31-S138 WeakPolarHBondContact O-CA 3.24Å; G31-S138 WeakPolarHBondContact O-CB 3.19Å; G31-S138 PolarHBondContact O-OG 3.46Å
32	I	89.9	Confident	86.5	Confident	8 Å²	8	57.4 Å²	57.4	4%	0.041	30%	0.304	C	S	.	.	P	Polyproline II helix	trans	-70.2	134.6	173.3	-48.6	171	0	0	0	108.2	C29 R30 P41 P43 S68 P70 L92 L108 S138	C29-I32 HydrophobicContact CB-CD1 4.06Å; C29-I32 HydrophobicContact CB-CG1 4.42Å; R30-I32 VanDerWaalsContact C-N 3.32Å; R30-I32 PolarHBondContact O-N 2.65Å; I32-P41 HydrophobicContact CB-CG 4.22Å; I32-P41 HydrophobicContact CG2-CB 4.31Å; I32-P41 HydrophobicContact CG2-CG 3.66Å; I32-P43 HydrophobicContact CD1-CB 3.93Å; I32-P43 HydrophobicContact CD1-CG 4.13Å; I32-S68 PolarHBondContact N-O 3.36Å; I32-S68 VanDerWaalsContact N-O 3.08Å; I32-S68 WeakPolarHBondContact O-CB 3.37Å; I32-P70 VanDerWaalsContact CD1-CD 3.46Å; I32-P70 HydrophobicContact CD1-CG 3.9Å; I32-L92 HydrophobicContact CD1-CD2 3.75Å; I32-L92 HydrophobicContact CG1-CD2 3.92Å; I32-L108 HydrophobicContact CG2-CD1 3.69Å; I32-S138 WeakPolarHBondContact CA-OG 3.35Å
33	S	85.1	Confident	86.6	Confident	67 Å²	67	53 Å²	53	47%	0.469	29%	0.285	S	S	.	.	P	Polyproline II helix	trans	-72	143.2	178.1	-56.8	0	0	0	0	110.7
34	D	79.7	Confident	86.7	Confident	86 Å²	86	53 Å²	53	46%	0.46	29%	0.285	S	S	.	.	P	Polyproline II helix	trans	-64.9	151.5	172.6	-63.5	-28	0	0	0	110.3	D36	D34-D36 WeakPolarHBondContact CB-O 3.4Å
35	R	70.9	Confident	86.7	Confident	90 Å²	90	51.2 Å²	51.2	34%	0.34	28%	0.277	S	S	.	.	S	Bend	trans	-67.1	-43.8	177	-68.4	174.9	177.3	156.4	-0.5	110.1	S39 D42 D94	R35-S39 WeakPolarHBondContact CB-OG 3.47Å; R35-S39 PolarHBondContact N-O 3.01Å; R35-D42 IonicContact CZ-OD2 2.98Å; R35-D42 VanDerWaalsContact CZ-OD2 3.31Å; R35-D42 IonicContact NH1-OD2 2.66Å; R35-D42 PolarHBondContact NH1-OD2 3.13Å; R35-D42 VanDerWaalsContact NH2-CG 3.3Å; R35-D42 IonicContact NH2-OD2 2.86Å; R35-D42 PolarHBondContact NH2-OD2 3.28Å; R35-D94 WeakPolarHBondContact CG-OD2 3.34Å; R35-D94 IonicContact CZ-OD1 2.62Å; R35-D94 IonicContact CZ-OD2 3.5Å; R35-D94 IonicContact NE-OD1 2.71Å; R35-D94 PolarHBondContact NE-OD1 2.88Å; R35-D94 IonicContact NE-OD2 3.38Å; R35-D94 PolarHBondContact NE-OD2 3.49Å; R35-D94 VanDerWaalsContact NH2-CG 3.34Å; R35-D94 IonicContact NH2-OD1 3.41Å; R35-D94 PolarHBondContact NH2-OD1 2.96Å; R35-D94 IonicContact NH2-OD2 2.71Å; R35-D94 PolarHBondContact NH2-OD2 2.95Å
36	D	73.9	Confident	86.8	Confident	92 Å²	92	51.3 Å²	51.3	49%	0.492	28%	0.278	S	S	.	.	B	Isolated β-bridge	trans	-152.2	-175.7	172	63.5	22.1	0	0	0	110.4	D34 L38 S39	D34-D36 WeakPolarHBondContact CB-O 3.4Å; D36-L38 PolarHBondContact O-N 2.92Å; D36-L38 PolarHBondContact OD1-N 3.06Å; D36-S39 PolarHBondContact O-N 2.61Å; D36-S39 WeakPolarHBondContact OD1-CB 3.41Å; D36-S39 PolarHBondContact OD1-N 2.9Å; D36-S39 PolarHBondContact OD1-OG 3.48Å; D36-S39 PolarHBondContact OD2-OG 3.43Å
37	A	68.3	Low	87	Confident	105 Å²	105	46.9 Å²	46.9	87%	0.868	26%	0.261	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.5	-12.3	-177	0	0	0	0	0	115
38	L	72.3	Confident	87.1	Confident	172 Å²	172	48.9 Å²	48.9	90%	0.901	27%	0.269	S	S	*	.	T	Hydrogen-bonded Turn	trans	-127.2	-10.5	-173.2	-67	170.5	0	0	0	113.8	D36	D36-L38 PolarHBondContact O-N 2.92Å; D36-L38 PolarHBondContact OD1-N 3.06Å
39	S	80.8	Confident	87.2	Confident	38 Å²	38	49.6 Å²	49.6	27%	0.266	27%	0.27	S	S	.	.	B	Isolated β-bridge	trans	-127.4	126.5	-175	66.4	0	0	0	0	112.9	R35 D36	R35-S39 WeakPolarHBondContact CB-OG 3.47Å; R35-S39 PolarHBondContact N-O 3.01Å; D36-S39 PolarHBondContact O-N 2.61Å; D36-S39 WeakPolarHBondContact OD1-CB 3.41Å; D36-S39 PolarHBondContact OD1-N 2.9Å; D36-S39 PolarHBondContact OD1-OG 3.48Å; D36-S39 PolarHBondContact OD2-OG 3.43Å
40	K	84.9	Confident	87.2	Confident	100 Å²	100	52.2 Å²	52.2	44%	0.435	28%	0.282	S	S	.	.			trans	-87.2	154.9	175.4	-69.7	-177.1	178.6	-178.3	0	110.5	S66	K40-S66 VanDerWaalsContact CB-C 3.49Å; K40-S66 WeakPolarHBondContact CD-O 3.39Å
41	P	88.9	Confident	87	Confident	1 Å²	1	45.7 Å²	45.7	1%	0.006	26%	0.261	C	S	.	.			trans	-69.7	160.2	176	29.9	-34.7	0	0	0	111.4	I32 P43 S66 S67 D94 L108	I32-P41 HydrophobicContact CB-CG 4.22Å; I32-P41 HydrophobicContact CG2-CB 4.31Å; I32-P41 HydrophobicContact CG2-CG 3.66Å; P41-P43 WeakPolarHBondContact O-CD 3.31Å; P41-S66 CarbonylContact O-C 3.54Å; P41-S66 VanDerWaalsContact O-CA 3.22Å; P41-S66 WeakPolarHBondContact O-CA 3.31Å; P41-S66 PolarHBondContact O-N 2.93Å; P41-S66 VanDerWaalsContact O-N 3.16Å; P41-S67 PolarHBondContact O-N 2.74Å; P41-D94 WeakPolarHBondContact CB-OD2 3.14Å; P41-L108 HydrophobicContact CB-CD1 4.44Å
42	D	90.9	Very high	86.7	Confident	7 Å²	7	52.2 Å²	52.2	4%	0.037	28%	0.281	C	S	.	.			trans	-111.4	73.8	172.4	-58	-47.3	0	0	0	108.7	R35 V63 I64 R65 S66 D94 I95	R35-D42 IonicContact CZ-OD2 2.98Å; R35-D42 VanDerWaalsContact CZ-OD2 3.31Å; R35-D42 IonicContact NH1-OD2 2.66Å; R35-D42 PolarHBondContact NH1-OD2 3.13Å; R35-D42 VanDerWaalsContact NH2-CG 3.3Å; R35-D42 IonicContact NH2-OD2 2.86Å; R35-D42 PolarHBondContact NH2-OD2 3.28Å; D42-V63 HydrophobicContact CB-CG1 3.81Å; D42-I64 CarbonylContact C-O 3.54Å; D42-I64 WeakPolarHBondContact CA-O 3.44Å; D42-R65 VanDerWaalsContact OD1-CA 3.24Å; D42-R65 WeakPolarHBondContact OD1-CA 3.42Å; D42-S66 PolarHBondContact OD1-N 3.26Å; D42-D94 PolarHBondContact N-OD1 2.82Å; D42-I95 WeakPolarHBondContact CB-O 3.38Å; D42-I95 PolarHBondContact O-N 2.94Å
43	P	92.3	Very high	86.4	Confident	0 Å²	0	54.6 Å²	54.6	0%	0	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.2	144.8	-170.6	25.4	-38.7	0	0	0	114.7	I32 P41 V63 I64 S67 P70 F72 L92 H93	I32-P43 HydrophobicContact CD1-CB 3.93Å; I32-P43 HydrophobicContact CD1-CG 4.13Å; P41-P43 WeakPolarHBondContact O-CD 3.31Å; P43-V63 WeakPolarHBondContact O-CA 3.22Å; P43-I64 WeakPolarHBondContact CD-O 3.31Å; P43-I64 HydrophobicContact CG-CB 4.4Å; P43-I64 PolarHBondContact O-N 2.95Å; P43-S67 WeakPolarHBondContact CD-O 3.23Å; P43-S67 WeakPolarHBondContact CG-O 3.3Å; P43-P70 HydrophobicContact CB-CB 4.5Å; P43-P70 HydrophobicContact CB-CG 3.91Å; P43-P70 HydrophobicContact CG-CB 3.72Å; P43-P70 HydrophobicContact CG-CG 3.5Å; P43-P70 VanDerWaalsContact CG-CG 3.5Å; P43-F72 HydrophobicContact CB-CZ 4.25Å; P43-L92 HydrophobicContact CB-CD1 3.81Å; P43-H93 CarbonylContact C-O 3.59Å; P43-H93 WeakPolarHBondContact CA-O 3.28Å
44	C	94.1	Very high	86.7	Confident	1 Å²	1	57.4 Å²	57.4	1%	0.007	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.5	138.2	169.4	176.4	0	0	0	0	109.2	T61 V63 H93 I95	C44-T61 PolarHBondContact SG-O 3.19Å; C44-T61 VanDerWaalsContact SG-O 3.33Å; C44-V63 HydrophobicContact CB-CG2 4.11Å; C44-H93 PolarHBondContact N-O 2.79Å; C44-H93 PolarHBondContact O-N 3.19Å; C44-I95 HydrophobicContact CB-CD1 3.49Å; C44-I95 VanDerWaalsContact CB-CD1 3.49Å; C44-I95 HydrophobicContact CB-CG1 3.89Å
45	V	96.3	Very high	87.4	Confident	0 Å²	0	57 Å²	57	0%	0	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	129.8	175	175	0	0	0	0	109.9	V27 R60 T61 F72 F90 E91 L92 I140	V27-V45 HydrophobicContact CG1-CG1 4.37Å; V27-V45 HydrophobicContact CG1-CG2 4.14Å; V45-R60 CarbonylContact O-C 3.58Å; V45-R60 VanDerWaalsContact O-CA 3.3Å; V45-R60 WeakPolarHBondContact O-CA 3.48Å; V45-T61 HydrophobicContact CB-CG2 3.87Å; V45-T61 PolarHBondContact N-OG1 3.09Å; V45-T61 PolarHBondContact O-N 3.28Å; V45-F72 HydrophobicContact CB-CE2 4.47Å; V45-F72 HydrophobicContact CG2-CD2 4.35Å; V45-F72 HydrophobicContact CG2-CE2 3.61Å; V45-F72 HydrophobicContact CG2-CZ 3.87Å; V45-F90 HydrophobicContact CG1-CB 4.22Å; V45-F90 HydrophobicContact CG1-CD1 4.08Å; V45-E91 CarbonylContact C-O 3.59Å; V45-E91 WeakPolarHBondContact CA-O 3.28Å; V45-L92 HydrophobicContact CG2-CD1 3.7Å; V45-I140 HydrophobicContact CG1-CD1 4.28Å; V45-I140 HydrophobicContact CG2-CD1 4.38Å
46	V	97.1	Very high	88.6	Confident	2 Å²	2	56.3 Å²	56.3	1%	0.012	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	123.1	172.1	-178.5	0	0	0	0	108.4	K48 E57 R60 E91 L102	V46-K48 HydrophobicContact CG1-CG 4.27Å; V46-E57 HydrophobicContact CG1-CG 3.69Å; V46-R60 HydrophobicContact CG2-CB 4.23Å; V46-E91 HydrophobicContact CB-CB 4.45Å; V46-E91 PolarHBondContact N-O 3.4Å; V46-E91 PolarHBondContact O-N 2.62Å; V46-L102 HydrophobicContact CG2-CD1 3.82Å; V46-L102 HydrophobicContact CG2-CD2 3.76Å; V46-L102 HydrophobicContact CG2-CG 4.47Å
47	L	98.1	Very high	89.6	Confident	0 Å²	0	56.1 Å²	56.1	0%	0	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.7	127.8	172.4	176.6	60.4	0	0	0	109.2	V58 D59 F76 V78 L88 F90	L47-V58 HydrophobicContact CB-CB 4.49Å; L47-V58 HydrophobicContact CD2-CB 4.22Å; L47-V58 HydrophobicContact CD2-CG1 4.25Å; L47-V58 HydrophobicContact CG-CB 4.11Å; L47-V58 HydrophobicContact CG-CG2 4.33Å; L47-V58 PolarHBondContact O-N 2.67Å; L47-D59 PolarHBondContact N-O 3.29Å; L47-F76 HydrophobicContact CB-CD1 4.04Å; L47-F76 HydrophobicContact CB-CE1 3.88Å; L47-F76 HydrophobicContact CB-CE2 4.4Å; L47-F76 HydrophobicContact CB-CG 4.36Å; L47-F76 HydrophobicContact CB-CZ 4.05Å; L47-F76 HydrophobicContact CD2-CB 3.71Å; L47-F76 HydrophobicContact CD2-CD1 3.91Å; L47-F76 HydrophobicContact CD2-CD2 4.24Å; L47-F76 HydrophobicContact CD2-CG 3.7Å; L47-V78 HydrophobicContact CD2-CG2 4.16Å; L47-L88 HydrophobicContact CD1-CB 4.22Å; L47-L88 HydrophobicContact CD1-CD2 4.29Å; L47-F90 HydrophobicContact CD1-CD1 4.01Å; L47-F90 HydrophobicContact CD1-CD2 4.26Å; L47-F90 HydrophobicContact CD1-CE1 3.7Å; L47-F90 HydrophobicContact CD1-CE2 3.97Å; L47-F90 HydrophobicContact CD1-CG 4.28Å; L47-F90 HydrophobicContact CD1-CZ 3.68Å
48	K	97.7	Very high	90.8	Very high	47 Å²	47	54.1 Å²	54.1	20%	0.204	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	148.7	170.8	-59.2	-178.3	179.6	169.4	0	110.6	V46 W55 F56 L88 R89 E91	V46-K48 HydrophobicContact CG1-CG 4.27Å; K48-W55 HydrophobicContact CB-CB 4.46Å; K48-W55 HydrophobicContact CB-CE3 4.05Å; K48-W55 HydrophobicContact CD-CB 4.3Å; K48-F56 CarbonylContact C-O 3.51Å; K48-F56 WeakPolarHBondContact CA-O 3.44Å; K48-F56 WeakPolarHBondContact CB-O 3.42Å; K48-L88 CarbonylContact O-C 3.53Å; K48-L88 WeakPolarHBondContact O-CA 3.21Å; K48-R89 HydrophobicContact CB-CB 4.29Å; K48-R89 PolarHBondContact N-O 2.95Å; K48-R89 PolarHBondContact O-N 2.94Å; K48-E91 VanDerWaalsContact CE-OE2 3.26Å; K48-E91 WeakPolarHBondContact CE-OE2 3.27Å; K48-E91 IonicContact NZ-OE1 2.8Å; K48-E91 PolarHBondContact NZ-OE1 3.07Å; K48-E91 IonicContact NZ-OE2 3.69Å; K48-E91 PolarHBondContact NZ-OE2 2.77Å
49	M	96.4	Very high	91.9	Very high	30 Å²	30	48.9 Å²	48.9	15%	0.148	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	140.6	174.1	-175.4	167	68	0	0	109.6	F14 F56 V58 R87 L88	F14-M49 HydrophobicContact CZ-CE 4.18Å; M49-F56 PolarHBondContact N-O 2.95Å; M49-F56 PolarHBondContact O-N 3.1Å; M49-V58 HydrophobicContact CB-CG2 3.57Å; M49-R87 WeakPolarHBondContact CA-O 3.15Å; M49-L88 HydrophobicContact CB-CD2 4.06Å; M49-L88 HydrophobicContact CG-CD2 4.01Å; M49-L88 HydrophobicContact SD-CD2 4.27Å
50	Q	93.8	Very high	92.5	Very high	58 Å²	58	52 Å²	52	27%	0.271	26%	0.256	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.3	130.5	178.4	-158.8	176.9	24.4	0	0	110.5	G53 Q54 W55 R87	Q50-G53 PolarHBondContact NE2-O 2.68Å; Q50-Q54 CarbonylContact C-O 3.58Å; Q50-Q54 VanDerWaalsContact CA-O 3.28Å; Q50-Q54 WeakPolarHBondContact CA-O 3.41Å; Q50-Q54 WeakPolarHBondContact CG-O 3.22Å; Q50-W55 HydrophobicContact CB-CD2 4.16Å; Q50-W55 HydrophobicContact CB-CE3 3.85Å; Q50-W55 HydrophobicContact CB-CH2 4.07Å; Q50-W55 HydrophobicContact CB-CZ2 4.37Å; Q50-W55 HydrophobicContact CB-CZ3 3.8Å; Q50-W55 HydrophobicContact CG-CD2 4.35Å; Q50-R87 HydrophobicContact CB-CB 3.93Å; Q50-R87 PolarHBondContact N-O 2.61Å
51	S	87	Confident	93	Very high	18 Å²	18	47.6 Å²	47.6	13%	0.126	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.5	134.4	170.2	178.5	0	0	0	0	108.9	G53 Q54 F56	S51-G53 PolarHBondContact O-N 2.79Å; S51-Q54 PolarHBondContact N-O 2.95Å; S51-Q54 PolarHBondContact O-N 2.84Å; S51-Q54 VanDerWaalsContact O-O 3.09Å; S51-F56 WeakPolarHBondContact O-CE2 3.21Å
52	H	82.2	Confident	93.1	Very high	175 Å²	175	50.4 Å²	50.4	81%	0.81	25%	0.251	S	S	*	.	T	Hydrogen-bonded Turn	trans	49.2	37.6	-178.8	-58.3	85.3	0	0	0	114.1	Q54	H52-Q54 PolarHBondContact O-N 3.28Å
53	G	84.5	Confident	93	Very high	57 Å²	57	53 Å²	53	59%	0.588	27%	0.266	S	S	*	.	T	Hydrogen-bonded Turn	trans	78.6	-5	-178.8	0	0	0	0	0	115.5	Q50 S51	Q50-G53 PolarHBondContact NE2-O 2.68Å; S51-G53 PolarHBondContact O-N 2.79Å
54	Q	91.7	Very high	92.7	Very high	127 Å²	127	55.1 Å²	55.1	59%	0.593	28%	0.277	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-107.3	147.1	-179.8	-64	-173	-12	0	0	111.8	Q50 S51 H52 F56	Q50-Q54 CarbonylContact C-O 3.58Å; Q50-Q54 VanDerWaalsContact CA-O 3.28Å; Q50-Q54 WeakPolarHBondContact CA-O 3.41Å; Q50-Q54 WeakPolarHBondContact CG-O 3.22Å; S51-Q54 PolarHBondContact N-O 2.95Å; S51-Q54 PolarHBondContact O-N 2.84Å; S51-Q54 VanDerWaalsContact O-O 3.09Å; H52-Q54 PolarHBondContact O-N 3.28Å; Q54-F56 HydrophobicContact CB-CE2 3.71Å; Q54-F56 HydrophobicContact CB-CZ 3.91Å; Q54-F56 WeakPolarHBondContact O-CD2 3.12Å
55	W	94.4	Very high	92.4	Very high	77 Å²	77	65.1 Å²	65.1	29%	0.292	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.8	124.8	177.3	-69.1	103.8	0	0	0	110.8	K48 Q50 R87 R89 E112	K48-W55 HydrophobicContact CB-CB 4.46Å; K48-W55 HydrophobicContact CB-CE3 4.05Å; K48-W55 HydrophobicContact CD-CB 4.3Å; Q50-W55 HydrophobicContact CB-CD2 4.16Å; Q50-W55 HydrophobicContact CB-CE3 3.85Å; Q50-W55 HydrophobicContact CB-CH2 4.07Å; Q50-W55 HydrophobicContact CB-CZ2 4.37Å; Q50-W55 HydrophobicContact CB-CZ3 3.8Å; Q50-W55 HydrophobicContact CG-CD2 4.35Å; W55-R87 HydrophobicContact CH2-CB 4.1Å; W55-R87 HydrophobicContact CZ3-CB 4.48Å; W55-R87 WeakPolarHBondContact CZ3-O 3.35Å; W55-R89 HydrophobicContact CD2-CB 4.25Å; W55-R89 HydrophobicContact CE3-CB 3.72Å; W55-R89 HydrophobicContact CH2-CB 3.62Å; W55-R89 HydrophobicContact CZ2-CB 4.15Å; W55-R89 HydrophobicContact CZ3-CB 3.39Å; W55-E112 HydrophobicContact CH2-CG 4.49Å; W55-E112 HydrophobicContact CZ2-CG 4.4Å
56	F	95	Very high	92	Very high	75 Å²	75	68.7 Å²	68.7	33%	0.329	34%	0.34	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	135	176.6	-62.7	-86.8	0	0	0	109.9	L12 K48 M49 S51 Q54 V58	L12-F56 HydrophobicContact CD2-CB 4.37Å; L12-F56 HydrophobicContact CD2-CD1 4.44Å; L12-F56 HydrophobicContact CD2-CD2 4.04Å; L12-F56 HydrophobicContact CD2-CE2 4.48Å; L12-F56 HydrophobicContact CD2-CG 4.02Å; K48-F56 CarbonylContact C-O 3.51Å; K48-F56 WeakPolarHBondContact CA-O 3.44Å; K48-F56 WeakPolarHBondContact CB-O 3.42Å; M49-F56 PolarHBondContact N-O 2.95Å; M49-F56 PolarHBondContact O-N 3.1Å; S51-F56 WeakPolarHBondContact O-CE2 3.21Å; Q54-F56 HydrophobicContact CB-CE2 3.71Å; Q54-F56 HydrophobicContact CB-CZ 3.91Å; Q54-F56 WeakPolarHBondContact O-CD2 3.12Å; F56-V58 PolarHBondContact O-N 2.91Å
57	E	95.1	Very high	91.5	Very high	88 Å²	88	69.8 Å²	69.8	41%	0.411	35%	0.348	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.7	125.3	170.9	-176.7	177	152.7	0	0	109.5	V46 R60	V46-E57 HydrophobicContact CG1-CG 3.69Å; E57-R60 VanDerWaalsContact CD-NH2 3.32Å; E57-R60 IonicContact OE1-CZ 3.24Å; E57-R60 IonicContact OE1-NE 3.63Å; E57-R60 PolarHBondContact OE1-NE 2.93Å; E57-R60 IonicContact OE1-NH2 2.84Å; E57-R60 PolarHBondContact OE1-NH2 2.99Å; E57-R60 IonicContact OE2-NH2 3.43Å; E57-R60 PolarHBondContact OE2-NH2 3.42Å
58	V	94.1	Very high	91.1	Very high	64 Å²	64	71.5 Å²	71.5	39%	0.388	36%	0.36	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.9	-55.8	174.7	178.4	0	0	0	0	108.9	L47 M49 F56	L47-V58 HydrophobicContact CB-CB 4.49Å; L47-V58 HydrophobicContact CD2-CB 4.22Å; L47-V58 HydrophobicContact CD2-CG1 4.25Å; L47-V58 HydrophobicContact CG-CB 4.11Å; L47-V58 HydrophobicContact CG-CG2 4.33Å; L47-V58 PolarHBondContact O-N 2.67Å; M49-V58 HydrophobicContact CB-CG2 3.57Å; F56-V58 PolarHBondContact O-N 2.91Å
59	D	94.5	Very high	90.6	Very high	61 Å²	61	72 Å²	72	33%	0.326	37%	0.369	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-167.5	179.8	-179.2	-151.6	-26.8	0	0	0	110.2	L47 K74 F76	L47-D59 PolarHBondContact N-O 3.29Å; D59-K74 VanDerWaalsContact CG-CE 3.44Å; D59-K74 IonicContact OD1-NZ 2.6Å; D59-K74 WeakPolarHBondContact OD2-CE 3.34Å; D59-K74 IonicContact OD2-NZ 3.41Å; D59-K74 PolarHBondContact OD2-NZ 2.64Å; D59-F76 HydrophobicContact CB-CD1 3.85Å; D59-F76 HydrophobicContact CB-CE1 3.9Å
60	R	94.6	Very high	90.3	Very high	104 Å²	104	70.6 Å²	70.6	39%	0.392	36%	0.362	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.8	155.6	176.9	66.5	-173.4	71.2	171.6	1.1	112.8	V45 V46 E57 L102	V45-R60 CarbonylContact O-C 3.58Å; V45-R60 VanDerWaalsContact O-CA 3.3Å; V45-R60 WeakPolarHBondContact O-CA 3.48Å; V46-R60 HydrophobicContact CG2-CB 4.23Å; E57-R60 VanDerWaalsContact CD-NH2 3.32Å; E57-R60 IonicContact OE1-CZ 3.24Å; E57-R60 IonicContact OE1-NE 3.63Å; E57-R60 PolarHBondContact OE1-NE 2.93Å; E57-R60 IonicContact OE1-NH2 2.84Å; E57-R60 PolarHBondContact OE1-NH2 2.99Å; E57-R60 IonicContact OE2-NH2 3.43Å; E57-R60 PolarHBondContact OE2-NH2 3.42Å; R60-L102 VanDerWaalsContact NH2-CD1 3.33Å
61	T	93.7	Very high	90.2	Very high	8 Å²	8	73.1 Å²	73.1	5%	0.049	38%	0.381	C	S	.	.	P	Polyproline II helix	trans	-76	168.6	172.5	69.9	0	0	0	0	112	C44 V45 F72 K74 F76	C44-T61 PolarHBondContact SG-O 3.19Å; C44-T61 VanDerWaalsContact SG-O 3.33Å; V45-T61 HydrophobicContact CB-CG2 3.87Å; V45-T61 PolarHBondContact N-OG1 3.09Å; V45-T61 PolarHBondContact O-N 3.28Å; T61-F72 HydrophobicContact CG2-CB 3.86Å; T61-F72 HydrophobicContact CG2-CD1 3.95Å; T61-F72 HydrophobicContact CG2-CD2 4.24Å; T61-F72 HydrophobicContact CG2-CG 3.76Å; T61-F72 VanDerWaalsContact OG1-CD1 3.24Å; T61-F72 WeakPolarHBondContact OG1-CD1 3.32Å; T61-F72 VanDerWaalsContact OG1-CE1 3.31Å; T61-F72 WeakPolarHBondContact OG1-CE1 3.42Å; T61-K74 HydrophobicContact CG2-CB 4.08Å; T61-K74 HydrophobicContact CG2-CG 4.4Å; T61-F76 HydrophobicContact CG2-CE2 3.9Å; T61-F76 HydrophobicContact CG2-CZ 3.56Å
62	E	90.8	Very high	90.4	Very high	60 Å²	60	72.8 Å²	72.8	28%	0.28	38%	0.378	S	S	.	.	P	Polyproline II helix	trans	-61.3	162.2	158.8	75.7	-81	-157.5	0	0	111.9	I64 S73 K74	E62-I64 HydrophobicContact CG-CD1 3.79Å; E62-S73 WeakPolarHBondContact OE1-CB 3.1Å; E62-S73 PolarHBondContact OE1-N 3.32Å; E62-S73 PolarHBondContact OE1-OG 3.04Å; E62-K74 WeakPolarHBondContact OE2-CB 3.21Å; E62-K74 PolarHBondContact OE2-N 2.86Å
63	V	90.6	Very high	90.7	Very high	60 Å²	60	68.9 Å²	68.9	36%	0.364	37%	0.37	S	S	.	.	P	Polyproline II helix	trans	-89.1	121.1	172.2	-178	0	0	0	0	109.1	D42 P43 C44 I95	D42-V63 HydrophobicContact CB-CG1 3.81Å; P43-V63 WeakPolarHBondContact O-CA 3.22Å; C44-V63 HydrophobicContact CB-CG2 4.11Å; V63-I95 HydrophobicContact CG1-CB 4.33Å; V63-I95 HydrophobicContact CG2-CB 4.07Å; V63-I95 HydrophobicContact CG2-CD1 3.84Å; V63-I95 HydrophobicContact CG2-CG1 4.3Å; V63-I95 HydrophobicContact CG2-CG2 4.37Å
64	I	85.7	Confident	91	Very high	46 Å²	46	69.2 Å²	69.2	24%	0.236	36%	0.355	C	S	.	.	P	Polyproline II helix	trans	-92.9	116.6	173.6	-57.6	-60.5	0	0	0	108.5	D42 P43 E62 P70 F72	D42-I64 CarbonylContact C-O 3.54Å; D42-I64 WeakPolarHBondContact CA-O 3.44Å; P43-I64 WeakPolarHBondContact CD-O 3.31Å; P43-I64 HydrophobicContact CG-CB 4.4Å; P43-I64 PolarHBondContact O-N 2.95Å; E62-I64 HydrophobicContact CG-CD1 3.79Å; I64-P70 HydrophobicContact CB-CB 3.97Å; I64-P70 HydrophobicContact CG1-CB 3.96Å; I64-P70 HydrophobicContact CG2-CB 4.2Å; I64-F72 HydrophobicContact CG1-CD1 3.77Å; I64-F72 HydrophobicContact CG1-CE1 3.76Å
65	R	87.6	Confident	90.9	Very high	210 Å²	210	65.6 Å²	65.6	79%	0.792	34%	0.339	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.9	137.4	-176.9	-67.2	-174.3	-179.6	175.1	0	112.4	D42 S67	D42-R65 VanDerWaalsContact OD1-CA 3.24Å; D42-R65 WeakPolarHBondContact OD1-CA 3.42Å; R65-S67 PolarHBondContact O-N 3Å
66	S	86.9	Confident	90.9	Very high	75 Å²	75	61.9 Å²	61.9	52%	0.524	33%	0.325	S	S	.	.	T	Hydrogen-bonded Turn	trans	51.8	50.9	168.6	-58.4	0	0	0	0	113.9	K40 P41 D42	K40-S66 VanDerWaalsContact CB-C 3.49Å; K40-S66 WeakPolarHBondContact CD-O 3.39Å; P41-S66 CarbonylContact O-C 3.54Å; P41-S66 VanDerWaalsContact O-CA 3.22Å; P41-S66 WeakPolarHBondContact O-CA 3.31Å; P41-S66 PolarHBondContact O-N 2.93Å; P41-S66 VanDerWaalsContact O-N 3.16Å; D42-S66 PolarHBondContact OD1-N 3.26Å
67	S	87.1	Confident	90.8	Very high	25 Å²	25	63.1 Å²	63.1	18%	0.175	34%	0.335	C	S	.	.			trans	-132.9	126.9	-176	-175.9	0	0	0	0	113	P41 P43 R65 S69	P41-S67 PolarHBondContact O-N 2.74Å; P43-S67 WeakPolarHBondContact CD-O 3.23Å; P43-S67 WeakPolarHBondContact CG-O 3.3Å; R65-S67 PolarHBondContact O-N 3Å; S67-S69 PolarHBondContact OG-N 2.99Å
68	S	89	Confident	90.8	Very high	36 Å²	36	59.4 Å²	59.4	25%	0.252	32%	0.318	S	S	.	.	S	Bend	trans	-92	-1	172.9	56.7	0	0	0	0	113.6	G31 I32	G31-S68 PolarHBondContact N-O 2.93Å; I32-S68 PolarHBondContact N-O 3.36Å; I32-S68 VanDerWaalsContact N-O 3.08Å; I32-S68 WeakPolarHBondContact O-CB 3.37Å
69	S	88.5	Confident	90.8	Very high	58 Å²	58	58.7 Å²	58.7	41%	0.406	31%	0.312	S	S	.	.	S	Bend	trans	-148.4	63.8	178.7	-63.9	0	0	0	0	111.2	C29 S67	C29-S69 CarbonylContact O-C 3.49Å; C29-S69 VanDerWaalsContact O-C 3.23Å; C29-S69 WeakPolarHBondContact O-CA 3.42Å; S67-S69 PolarHBondContact OG-N 2.99Å
70	P	90.3	Very high	90.8	Very high	1 Å²	1	55.8 Å²	55.8	1%	0.006	30%	0.297	C	S	.	.			trans	-68.7	143.9	-176.4	33	-39.9	0	0	0	111.6	A28 C29 I32 P43 I64 F72	A28-P70 CarbonylContact C-O 3.55Å; A28-P70 WeakPolarHBondContact CA-O 3.37Å; C29-P70 HydrophobicContact CB-CG 3.84Å; C29-P70 PolarHBondContact N-O 2.89Å; I32-P70 VanDerWaalsContact CD1-CD 3.46Å; I32-P70 HydrophobicContact CD1-CG 3.9Å; P43-P70 HydrophobicContact CB-CB 4.5Å; P43-P70 HydrophobicContact CB-CG 3.91Å; P43-P70 HydrophobicContact CG-CB 3.72Å; P43-P70 HydrophobicContact CG-CG 3.5Å; P43-P70 VanDerWaalsContact CG-CG 3.5Å; I64-P70 HydrophobicContact CB-CB 3.97Å; I64-P70 HydrophobicContact CG1-CB 3.96Å; I64-P70 HydrophobicContact CG2-CB 4.2Å; P70-F72 HydrophobicContact CB-CE1 4.07Å; P70-F72 HydrophobicContact CB-CE2 3.95Å; P70-F72 HydrophobicContact CB-CZ 3.66Å; P70-F72 HydrophobicContact CG-CE1 4.42Å; P70-F72 HydrophobicContact CG-CE2 3.72Å; P70-F72 HydrophobicContact CG-CZ 3.55Å
71	V	91.7	Very high	90.7	Very high	110 Å²	110	51.9 Å²	51.9	67%	0.667	28%	0.282	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-117.3	122.3	164.1	-179.5	0	0	0	0	105.8	A28	A28-V71 HydrophobicContact CB-CB 4.47Å; A28-V71 HydrophobicContact CB-CG1 4.46Å; A28-V71 HydrophobicContact CB-CG2 4.07Å
72	F	91.2	Very high	90.7	Very high	12 Å²	12	51.5 Å²	51.5	5%	0.053	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.2	142.5	-173.9	-57.7	-82.8	0	0	0	110.7	V27 P43 V45 T61 I64 P70	V27-F72 HydrophobicContact CB-CD2 4.31Å; V27-F72 HydrophobicContact CG1-CD2 4.22Å; V27-F72 HydrophobicContact CG1-CE2 4.5Å; V27-F72 WeakPolarHBondContact O-CD2 3.46Å; V27-F72 PolarHBondContact O-N 2.68Å; V27-F72 VanDerWaalsContact O-N 3.13Å; P43-F72 HydrophobicContact CB-CZ 4.25Å; V45-F72 HydrophobicContact CB-CE2 4.47Å; V45-F72 HydrophobicContact CG2-CD2 4.35Å; V45-F72 HydrophobicContact CG2-CE2 3.61Å; V45-F72 HydrophobicContact CG2-CZ 3.87Å; T61-F72 HydrophobicContact CG2-CB 3.86Å; T61-F72 HydrophobicContact CG2-CD1 3.95Å; T61-F72 HydrophobicContact CG2-CD2 4.24Å; T61-F72 HydrophobicContact CG2-CG 3.76Å; T61-F72 VanDerWaalsContact OG1-CD1 3.24Å; T61-F72 WeakPolarHBondContact OG1-CD1 3.32Å; T61-F72 VanDerWaalsContact OG1-CE1 3.31Å; T61-F72 WeakPolarHBondContact OG1-CE1 3.42Å; I64-F72 HydrophobicContact CG1-CD1 3.77Å; I64-F72 HydrophobicContact CG1-CE1 3.76Å; P70-F72 HydrophobicContact CB-CE1 4.07Å; P70-F72 HydrophobicContact CB-CE2 3.95Å; P70-F72 HydrophobicContact CB-CZ 3.66Å; P70-F72 HydrophobicContact CG-CE1 4.42Å; P70-F72 HydrophobicContact CG-CE2 3.72Å; P70-F72 HydrophobicContact CG-CZ 3.55Å
73	S	87.1	Confident	90.7	Very high	92 Å²	92	49.7 Å²	49.7	64%	0.643	27%	0.271	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-85	-24.3	174.9	62.6	0	0	0	0	112.5	E62 I75	E62-S73 WeakPolarHBondContact OE1-CB 3.1Å; E62-S73 PolarHBondContact OE1-N 3.32Å; E62-S73 PolarHBondContact OE1-OG 3.04Å; S73-I75 PolarHBondContact O-N 2.82Å
74	K	90.7	Very high	90.7	Very high	65 Å²	65	49.5 Å²	49.5	28%	0.283	27%	0.266	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-57.6	130.3	173.1	179.3	67.1	174.3	179.6	0	111.1	D59 T61 E62 F76	D59-K74 VanDerWaalsContact CG-CE 3.44Å; D59-K74 IonicContact OD1-NZ 2.6Å; D59-K74 WeakPolarHBondContact OD2-CE 3.34Å; D59-K74 IonicContact OD2-NZ 3.41Å; D59-K74 PolarHBondContact OD2-NZ 2.64Å; T61-K74 HydrophobicContact CG2-CB 4.08Å; T61-K74 HydrophobicContact CG2-CG 4.4Å; E62-K74 WeakPolarHBondContact OE2-CB 3.21Å; E62-K74 PolarHBondContact OE2-N 2.86Å; K74-F76 HydrophobicContact CG-CD1 4.43Å; K74-F76 HydrophobicContact CG-CE1 4.14Å; K74-F76 HydrophobicContact CG-CZ 4.39Å
75	I	90.7	Very high	91	Very high	50 Å²	50	49.5 Å²	49.5	26%	0.256	27%	0.269	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	129.9	169	-57.6	163.5	0	0	0	107.3	E24 R26 S73 L77	E24-I75 HydrophobicContact CB-CG2 3.66Å; E24-I75 HydrophobicContact CG-CG2 3.85Å; R26-I75 HydrophobicContact CG-CG1 4.47Å; S73-I75 PolarHBondContact O-N 2.82Å; I75-L77 HydrophobicContact CG2-CD2 4.1Å
76	F	94.5	Very high	91.3	Very high	0 Å²	0	40.2 Å²	40.2	0%	0	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.7	127.8	167.6	-57.1	-70.3	0	0	0	108.9	E24 L25 V27 L47 D59 T61 K74	E24-F76 WeakPolarHBondContact CA-O 3.26Å; L25-F76 HydrophobicContact CB-CB 4.18Å; L25-F76 PolarHBondContact N-O 3.1Å; L25-F76 PolarHBondContact O-N 2.85Å; V27-F76 HydrophobicContact CG2-CD2 4.02Å; V27-F76 HydrophobicContact CG2-CE2 3.76Å; L47-F76 HydrophobicContact CB-CD1 4.04Å; L47-F76 HydrophobicContact CB-CE1 3.88Å; L47-F76 HydrophobicContact CB-CE2 4.4Å; L47-F76 HydrophobicContact CB-CG 4.36Å; L47-F76 HydrophobicContact CB-CZ 4.05Å; L47-F76 HydrophobicContact CD2-CB 3.71Å; L47-F76 HydrophobicContact CD2-CD1 3.91Å; L47-F76 HydrophobicContact CD2-CD2 4.24Å; L47-F76 HydrophobicContact CD2-CG 3.7Å; D59-F76 HydrophobicContact CB-CD1 3.85Å; D59-F76 HydrophobicContact CB-CE1 3.9Å; T61-F76 HydrophobicContact CG2-CE2 3.9Å; T61-F76 HydrophobicContact CG2-CZ 3.56Å; K74-F76 HydrophobicContact CG-CD1 4.43Å; K74-F76 HydrophobicContact CG-CE1 4.14Å; K74-F76 HydrophobicContact CG-CZ 4.39Å
77	L	93	Very high	91.8	Very high	100 Å²	100	42.1 Å²	42.1	52%	0.524	23%	0.23	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-99	121.8	173.1	-63.3	-177.6	0	0	0	108.5	E24 I75 L147	E24-L77 HydrophobicContact CG-CD2 3.76Å; I75-L77 HydrophobicContact CG2-CD2 4.1Å; L77-L147 HydrophobicContact CD2-CD1 3.43Å; L77-L147 VanDerWaalsContact CD2-CD1 3.43Å
78	V	94.6	Very high	92.3	Very high	10 Å²	10	40.9 Å²	40.9	6%	0.061	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	130.8	-179.4	-169.6	0	0	0	0	108.9	V23 L25 L47 L115	V23-V78 PolarHBondContact N-O 3.48Å; V23-V78 PolarHBondContact O-N 2.84Å; L25-V78 HydrophobicContact CD1-CG2 3.74Å; L25-V78 HydrophobicContact CG-CG2 4.33Å; L47-V78 HydrophobicContact CD2-CG2 4.16Å; V78-L115 HydrophobicContact CB-CD2 4.31Å; V78-L115 HydrophobicContact CG1-CD2 3.8Å
79	D	94	Very high	92.7	Very high	50 Å²	50	42.1 Å²	42.1	27%	0.267	22%	0.22	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-68	135.2	172.2	-67.2	-10.3	0	0	0	109.1	C19 K22 Y81 Q86	C19-D79 HydrophobicContact CB-CB 3.82Å; K22-D79 IonicContact NZ-OD1 2.8Å; K22-D79 PolarHBondContact NZ-OD1 3.01Å; K22-D79 IonicContact NZ-OD2 3.56Å; D79-Y81 HydrophobicContact CB-CD2 4.42Å; D79-Y81 HydrophobicContact CB-CE2 3.6Å; D79-Q86 PolarHBondContact O-NE2 2.93Å
80	Y	93.9	Very high	93.1	Very high	0 Å²	0	39.4 Å²	39.4	0%	0	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	126	179.9	174.9	-104.3	0	0	0	111	L20 T21 V23 F82 L115 V119 F294 L295 Y350	L20-Y80 HydrophobicContact CB-CD1 4.13Å; L20-Y80 HydrophobicContact CD2-CD1 3.92Å; L20-Y80 HydrophobicContact CD2-CE1 3.67Å; L20-Y80 PolarHBondContact N-O 3.19Å; T21-Y80 HydrophobicContact CG2-CD1 3.97Å; T21-Y80 HydrophobicContact CG2-CG 4.43Å; T21-Y80 PolarHBondContact O-N 3.42Å; V23-Y80 HydrophobicContact CG2-CG 4.39Å; Y80-F82 HydrophobicContact CE1-CB 4.13Å; Y80-L115 HydrophobicContact CD2-CD2 3.84Å; Y80-L115 HydrophobicContact CD2-CG 4.08Å; Y80-V119 HydrophobicContact CE2-CG2 3.92Å; Y80-F294 HydrophobicContact CE1-CD1 4.28Å; Y80-F294 HydrophobicContact CE1-CE1 4.38Å; Y80-L295 HydrophobicContact CD1-CD1 3.82Å; Y80-L295 HydrophobicContact CD1-CD2 4.13Å; Y80-L295 HydrophobicContact CD1-CG 4.04Å; Y80-L295 HydrophobicContact CE1-CD1 4.12Å; Y80-L295 HydrophobicContact CE1-CD2 3.56Å; Y80-L295 HydrophobicContact CE1-CG 3.87Å; Y80-L295 HydrophobicContact CE2-CD2 4.32Å; Y80-L295 HydrophobicContact CG-CD1 4.11Å; Y80-Y350 WeakPolarHBondContact CE2-OH 3.5Å; Y80-Y350 WeakPolarHBondContact OH-CE1 3.2Å; Y80-Y350 PolarHBondContact OH-OH 2.75Å
81	Y	93.4	Very high	93.4	Very high	22 Å²	22	40 Å²	40	9%	0.086	20%	0.204	C	C	.	.			trans	-122.2	111.7	174.7	-58.7	-89.4	0	0	0	106.6	C19 D79 E83 E84 Q86	C19-Y81 HydrophobicContact CB-CD1 4.18Å; C19-Y81 HydrophobicContact CB-CD2 4.5Å; C19-Y81 HydrophobicContact CB-CE1 3.64Å; C19-Y81 HydrophobicContact CB-CE2 3.99Å; D79-Y81 HydrophobicContact CB-CD2 4.42Å; D79-Y81 HydrophobicContact CB-CE2 3.6Å; Y81-E83 PolarHBondContact O-N 2.83Å; Y81-E84 PolarHBondContact O-N 3.43Å; Y81-Q86 PolarHBondContact O-OE1 2.64Å
82	F	93	Very high	93.5	Very high	0 Å²	0	34.7 Å²	34.7	0%	0	17%	0.172	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.9	-37.1	-179.7	166.6	-109.8	0	0	0	110.7	L20 Y80 E84 F294 I346 Y350 L522 V525 P526	L20-F82 HydrophobicContact CD2-CB 4.5Å; Y80-F82 HydrophobicContact CE1-CB 4.13Å; F82-E84 VanDerWaalsContact C-N 3.27Å; F82-E84 PolarHBondContact O-N 2.91Å; F82-F294 HydrophobicContact CB-CE1 4.36Å; F82-F294 AromaticContact CD2-CE1 3.51Å; F82-F294 HydrophobicContact CD2-CE1 3.51Å; F82-F294 AromaticContact CD2-CZ 3.57Å; F82-F294 HydrophobicContact CD2-CZ 3.57Å; F82-F294 HydrophobicContact CE2-CE1 4.07Å; F82-F294 AromaticContact CE2-CZ 3.63Å; F82-F294 HydrophobicContact CE2-CZ 3.63Å; F82-F294 HydrophobicContact CG-CE1 4.09Å; F82-F294 HydrophobicContact CG-CZ 4.29Å; F82-F294 HydrophobicContact CZ-CZ 4.38Å; F82-I346 WeakPolarHBondContact O-CG2 3.15Å; F82-Y350 HydrophobicContact CD2-CD2 4.45Å; F82-Y350 HydrophobicContact CD2-CE1 4.35Å; F82-Y350 AromaticContact CD2-CE2 3.85Å; F82-Y350 HydrophobicContact CD2-CE2 3.85Å; F82-Y350 AromaticContact CD2-CZ 3.8Å; F82-Y350 AromaticContact CE2-CD2 3.88Å; F82-Y350 HydrophobicContact CE2-CD2 3.88Å; F82-Y350 AromaticContact CE2-CE2 3.7Å; F82-Y350 HydrophobicContact CE2-CE2 3.7Å; F82-Y350 HydrophobicContact CE2-CG 4.36Å; F82-L522 HydrophobicContact CD1-CB 4.12Å; F82-L522 HydrophobicContact CE1-CB 3.82Å; F82-L522 HydrophobicContact CE1-CD1 4.3Å; F82-L522 HydrophobicContact CE1-CD2 4.03Å; F82-L522 HydrophobicContact CE1-CG 4.27Å; F82-L522 HydrophobicContact CZ-CD2 4.46Å; F82-V525 HydrophobicContact CD1-CB 4.46Å; F82-V525 HydrophobicContact CE1-CB 3.7Å; F82-V525 HydrophobicContact CE1-CG1 3.71Å; F82-V525 HydrophobicContact CE1-CG2 4.37Å; F82-V525 HydrophobicContact CZ-CB 4.33Å; F82-V525 HydrophobicContact CZ-CG1 3.82Å; F82-P526 HydrophobicContact CB-CG 3.84Å; F82-P526 HydrophobicContact CD1-CG 3.62Å; F82-P526 HydrophobicContact CE1-CG 4.4Å; F82-P526 HydrophobicContact CG-CG 3.83Å
83	E	91.4	Very high	93.6	Very high	21 Å²	21	35.1 Å²	35.1	10%	0.098	17%	0.174	C	C	.	.	T	Hydrogen-bonded Turn	trans	-84.8	11.6	-173	75.8	-73.8	-175.2	0	0	114.6	Y81 I346 K519 L522	Y81-E83 PolarHBondContact O-N 2.83Å; E83-I346 WeakPolarHBondContact O-CD1 3.5Å; E83-K519 HydrophobicContact CG-CB 3.84Å; E83-K519 HydrophobicContact CG-CD 4.34Å; E83-K519 HydrophobicContact CG-CG 3.79Å; E83-K519 IonicContact OE1-NZ 2.73Å; E83-L522 HydrophobicContact CB-CB 3.91Å
84	E	90.9	Very high	93.8	Very high	56 Å²	56	30.9 Å²	30.9	26%	0.262	14%	0.144	S	C	.	.	S	Bend	trans	-129.3	141	178.6	-62.3	-169.9	-177.5	0	0	113.2	Y81 F82 Q86	Y81-E84 PolarHBondContact O-N 3.43Å; F82-E84 VanDerWaalsContact C-N 3.27Å; F82-E84 PolarHBondContact O-N 2.91Å; E84-Q86 VanDerWaalsContact C-N 3.34Å; E84-Q86 HydrophobicContact CB-CG 4Å; E84-Q86 PolarHBondContact O-N 3.41Å
85	V	91.6	Very high	93.6	Very high	47 Å²	47	29.1 Å²	29.1	29%	0.285	14%	0.138	S	C	.	.			trans	-79.8	84.7	168.4	-171.6	0	0	0	0	109.5	R87 T114 E345 I346	V85-R87 HydrophobicContact CG1-CG 4.05Å; V85-R87 PolarHBondContact O-N 3.37Å; V85-R87 VanDerWaalsContact O-N 3.1Å; V85-T114 HydrophobicContact CG1-CG2 3.75Å; V85-E345 HydrophobicContact CG2-CB 4.13Å; V85-I346 HydrophobicContact CG2-CG1 3.47Å; V85-I346 VanDerWaalsContact CG2-CG1 3.47Å
86	Q	94.1	Very high	92.9	Very high	15 Å²	15	28.1 Å²	28.1	7%	0.07	14%	0.135	C	C	.	.			trans	-80.2	92.5	-178.9	-60.3	-179.1	-97	0	0	111.4	D79 Y81 E84 T114 L115	D79-Q86 PolarHBondContact O-NE2 2.93Å; Y81-Q86 PolarHBondContact O-OE1 2.64Å; E84-Q86 VanDerWaalsContact C-N 3.34Å; E84-Q86 HydrophobicContact CB-CG 4Å; E84-Q86 PolarHBondContact O-N 3.41Å; Q86-T114 CarbonylContact O-C 3.44Å; Q86-T114 VanDerWaalsContact O-CA 3.27Å; Q86-T114 WeakPolarHBondContact O-CA 3.45Å; Q86-L115 HydrophobicContact CB-CB 3.97Å; Q86-L115 PolarHBondContact O-N 3.46Å
87	R	96.3	Very high	91.4	Very high	114 Å²	114	33.7 Å²	33.7	43%	0.43	17%	0.174	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.8	125.8	-177.1	-66.3	175	177.1	-132.1	2.9	111.8	M49 Q50 W55 V85 T114	M49-R87 WeakPolarHBondContact CA-O 3.15Å; Q50-R87 HydrophobicContact CB-CB 3.93Å; Q50-R87 PolarHBondContact N-O 2.61Å; W55-R87 HydrophobicContact CH2-CB 4.1Å; W55-R87 HydrophobicContact CZ3-CB 4.48Å; W55-R87 WeakPolarHBondContact CZ3-O 3.35Å; V85-R87 HydrophobicContact CG1-CG 4.05Å; V85-R87 PolarHBondContact O-N 3.37Å; V85-R87 VanDerWaalsContact O-N 3.1Å; R87-T114 HydrophobicContact CG-CG2 4.32Å
88	L	97.7	Very high	89.8	Confident	0 Å²	0	32.3 Å²	32.3	0%	0	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	143.9	-179.2	-58.1	-179.3	0	0	0	111	L25 L47 K48 M49 F90 E112 C113 L115 I118	L25-L88 HydrophobicContact CD1-CD1 3.98Å; L47-L88 HydrophobicContact CD1-CB 4.22Å; L47-L88 HydrophobicContact CD1-CD2 4.29Å; K48-L88 CarbonylContact O-C 3.53Å; K48-L88 WeakPolarHBondContact O-CA 3.21Å; M49-L88 HydrophobicContact CB-CD2 4.06Å; M49-L88 HydrophobicContact CG-CD2 4.01Å; M49-L88 HydrophobicContact SD-CD2 4.27Å; L88-F90 HydrophobicContact CB-CE2 3.93Å; L88-F90 HydrophobicContact CD1-CE2 4.33Å; L88-F90 HydrophobicContact CD1-CZ 4.39Å; L88-E112 WeakPolarHBondContact O-CA 3.49Å; L88-C113 PolarHBondContact N-O 2.73Å; L88-C113 PolarHBondContact O-N 3.44Å; L88-L115 HydrophobicContact CD1-CB 4.1Å; L88-L115 HydrophobicContact CD1-CD1 4.17Å; L88-I118 HydrophobicContact CD1-CD1 3.87Å
89	R	97.4	Very high	88	Confident	62 Å²	62	33.8 Å²	33.8	23%	0.234	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.3	119.5	175	177.2	176.7	171	135.9	-4.6	109.9	K48 W55 E91 A110 M111 E112	K48-R89 HydrophobicContact CB-CB 4.29Å; K48-R89 PolarHBondContact N-O 2.95Å; K48-R89 PolarHBondContact O-N 2.94Å; W55-R89 HydrophobicContact CD2-CB 4.25Å; W55-R89 HydrophobicContact CE3-CB 3.72Å; W55-R89 HydrophobicContact CH2-CB 3.62Å; W55-R89 HydrophobicContact CZ2-CB 4.15Å; W55-R89 HydrophobicContact CZ3-CB 3.39Å; R89-E91 HydrophobicContact CG-CG 4.09Å; R89-E91 IonicContact CZ-OE1 3.92Å; R89-E91 IonicContact NE-OE1 2.87Å; R89-E91 PolarHBondContact NE-OE1 2.84Å; R89-E91 IonicContact NH2-OE1 3.17Å; R89-E91 PolarHBondContact NH2-OE1 3.33Å; R89-A110 HydrophobicContact CG-CB 4.47Å; R89-M111 CarbonylContact C-O 3.57Å; R89-M111 WeakPolarHBondContact CA-O 3.46Å; R89-E112 HydrophobicContact CB-CG 3.99Å; R89-E112 WeakPolarHBondContact CD-OE1 3.37Å; R89-E112 HydrophobicContact CG-CG 3.85Å; R89-E112 IonicContact CZ-OE1 3.75Å; R89-E112 IonicContact NE-OE1 2.75Å; R89-E112 IonicContact NH1-OE1 3.31Å; R89-E112 PolarHBondContact NH1-OE1 3.49Å
90	F	97.6	Very high	86.2	Confident	0 Å²	0	38.7 Å²	38.7	0%	0	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.6	114.8	177	-62.8	-102.2	0	0	0	108.4	L25 V27 V45 L47 L88 A110 M111 I118 I140 V142	L25-F90 HydrophobicContact CD1-CZ 4.21Å; V27-F90 HydrophobicContact CG2-CD1 4.15Å; V27-F90 HydrophobicContact CG2-CE1 3.89Å; V45-F90 HydrophobicContact CG1-CB 4.22Å; V45-F90 HydrophobicContact CG1-CD1 4.08Å; L47-F90 HydrophobicContact CD1-CD1 4.01Å; L47-F90 HydrophobicContact CD1-CD2 4.26Å; L47-F90 HydrophobicContact CD1-CE1 3.7Å; L47-F90 HydrophobicContact CD1-CE2 3.97Å; L47-F90 HydrophobicContact CD1-CG 4.28Å; L47-F90 HydrophobicContact CD1-CZ 3.68Å; L88-F90 HydrophobicContact CB-CE2 3.93Å; L88-F90 HydrophobicContact CD1-CE2 4.33Å; L88-F90 HydrophobicContact CD1-CZ 4.39Å; F90-A110 CarbonylContact O-C 3.59Å; F90-A110 WeakPolarHBondContact O-CA 3.43Å; F90-A110 WeakPolarHBondContact O-CB 3.05Å; F90-M111 HydrophobicContact CB-CE 4.29Å; F90-M111 HydrophobicContact CD2-CE 3.21Å; F90-M111 HydrophobicContact CE2-CE 3.62Å; F90-M111 HydrophobicContact CG-CE 3.87Å; F90-M111 PolarHBondContact N-O 2.83Å; F90-M111 PolarHBondContact O-N 3.46Å; F90-I118 HydrophobicContact CE2-CD1 4.15Å; F90-I118 HydrophobicContact CZ-CD1 4.16Å; F90-I140 HydrophobicContact CB-CD1 3.61Å; F90-I140 HydrophobicContact CD1-CD1 4.19Å; F90-I140 HydrophobicContact CG-CD1 4.1Å; F90-V142 HydrophobicContact CD1-CG2 4.3Å; F90-V142 HydrophobicContact CE1-CG1 4.28Å; F90-V142 HydrophobicContact CE1-CG2 3.93Å; F90-V142 HydrophobicContact CE2-CG2 4.24Å; F90-V142 HydrophobicContact CZ-CG1 4.02Å; F90-V142 HydrophobicContact CZ-CG2 3.9Å
91	E	96.1	Very high	84.8	Confident	13 Å²	13	40.1 Å²	40.1	6%	0.061	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105	124.1	177.7	-59.4	-175.5	167.7	0	0	110.1	V45 V46 K48 R89 H93 F107 A110	V45-E91 CarbonylContact C-O 3.59Å; V45-E91 WeakPolarHBondContact CA-O 3.28Å; V46-E91 HydrophobicContact CB-CB 4.45Å; V46-E91 PolarHBondContact N-O 3.4Å; V46-E91 PolarHBondContact O-N 2.62Å; K48-E91 VanDerWaalsContact CE-OE2 3.26Å; K48-E91 WeakPolarHBondContact CE-OE2 3.27Å; K48-E91 IonicContact NZ-OE1 2.8Å; K48-E91 PolarHBondContact NZ-OE1 3.07Å; K48-E91 IonicContact NZ-OE2 3.69Å; K48-E91 PolarHBondContact NZ-OE2 2.77Å; R89-E91 HydrophobicContact CG-CG 4.09Å; R89-E91 IonicContact CZ-OE1 3.92Å; R89-E91 IonicContact NE-OE1 2.87Å; R89-E91 PolarHBondContact NE-OE1 2.84Å; R89-E91 IonicContact NH2-OE1 3.17Å; R89-E91 PolarHBondContact NH2-OE1 3.33Å; E91-H93 VanDerWaalsContact CB-NE2 3.33Å; E91-H93 WeakPolarHBondContact CB-NE2 3.35Å; E91-H93 PolarHBondContact O-CD2 3.27Å; E91-H93 IonicContact OE2-CE1 2.68Å; E91-H93 IonicContact OE2-NE2 3.18Å; E91-H93 PolarHBondContact OE2-NE2 2.82Å; E91-H93 VanDerWaalsContact OE2-NE2 3.11Å; E91-F107 HydrophobicContact CB-CE2 4.13Å; E91-F107 HydrophobicContact CG-CE2 4.23Å; E91-A110 HydrophobicContact CG-CB 4.11Å
92	L	94.9	Very high	83.6	Confident	0 Å²	0	41 Å²	41	0%	0	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.9	124.2	173.7	-177.1	67.9	0	0	0	109.4	I32 P43 V45 L108 G109 L128	I32-L92 HydrophobicContact CD1-CD2 3.75Å; I32-L92 HydrophobicContact CG1-CD2 3.92Å; P43-L92 HydrophobicContact CB-CD1 3.81Å; V45-L92 HydrophobicContact CG2-CD1 3.7Å; L92-L108 HydrophobicContact CB-CB 4.35Å; L92-L108 HydrophobicContact CD2-CB 4.01Å; L92-L108 HydrophobicContact CD2-CD1 4.09Å; L92-L108 HydrophobicContact CG-CB 4.02Å; L92-L108 HydrophobicContact CG-CD1 4.06Å; L92-L108 WeakPolarHBondContact O-CB 3.48Å; L92-L108 PolarHBondContact O-N 2.92Å; L92-G109 PolarHBondContact N-O 2.91Å; L92-G109 PolarHBondContact O-N 2.94Å; L92-L128 HydrophobicContact CB-CD1 3.93Å; L92-L128 HydrophobicContact CD2-CD1 3.44Å; L92-L128 VanDerWaalsContact CD2-CD1 3.44Å; L92-L128 HydrophobicContact CG-CD1 4.32Å
93	H	92.9	Very high	82.3	Confident	20 Å²	20	52.4 Å²	52.4	9%	0.093	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123	149.6	-179.5	-66.7	-88.6	0	0	0	111.1	P43 C44 E91 L102 A105 D106 F107	P43-H93 CarbonylContact C-O 3.59Å; P43-H93 WeakPolarHBondContact CA-O 3.28Å; C44-H93 PolarHBondContact N-O 2.79Å; C44-H93 PolarHBondContact O-N 3.19Å; E91-H93 VanDerWaalsContact CB-NE2 3.33Å; E91-H93 WeakPolarHBondContact CB-NE2 3.35Å; E91-H93 PolarHBondContact O-CD2 3.27Å; E91-H93 IonicContact OE2-CE1 2.68Å; E91-H93 IonicContact OE2-NE2 3.18Å; E91-H93 PolarHBondContact OE2-NE2 2.82Å; E91-H93 VanDerWaalsContact OE2-NE2 3.11Å; H93-L102 HydrophobicContact CB-CD2 4.11Å; H93-A105 HydrophobicContact CB-CB 4.14Å; H93-D106 CarbonylContact C-O 3.48Å; H93-D106 WeakPolarHBondContact CA-O 3.16Å; H93-F107 AromaticContact CE1-CD2 3.8Å
94	D	91.3	Very high	81.4	Confident	4 Å²	4	55.5 Å²	55.5	2%	0.021	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.4	110.6	172.6	-163.6	1	0	0	0	110.6	R35 P41 D42 S96 A105 D106 L108	R35-D94 WeakPolarHBondContact CG-OD2 3.34Å; R35-D94 IonicContact CZ-OD1 2.62Å; R35-D94 IonicContact CZ-OD2 3.5Å; R35-D94 IonicContact NE-OD1 2.71Å; R35-D94 PolarHBondContact NE-OD1 2.88Å; R35-D94 IonicContact NE-OD2 3.38Å; R35-D94 PolarHBondContact NE-OD2 3.49Å; R35-D94 VanDerWaalsContact NH2-CG 3.34Å; R35-D94 IonicContact NH2-OD1 3.41Å; R35-D94 PolarHBondContact NH2-OD1 2.96Å; R35-D94 IonicContact NH2-OD2 2.71Å; R35-D94 PolarHBondContact NH2-OD2 2.95Å; P41-D94 WeakPolarHBondContact CB-OD2 3.14Å; D42-D94 PolarHBondContact N-OD1 2.82Å; D94-S96 PolarHBondContact O-N 3.47Å; D94-A105 WeakPolarHBondContact O-CA 3.19Å; D94-A105 WeakPolarHBondContact O-CB 3.4Å; D94-D106 HydrophobicContact CB-CB 4.08Å; D94-D106 PolarHBondContact N-O 3.28Å; D94-D106 PolarHBondContact O-N 3.45Å; D94-D106 VanDerWaalsContact O-N 3.12Å; D94-L108 HydrophobicContact CB-CD1 3.84Å; D94-L108 HydrophobicContact CB-CD2 4.08Å; D94-L108 HydrophobicContact CB-CG 3.97Å
95	I	86.1	Confident	81	Confident	28 Å²	28	53.7 Å²	53.7	14%	0.144	29%	0.293	C	S	.	.			trans	-101.3	81.2	-175.1	-51.1	-167	0	0	0	109.3	D42 C44 V63 L102 A105	D42-I95 WeakPolarHBondContact CB-O 3.38Å; D42-I95 PolarHBondContact O-N 2.94Å; C44-I95 HydrophobicContact CB-CD1 3.49Å; C44-I95 VanDerWaalsContact CB-CD1 3.49Å; C44-I95 HydrophobicContact CB-CG1 3.89Å; V63-I95 HydrophobicContact CG1-CB 4.33Å; V63-I95 HydrophobicContact CG2-CB 4.07Å; V63-I95 HydrophobicContact CG2-CD1 3.84Å; V63-I95 HydrophobicContact CG2-CG1 4.3Å; V63-I95 HydrophobicContact CG2-CG2 4.37Å; I95-L102 HydrophobicContact CD1-CD2 4.13Å; I95-L102 HydrophobicContact CD1-CG 4.32Å; I95-A105 HydrophobicContact CG1-CB 4.11Å
96	S	75.8	Confident	80.8	Confident	29 Å²	29	55.9 Å²	55.9	20%	0.203	30%	0.303	C	S	.	.			trans	-64	150.2	179.4	85.5	0	0	0	0	112.9	D94 G98 N99	D94-S96 PolarHBondContact O-N 3.47Å; S96-G98 PolarHBondContact O-N 2.9Å; S96-N99 WeakPolarHBondContact O-CB 3.44Å; S96-N99 PolarHBondContact O-N 3.34Å; S96-N99 PolarHBondContact OG-ND2 2.9Å; S96-N99 PolarHBondContact OG-OD1 3.23Å
97	S	62.5	Low	80.6	Confident	117 Å²	117	58.1 Å²	58.1	82%	0.818	31%	0.313	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.3	-18.5	-179.9	-42.2	0	0	0	0	114.9
98	G	59.8	Low	80.4	Confident	70 Å²	70	54.2 Å²	54.2	72%	0.722	30%	0.3	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.9	-8.9	177.6	0	0	0	0	0	114.6	S96	S96-G98 PolarHBondContact O-N 2.9Å
99	N	58	Low	80.1	Confident	42 Å²	42	54.2 Å²	54.2	23%	0.225	30%	0.3	C	S	.	.	S	Bend	trans	-92.3	135.9	-173.6	-68.9	-14.6	0	0	0	111.3	S96 G101 D104	S96-N99 WeakPolarHBondContact O-CB 3.44Å; S96-N99 PolarHBondContact O-N 3.34Å; S96-N99 PolarHBondContact OG-ND2 2.9Å; S96-N99 PolarHBondContact OG-OD1 3.23Å; N99-G101 PolarHBondContact O-N 2.81Å; N99-D104 HydrophobicContact CB-CB 3.88Å; N99-D104 PolarHBondContact ND2-O 2.98Å
100	N	56.2	Low	80	Confident	153 Å²	153	51.6 Å²	51.6	82%	0.818	29%	0.292	S	S	*	.	S	Bend	trans	-78.4	46.5	176.5	-77.9	-33.9	0	0	0	111.9
101	G	64.3	Low	79.9	Confident	30 Å²	30	51.8 Å²	51.8	31%	0.309	29%	0.293	S	S	.	.	S	Bend	trans	90.1	-160.1	-175.9	0	0	0	0	0	114.1	N99 R103 D104	N99-G101 PolarHBondContact O-N 2.81Å; G101-R103 PolarHBondContact O-N 2.78Å; G101-D104 PolarHBondContact O-N 2.86Å
102	L	67.4	Low	79.9	Confident	39 Å²	39	55.8 Å²	55.8	20%	0.204	31%	0.311	C	S	.	.	G	3₁₀ helix	trans	-58.9	-19.4	-172.5	-85.7	170.1	0	0	0	115.7	V46 R60 H93 I95 D104 A105	V46-L102 HydrophobicContact CG2-CD1 3.82Å; V46-L102 HydrophobicContact CG2-CD2 3.76Å; V46-L102 HydrophobicContact CG2-CG 4.47Å; R60-L102 VanDerWaalsContact NH2-CD1 3.33Å; H93-L102 HydrophobicContact CB-CD2 4.11Å; I95-L102 HydrophobicContact CD1-CD2 4.13Å; I95-L102 HydrophobicContact CD1-CG 4.32Å; L102-D104 PolarHBondContact O-N 2.87Å; L102-A105 HydrophobicContact CD2-CB 4.4Å; L102-A105 PolarHBondContact O-N 2.86Å
103	R	66.7	Low	79.9	Confident	241 Å²	241	56.2 Å²	56.2	91%	0.909	32%	0.315	S	S	*	.	G	3₁₀ helix	trans	-65.6	-29.9	-177.2	-75.3	-175.1	172.8	-177.9	-1.6	113.1	G101	G101-R103 PolarHBondContact O-N 2.78Å
104	D	70.8	Confident	80.1	Confident	86 Å²	86	55.9 Å²	55.9	46%	0.46	31%	0.314	S	S	.	.	G	3₁₀ helix	trans	-113.1	10.3	-178.4	-52.5	-43.8	0	0	0	111.7	N99 G101 L102	N99-D104 HydrophobicContact CB-CB 3.88Å; N99-D104 PolarHBondContact ND2-O 2.98Å; G101-D104 PolarHBondContact O-N 2.86Å; L102-D104 PolarHBondContact O-N 2.87Å
105	A	83.1	Confident	80.3	Confident	18 Å²	18	55.7 Å²	55.7	15%	0.149	31%	0.313	C	S	.	.	P	Polyproline II helix	trans	-75.3	143.2	-177.2	0	0	0	0	0	112.2	H93 D94 I95 L102	H93-A105 HydrophobicContact CB-CB 4.14Å; D94-A105 WeakPolarHBondContact O-CA 3.19Å; D94-A105 WeakPolarHBondContact O-CB 3.4Å; I95-A105 HydrophobicContact CG1-CB 4.11Å; L102-A105 HydrophobicContact CD2-CB 4.4Å; L102-A105 PolarHBondContact O-N 2.86Å
106	D	88.1	Confident	80.7	Confident	92 Å²	92	54.6 Å²	54.6	49%	0.492	31%	0.309	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81	125.3	178	-62.5	-49	0	0	0	110.3	H93 D94 L108	H93-D106 CarbonylContact C-O 3.48Å; H93-D106 WeakPolarHBondContact CA-O 3.16Å; D94-D106 HydrophobicContact CB-CB 4.08Å; D94-D106 PolarHBondContact N-O 3.28Å; D94-D106 PolarHBondContact O-N 3.45Å; D94-D106 VanDerWaalsContact O-N 3.12Å; D106-L108 PolarHBondContact O-N 2.95Å
107	F	90.7	Very high	81.6	Confident	62 Å²	62	55 Å²	55	27%	0.272	31%	0.307	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.5	118	176.9	177	-104	0	0	0	110.9	E91 H93 G109 A110 Q131	E91-F107 HydrophobicContact CB-CE2 4.13Å; E91-F107 HydrophobicContact CG-CE2 4.23Å; H93-F107 AromaticContact CE1-CD2 3.8Å; F107-G109 WeakPolarHBondContact CE2-O 3.39Å; F107-G109 VanDerWaalsContact CZ-CA 3.48Å; F107-A110 HydrophobicContact CE2-CB 3.98Å; F107-A110 HydrophobicContact CZ-CB 3.71Å; F107-Q131 HydrophobicContact CD1-CG 4.33Å; F107-Q131 HydrophobicContact CE1-CG 4.35Å
108	L	90.5	Very high	83.1	Confident	32 Å²	32	49.5 Å²	49.5	17%	0.168	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.8	-25.6	-177.4	-60.6	-179	0	0	0	113	I32 P41 L92 D94 D106	I32-L108 HydrophobicContact CG2-CD1 3.69Å; P41-L108 HydrophobicContact CB-CD1 4.44Å; L92-L108 HydrophobicContact CB-CB 4.35Å; L92-L108 HydrophobicContact CD2-CB 4.01Å; L92-L108 HydrophobicContact CD2-CD1 4.09Å; L92-L108 HydrophobicContact CG-CB 4.02Å; L92-L108 HydrophobicContact CG-CD1 4.06Å; L92-L108 WeakPolarHBondContact O-CB 3.48Å; L92-L108 PolarHBondContact O-N 2.92Å; D94-L108 HydrophobicContact CB-CD1 3.84Å; D94-L108 HydrophobicContact CB-CD2 4.08Å; D94-L108 HydrophobicContact CB-CG 3.97Å; D106-L108 PolarHBondContact O-N 2.95Å
109	G	92.9	Very high	84.8	Confident	0 Å²	0	46.1 Å²	46.1	0%	0	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	155.9	171.6	174.7	0	0	0	0	0	112.7	L92 F107 L129	L92-G109 PolarHBondContact N-O 2.91Å; L92-G109 PolarHBondContact O-N 2.94Å; F107-G109 WeakPolarHBondContact CE2-O 3.39Å; F107-G109 VanDerWaalsContact CZ-CA 3.48Å; G109-L129 CarbonylContact C-O 3.57Å; G109-L129 WeakPolarHBondContact CA-O 3.07Å
110	A	95	Very high	86.4	Confident	8 Å²	8	45.7 Å²	45.7	7%	0.066	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.2	155.1	176.6	0	0	0	0	0	112.7	R89 F90 E91 F107 L129	R89-A110 HydrophobicContact CG-CB 4.47Å; F90-A110 CarbonylContact O-C 3.59Å; F90-A110 WeakPolarHBondContact O-CA 3.43Å; F90-A110 WeakPolarHBondContact O-CB 3.05Å; E91-A110 HydrophobicContact CG-CB 4.11Å; F107-A110 HydrophobicContact CE2-CB 3.98Å; F107-A110 HydrophobicContact CZ-CB 3.71Å; A110-L129 PolarHBondContact N-O 3.43Å; A110-L129 PolarHBondContact O-N 3.08Å
111	M	95.1	Very high	87.9	Confident	4 Å²	4	42.2 Å²	42.2	2%	0.02	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	132.6	167.1	176.5	-165.2	69.1	0	0	108.6	R89 F90 L124 K126 L128 I140 V142	R89-M111 CarbonylContact C-O 3.57Å; R89-M111 WeakPolarHBondContact CA-O 3.46Å; F90-M111 HydrophobicContact CB-CE 4.29Å; F90-M111 HydrophobicContact CD2-CE 3.21Å; F90-M111 HydrophobicContact CE2-CE 3.62Å; F90-M111 HydrophobicContact CG-CE 3.87Å; F90-M111 PolarHBondContact N-O 2.83Å; F90-M111 PolarHBondContact O-N 3.46Å; M111-L124 HydrophobicContact SD-CD2 4.41Å; M111-K126 HydrophobicContact CG-CB 3.89Å; M111-K126 HydrophobicContact CG-CD 3.92Å; M111-K126 HydrophobicContact CG-CG 4.34Å; M111-K126 HydrophobicContact SD-CB 3.66Å; M111-K126 HydrophobicContact SD-CD 3.95Å; M111-K126 HydrophobicContact SD-CG 3.91Å; M111-L128 HydrophobicContact CB-CD2 4.2Å; M111-I140 HydrophobicContact CB-CG2 3.59Å; M111-I140 HydrophobicContact CE-CG2 4.11Å; M111-I140 HydrophobicContact CG-CG2 4.1Å; M111-I140 HydrophobicContact SD-CG2 3.58Å; M111-I140 VanDerWaalsContact SD-CG2 3.58Å; M111-V142 HydrophobicContact CE-CG2 3.75Å
112	E	95.6	Very high	88.9	Confident	96 Å²	96	45.1 Å²	45.1	45%	0.449	22%	0.215	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	140	168.6	-64.6	-174.7	-175.9	0	0	110.1	W55 L88 R89	W55-E112 HydrophobicContact CH2-CG 4.49Å; W55-E112 HydrophobicContact CZ2-CG 4.4Å; L88-E112 WeakPolarHBondContact O-CA 3.49Å; R89-E112 HydrophobicContact CB-CG 3.99Å; R89-E112 WeakPolarHBondContact CD-OE1 3.37Å; R89-E112 HydrophobicContact CG-CG 3.85Å; R89-E112 IonicContact CZ-OE1 3.75Å; R89-E112 IonicContact NE-OE1 2.75Å; R89-E112 IonicContact NH1-OE1 3.31Å; R89-E112 PolarHBondContact NH1-OE1 3.49Å
113	C	95.8	Very high	90	Very high	10 Å²	10	48.7 Å²	48.7	7%	0.068	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-161.5	175.2	177.7	59.5	0	0	0	0	109.5	L88 L124	L88-C113 PolarHBondContact N-O 2.73Å; L88-C113 PolarHBondContact O-N 3.44Å; C113-L124 HydrophobicContact CB-CD2 3.84Å
114	T	95.9	Very high	91.3	Very high	13 Å²	13	37.5 Å²	37.5	8%	0.08	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.6	157.1	168.2	60.4	0	0	0	0	110.2	V85 Q86 R87 G116 Q117 I118 D349	V85-T114 HydrophobicContact CG1-CG2 3.75Å; Q86-T114 CarbonylContact O-C 3.44Å; Q86-T114 VanDerWaalsContact O-CA 3.27Å; Q86-T114 WeakPolarHBondContact O-CA 3.45Å; R87-T114 HydrophobicContact CG-CG2 4.32Å; T114-G116 PolarHBondContact O-N 2.84Å; T114-Q117 PolarHBondContact O-N 3.11Å; T114-Q117 VanDerWaalsContact OG1-CG 3.25Å; T114-Q117 WeakPolarHBondContact OG1-CG 3.2Å; T114-Q117 PolarHBondContact OG1-N 2.91Å; T114-I118 PolarHBondContact O-N 2.75Å; T114-D349 VanDerWaalsContact CB-OD2 3.25Å; T114-D349 WeakPolarHBondContact CB-OD2 3.19Å; T114-D349 WeakPolarHBondContact CG2-OD2 3.21Å; T114-D349 VanDerWaalsContact OG1-CG 3.26Å; T114-D349 PolarHBondContact OG1-OD2 3.36Å
115	L	96.4	Very high	92.4	Very high	0 Å²	0	36.7 Å²	36.7	0%	0	19%	0.185	C	C	.	.	H	α-helix	trans	-60.6	-37.7	171.4	-175.9	56.4	0	0	0	111.1	V23 L25 V78 Y80 Q86 L88 Q117 I118 V119	V23-L115 HydrophobicContact CG1-CD1 4.42Å; L25-L115 HydrophobicContact CD1-CD1 4.23Å; L25-L115 HydrophobicContact CD2-CD1 4.06Å; V78-L115 HydrophobicContact CB-CD2 4.31Å; V78-L115 HydrophobicContact CG1-CD2 3.8Å; Y80-L115 HydrophobicContact CD2-CD2 3.84Å; Y80-L115 HydrophobicContact CD2-CG 4.08Å; Q86-L115 HydrophobicContact CB-CB 3.97Å; Q86-L115 PolarHBondContact O-N 3.46Å; L88-L115 HydrophobicContact CD1-CB 4.1Å; L88-L115 HydrophobicContact CD1-CD1 4.17Å; L115-Q117 VanDerWaalsContact C-N 3.33Å; L115-Q117 PolarHBondContact O-N 2.76Å; L115-I118 PolarHBondContact O-N 3.15Å; L115-V119 HydrophobicContact CD1-CG1 4.16Å; L115-V119 HydrophobicContact CG-CG1 4.34Å; L115-V119 PolarHBondContact O-N 3.28Å
116	G	94.8	Very high	92.9	Very high	5 Å²	5	39.2 Å²	39.2	5%	0.052	19%	0.193	C	C	.	.	H	α-helix	trans	-50.3	-47.9	173.1	0	0	0	0	0	113	T114 I118 V119 S120	T114-G116 PolarHBondContact O-N 2.84Å; G116-I118 VanDerWaalsContact C-N 3.3Å; G116-I118 PolarHBondContact O-N 2.8Å; G116-V119 VanDerWaalsContact O-CG2 3.3Å; G116-V119 WeakPolarHBondContact O-CG2 3.33Å; G116-V119 PolarHBondContact O-N 2.62Å; G116-S120 WeakPolarHBondContact O-CB 3.38Å; G116-S120 PolarHBondContact O-N 3.16Å; G116-S120 PolarHBondContact O-OG 3.34Å; G116-S120 VanDerWaalsContact O-OG 3.08Å
117	Q	94.3	Very high	93.2	Very high	38 Å²	38	37 Å²	37	18%	0.178	19%	0.187	C	C	.	.	H	α-helix	trans	-62.3	-34.1	176.7	-74.7	169.7	3.4	0	0	113.8	T114 L115 S120 Q121 D349	T114-Q117 PolarHBondContact O-N 3.11Å; T114-Q117 VanDerWaalsContact OG1-CG 3.25Å; T114-Q117 WeakPolarHBondContact OG1-CG 3.2Å; T114-Q117 PolarHBondContact OG1-N 2.91Å; L115-Q117 VanDerWaalsContact C-N 3.33Å; L115-Q117 PolarHBondContact O-N 2.76Å; Q117-S120 PolarHBondContact O-OG 3.4Å; Q117-Q121 WeakPolarHBondContact O-CG 3.15Å; Q117-Q121 PolarHBondContact O-N 3.36Å; Q117-D349 HydrophobicContact CG-CB 4.27Å; Q117-D349 VanDerWaalsContact CG-OD1 3.29Å; Q117-D349 WeakPolarHBondContact CG-OD1 3.1Å; Q117-D349 PolarHBondContact NE2-OD1 3.11Å
118	I	94.7	Very high	93.2	Very high	0 Å²	0	34.1 Å²	34.1	0%	0	18%	0.175	C	C	.	.	H	α-helix	trans	-74.3	-44.6	-179.9	-55	170.8	0	0	0	109.7	L25 L88 F90 T114 L115 G116 Q121 R122 L124 V142 A144	L25-I118 HydrophobicContact CD1-CD1 4.37Å; L25-I118 HydrophobicContact CD2-CD1 4.48Å; L25-I118 HydrophobicContact CD2-CG2 4.06Å; L88-I118 HydrophobicContact CD1-CD1 3.87Å; F90-I118 HydrophobicContact CE2-CD1 4.15Å; F90-I118 HydrophobicContact CZ-CD1 4.16Å; T114-I118 PolarHBondContact O-N 2.75Å; L115-I118 PolarHBondContact O-N 3.15Å; G116-I118 VanDerWaalsContact C-N 3.3Å; G116-I118 PolarHBondContact O-N 2.8Å; I118-Q121 PolarHBondContact O-N 2.87Å; I118-R122 CarbonylContact O-C 3.59Å; I118-R122 VanDerWaalsContact O-CA 3.26Å; I118-R122 WeakPolarHBondContact O-CA 3.48Å; I118-R122 PolarHBondContact O-N 2.77Å; I118-L124 HydrophobicContact CG1-CB 4.46Å; I118-L124 HydrophobicContact CG1-CD2 3.89Å; I118-V142 HydrophobicContact CD1-CG1 4.13Å; I118-V142 HydrophobicContact CG2-CB 4.44Å; I118-V142 HydrophobicContact CG2-CG1 4.02Å; I118-A144 HydrophobicContact CG2-CB 3.74Å
119	V	93.8	Very high	93.2	Very high	0 Å²	0	35.8 Å²	35.8	0%	0	18%	0.183	C	C	.	.	H	α-helix	trans	-71.9	-34.6	-177.8	-59.6	0	0	0	0	112.3	V23 Y80 L115 G116 Q121 R122 A144 L295 M299 Y350	V23-V119 HydrophobicContact CG1-CG1 4.14Å; V23-V119 HydrophobicContact CG2-CG1 4.08Å; Y80-V119 HydrophobicContact CE2-CG2 3.92Å; L115-V119 HydrophobicContact CD1-CG1 4.16Å; L115-V119 HydrophobicContact CG-CG1 4.34Å; L115-V119 PolarHBondContact O-N 3.28Å; G116-V119 VanDerWaalsContact O-CG2 3.3Å; G116-V119 WeakPolarHBondContact O-CG2 3.33Å; G116-V119 PolarHBondContact O-N 2.62Å; V119-Q121 VanDerWaalsContact C-N 3.31Å; V119-Q121 PolarHBondContact O-N 3.23Å; V119-R122 PolarHBondContact O-N 3.17Å; V119-A144 HydrophobicContact CG1-CB 4.39Å; V119-L295 HydrophobicContact CB-CD2 4.04Å; V119-L295 HydrophobicContact CG1-CD1 4.44Å; V119-L295 HydrophobicContact CG1-CD2 4.48Å; V119-L295 HydrophobicContact CG2-CD2 3.94Å; V119-M299 HydrophobicContact CB-CE 3.97Å; V119-M299 HydrophobicContact CG1-CE 3.85Å; V119-M299 WeakPolarHBondContact O-CG 3.16Å; V119-Y350 HydrophobicContact CG2-CE1 4.1Å
120	S	91.5	Very high	92.9	Very high	33 Å²	33	40.6 Å²	40.6	23%	0.231	20%	0.204	C	C	.	.	H	α-helix	trans	-68.2	-29.8	176.8	63.6	0	0	0	0	113.4	G116 Q117 D349	G116-S120 WeakPolarHBondContact O-CB 3.38Å; G116-S120 PolarHBondContact O-N 3.16Å; G116-S120 PolarHBondContact O-OG 3.34Å; G116-S120 VanDerWaalsContact O-OG 3.08Å; Q117-S120 PolarHBondContact O-OG 3.4Å; S120-D349 VanDerWaalsContact CB-O 3.32Å; S120-D349 WeakPolarHBondContact CB-O 3.3Å; S120-D349 PolarHBondContact OG-O 3.15Å
121	Q	88.1	Confident	92	Very high	79 Å²	79	48.2 Å²	48.2	37%	0.369	24%	0.239	S	C	.	.	H	α-helix	trans	-96.5	-14.2	177.3	-62.7	-179.7	32	0	0	113.1	Q117 I118 V119 K123	Q117-Q121 WeakPolarHBondContact O-CG 3.15Å; Q117-Q121 PolarHBondContact O-N 3.36Å; I118-Q121 PolarHBondContact O-N 2.87Å; V119-Q121 VanDerWaalsContact C-N 3.31Å; V119-Q121 PolarHBondContact O-N 3.23Å; Q121-K123 PolarHBondContact O-N 3.27Å
122	R	86.7	Confident	90.7	Very high	92 Å²	92	51.4 Å²	51.4	35%	0.347	27%	0.273	S	S	.	.	S	Bend	trans	58.6	-30.8	-167.5	-169.9	178.6	177.1	-178.7	0.8	115.1	I118 V119 T143 A144 I543	I118-R122 CarbonylContact O-C 3.59Å; I118-R122 VanDerWaalsContact O-CA 3.26Å; I118-R122 WeakPolarHBondContact O-CA 3.48Å; I118-R122 PolarHBondContact O-N 2.77Å; V119-R122 PolarHBondContact O-N 3.17Å; R122-T143 CarbonylContact O-C 3.54Å; R122-T143 WeakPolarHBondContact O-CA 3.43Å; R122-A144 PolarHBondContact O-N 2.94Å; R122-I543 HydrophobicContact CB-CD1 4.32Å
123	K	89.9	Confident	89.5	Confident	114 Å²	114	53.3 Å²	53.3	50%	0.496	29%	0.286	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.2	101.7	-178	-175.3	-177.4	-177.6	-179.8	0	110	Q121 M141 V142	Q121-K123 PolarHBondContact O-N 3.27Å; K123-M141 HydrophobicContact CD-SD 4.41Å; K123-M141 VanDerWaalsContact CE-CE 3.47Å; K123-M141 WeakPolarHBondContact CE-SD 3.42Å; K123-M141 HydrophobicContact CG-CG 4.21Å; K123-V142 CarbonylContact C-O 3.23Å; K123-V142 WeakPolarHBondContact CA-O 3.31Å
124	L	92.8	Very high	88.3	Confident	5 Å²	5	57.3 Å²	57.3	3%	0.026	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.3	128.4	180	-177.6	64.5	0	0	0	110.2	M111 C113 I118 K126 M141 V142	M111-L124 HydrophobicContact SD-CD2 4.41Å; C113-L124 HydrophobicContact CB-CD2 3.84Å; I118-L124 HydrophobicContact CG1-CB 4.46Å; I118-L124 HydrophobicContact CG1-CD2 3.89Å; L124-K126 HydrophobicContact CD1-CG 4.2Å; L124-K126 HydrophobicContact CD2-CD 4.45Å; L124-K126 HydrophobicContact CG-CG 4.23Å; L124-M141 CarbonylContact O-C 3.53Å; L124-M141 WeakPolarHBondContact O-CA 3.31Å; L124-V142 PolarHBondContact N-O 2.81Å; L124-V142 PolarHBondContact O-N 2.84Å
125	T	94	Very high	87.1	Confident	69 Å²	69	60 Å²	60	42%	0.423	33%	0.333	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	121.8	172	-57.1	0	0	0	0	109.8	I140 M141	T125-I140 WeakPolarHBondContact CA-O 3.41Å; T125-M141 HydrophobicContact CG2-CE 4.49Å; T125-M141 WeakPolarHBondContact OG1-CE 3.48Å
126	K	94.2	Very high	85.8	Confident	71 Å²	71	61 Å²	61	31%	0.309	34%	0.344	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	157.3	175.6	-62.7	-170.9	178.4	179.1	0	111.4	M111 L124 S139 I140	M111-K126 HydrophobicContact CG-CB 3.89Å; M111-K126 HydrophobicContact CG-CD 3.92Å; M111-K126 HydrophobicContact CG-CG 4.34Å; M111-K126 HydrophobicContact SD-CB 3.66Å; M111-K126 HydrophobicContact SD-CD 3.95Å; M111-K126 HydrophobicContact SD-CG 3.91Å; L124-K126 HydrophobicContact CD1-CG 4.2Å; L124-K126 HydrophobicContact CD2-CD 4.45Å; L124-K126 HydrophobicContact CG-CG 4.23Å; K126-S139 VanDerWaalsContact O-CA 3.27Å; K126-S139 WeakPolarHBondContact O-CA 3.46Å; K126-S139 WeakPolarHBondContact O-CB 3.4Å; K126-I140 PolarHBondContact N-O 3.18Å; K126-I140 PolarHBondContact O-N 3.04Å
127	A	93.8	Very high	85.2	Confident	46 Å²	46	70.1 Å²	70.1	38%	0.38	38%	0.382	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.6	144.9	168.5	0	0	0	0	0	110.4
128	L	91.8	Very high	85	Confident	2 Å²	2	68.6 Å²	68.6	1%	0.01	38%	0.376	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.5	126.4	172.1	-71.7	168.5	0	0	0	109.5	L92 M111 G136 S138 I140	L92-L128 HydrophobicContact CB-CD1 3.93Å; L92-L128 HydrophobicContact CD2-CD1 3.44Å; L92-L128 VanDerWaalsContact CD2-CD1 3.44Å; L92-L128 HydrophobicContact CG-CD1 4.32Å; M111-L128 HydrophobicContact CB-CD2 4.2Å; L128-G136 PolarHBondContact O-N 2.77Å; L128-S138 PolarHBondContact N-O 3.02Å; L128-I140 HydrophobicContact CD1-CB 4.42Å; L128-I140 HydrophobicContact CD2-CB 3.93Å; L128-I140 HydrophobicContact CD2-CG2 3.58Å; L128-I140 HydrophobicContact CG-CB 4.15Å; L128-I140 HydrophobicContact CG-CG2 4.03Å
129	L	90.5	Very high	85	Confident	66 Å²	66	70.1 Å²	70.1	35%	0.346	39%	0.387	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.9	132.3	178	-57.4	-176.8	0	0	0	110.2	G109 A110 A135	G109-L129 CarbonylContact C-O 3.57Å; G109-L129 WeakPolarHBondContact CA-O 3.07Å; A110-L129 PolarHBondContact N-O 3.43Å; A110-L129 PolarHBondContact O-N 3.08Å; L129-A135 HydrophobicContact CD2-CB 4.17Å
130	K	85.8	Confident	85.1	Confident	101 Å²	101	70.1 Å²	70.1	44%	0.439	39%	0.387	S	S	.	.	P	Polyproline II helix	trans	-86.9	173.6	172.5	-66.3	-170.4	176.9	-170.2	0	111	G132 N133 T134	K130-G132 PolarHBondContact O-N 2.96Å; K130-N133 PolarHBondContact O-N 3.48Å; K130-T134 PolarHBondContact N-O 3.06Å
131	Q	76.1	Confident	85.3	Confident	169 Å²	169	70.1 Å²	70.1	79%	0.79	38%	0.383	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.8	127	171.3	-71.9	-178.3	-1.3	0	0	110	F107	F107-Q131 HydrophobicContact CD1-CG 4.33Å; F107-Q131 HydrophobicContact CE1-CG 4.35Å
132	G	68.4	Low	85.7	Confident	71 Å²	71	66.4 Å²	66.4	73%	0.732	37%	0.366	S	S	*	.	T	Hydrogen-bonded Turn	trans	93.3	11.1	-173.8	0	0	0	0	0	115.7	K130 T134	K130-G132 PolarHBondContact O-N 2.96Å; G132-T134 PolarHBondContact O-N 3.2Å
133	N	69.6	Low	86	Confident	136 Å²	136	63.9 Å²	63.9	73%	0.727	36%	0.361	S	S	*	.	S	Bend	trans	62.5	21.3	177.5	-65.3	-15.2	0	0	0	115.2	K130	K130-N133 PolarHBondContact O-N 3.48Å
134	T	72.1	Confident	86.2	Confident	94 Å²	94	58.4 Å²	58.4	58%	0.577	34%	0.337	S	S	*	.	P	Polyproline II helix	trans	-79.2	124.3	174.1	-45.6	0	0	0	0	109.9	K130 G132 G136	K130-T134 PolarHBondContact N-O 3.06Å; G132-T134 PolarHBondContact O-N 3.2Å; T134-G136 PolarHBondContact O-N 3.35Å
135	A	70.2	Confident	85.9	Confident	68 Å²	68	62 Å²	62	56%	0.562	35%	0.354	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-64.7	122.6	175.2	0	0	0	0	0	110.9	L129	L129-A135 HydrophobicContact CD2-CB 4.17Å
136	G	69.4	Low	85.7	Confident	23 Å²	23	60.4 Å²	60.4	24%	0.237	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.1	173	171.9	0	0	0	0	0	112.7	L128 T134 S138	L128-G136 PolarHBondContact O-N 2.77Å; T134-G136 PolarHBondContact O-N 3.35Å; G136-S138 PolarHBondContact O-N 3.14Å
137	K	82	Confident	85.1	Confident	195 Å²	195	60.7 Å²	60.7	85%	0.848	35%	0.346	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-74.7	-11	168.1	-66	-176.6	179.2	179.9	0	113
138	S	90.4	Very high	83.9	Confident	6 Å²	6	62 Å²	62	4%	0.042	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.6	142.3	-176.5	-45.4	0	0	0	0	110.3	R30 G31 I32 L128 G136	R30-S138 CarbonylContact O-C 3.56Å; R30-S138 VanDerWaalsContact O-CA 3.26Å; R30-S138 WeakPolarHBondContact O-CA 3.34Å; G31-S138 WeakPolarHBondContact O-CA 3.24Å; G31-S138 WeakPolarHBondContact O-CB 3.19Å; G31-S138 PolarHBondContact O-OG 3.46Å; I32-S138 WeakPolarHBondContact CA-OG 3.35Å; L128-S138 PolarHBondContact N-O 3.02Å; G136-S138 PolarHBondContact O-N 3.14Å
139	S	94	Very high	82.5	Confident	33 Å²	33	64.3 Å²	64.3	23%	0.231	38%	0.377	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127	153	176.4	52.4	0	0	0	0	110.5	C29 R30 K126	C29-S139 CarbonylContact C-O 3.49Å; C29-S139 VanDerWaalsContact CA-O 3.23Å; C29-S139 WeakPolarHBondContact CA-O 3.37Å; R30-S139 PolarHBondContact N-O 3.09Å; R30-S139 PolarHBondContact O-N 2.79Å; K126-S139 VanDerWaalsContact O-CA 3.27Å; K126-S139 WeakPolarHBondContact O-CA 3.46Å; K126-S139 WeakPolarHBondContact O-CB 3.4Å
140	I	95.7	Very high	81.2	Confident	0 Å²	0	64 Å²	64	0%	0	38%	0.376	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	138.9	171.9	-175.8	166.8	0	0	0	108.2	V27 A28 V45 F90 M111 T125 K126 L128 V142	V27-I140 HydrophobicContact CG1-CD1 3.6Å; V27-I140 HydrophobicContact CG1-CG1 3.68Å; A28-I140 WeakPolarHBondContact O-CA 3.46Å; V45-I140 HydrophobicContact CG1-CD1 4.28Å; V45-I140 HydrophobicContact CG2-CD1 4.38Å; F90-I140 HydrophobicContact CB-CD1 3.61Å; F90-I140 HydrophobicContact CD1-CD1 4.19Å; F90-I140 HydrophobicContact CG-CD1 4.1Å; M111-I140 HydrophobicContact CB-CG2 3.59Å; M111-I140 HydrophobicContact CE-CG2 4.11Å; M111-I140 HydrophobicContact CG-CG2 4.1Å; M111-I140 HydrophobicContact SD-CG2 3.58Å; M111-I140 VanDerWaalsContact SD-CG2 3.58Å; T125-I140 WeakPolarHBondContact CA-O 3.41Å; K126-I140 PolarHBondContact N-O 3.18Å; K126-I140 PolarHBondContact O-N 3.04Å; L128-I140 HydrophobicContact CD1-CB 4.42Å; L128-I140 HydrophobicContact CD2-CB 3.93Å; L128-I140 HydrophobicContact CD2-CG2 3.58Å; L128-I140 HydrophobicContact CG-CB 4.15Å; L128-I140 HydrophobicContact CG-CG2 4.03Å; I140-V142 HydrophobicContact CG1-CG2 4.35Å
141	M	96.3	Very high	80.5	Confident	33 Å²	33	64 Å²	64	16%	0.163	38%	0.38	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	126.9	177.6	176.9	-179.1	-71.5	0	0	107.8	V27 A28 K123 L124 T125	V27-M141 WeakPolarHBondContact CA-O 3.48Å; A28-M141 PolarHBondContact N-O 3.4Å; A28-M141 PolarHBondContact O-N 2.92Å; K123-M141 HydrophobicContact CD-SD 4.41Å; K123-M141 VanDerWaalsContact CE-CE 3.47Å; K123-M141 WeakPolarHBondContact CE-SD 3.42Å; K123-M141 HydrophobicContact CG-CG 4.21Å; L124-M141 CarbonylContact O-C 3.53Å; L124-M141 WeakPolarHBondContact O-CA 3.31Å; T125-M141 HydrophobicContact CG2-CE 4.49Å; T125-M141 WeakPolarHBondContact OG1-CE 3.48Å
142	V	96.6	Very high	81	Confident	0 Å²	0	57 Å²	57	0%	0	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	124.2	176.6	-171.4	0	0	0	0	108.3	L25 R26 V27 F90 M111 I118 K123 L124 I140	L25-V142 HydrophobicContact CB-CG1 4.04Å; L25-V142 HydrophobicContact CD2-CG1 4.28Å; R26-V142 CarbonylContact O-C 3.52Å; R26-V142 WeakPolarHBondContact O-CA 3.37Å; V27-V142 HydrophobicContact CG2-CG1 4.44Å; V27-V142 HydrophobicContact CG2-CG2 4.3Å; F90-V142 HydrophobicContact CD1-CG2 4.3Å; F90-V142 HydrophobicContact CE1-CG1 4.28Å; F90-V142 HydrophobicContact CE1-CG2 3.93Å; F90-V142 HydrophobicContact CE2-CG2 4.24Å; F90-V142 HydrophobicContact CZ-CG1 4.02Å; F90-V142 HydrophobicContact CZ-CG2 3.9Å; M111-V142 HydrophobicContact CE-CG2 3.75Å; I118-V142 HydrophobicContact CD1-CG1 4.13Å; I118-V142 HydrophobicContact CG2-CB 4.44Å; I118-V142 HydrophobicContact CG2-CG1 4.02Å; K123-V142 CarbonylContact C-O 3.23Å; K123-V142 WeakPolarHBondContact CA-O 3.31Å; L124-V142 PolarHBondContact N-O 2.81Å; L124-V142 PolarHBondContact O-N 2.84Å; I140-V142 HydrophobicContact CG1-CG2 4.35Å
143	T	93.1	Very high	82	Confident	39 Å²	39	58.3 Å²	58.3	24%	0.239	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	131.9	174.1	-54.7	0	0	0	0	108.8	L25 R26 R122	L25-T143 WeakPolarHBondContact CA-O 3.41Å; R26-T143 PolarHBondContact N-O 3.16Å; R26-T143 PolarHBondContact O-N 3.07Å; R122-T143 CarbonylContact O-C 3.54Å; R122-T143 WeakPolarHBondContact O-CA 3.43Å
144	A	92.8	Very high	83	Confident	0 Å²	0	51.8 Å²	51.8	0%	0	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105	141	175.6	0	0	0	0	0	111.8	V23 E24 L25 I118 V119 R122 M299	V23-A144 HydrophobicContact CG1-CB 3.78Å; E24-A144 VanDerWaalsContact O-CA 3.29Å; E24-A144 WeakPolarHBondContact O-CA 3.3Å; L25-A144 HydrophobicContact CD2-CB 3.85Å; I118-A144 HydrophobicContact CG2-CB 3.74Å; V119-A144 HydrophobicContact CG1-CB 4.39Å; R122-A144 PolarHBondContact O-N 2.94Å; A144-M299 HydrophobicContact CB-CE 4.16Å
145	E	88.2	Confident	84.1	Confident	79 Å²	79	50 Å²	50	37%	0.369	28%	0.282	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.7	137.7	167.7	-65.4	-179.3	152.7	0	0	108.4	V23 E24 R26	V23-E145 WeakPolarHBondContact CA-O 3.25Å; E24-E145 HydrophobicContact CB-CB 4.46Å; E24-E145 PolarHBondContact N-O 2.95Å; E24-E145 PolarHBondContact O-N 3.29Å; R26-E145 IonicContact NE-OE2 3.11Å
146	E	89.3	Confident	85.3	Confident	37 Å²	37	46.8 Å²	46.8	17%	0.173	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.4	136.5	174.1	-172.1	-174.4	-172.8	0	0	110.6	T21 S148 S293 L295 M299	T21-E146 VanDerWaalsContact CB-OE1 3.25Å; T21-E146 WeakPolarHBondContact CB-OE1 3.31Å; T21-E146 HydrophobicContact CG2-CG 3.83Å; T21-E146 WeakPolarHBondContact CG2-OE1 3.32Å; T21-E146 WeakPolarHBondContact OG1-CG 3.46Å; T21-E146 PolarHBondContact OG1-OE1 3.28Å; E146-S148 VanDerWaalsContact C-N 3.28Å; E146-S148 PolarHBondContact O-N 3.48Å; E146-S293 PolarHBondContact OE1-OG 3.28Å; E146-S293 PolarHBondContact OE2-OG 3.32Å; E146-L295 HydrophobicContact CB-CB 4.43Å; E146-L295 HydrophobicContact CB-CD1 4.4Å; E146-L295 HydrophobicContact CG-CB 4.34Å; E146-L295 HydrophobicContact CG-CD1 4.14Å; E146-L295 WeakPolarHBondContact OE2-CB 3.38Å; E146-M299 HydrophobicContact CB-CE 4.28Å; E146-M299 HydrophobicContact CB-SD 4.47Å
147	L	82	Confident	86.5	Confident	76 Å²	76	46.1 Å²	46.1	40%	0.398	25%	0.247	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.6	73.5	163.1	-83	155.5	0	0	0	109.3	K22 E24 L77	K22-L147 HydrophobicContact CB-CB 4.16Å; K22-L147 HydrophobicContact CB-CD1 4.12Å; K22-L147 WeakPolarHBondContact O-CB 3.48Å; K22-L147 PolarHBondContact O-N 2.86Å; E24-L147 HydrophobicContact CG-CD1 3.53Å; E24-L147 HydrophobicContact CG-CD2 4.38Å; E24-L147 HydrophobicContact CG-CG 3.72Å; L77-L147 HydrophobicContact CD2-CD1 3.43Å; L77-L147 VanDerWaalsContact CD2-CD1 3.43Å
148	S	68.6	Low	87.3	Confident	73 Å²	73	36.9 Å²	36.9	51%	0.51	21%	0.207	S	C	.	.			trans	-71.8	136.2	179.1	61	0	0	0	0	111.4	E146	E146-S148 VanDerWaalsContact C-N 3.28Å; E146-S148 PolarHBondContact O-N 3.48Å
149	G	61.8	Low	87.7	Confident	52 Å²	52	37 Å²	37	54%	0.536	21%	0.208	S	C	.	.			trans	-69.8	159	159.7	0	0	0	0	0	111.2	D151	G149-D151 PolarHBondContact O-N 3.36Å
150	N	63.2	Low	87.9	Confident	59 Å²	59	35.6 Å²	35.6	32%	0.316	20%	0.198	S	C	.	.			trans	-87.6	84.8	177	-161.9	3.6	0	0	0	110.4	D152 N212	N150-D152 VanDerWaalsContact C-N 3.27Å; N150-D152 WeakPolarHBondContact OD1-CB 3.38Å; N150-D152 VanDerWaalsContact OD1-CG 3.29Å; N150-D152 PolarHBondContact OD1-OD2 2.9Å; N150-N212 PolarHBondContact O-ND2 3.21Å
151	D	71.4	Confident	88	Confident	101 Å²	101	41.9 Å²	41.9	54%	0.54	22%	0.222	S	C	.	.			trans	-90.5	13.4	178.7	-66.3	-33.2	0	0	0	113.3	G149 Y153 N212 M291	G149-D151 PolarHBondContact O-N 3.36Å; D151-Y153 WeakPolarHBondContact O-CD2 3.46Å; D151-N212 PolarHBondContact OD1-ND2 3.34Å; D151-M291 WeakPolarHBondContact O-CG 3.31Å
152	D	86.1	Confident	88	Confident	22 Å²	22	48.7 Å²	48.7	12%	0.118	25%	0.25	C	S	.	.			trans	-56.5	146.8	174.8	-74.5	-6.3	0	0	0	111.3	N150 S210 L211 I288 K290 M291	N150-D152 VanDerWaalsContact C-N 3.27Å; N150-D152 WeakPolarHBondContact OD1-CB 3.38Å; N150-D152 VanDerWaalsContact OD1-CG 3.29Å; N150-D152 PolarHBondContact OD1-OD2 2.9Å; D152-S210 CarbonylContact O-C 3.56Å; D152-S210 WeakPolarHBondContact O-CA 3.45Å; D152-L211 HydrophobicContact CB-CD1 3.75Å; D152-L211 HydrophobicContact CB-CG 4.21Å; D152-L211 WeakPolarHBondContact O-CG 3.33Å; D152-L211 PolarHBondContact O-N 3Å; D152-I288 HydrophobicContact CB-CG2 4.31Å; D152-K290 VanDerWaalsContact OD1-CA 3.27Å; D152-K290 WeakPolarHBondContact OD1-CA 3.17Å; D152-M291 PolarHBondContact OD1-N 3.44Å
153	Y	88.8	Confident	88	Confident	98 Å²	98	48.9 Å²	48.9	38%	0.384	25%	0.251	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	152.9	171.5	-77.9	-107.6	0	0	0	109.9	D151 K208 V209 I289 M291	D151-Y153 WeakPolarHBondContact O-CD2 3.46Å; Y153-K208 HydrophobicContact CD1-CB 4.24Å; Y153-V209 WeakPolarHBondContact CA-O 3.48Å; Y153-V209 VanDerWaalsContact CD1-C 3.42Å; Y153-I289 PolarHBondContact N-O 3.28Å; Y153-I289 PolarHBondContact O-N 3.36Å; Y153-M291 HydrophobicContact CD2-CG 3.69Å; Y153-M291 HydrophobicContact CD2-SD 4.29Å; Y153-M291 HydrophobicContact CE2-CG 4.22Å
154	V	91.7	Very high	88.1	Confident	0 Å²	0	49.1 Å²	49.1	0%	0	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	131.3	163.5	62.2	0	0	0	0	109.5	L156 K208 V209 L211 L214 Y246 K287	V154-L156 HydrophobicContact CG1-CD1 4.16Å; V154-L156 HydrophobicContact CG1-CG 4.15Å; V154-L156 HydrophobicContact CG2-CD2 3.68Å; V154-L156 HydrophobicContact CG2-CG 3.89Å; V154-K208 WeakPolarHBondContact O-CA 3.43Å; V154-V209 HydrophobicContact CG1-CG1 3.77Å; V154-V209 PolarHBondContact N-O 2.71Å; V154-V209 PolarHBondContact O-N 3.37Å; V154-L211 HydrophobicContact CB-CD2 4.15Å; V154-L211 HydrophobicContact CG1-CD2 4.12Å; V154-L214 HydrophobicContact CG1-CD2 3.53Å; V154-Y246 HydrophobicContact CB-CE2 4.14Å; V154-Y246 HydrophobicContact CG1-CE2 4.48Å; V154-Y246 HydrophobicContact CG2-CE2 3.93Å; V154-K287 WeakPolarHBondContact CA-O 3.31Å
155	E	94.4	Very high	88.2	Confident	55 Å²	55	52.5 Å²	52.5	26%	0.257	27%	0.269	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.9	119.7	167.3	-179.3	172.6	-150.4	0	0	108.9	F207 K208 K287 I289	E155-F207 WeakPolarHBondContact CA-O 3.43Å; E155-K208 HydrophobicContact CB-CG 4.18Å; E155-K208 HydrophobicContact CG-CG 4.38Å; E155-K287 HydrophobicContact CB-CB 4.37Å; E155-K287 PolarHBondContact N-O 3.3Å; E155-K287 PolarHBondContact O-N 2.93Å; E155-I289 HydrophobicContact CB-CD1 3.92Å; E155-I289 HydrophobicContact CB-CG1 4.48Å
156	L	95.3	Very high	88.3	Confident	1 Å²	1	50.1 Å²	50.1	1%	0.005	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	142.9	-177.5	-64.2	172	0	0	0	110.1	V154 F158 S206 F207 L214 M249 L283 H285 C286	V154-L156 HydrophobicContact CG1-CD1 4.16Å; V154-L156 HydrophobicContact CG1-CG 4.15Å; V154-L156 HydrophobicContact CG2-CD2 3.68Å; V154-L156 HydrophobicContact CG2-CG 3.89Å; L156-F158 HydrophobicContact CB-CD2 4.42Å; L156-F158 HydrophobicContact CB-CE2 3.81Å; L156-F158 HydrophobicContact CD1-CE2 4.2Å; L156-F158 HydrophobicContact CG-CE2 4.45Å; L156-S206 VanDerWaalsContact O-CA 3.3Å; L156-S206 WeakPolarHBondContact O-CA 3.43Å; L156-F207 HydrophobicContact CB-CE1 4.08Å; L156-F207 HydrophobicContact CB-CE2 3.97Å; L156-F207 HydrophobicContact CB-CZ 3.67Å; L156-F207 HydrophobicContact CD1-CE2 3.92Å; L156-F207 HydrophobicContact CD1-CZ 3.95Å; L156-F207 HydrophobicContact CG-CE2 4.45Å; L156-F207 HydrophobicContact CG-CZ 4.43Å; L156-F207 PolarHBondContact N-O 2.93Å; L156-F207 PolarHBondContact O-N 3.27Å; L156-L214 HydrophobicContact CD1-CD2 4.43Å; L156-M249 HydrophobicContact CD1-CE 4.47Å; L156-M249 HydrophobicContact CD2-CE 4.41Å; L156-M249 HydrophobicContact CD2-SD 4.17Å; L156-L283 HydrophobicContact CD2-CD1 4.1Å; L156-H285 WeakPolarHBondContact CA-O 3.09Å; L156-C286 HydrophobicContact CD2-CB 3.87Å
157	S	95.8	Very high	88.2	Confident	9 Å²	9	50.3 Å²	50.3	6%	0.063	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.2	133.2	170.1	176.8	0	0	0	0	110	N284 H285	S157-N284 PolarHBondContact O-N 3.4Å; S157-N284 PolarHBondContact OG-ND2 3.44Å; S157-N284 VanDerWaalsContact OG-ND2 3.14Å; S157-H285 PolarHBondContact N-O 3.09Å; S157-H285 VanDerWaalsContact N-O 3.09Å; S157-H285 PolarHBondContact O-N 3.28Å
158	F	97.9	Very high	88.2	Confident	2 Å²	2	56 Å²	56	1%	0.009	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	151.1	-180	-68	-91.4	0	0	0	111.5	L156 L176 I178 W204 F207 M249 W261 V281 I282 L283 N284	L156-F158 HydrophobicContact CB-CD2 4.42Å; L156-F158 HydrophobicContact CB-CE2 3.81Å; L156-F158 HydrophobicContact CD1-CE2 4.2Å; L156-F158 HydrophobicContact CG-CE2 4.45Å; F158-L176 HydrophobicContact CB-CD2 3.97Å; F158-L176 HydrophobicContact CD1-CD2 4.31Å; F158-L176 HydrophobicContact CD2-CD2 3.92Å; F158-L176 HydrophobicContact CE2-CD2 4.49Å; F158-L176 HydrophobicContact CG-CD2 3.82Å; F158-I178 HydrophobicContact CE2-CD1 3.9Å; F158-I178 HydrophobicContact CZ-CD1 4.29Å; F158-W204 HydrophobicContact CB-CE3 3.81Å; F158-W204 HydrophobicContact CB-CZ3 4.17Å; F158-W204 PolarHBondContact O-N 3.35Å; F158-W204 VanDerWaalsContact O-N 3.15Å; F158-F207 AromaticContact CD2-CE1 3.97Å; F158-F207 HydrophobicContact CD2-CE1 3.97Å; F158-F207 HydrophobicContact CD2-CZ 4.25Å; F158-F207 HydrophobicContact CE2-CE1 4.16Å; F158-F207 AromaticContact CE2-CZ 3.97Å; F158-F207 HydrophobicContact CE2-CZ 3.97Å; F158-M249 HydrophobicContact CZ-SD 4.02Å; F158-W261 HydrophobicContact CD1-CZ3 4.45Å; F158-W261 HydrophobicContact CE1-CH2 4.38Å; F158-W261 AromaticContact CE1-CZ3 3.89Å; F158-W261 HydrophobicContact CE1-CZ3 3.89Å; F158-V281 HydrophobicContact CD1-CG1 3.98Å; F158-I282 CarbonylContact C-O 3.05Å; F158-I282 VanDerWaalsContact CA-O 3.31Å; F158-I282 WeakPolarHBondContact CA-O 3.42Å; F158-L283 HydrophobicContact CD1-CD1 4.19Å; F158-L283 HydrophobicContact CE1-CB 4.28Å; F158-L283 HydrophobicContact CE1-CD1 3.68Å; F158-L283 HydrophobicContact CE2-CD1 4.14Å; F158-L283 HydrophobicContact CZ-CD1 3.65Å; F158-N284 PolarHBondContact O-ND2 3.48Å
159	S	98.3	Very high	88.8	Confident	9 Å²	9	62.6 Å²	62.6	6%	0.063	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133	164.6	163.4	61.1	0	0	0	0	109.8	P202 V281 I282 N284	S159-P202 CarbonylContact C-O 3.51Å; S159-P202 VanDerWaalsContact CA-O 3.24Å; S159-P202 WeakPolarHBondContact CA-O 3.24Å; S159-P202 WeakPolarHBondContact CB-O 3.36Å; S159-V281 CarbonylContact O-C 3.56Å; S159-V281 WeakPolarHBondContact O-CA 3.45Å; S159-I282 PolarHBondContact N-O 3.44Å; S159-I282 PolarHBondContact O-N 3.37Å; S159-N284 PolarHBondContact N-ND2 3.47Å; S159-N284 PolarHBondContact OG-OD1 3.36Å
160	A	98.3	Very high	90.1	Very high	2 Å²	2	62.7 Å²	62.7	2%	0.017	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.5	163.1	170	0	0	0	0	0	111.3	L163 S201 P202 W204 T280 V281	A160-L163 HydrophobicContact CB-CD1 3.85Å; A160-L163 HydrophobicContact CB-CD2 3.85Å; A160-L163 HydrophobicContact CB-CG 3.87Å; A160-S201 CarbonylContact O-C 3.58Å; A160-S201 VanDerWaalsContact O-C 3.26Å; A160-S201 WeakPolarHBondContact O-CA 3.35Å; A160-S201 WeakPolarHBondContact O-CB 3.42Å; A160-P202 HydrophobicContact CB-CG 3.96Å; A160-P202 PolarHBondContact N-O 3.41Å; A160-W204 HydrophobicContact CB-CH2 3.68Å; A160-W204 HydrophobicContact CB-CZ3 3.91Å; A160-T280 CarbonylContact C-O 3.46Å; A160-T280 WeakPolarHBondContact CA-O 3.27Å; A160-V281 HydrophobicContact CB-CG2 4.23Å
161	R	97.7	Very high	91.5	Very high	132 Å²	132	64.6 Å²	64.6	50%	0.498	30%	0.3	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.2	140.9	178.6	-64.2	-174.4	-176.5	169.7	2.1	110.8	L163 L200 G279 T280 I282	R161-L163 PolarHBondContact O-N 3.14Å; R161-L200 CarbonylContact C-O 3.54Å; R161-G279 WeakPolarHBondContact O-CA 3.44Å; R161-T280 PolarHBondContact N-O 3.41Å; R161-T280 PolarHBondContact O-N 2.93Å; R161-I282 HydrophobicContact CG-CD1 3.9Å
162	K	96.8	Very high	92.5	Very high	176 Å²	176	59.8 Å²	59.8	77%	0.765	27%	0.274	S	S	*	.	S	Bend	trans	50	44.1	174.9	-56.4	178.2	180	177.7	0	112.4	L200 S201 G279	K162-L200 PolarHBondContact N-O 3.15Å; K162-S201 PolarHBondContact N-OG 3.41Å; K162-G279 WeakPolarHBondContact O-CA 3.43Å
163	L	97.5	Very high	92.9	Very high	4 Å²	4	59.9 Å²	59.9	2%	0.021	28%	0.275	C	S	.	.	P	Polyproline II helix	trans	-59.2	146.6	172.9	-66.2	178.1	0	0	0	110.1	A160 R161 D165 P174 L200 P202 V227 I239 S278	A160-L163 HydrophobicContact CB-CD1 3.85Å; A160-L163 HydrophobicContact CB-CD2 3.85Å; A160-L163 HydrophobicContact CB-CG 3.87Å; R161-L163 PolarHBondContact O-N 3.14Å; L163-D165 PolarHBondContact O-N 3.02Å; L163-P174 HydrophobicContact CD1-CB 3.62Å; L163-P174 HydrophobicContact CD1-CG 3.83Å; L163-L200 HydrophobicContact CB-CB 4.48Å; L163-L200 PolarHBondContact N-O 2.6Å; L163-P202 HydrophobicContact CD1-CG 3.92Å; L163-V227 HydrophobicContact CD1-CG1 4.06Å; L163-V227 HydrophobicContact CD2-CG1 4.36Å; L163-I239 HydrophobicContact CB-CG2 4.44Å; L163-I239 HydrophobicContact CD2-CG2 4.26Å; L163-S278 WeakPolarHBondContact CA-O 3.2Å
164	D	94.8	Very high	93.3	Very high	44 Å²	44	55.2 Å²	55.2	24%	0.235	26%	0.256	C	S	.	.	P	Polyproline II helix	trans	-62.7	131.1	172.7	-89.2	-10.5	0	0	0	109.7	S172 I239 Y268 S278	D164-S172 PolarHBondContact O-OG 2.89Å; D164-I239 HydrophobicContact CB-CG2 4.39Å; D164-Y268 WeakPolarHBondContact OD2-CE2 3.48Å; D164-S278 PolarHBondContact N-O 3.41Å; D164-S278 VanDerWaalsContact N-O 3.13Å; D164-S278 VanDerWaalsContact OD2-CB 3.31Å; D164-S278 WeakPolarHBondContact OD2-CB 3.01Å; D164-S278 PolarHBondContact OD2-OG 2.89Å
165	D	93.9	Very high	93.6	Very high	71 Å²	71	55.4 Å²	55.4	38%	0.38	26%	0.257	S	S	.	.	P	Polyproline II helix	trans	-78.7	128.2	173.9	-154.5	-14.3	0	0	0	110.4	L163 D167 K171 S172 L200	L163-D165 PolarHBondContact O-N 3.02Å; D165-D167 PolarHBondContact OD1-N 2.75Å; D165-K171 VanDerWaalsContact OD1-CA 3.27Å; D165-K171 WeakPolarHBondContact OD1-CA 3.48Å; D165-S172 PolarHBondContact OD1-N 3.47Å; D165-L200 HydrophobicContact CB-CD1 4.06Å; D165-L200 HydrophobicContact CB-CD2 3.98Å
166	K	91.6	Very high	93.7	Very high	29 Å²	29	52.8 Å²	52.8	13%	0.126	25%	0.245	C	C	.	.			trans	-104.4	-12.5	175.8	-47	-67.7	174.9	162.2	0	112.7	S172 D229 D237 F238 I239 Y268	K166-S172 PolarHBondContact N-OG 3.07Å; K166-D229 HydrophobicContact CB-CB 4.35Å; K166-D229 VanDerWaalsContact CB-OD2 3.26Å; K166-D229 WeakPolarHBondContact CB-OD2 3.49Å; K166-D229 HydrophobicContact CG-CB 4.05Å; K166-D237 HydrophobicContact CB-CB 4.12Å; K166-D237 HydrophobicContact CG-CB 4.07Å; K166-F238 WeakPolarHBondContact CE-O 3.19Å; K166-F238 PolarHBondContact NZ-O 3.2Å; K166-F238 VanDerWaalsContact NZ-O 3.08Å; K166-I239 HydrophobicContact CG-CG1 4.19Å; K166-Y268 PolarHBondContact NZ-OH 2.57Å; K166-Y268 VanDerWaalsContact NZ-OH 3.1Å
167	D	86.4	Confident	93.9	Very high	42 Å²	42	53.4 Å²	53.4	23%	0.225	25%	0.248	C	C	.	.			trans	-89.4	152.3	-178.4	-82	-27.5	0	0	0	113.3	D165 S170	D165-D167 PolarHBondContact OD1-N 2.75Å; D167-S170 VanDerWaalsContact CB-O 3.22Å; D167-S170 WeakPolarHBondContact CB-O 3.43Å; D167-S170 WeakPolarHBondContact CB-OG 3.31Å; D167-S170 PolarHBondContact OD2-OG 2.72Å
168	F	81.6	Confident	94	Very high	194 Å²	194	53.1 Å²	53.1	85%	0.851	25%	0.245	S	C	*	.	S	Bend	trans	-94.2	-27.3	179	-74.4	-87.2	0	0	0	113.9
169	F	82.1	Confident	93.9	Very high	212 Å²	212	54.7 Å²	54.7	93%	0.93	25%	0.252	S	S	*	.	S	Bend	trans	-129	-5.6	-174.5	-61.8	-69.5	0	0	0	114
170	S	88.4	Confident	93.8	Very high	54 Å²	54	56.6 Å²	56.6	38%	0.378	26%	0.258	S	S	.	.	S	Bend	trans	-127.7	179.6	171.7	38.1	0	0	0	0	108.2	D167	D167-S170 VanDerWaalsContact CB-O 3.22Å; D167-S170 WeakPolarHBondContact CB-O 3.43Å; D167-S170 WeakPolarHBondContact CB-OG 3.31Å; D167-S170 PolarHBondContact OD2-OG 2.72Å
171	K	92.6	Very high	93.6	Very high	99 Å²	99	57.9 Å²	57.9	43%	0.43	27%	0.266	S	S	.	.			trans	-93.2	157.3	159	-58.1	166.5	179.7	174.4	0	108.5	D165 N198 L200	D165-K171 VanDerWaalsContact OD1-CA 3.27Å; D165-K171 WeakPolarHBondContact OD1-CA 3.48Å; K171-N198 WeakPolarHBondContact CB-OD1 3.41Å; K171-N198 WeakPolarHBondContact CD-OD1 3.02Å; K171-N198 VanDerWaalsContact CG-OD1 3.28Å; K171-N198 WeakPolarHBondContact CG-OD1 3.15Å; K171-N198 PolarHBondContact N-OD1 3.42Å; K171-N198 WeakPolarHBondContact O-CA 3.5Å; K171-L200 HydrophobicContact CB-CD2 4.01Å; K171-L200 HydrophobicContact CB-CG 4.04Å; K171-L200 HydrophobicContact CD-CG 4.2Å; K171-L200 HydrophobicContact CG-CD1 4.48Å; K171-L200 HydrophobicContact CG-CG 4.23Å
172	S	93.4	Very high	93.2	Very high	0 Å²	0	53 Å²	53	0%	0	25%	0.249	C	C	.	.			trans	-46.2	147.8	168.4	-66.7	0	0	0	0	114.5	D164 D165 K166 P174 N199 D229	D164-S172 PolarHBondContact O-OG 2.89Å; D165-S172 PolarHBondContact OD1-N 3.47Å; K166-S172 PolarHBondContact N-OG 3.07Å; S172-P174 WeakPolarHBondContact O-CD 3.12Å; S172-N199 PolarHBondContact O-N 3.34Å; S172-D229 VanDerWaalsContact CA-OD1 3.31Å; S172-D229 WeakPolarHBondContact CA-OD1 3.45Å; S172-D229 VanDerWaalsContact CA-OD2 3.3Å; S172-D229 WeakPolarHBondContact CA-OD2 3.15Å; S172-D229 VanDerWaalsContact CB-CG 3.42Å; S172-D229 WeakPolarHBondContact CB-OD1 3.25Å; S172-D229 WeakPolarHBondContact CB-OD2 3.33Å; S172-D229 PolarHBondContact OG-OD2 2.85Å
173	D	94.7	Very high	92.7	Very high	24 Å²	24	51.4 Å²	51.4	13%	0.128	25%	0.249	C	C	.	.			trans	-106	71.3	176.8	-63.9	-28.1	0	0	0	110.3	T195 V196 M197 N198 D229 W230	D173-T195 HydrophobicContact CB-CG2 3.85Å; D173-T195 WeakPolarHBondContact O-CG2 3.45Å; D173-V196 CarbonylContact C-O 3.53Å; D173-V196 WeakPolarHBondContact CA-O 3.45Å; D173-M197 HydrophobicContact CB-SD 3.79Å; D173-M197 WeakPolarHBondContact OD1-CA 3.39Å; D173-N198 PolarHBondContact OD1-N 3.44Å; D173-D229 WeakPolarHBondContact CA-OD1 3.41Å; D173-D229 PolarHBondContact N-OD1 2.65Å; D173-W230 HydrophobicContact CB-CB 4.09Å; D173-W230 WeakPolarHBondContact O-CB 3.44Å; D173-W230 PolarHBondContact O-N 3.49Å
174	P	96.6	Very high	92.3	Very high	0 Å²	0	56.9 Å²	56.9	0%	0	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.4	143.4	-167	29.3	-40.4	0	0	0	115.5	L163 S172 V196 N199 P202 W204 V227 W228 I239	L163-P174 HydrophobicContact CD1-CB 3.62Å; L163-P174 HydrophobicContact CD1-CG 3.83Å; S172-P174 WeakPolarHBondContact O-CD 3.12Å; P174-V196 WeakPolarHBondContact CD-O 3.3Å; P174-V196 PolarHBondContact O-N 3.47Å; P174-V196 VanDerWaalsContact O-N 3.09Å; P174-N199 VanDerWaalsContact CD-O 3.28Å; P174-N199 WeakPolarHBondContact CD-O 3.14Å; P174-N199 WeakPolarHBondContact CG-O 3.43Å; P174-P202 HydrophobicContact CB-CG 4.23Å; P174-P202 HydrophobicContact CG-CB 3.88Å; P174-P202 HydrophobicContact CG-CG 3.55Å; P174-W204 HydrophobicContact CB-CZ2 4.21Å; P174-W204 PolarHBondContact O-NE1 2.99Å; P174-V227 HydrophobicContact CB-CG1 4.25Å; P174-W228 CarbonylContact C-O 3.51Å; P174-W228 WeakPolarHBondContact CA-O 3.48Å; P174-I239 HydrophobicContact CB-CD1 4.26Å
175	F	96.8	Very high	92	Very high	4 Å²	4	57.2 Å²	57.2	2%	0.018	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132	155.2	162.7	67.6	-85.2	0	0	0	111.5	E177 R192 V227 W228 W230 H236	F175-E177 HydrophobicContact CD2-CG 4.05Å; F175-E177 HydrophobicContact CE2-CG 3.83Å; F175-R192 HydrophobicContact CD2-CG 3.88Å; F175-R192 HydrophobicContact CE2-CG 4.33Å; F175-V227 WeakPolarHBondContact O-CA 3.23Å; F175-W228 HydrophobicContact CD1-CB 3.97Å; F175-W228 HydrophobicContact CD2-CB 4.31Å; F175-W228 HydrophobicContact CE1-CB 3.4Å; F175-W228 HydrophobicContact CE1-CG 4.35Å; F175-W228 HydrophobicContact CE2-CB 3.78Å; F175-W228 AromaticContact CE2-CD1 3.84Å; F175-W228 HydrophobicContact CE2-CG 4.01Å; F175-W228 HydrophobicContact CG-CB 4.41Å; F175-W228 HydrophobicContact CZ-CB 3.3Å; F175-W228 AromaticContact CZ-CG 3.78Å; F175-W228 HydrophobicContact CZ-CG 3.78Å; F175-W228 PolarHBondContact N-O 3.26Å; F175-W228 PolarHBondContact O-N 3.29Å; F175-W230 HydrophobicContact CD1-CB 3.97Å; F175-W230 HydrophobicContact CE1-CB 4.06Å; F175-H236 HydrophobicContact CE1-CB 4.15Å; F175-H236 AromaticContact CE1-CD2 3.95Å; F175-H236 AromaticContact CE1-CG 3.85Å; F175-H236 HydrophobicContact CZ-CB 4.16Å; F175-H236 AromaticContact CZ-CD2 3.65Å; F175-H236 AromaticContact CZ-CG 3.91Å
176	L	97.9	Very high	91.8	Very high	0 Å²	0	57 Å²	57	0%	0	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110	136.6	-179.8	170.9	69.2	0	0	0	110.1	F158 I178 R192 T193 W204 C225 T226 V227 F242	F158-L176 HydrophobicContact CB-CD2 3.97Å; F158-L176 HydrophobicContact CD1-CD2 4.31Å; F158-L176 HydrophobicContact CD2-CD2 3.92Å; F158-L176 HydrophobicContact CE2-CD2 4.49Å; F158-L176 HydrophobicContact CG-CD2 3.82Å; L176-I178 HydrophobicContact CD2-CD1 4.5Å; L176-I178 HydrophobicContact CD2-CG1 4.41Å; L176-I178 HydrophobicContact CG-CG1 4.33Å; L176-R192 WeakPolarHBondContact O-CA 3.02Å; L176-T193 HydrophobicContact CB-CG2 3.89Å; L176-T193 HydrophobicContact CD2-CG2 4.35Å; L176-T193 HydrophobicContact CG-CG2 4.44Å; L176-T193 PolarHBondContact N-OG1 3.41Å; L176-T193 PolarHBondContact O-N 2.8Å; L176-T193 PolarHBondContact O-OG1 2.89Å; L176-W204 HydrophobicContact CB-CD2 4.44Å; L176-W204 HydrophobicContact CB-CE3 4.49Å; L176-W204 HydrophobicContact CB-CH2 4.2Å; L176-W204 HydrophobicContact CB-CZ2 4.14Å; L176-W204 HydrophobicContact CB-CZ3 4.39Å; L176-W204 HydrophobicContact CD2-CZ3 4.47Å; L176-C225 HydrophobicContact CD1-CB 4.12Å; L176-T226 WeakPolarHBondContact CA-O 3.39Å; L176-V227 HydrophobicContact CD1-CG2 4.05Å; L176-F242 HydrophobicContact CD1-CE1 4.23Å
177	E	98	Very high	91.9	Very high	14 Å²	14	60 Å²	60	7%	0.065	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	138.3	168.3	-61	-174.5	132.2	0	0	110.5	F175 F179 L189 H191 R192 C225 T226 W228	F175-E177 HydrophobicContact CD2-CG 4.05Å; F175-E177 HydrophobicContact CE2-CG 3.83Å; E177-F179 HydrophobicContact CB-CD2 4.24Å; E177-F179 HydrophobicContact CB-CE2 3.51Å; E177-F179 HydrophobicContact CB-CZ 4.15Å; E177-F179 HydrophobicContact CG-CE2 4.44Å; E177-F179 WeakPolarHBondContact OE2-CZ 3.2Å; E177-L189 HydrophobicContact CB-CD1 3.94Å; E177-L189 HydrophobicContact CG-CD1 4.3Å; E177-H191 WeakPolarHBondContact CA-O 3.43Å; E177-R192 HydrophobicContact CG-CB 4.29Å; E177-R192 HydrophobicContact CG-CG 4Å; E177-R192 IonicContact OE1-CZ 2.99Å; E177-R192 IonicContact OE1-NE 3.08Å; E177-R192 PolarHBondContact OE1-NE 3.22Å; E177-R192 IonicContact OE1-NH2 2.74Å; E177-R192 PolarHBondContact OE1-NH2 3.41Å; E177-C225 CarbonylContact O-C 3.51Å; E177-C225 VanDerWaalsContact O-CA 3.3Å; E177-C225 WeakPolarHBondContact O-CA 3.26Å; E177-T226 PolarHBondContact N-O 3.29Å; E177-T226 PolarHBondContact O-N 3.06Å; E177-W228 PolarHBondContact OE2-NE1 3.46Å; E177-W228 VanDerWaalsContact OE2-NE1 3.1Å
178	I	97.9	Very high	92.1	Very high	3 Å²	3	60 Å²	60	2%	0.015	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116	126.3	176.3	-55.2	178.8	0	0	0	108	F158 L176 V190 H191 F207 L214	F158-I178 HydrophobicContact CE2-CD1 3.9Å; F158-I178 HydrophobicContact CZ-CD1 4.29Å; L176-I178 HydrophobicContact CD2-CD1 4.5Å; L176-I178 HydrophobicContact CD2-CG1 4.41Å; L176-I178 HydrophobicContact CG-CG1 4.33Å; I178-V190 HydrophobicContact CG2-CB 4.45Å; I178-V190 WeakPolarHBondContact O-CB 3.28Å; I178-V190 PolarHBondContact O-N 3Å; I178-H191 PolarHBondContact N-O 2.67Å; I178-H191 PolarHBondContact O-N 3Å; I178-F207 HydrophobicContact CD1-CE2 4.31Å; I178-F207 HydrophobicContact CD1-CZ 3.6Å; I178-L214 HydrophobicContact CG2-CD1 4.33Å
179	F	97.3	Very high	92.7	Very high	35 Å²	35	54.8 Å²	54.8	15%	0.154	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	137.6	177.7	-63.9	-95.4	0	0	0	110.3	E177 E187 S188 L189 L223 K224	E177-F179 HydrophobicContact CB-CD2 4.24Å; E177-F179 HydrophobicContact CB-CE2 3.51Å; E177-F179 HydrophobicContact CB-CZ 4.15Å; E177-F179 HydrophobicContact CG-CE2 4.44Å; E177-F179 WeakPolarHBondContact OE2-CZ 3.2Å; F179-E187 HydrophobicContact CB-CB 4.23Å; F179-E187 HydrophobicContact CD1-CB 4.08Å; F179-E187 HydrophobicContact CG-CB 4.44Å; F179-S188 CarbonylContact C-O 3.53Å; F179-S188 VanDerWaalsContact CA-O 3.25Å; F179-S188 WeakPolarHBondContact CA-O 3.49Å; F179-L189 HydrophobicContact CD1-CB 4Å; F179-L189 HydrophobicContact CD1-CD1 4.23Å; F179-L189 HydrophobicContact CE1-CB 3.74Å; F179-L189 HydrophobicContact CE1-CD1 3.8Å; F179-L189 HydrophobicContact CE1-CG 4.34Å; F179-L189 HydrophobicContact CE2-CD1 4.11Å; F179-L189 HydrophobicContact CZ-CB 4.49Å; F179-L189 HydrophobicContact CZ-CD1 3.72Å; F179-L223 CarbonylContact O-C 3.26Å; F179-L223 VanDerWaalsContact O-CA 3.31Å; F179-L223 WeakPolarHBondContact O-CA 3.19Å; F179-K224 HydrophobicContact CB-CB 4.37Å; F179-K224 PolarHBondContact N-O 2.83Å; F179-K224 PolarHBondContact O-N 2.84Å
180	R	95.5	Very high	93.2	Very high	49 Å²	49	45.6 Å²	45.6	19%	0.185	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.2	131.2	165.9	-176.9	-174.1	72.6	-160	-4.8	108.6	N182 E187 S188 V190 N212 L214 S216 R221 L223	R180-N182 PolarHBondContact NE-OD1 3.47Å; R180-N182 PolarHBondContact NH2-OD1 3Å; R180-E187 WeakPolarHBondContact O-CA 3.39Å; R180-S188 PolarHBondContact N-O 3.03Å; R180-S188 PolarHBondContact O-N 2.76Å; R180-V190 HydrophobicContact CB-CG2 3.69Å; R180-N212 PolarHBondContact NH1-O 3.23Å; R180-L214 WeakPolarHBondContact CG-O 3.4Å; R180-S216 PolarHBondContact NH1-OG 2.92Å; R180-R221 HydrophobicContact CG-CG 4.3Å; R180-L223 HydrophobicContact CB-CD2 4.47Å
181	V	94.4	Very high	93.5	Very high	30 Å²	30	45.3 Å²	45.3	18%	0.182	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.2	120.4	170.2	-173.1	0	0	0	0	108.9	R221 E222 K224	V181-R221 PolarHBondContact O-NH1 2.93Å; V181-E222 HydrophobicContact CB-CB 4.26Å; V181-E222 HydrophobicContact CG2-CB 4.18Å; V181-E222 HydrophobicContact CG2-CG 4.27Å; V181-E222 PolarHBondContact N-O 3.4Å; V181-E222 VanDerWaalsContact N-O 3.08Å; V181-K224 HydrophobicContact CG2-CB 4.39Å
182	N	89.1	Confident	93.7	Very high	28 Å²	28	47 Å²	47	15%	0.15	25%	0.25	C	C	.	.	P	Polyproline II helix	trans	-82.7	166.3	179.5	-60.6	-42.7	0	0	0	111	R180 D184 G185 T186 S188	R180-N182 PolarHBondContact NE-OD1 3.47Å; R180-N182 PolarHBondContact NH2-OD1 3Å; N182-D184 VanDerWaalsContact CB-OD1 3.31Å; N182-D184 WeakPolarHBondContact CB-OD1 3.42Å; N182-D184 PolarHBondContact O-N 3.2Å; N182-G185 WeakPolarHBondContact O-CA 3.18Å; N182-G185 PolarHBondContact O-N 3.35Å; N182-T186 WeakPolarHBondContact CB-O 3.35Å; N182-T186 PolarHBondContact N-O 3.17Å; N182-T186 PolarHBondContact ND2-O 3.48Å; N182-T186 PolarHBondContact ND2-OG1 3.35Å; N182-S188 PolarHBondContact ND2-OG 3.41Å
183	D	85.9	Confident	93.9	Very high	143 Å²	143	47.5 Å²	47.5	77%	0.765	25%	0.253	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.3	-25.6	-176.7	-61.4	-16.8	0	0	0	113	G185 R221	D183-G185 VanDerWaalsContact C-N 3.27Å; D183-R221 IonicContact OD1-CZ 2.73Å; D183-R221 IonicContact OD1-NH1 2.64Å; D183-R221 PolarHBondContact OD1-NH1 2.78Å; D183-R221 IonicContact OD1-NH2 3.79Å; D183-R221 PolarHBondContact OD1-NH2 3.15Å; D183-R221 IonicContact OD2-NH2 3.16Å
184	D	88.6	Confident	93.9	Very high	120 Å²	120	49.3 Å²	49.3	64%	0.642	26%	0.261	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.3	3	175.2	68.4	-7.8	0	0	0	113.4	N182 T186	N182-D184 VanDerWaalsContact CB-OD1 3.31Å; N182-D184 WeakPolarHBondContact CB-OD1 3.42Å; N182-D184 PolarHBondContact O-N 3.2Å; D184-T186 VanDerWaalsContact C-N 3.27Å; D184-T186 PolarHBondContact O-N 3.01Å; D184-T186 VanDerWaalsContact OD1-CB 3.31Å; D184-T186 WeakPolarHBondContact OD1-CB 3.3Å; D184-T186 WeakPolarHBondContact OD1-CG2 3.34Å; D184-T186 PolarHBondContact OD1-N 2.87Å; D184-T186 PolarHBondContact OD1-OG1 3.39Å; D184-T186 WeakPolarHBondContact OD2-CG2 3.47Å; D184-T186 PolarHBondContact OD2-OG1 2.96Å
185	G	88.4	Confident	93.9	Very high	51 Å²	51	51.4 Å²	51.4	53%	0.526	27%	0.274	S	S	.	.	S	Bend	trans	78.9	2.1	-177.5	0	0	0	0	0	114.6	N182 D183	N182-G185 WeakPolarHBondContact O-CA 3.18Å; N182-G185 PolarHBondContact O-N 3.35Å; D183-G185 VanDerWaalsContact C-N 3.27Å
186	T	90.7	Very high	93.8	Very high	67 Å²	67	52.6 Å²	52.6	41%	0.411	28%	0.281	S	S	.	.			trans	-73.2	154.1	172.5	64.5	0	0	0	0	111.2	N182 D184	N182-T186 WeakPolarHBondContact CB-O 3.35Å; N182-T186 PolarHBondContact N-O 3.17Å; N182-T186 PolarHBondContact ND2-O 3.48Å; N182-T186 PolarHBondContact ND2-OG1 3.35Å; D184-T186 VanDerWaalsContact C-N 3.27Å; D184-T186 PolarHBondContact O-N 3.01Å; D184-T186 VanDerWaalsContact OD1-CB 3.31Å; D184-T186 WeakPolarHBondContact OD1-CB 3.3Å; D184-T186 WeakPolarHBondContact OD1-CG2 3.34Å; D184-T186 PolarHBondContact OD1-N 2.87Å; D184-T186 PolarHBondContact OD1-OG1 3.39Å; D184-T186 WeakPolarHBondContact OD2-CG2 3.47Å; D184-T186 PolarHBondContact OD2-OG1 2.96Å
187	E	93.9	Very high	93.6	Very high	91 Å²	91	57.8 Å²	57.8	43%	0.425	31%	0.306	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106	131.6	-179.6	-66.9	173.8	-167.9	0	0	109.8	F179 R180 K224	F179-E187 HydrophobicContact CB-CB 4.23Å; F179-E187 HydrophobicContact CD1-CB 4.08Å; F179-E187 HydrophobicContact CG-CB 4.44Å; R180-E187 WeakPolarHBondContact O-CA 3.39Å; E187-K224 WeakPolarHBondContact OE1-CD 3.23Å; E187-K224 IonicContact OE1-NZ 3.93Å; E187-K224 PolarHBondContact OE1-NZ 2.96Å; E187-K224 IonicContact OE2-NZ 2.68Å; E187-K224 PolarHBondContact OE2-NZ 3.33Å
188	S	90.8	Very high	93.4	Very high	43 Å²	43	61.4 Å²	61.4	30%	0.301	33%	0.326	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	123.6	173.1	-64.1	0	0	0	0	109.9	F179 R180 N182 V190	F179-S188 CarbonylContact C-O 3.53Å; F179-S188 VanDerWaalsContact CA-O 3.25Å; F179-S188 WeakPolarHBondContact CA-O 3.49Å; R180-S188 PolarHBondContact N-O 3.03Å; R180-S188 PolarHBondContact O-N 2.76Å; N182-S188 PolarHBondContact ND2-OG 3.41Å; S188-V190 PolarHBondContact O-N 3.5Å
189	L	93.1	Very high	93.2	Very high	83 Å²	83	63.8 Å²	63.8	44%	0.435	34%	0.339	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.3	119.6	176.2	-179.3	66.7	0	0	0	109.4	E177 F179	E177-L189 HydrophobicContact CB-CD1 3.94Å; E177-L189 HydrophobicContact CG-CD1 4.3Å; F179-L189 HydrophobicContact CD1-CB 4Å; F179-L189 HydrophobicContact CD1-CD1 4.23Å; F179-L189 HydrophobicContact CE1-CB 3.74Å; F179-L189 HydrophobicContact CE1-CD1 3.8Å; F179-L189 HydrophobicContact CE1-CG 4.34Å; F179-L189 HydrophobicContact CE2-CD1 4.11Å; F179-L189 HydrophobicContact CZ-CB 4.49Å; F179-L189 HydrophobicContact CZ-CD1 3.72Å
190	V	92.5	Very high	93.2	Very high	19 Å²	19	63.9 Å²	63.9	12%	0.115	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.2	-47.3	179.2	174	0	0	0	0	110.2	I178 R180 S188 V209 T213 L214	I178-V190 HydrophobicContact CG2-CB 4.45Å; I178-V190 WeakPolarHBondContact O-CB 3.28Å; I178-V190 PolarHBondContact O-N 3Å; R180-V190 HydrophobicContact CB-CG2 3.69Å; S188-V190 PolarHBondContact O-N 3.5Å; V190-V209 HydrophobicContact CG1-CG1 4.45Å; V190-V209 HydrophobicContact CG1-CG2 3.67Å; V190-T213 HydrophobicContact CG1-CG2 4.21Å; V190-T213 WeakPolarHBondContact CG2-O 3.41Å; V190-L214 HydrophobicContact CG1-CB 4.4Å; V190-L214 HydrophobicContact CG1-CD1 3.82Å
191	H	96	Very high	93.3	Very high	48 Å²	48	64.1 Å²	64.1	22%	0.222	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.4	148.3	-177	-169.4	72.9	0	0	0	111.7	E177 I178 F207	E177-H191 WeakPolarHBondContact CA-O 3.43Å; I178-H191 PolarHBondContact N-O 2.67Å; I178-H191 PolarHBondContact O-N 3Å; H191-F207 HydrophobicContact CB-CD2 4.22Å; H191-F207 HydrophobicContact CB-CE2 3.91Å; H191-F207 HydrophobicContact CB-CZ 4.45Å; H191-F207 AromaticContact CD2-CD1 3.53Å; H191-F207 AromaticContact CD2-CD2 3.45Å; H191-F207 VanDerWaalsContact CD2-CD2 3.45Å; H191-F207 WeakPolarHBondContact CD2-CD2 3.5Å; H191-F207 AromaticContact CD2-CE1 3.65Å; H191-F207 AromaticContact CD2-CE2 3.57Å; H191-F207 AromaticContact CD2-CG 3.43Å; H191-F207 VanDerWaalsContact CD2-CG 3.43Å; H191-F207 WeakPolarHBondContact CD2-CG 3.16Å; H191-F207 AromaticContact CD2-CZ 3.68Å; H191-F207 VanDerWaalsContact CE1-CB 3.49Å; H191-F207 WeakPolarHBondContact CE1-CB 3.18Å; H191-F207 AromaticContact CE1-CD2 3.78Å; H191-F207 AromaticContact CE1-CG 3.59Å; H191-F207 AromaticContact CG-CD2 3.52Å; H191-F207 AromaticContact CG-CE2 3.64Å; H191-F207 AromaticContact CG-CG 3.94Å; H191-F207 AromaticContact ND1-CD2 3.72Å; H191-F207 WeakPolarHBondContact NE2-CB 3.27Å; H191-F207 AromaticContact NE2-CD1 3.43Å; H191-F207 WeakPolarHBondContact NE2-CD1 3.5Å; H191-F207 AromaticContact NE2-CD2 3.64Å; H191-F207 AromaticContact NE2-CG 3.2Å; H191-F207 WeakPolarHBondContact NE2-CG 3.48Å
192	R	96.9	Very high	93.4	Very high	135 Å²	135	62.7 Å²	62.7	51%	0.509	34%	0.341	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.2	126.9	169.4	180	-174.5	-65.7	160.3	-2.4	108.7	F175 L176 E177	F175-R192 HydrophobicContact CD2-CG 3.88Å; F175-R192 HydrophobicContact CE2-CG 4.33Å; L176-R192 WeakPolarHBondContact O-CA 3.02Å; E177-R192 HydrophobicContact CG-CB 4.29Å; E177-R192 HydrophobicContact CG-CG 4Å; E177-R192 IonicContact OE1-CZ 2.99Å; E177-R192 IonicContact OE1-NE 3.08Å; E177-R192 PolarHBondContact OE1-NE 3.22Å; E177-R192 IonicContact OE1-NH2 2.74Å; E177-R192 PolarHBondContact OE1-NH2 3.41Å
193	T	97.1	Very high	93.9	Very high	10 Å²	10	66 Å²	66	6%	0.061	36%	0.362	C	S	.	.	P	Polyproline II helix	trans	-73.8	171.3	177.6	66.7	0	0	0	0	111.8	L176 W204 F207	L176-T193 HydrophobicContact CB-CG2 3.89Å; L176-T193 HydrophobicContact CD2-CG2 4.35Å; L176-T193 HydrophobicContact CG-CG2 4.44Å; L176-T193 PolarHBondContact N-OG1 3.41Å; L176-T193 PolarHBondContact O-N 2.8Å; L176-T193 PolarHBondContact O-OG1 2.89Å; T193-W204 HydrophobicContact CG2-CB 4.02Å; T193-W204 HydrophobicContact CG2-CG 4.05Å; T193-W204 VanDerWaalsContact OG1-CD1 3.24Å; T193-W204 PolarHBondContact OG1-NE1 2.72Å; T193-F207 HydrophobicContact CG2-CE1 4.35Å
194	E	95.1	Very high	94.4	Very high	63 Å²	63	59.4 Å²	59.4	29%	0.294	33%	0.327	S	S	.	.	P	Polyproline II helix	trans	-65.3	158.4	163.6	78.5	-72.6	-178.7	0	0	112.2	W204 K205	E194-W204 PolarHBondContact O-NE1 2.77Å; E194-W204 VanDerWaalsContact OE1-CA 3.27Å; E194-W204 WeakPolarHBondContact OE1-CA 3.39Å; E194-K205 WeakPolarHBondContact OE1-CG 3.41Å; E194-K205 PolarHBondContact OE1-N 3.12Å; E194-K205 PolarHBondContact OE2-N 3.11Å
195	T	95.4	Very high	94.8	Very high	44 Å²	44	60.9 Å²	60.9	27%	0.27	33%	0.327	S	S	.	.	P	Polyproline II helix	trans	-80.4	130.7	169.5	-57.1	0	0	0	0	110.3	D173 M197 W230	D173-T195 HydrophobicContact CB-CG2 3.85Å; D173-T195 WeakPolarHBondContact O-CG2 3.45Å; T195-M197 HydrophobicContact CG2-CE 4.29Å; T195-M197 HydrophobicContact CG2-SD 3.68Å; T195-W230 HydrophobicContact CG2-CB 3.45Å; T195-W230 VanDerWaalsContact CG2-CB 3.45Å; T195-W230 HydrophobicContact CG2-CD2 4.48Å; T195-W230 HydrophobicContact CG2-CG 3.93Å
196	V	95.1	Very high	95.1	Very high	29 Å²	29	61.6 Å²	61.6	18%	0.176	32%	0.324	C	S	.	.			trans	-105.9	109.7	174.1	-178.4	0	0	0	0	109.3	D173 P174 N199 P202	D173-V196 CarbonylContact C-O 3.53Å; D173-V196 WeakPolarHBondContact CA-O 3.45Å; P174-V196 WeakPolarHBondContact CD-O 3.3Å; P174-V196 PolarHBondContact O-N 3.47Å; P174-V196 VanDerWaalsContact O-N 3.09Å; V196-N199 HydrophobicContact CG1-CB 3.85Å; V196-P202 HydrophobicContact CB-CB 3.84Å; V196-P202 HydrophobicContact CG1-CB 4.06Å; V196-P202 HydrophobicContact CG2-CB 3.95Å
197	M	94	Very high	95.3	Very high	108 Å²	108	59.3 Å²	59.3	53%	0.532	31%	0.309	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.9	140.4	-173.2	-54.5	-57.5	-159.7	0	0	113.4	D173 T195 N199 W230	D173-M197 HydrophobicContact CB-SD 3.79Å; D173-M197 WeakPolarHBondContact OD1-CA 3.39Å; T195-M197 HydrophobicContact CG2-CE 4.29Å; T195-M197 HydrophobicContact CG2-SD 3.68Å; M197-N199 PolarHBondContact O-N 3.24Å; M197-W230 HydrophobicContact CE-CE3 4.01Å; M197-W230 HydrophobicContact CE-CZ3 3.98Å; M197-W230 HydrophobicContact SD-CE3 4.43Å
198	N	93.5	Very high	95.2	Very high	90 Å²	90	61 Å²	61	48%	0.481	32%	0.315	S	S	.	.	T	Hydrogen-bonded Turn	trans	54	48.4	169	-166.9	12	0	0	0	113.3	K171 D173	K171-N198 WeakPolarHBondContact CB-OD1 3.41Å; K171-N198 WeakPolarHBondContact CD-OD1 3.02Å; K171-N198 VanDerWaalsContact CG-OD1 3.28Å; K171-N198 WeakPolarHBondContact CG-OD1 3.15Å; K171-N198 PolarHBondContact N-OD1 3.42Å; K171-N198 WeakPolarHBondContact O-CA 3.5Å; D173-N198 PolarHBondContact OD1-N 3.44Å
199	N	94.5	Very high	95.2	Very high	53 Å²	53	59.5 Å²	59.5	28%	0.283	30%	0.304	S	S	.	.			trans	-148	108.4	-169.8	-166.9	-10.2	0	0	0	113.9	S172 P174 V196 M197 S201	S172-N199 PolarHBondContact O-N 3.34Å; P174-N199 VanDerWaalsContact CD-O 3.28Å; P174-N199 WeakPolarHBondContact CD-O 3.14Å; P174-N199 WeakPolarHBondContact CG-O 3.43Å; V196-N199 HydrophobicContact CG1-CB 3.85Å; M197-N199 PolarHBondContact O-N 3.24Å; N199-S201 PolarHBondContact O-N 3.08Å; N199-S201 WeakPolarHBondContact OD1-CA 3.34Å; N199-S201 PolarHBondContact OD1-N 3.38Å; N199-S201 PolarHBondContact OD1-O 3.46Å
200	L	96.2	Very high	95	Very high	38 Å²	38	56.4 Å²	56.4	20%	0.199	29%	0.289	C	S	.	.	S	Bend	trans	-80.2	4.2	174.3	-53.3	-179.5	0	0	0	114	R161 K162 L163 D165 K171	R161-L200 CarbonylContact C-O 3.54Å; K162-L200 PolarHBondContact N-O 3.15Å; L163-L200 HydrophobicContact CB-CB 4.48Å; L163-L200 PolarHBondContact N-O 2.6Å; D165-L200 HydrophobicContact CB-CD1 4.06Å; D165-L200 HydrophobicContact CB-CD2 3.98Å; K171-L200 HydrophobicContact CB-CD2 4.01Å; K171-L200 HydrophobicContact CB-CG 4.04Å; K171-L200 HydrophobicContact CD-CG 4.2Å; K171-L200 HydrophobicContact CG-CD1 4.48Å; K171-L200 HydrophobicContact CG-CG 4.23Å
201	S	97.7	Very high	94.8	Very high	53 Å²	53	55.6 Å²	55.6	37%	0.371	28%	0.284	S	S	.	.	S	Bend	trans	-141.2	60.7	176.6	-60.3	0	0	0	0	110.9	A160 K162 N199	A160-S201 CarbonylContact O-C 3.58Å; A160-S201 VanDerWaalsContact O-C 3.26Å; A160-S201 WeakPolarHBondContact O-CA 3.35Å; A160-S201 WeakPolarHBondContact O-CB 3.42Å; K162-S201 PolarHBondContact N-OG 3.41Å; N199-S201 PolarHBondContact O-N 3.08Å; N199-S201 WeakPolarHBondContact OD1-CA 3.34Å; N199-S201 PolarHBondContact OD1-N 3.38Å; N199-S201 PolarHBondContact OD1-O 3.46Å
202	P	97.9	Very high	94.3	Very high	0 Å²	0	56.3 Å²	56.3	0%	0	29%	0.289	C	S	.	.			trans	-67.2	150.6	-175	32.9	-40	0	0	0	111.6	S159 A160 L163 P174 V196 W204	S159-P202 CarbonylContact C-O 3.51Å; S159-P202 VanDerWaalsContact CA-O 3.24Å; S159-P202 WeakPolarHBondContact CA-O 3.24Å; S159-P202 WeakPolarHBondContact CB-O 3.36Å; A160-P202 HydrophobicContact CB-CG 3.96Å; A160-P202 PolarHBondContact N-O 3.41Å; L163-P202 HydrophobicContact CD1-CG 3.92Å; P174-P202 HydrophobicContact CB-CG 4.23Å; P174-P202 HydrophobicContact CG-CB 3.88Å; P174-P202 HydrophobicContact CG-CG 3.55Å; V196-P202 HydrophobicContact CB-CB 3.84Å; V196-P202 HydrophobicContact CG1-CB 4.06Å; V196-P202 HydrophobicContact CG2-CB 3.95Å; P202-W204 HydrophobicContact CB-CD2 4.43Å; P202-W204 HydrophobicContact CB-CZ2 4.13Å; P202-W204 HydrophobicContact CG-CD2 4.41Å; P202-W204 HydrophobicContact CG-CH2 3.69Å; P202-W204 HydrophobicContact CG-CZ2 3.43Å; P202-W204 VanDerWaalsContact CG-CZ2 3.43Å; P202-W204 HydrophobicContact CG-CZ3 4.26Å
203	V	98	Very high	93.9	Very high	98 Å²	98	53 Å²	53	59%	0.594	29%	0.285	S	S	*	.	B	Isolated β-bridge	trans	-118.3	112.3	162.7	-178.9	0	0	0	0	105.4
204	W	97.9	Very high	93.6	Very high	5 Å²	5	52.6 Å²	52.6	2%	0.019	28%	0.282	C	S	.	.	P	Polyproline II helix	trans	-84.2	154.9	178.9	-61	-75.4	0	0	0	110.6	F158 A160 P174 L176 T193 E194 P202 V227	F158-W204 HydrophobicContact CB-CE3 3.81Å; F158-W204 HydrophobicContact CB-CZ3 4.17Å; F158-W204 PolarHBondContact O-N 3.35Å; F158-W204 VanDerWaalsContact O-N 3.15Å; A160-W204 HydrophobicContact CB-CH2 3.68Å; A160-W204 HydrophobicContact CB-CZ3 3.91Å; P174-W204 HydrophobicContact CB-CZ2 4.21Å; P174-W204 PolarHBondContact O-NE1 2.99Å; L176-W204 HydrophobicContact CB-CD2 4.44Å; L176-W204 HydrophobicContact CB-CE3 4.49Å; L176-W204 HydrophobicContact CB-CH2 4.2Å; L176-W204 HydrophobicContact CB-CZ2 4.14Å; L176-W204 HydrophobicContact CB-CZ3 4.39Å; L176-W204 HydrophobicContact CD2-CZ3 4.47Å; T193-W204 HydrophobicContact CG2-CB 4.02Å; T193-W204 HydrophobicContact CG2-CG 4.05Å; T193-W204 VanDerWaalsContact OG1-CD1 3.24Å; T193-W204 PolarHBondContact OG1-NE1 2.72Å; E194-W204 PolarHBondContact O-NE1 2.77Å; E194-W204 VanDerWaalsContact OE1-CA 3.27Å; E194-W204 WeakPolarHBondContact OE1-CA 3.39Å; P202-W204 HydrophobicContact CB-CD2 4.43Å; P202-W204 HydrophobicContact CB-CZ2 4.13Å; P202-W204 HydrophobicContact CG-CD2 4.41Å; P202-W204 HydrophobicContact CG-CH2 3.69Å; P202-W204 HydrophobicContact CG-CZ2 3.43Å; P202-W204 VanDerWaalsContact CG-CZ2 3.43Å; P202-W204 HydrophobicContact CG-CZ3 4.26Å; W204-V227 HydrophobicContact CZ2-CG1 4.49Å
205	K	95.3	Very high	93.3	Very high	150 Å²	150	49.6 Å²	49.6	65%	0.652	27%	0.268	S	S	*	.	P	Polyproline II helix	trans	-61.5	145.8	174.6	-70.6	172.4	-176.1	177.3	0	110.4	E194	E194-K205 WeakPolarHBondContact OE1-CG 3.41Å; E194-K205 PolarHBondContact OE1-N 3.12Å; E194-K205 PolarHBondContact OE2-N 3.11Å
206	S	95.6	Very high	92.8	Very high	66 Å²	66	50 Å²	50	46%	0.462	27%	0.273	S	S	.	.	P	Polyproline II helix	trans	-62.6	144.5	169.6	-54.5	0	0	0	0	110.4	L156	L156-S206 VanDerWaalsContact O-CA 3.3Å; L156-S206 WeakPolarHBondContact O-CA 3.43Å
207	F	94.7	Very high	91.9	Very high	19 Å²	19	50.3 Å²	50.3	8%	0.083	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.1	158.7	176.6	63.1	-90.4	0	0	0	110.8	E155 L156 F158 I178 H191 T193 V209	E155-F207 WeakPolarHBondContact CA-O 3.43Å; L156-F207 HydrophobicContact CB-CE1 4.08Å; L156-F207 HydrophobicContact CB-CE2 3.97Å; L156-F207 HydrophobicContact CB-CZ 3.67Å; L156-F207 HydrophobicContact CD1-CE2 3.92Å; L156-F207 HydrophobicContact CD1-CZ 3.95Å; L156-F207 HydrophobicContact CG-CE2 4.45Å; L156-F207 HydrophobicContact CG-CZ 4.43Å; L156-F207 PolarHBondContact N-O 2.93Å; L156-F207 PolarHBondContact O-N 3.27Å; F158-F207 AromaticContact CD2-CE1 3.97Å; F158-F207 HydrophobicContact CD2-CE1 3.97Å; F158-F207 HydrophobicContact CD2-CZ 4.25Å; F158-F207 HydrophobicContact CE2-CE1 4.16Å; F158-F207 AromaticContact CE2-CZ 3.97Å; F158-F207 HydrophobicContact CE2-CZ 3.97Å; I178-F207 HydrophobicContact CD1-CE2 4.31Å; I178-F207 HydrophobicContact CD1-CZ 3.6Å; H191-F207 HydrophobicContact CB-CD2 4.22Å; H191-F207 HydrophobicContact CB-CE2 3.91Å; H191-F207 HydrophobicContact CB-CZ 4.45Å; H191-F207 AromaticContact CD2-CD1 3.53Å; H191-F207 AromaticContact CD2-CD2 3.45Å; H191-F207 VanDerWaalsContact CD2-CD2 3.45Å; H191-F207 WeakPolarHBondContact CD2-CD2 3.5Å; H191-F207 AromaticContact CD2-CE1 3.65Å; H191-F207 AromaticContact CD2-CE2 3.57Å; H191-F207 AromaticContact CD2-CG 3.43Å; H191-F207 VanDerWaalsContact CD2-CG 3.43Å; H191-F207 WeakPolarHBondContact CD2-CG 3.16Å; H191-F207 AromaticContact CD2-CZ 3.68Å; H191-F207 VanDerWaalsContact CE1-CB 3.49Å; H191-F207 WeakPolarHBondContact CE1-CB 3.18Å; H191-F207 AromaticContact CE1-CD2 3.78Å; H191-F207 AromaticContact CE1-CG 3.59Å; H191-F207 AromaticContact CG-CD2 3.52Å; H191-F207 AromaticContact CG-CE2 3.64Å; H191-F207 AromaticContact CG-CG 3.94Å; H191-F207 AromaticContact ND1-CD2 3.72Å; H191-F207 WeakPolarHBondContact NE2-CB 3.27Å; H191-F207 AromaticContact NE2-CD1 3.43Å; H191-F207 WeakPolarHBondContact NE2-CD1 3.5Å; H191-F207 AromaticContact NE2-CD2 3.64Å; H191-F207 AromaticContact NE2-CG 3.2Å; H191-F207 WeakPolarHBondContact NE2-CG 3.48Å; T193-F207 HydrophobicContact CG2-CE1 4.35Å; F207-V209 HydrophobicContact CE2-CG1 4.38Å
208	K	92.6	Very high	91.6	Very high	127 Å²	127	48.3 Å²	48.3	55%	0.552	27%	0.273	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-113.6	140.9	176.9	-62.7	-178.1	-176.9	-177.7	0	110.1	Y153 V154 E155 I289	Y153-K208 HydrophobicContact CD1-CB 4.24Å; V154-K208 WeakPolarHBondContact O-CA 3.43Å; E155-K208 HydrophobicContact CB-CG 4.18Å; E155-K208 HydrophobicContact CG-CG 4.38Å; K208-I289 HydrophobicContact CD-CD1 3.69Å; K208-I289 HydrophobicContact CG-CD1 4.16Å
209	V	90.9	Very high	91.5	Very high	11 Å²	11	47.5 Å²	47.5	7%	0.067	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.8	141.3	172.6	62.7	0	0	0	0	110	Y153 V154 V190 F207 T213 L214	Y153-V209 WeakPolarHBondContact CA-O 3.48Å; Y153-V209 VanDerWaalsContact CD1-C 3.42Å; V154-V209 HydrophobicContact CG1-CG1 3.77Å; V154-V209 PolarHBondContact N-O 2.71Å; V154-V209 PolarHBondContact O-N 3.37Å; V190-V209 HydrophobicContact CG1-CG1 4.45Å; V190-V209 HydrophobicContact CG1-CG2 3.67Å; F207-V209 HydrophobicContact CE2-CG1 4.38Å; V209-T213 HydrophobicContact CG2-CG2 3.93Å; V209-L214 HydrophobicContact CG1-CB 4.14Å; V209-L214 HydrophobicContact CG1-CD1 4.32Å; V209-L214 HydrophobicContact CG1-CD2 4.42Å
210	S	88.9	Confident	91.5	Very high	18 Å²	18	49.4 Å²	49.4	13%	0.126	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.8	145.2	174.9	65.7	0	0	0	0	110.4	D152 N212 T213 L214	D152-S210 CarbonylContact O-C 3.56Å; D152-S210 WeakPolarHBondContact O-CA 3.45Å; S210-N212 PolarHBondContact O-N 2.78Å; S210-T213 PolarHBondContact O-N 3.27Å; S210-T213 VanDerWaalsContact O-N 3.16Å; S210-T213 WeakPolarHBondContact OG-CB 3.48Å; S210-T213 PolarHBondContact OG-N 2.94Å; S210-T213 VanDerWaalsContact OG-N 3.07Å; S210-T213 PolarHBondContact OG-OG1 3.44Å; S210-L214 PolarHBondContact O-N 2.75Å
211	L	87.8	Confident	91.4	Very high	2 Å²	2	49.2 Å²	49.2	1%	0.01	27%	0.273	C	S	.	.	H	α-helix	trans	-60.4	-32.8	175	-71.2	-176.3	0	0	0	112.7	D152 V154 L214 C215 S216 Y246	D152-L211 HydrophobicContact CB-CD1 3.75Å; D152-L211 HydrophobicContact CB-CG 4.21Å; D152-L211 WeakPolarHBondContact O-CG 3.33Å; D152-L211 PolarHBondContact O-N 3Å; V154-L211 HydrophobicContact CB-CD2 4.15Å; V154-L211 HydrophobicContact CG1-CD2 4.12Å; L211-L214 PolarHBondContact O-N 3Å; L211-C215 PolarHBondContact O-N 3.4Å; L211-C215 PolarHBondContact O-SG 3.13Å; L211-C215 VanDerWaalsContact O-SG 3.36Å; L211-S216 PolarHBondContact O-N 2.99Å; L211-Y246 HydrophobicContact CD1-CE1 4.21Å; L211-Y246 HydrophobicContact CD2-CD1 4.12Å; L211-Y246 HydrophobicContact CD2-CD2 4.12Å; L211-Y246 HydrophobicContact CD2-CE1 3.64Å; L211-Y246 HydrophobicContact CD2-CE2 3.65Å; L211-Y246 HydrophobicContact CD2-CG 4.32Å
212	N	86.1	Confident	91.4	Very high	63 Å²	63	50.3 Å²	50.3	34%	0.337	27%	0.272	S	S	.	.	H	α-helix	trans	-63.3	-45.8	174.2	-77.2	-25.1	0	0	0	112.4	N150 D151 R180 S210 S216	N150-N212 PolarHBondContact O-ND2 3.21Å; D151-N212 PolarHBondContact OD1-ND2 3.34Å; R180-N212 PolarHBondContact NH1-O 3.23Å; S210-N212 PolarHBondContact O-N 2.78Å; N212-S216 WeakPolarHBondContact O-CA 3.41Å; N212-S216 PolarHBondContact O-N 3.31Å
213	T	86.8	Confident	91.4	Very high	66 Å²	66	50.4 Å²	50.4	41%	0.405	27%	0.273	S	S	.	.	H	α-helix	trans	-65.3	-42.1	174.8	-57.7	0	0	0	0	111.5	V190 V209 S210	V190-T213 HydrophobicContact CG1-CG2 4.21Å; V190-T213 WeakPolarHBondContact CG2-O 3.41Å; V209-T213 HydrophobicContact CG2-CG2 3.93Å; S210-T213 PolarHBondContact O-N 3.27Å; S210-T213 VanDerWaalsContact O-N 3.16Å; S210-T213 WeakPolarHBondContact OG-CB 3.48Å; S210-T213 PolarHBondContact OG-N 2.94Å; S210-T213 VanDerWaalsContact OG-N 3.07Å; S210-T213 PolarHBondContact OG-OG1 3.44Å
214	L	91.1	Very high	91.4	Very high	1 Å²	1	47.8 Å²	47.8	1%	0.005	25%	0.253	C	S	.	.	H	α-helix	trans	-66.6	-52	-178.3	-176.5	64.7	0	0	0	112.1	V154 L156 I178 R180 V190 V209 S210 L211 L223 Y246 M249	V154-L214 HydrophobicContact CG1-CD2 3.53Å; L156-L214 HydrophobicContact CD1-CD2 4.43Å; I178-L214 HydrophobicContact CG2-CD1 4.33Å; R180-L214 WeakPolarHBondContact CG-O 3.4Å; V190-L214 HydrophobicContact CG1-CB 4.4Å; V190-L214 HydrophobicContact CG1-CD1 3.82Å; V209-L214 HydrophobicContact CG1-CB 4.14Å; V209-L214 HydrophobicContact CG1-CD1 4.32Å; V209-L214 HydrophobicContact CG1-CD2 4.42Å; S210-L214 PolarHBondContact O-N 2.75Å; L211-L214 PolarHBondContact O-N 3Å; L214-L223 HydrophobicContact CD1-CD1 3.72Å; L214-L223 HydrophobicContact CD1-CD2 4.01Å; L214-L223 HydrophobicContact CD2-CD1 4.45Å; L214-L223 HydrophobicContact CG-CD1 4.07Å; L214-L223 HydrophobicContact CG-CD2 4.34Å; L214-L223 WeakPolarHBondContact O-CD2 3.34Å; L214-Y246 HydrophobicContact CD2-CD2 4Å; L214-Y246 HydrophobicContact CD2-CG 4.41Å; L214-M249 HydrophobicContact CD2-CE 4.44Å
215	C	89.1	Confident	91.4	Very high	0 Å²	0	47.6 Å²	47.6	0%	0	25%	0.253	C	S	.	.	H	α-helix	trans	-141.6	10.9	-167.8	71.7	0	0	0	0	114.7	L211 G217 D218 R221	L211-C215 PolarHBondContact O-N 3.4Å; L211-C215 PolarHBondContact O-SG 3.13Å; L211-C215 VanDerWaalsContact O-SG 3.36Å; C215-G217 PolarHBondContact O-N 3.36Å; C215-D218 VanDerWaalsContact CB-O 3.28Å; C215-D218 WeakPolarHBondContact CB-O 3.44Å; C215-D218 PolarHBondContact O-N 2.95Å; C215-R221 HydrophobicContact CB-CB 4.24Å; C215-R221 WeakPolarHBondContact O-CD 3.18Å; C215-R221 PolarHBondContact O-NE 3.3Å
216	S	84.2	Confident	91.6	Very high	54 Å²	54	40.7 Å²	40.7	38%	0.378	22%	0.223	S	C	.	.	T	Hydrogen-bonded Turn	trans	54.7	32.7	-178.5	-53.9	0	0	0	0	113.6	R180 L211 N212 D218	R180-S216 PolarHBondContact NH1-OG 2.92Å; L211-S216 PolarHBondContact O-N 2.99Å; N212-S216 WeakPolarHBondContact O-CA 3.41Å; N212-S216 PolarHBondContact O-N 3.31Å; S216-D218 PolarHBondContact O-N 3.22Å; S216-D218 VanDerWaalsContact O-N 3.14Å
217	G	77.1	Confident	91.7	Very high	34 Å²	34	37.6 Å²	37.6	35%	0.351	20%	0.201	S	C	.	.	T	Hydrogen-bonded Turn	trans	73.9	-8.7	-174.7	0	0	0	0	0	115.2	C215 H219	C215-G217 PolarHBondContact O-N 3.36Å; G217-H219 PolarHBondContact O-CD2 3.2Å; G217-H219 PolarHBondContact O-N 3.13Å
218	D	87.8	Confident	91.8	Very high	66 Å²	66	39.8 Å²	39.8	35%	0.353	21%	0.209	S	C	.	.			trans	-88.3	101	174.7	178.2	3.3	0	0	0	110.1	C215 S216 D220 R221	C215-D218 VanDerWaalsContact CB-O 3.28Å; C215-D218 WeakPolarHBondContact CB-O 3.44Å; C215-D218 PolarHBondContact O-N 2.95Å; S216-D218 PolarHBondContact O-N 3.22Å; S216-D218 VanDerWaalsContact O-N 3.14Å; D218-D220 PolarHBondContact O-N 2.88Å; D218-D220 PolarHBondContact OD1-N 3.34Å; D218-R221 HydrophobicContact CB-CB 4.07Å; D218-R221 WeakPolarHBondContact O-CB 3.42Å; D218-R221 PolarHBondContact O-N 2.93Å; D218-R221 PolarHBondContact OD1-N 3.02Å; D218-R221 IonicContact OD2-NH2 2.77Å
219	H	91.6	Very high	92	Very high	73 Å²	73	33.8 Å²	33.8	34%	0.338	18%	0.183	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66.5	-19	-176.1	-60.3	177.6	0	0	0	113.6	G217 Y246 K247	G217-H219 PolarHBondContact O-CD2 3.2Å; G217-H219 PolarHBondContact O-N 3.13Å; H219-Y246 HydrophobicContact CB-CD1 3.93Å; H219-Y246 AromaticContact CD2-CD1 3.57Å; H219-Y246 AromaticContact CD2-CE1 3.75Å; H219-Y246 AromaticContact CE1-CE1 3.96Å; H219-Y246 AromaticContact CG-CD1 3.64Å; H219-Y246 AromaticContact CG-CE1 3.93Å; H219-Y246 AromaticContact NE2-CE1 3.76Å; H219-K247 HydrophobicContact CB-CB 4.13Å; H219-K247 WeakPolarHBondContact O-CB 3.01Å; H219-K247 PolarHBondContact O-N 2.71Å
220	D	94.8	Very high	92.1	Very high	93 Å²	93	37.4 Å²	37.4	50%	0.497	20%	0.195	S	C	.	.	T	Hydrogen-bonded Turn	trans	-89.6	-4.4	176.8	-76	-78	0	0	0	112.4	D218 E222 T245 K247	D218-D220 PolarHBondContact O-N 2.88Å; D218-D220 PolarHBondContact OD1-N 3.34Å; D220-E222 PolarHBondContact O-N 3.25Å; D220-T245 WeakPolarHBondContact O-CG2 3.33Å; D220-K247 WeakPolarHBondContact OD1-CD 3.44Å; D220-K247 WeakPolarHBondContact OD1-CE 2.99Å; D220-K247 IonicContact OD1-NZ 2.75Å; D220-K247 PolarHBondContact OD1-NZ 3.47Å; D220-K247 WeakPolarHBondContact OD2-CD 3.3Å; D220-K247 IonicContact OD2-NZ 3.98Å; D220-K247 PolarHBondContact OD2-NZ 3.01Å
221	R	94.1	Very high	92.1	Very high	34 Å²	34	38 Å²	38	13%	0.128	20%	0.197	C	C	.	.			trans	-61.8	135.5	179.4	-171.4	167.6	-67.4	-103.8	-5.4	111.8	R180 V181 D183 C215 D218	R180-R221 HydrophobicContact CG-CG 4.3Å; V181-R221 PolarHBondContact O-NH1 2.93Å; D183-R221 IonicContact OD1-CZ 2.73Å; D183-R221 IonicContact OD1-NH1 2.64Å; D183-R221 PolarHBondContact OD1-NH1 2.78Å; D183-R221 IonicContact OD1-NH2 3.79Å; D183-R221 PolarHBondContact OD1-NH2 3.15Å; D183-R221 IonicContact OD2-NH2 3.16Å; C215-R221 HydrophobicContact CB-CB 4.24Å; C215-R221 WeakPolarHBondContact O-CD 3.18Å; C215-R221 PolarHBondContact O-NE 3.3Å; D218-R221 HydrophobicContact CB-CB 4.07Å; D218-R221 WeakPolarHBondContact O-CB 3.42Å; D218-R221 PolarHBondContact O-N 2.93Å; D218-R221 PolarHBondContact OD1-N 3.02Å; D218-R221 IonicContact OD2-NH2 2.77Å
222	E	97.4	Very high	91.9	Very high	77 Å²	77	43 Å²	43	36%	0.36	23%	0.232	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.9	131.4	-177.8	-166.2	-175.2	143.3	0	0	111.7	V181 D220 Q243	V181-E222 HydrophobicContact CB-CB 4.26Å; V181-E222 HydrophobicContact CG2-CB 4.18Å; V181-E222 HydrophobicContact CG2-CG 4.27Å; V181-E222 PolarHBondContact N-O 3.4Å; V181-E222 VanDerWaalsContact N-O 3.08Å; D220-E222 PolarHBondContact O-N 3.25Å; E222-Q243 HydrophobicContact CG-CG 4.48Å; E222-Q243 WeakPolarHBondContact OE1-CG 3.5Å; E222-Q243 PolarHBondContact OE1-NE2 3.25Å
223	L	97.9	Very high	91.7	Very high	2 Å²	2	45.3 Å²	45.3	1%	0.01	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	125.4	171	-57.3	177.7	0	0	0	108.7	F179 R180 L214 Q243 T244 M249	F179-L223 CarbonylContact O-C 3.26Å; F179-L223 VanDerWaalsContact O-CA 3.31Å; F179-L223 WeakPolarHBondContact O-CA 3.19Å; R180-L223 HydrophobicContact CB-CD2 4.47Å; L214-L223 HydrophobicContact CD1-CD1 3.72Å; L214-L223 HydrophobicContact CD1-CD2 4.01Å; L214-L223 HydrophobicContact CD2-CD1 4.45Å; L214-L223 HydrophobicContact CG-CD1 4.07Å; L214-L223 HydrophobicContact CG-CD2 4.34Å; L214-L223 WeakPolarHBondContact O-CD2 3.34Å; L223-Q243 WeakPolarHBondContact O-CA 3.3Å; L223-T244 HydrophobicContact CB-CG2 4.14Å; L223-T244 HydrophobicContact CD1-CG2 4.46Å; L223-T244 PolarHBondContact N-O 3.36Å; L223-T244 PolarHBondContact O-N 2.91Å; L223-M249 HydrophobicContact CD1-CE 3.68Å
224	K	97.9	Very high	91.3	Very high	43 Å²	43	44.6 Å²	44.6	19%	0.187	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.6	123.4	172.8	-178	-173.6	177.7	-169.1	0	109.2	F179 V181 E187 T226 E241	F179-K224 HydrophobicContact CB-CB 4.37Å; F179-K224 PolarHBondContact N-O 2.83Å; F179-K224 PolarHBondContact O-N 2.84Å; V181-K224 HydrophobicContact CG2-CB 4.39Å; E187-K224 WeakPolarHBondContact OE1-CD 3.23Å; E187-K224 IonicContact OE1-NZ 3.93Å; E187-K224 PolarHBondContact OE1-NZ 2.96Å; E187-K224 IonicContact OE2-NZ 2.68Å; E187-K224 PolarHBondContact OE2-NZ 3.33Å; K224-T226 HydrophobicContact CG-CG2 4.4Å; K224-E241 WeakPolarHBondContact CE-OE2 3.27Å; K224-E241 IonicContact NZ-OE2 2.78Å
225	C	98.3	Very high	91.1	Very high	1 Å²	1	52.6 Å²	52.6	1%	0.007	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	129.7	-178.4	-64.7	0	0	0	0	109.5	L176 E177 E241 F242	L176-C225 HydrophobicContact CD1-CB 4.12Å; E177-C225 CarbonylContact O-C 3.51Å; E177-C225 VanDerWaalsContact O-CA 3.3Å; E177-C225 WeakPolarHBondContact O-CA 3.26Å; C225-E241 CarbonylContact O-C 3.56Å; C225-E241 WeakPolarHBondContact O-CA 3.36Å; C225-E241 WeakPolarHBondContact O-CB 3.38Å; C225-F242 HydrophobicContact CB-CD1 3.66Å; C225-F242 HydrophobicContact CB-CD2 3.95Å; C225-F242 HydrophobicContact CB-CE1 3.23Å; C225-F242 HydrophobicContact CB-CE2 3.57Å; C225-F242 HydrophobicContact CB-CG 4.01Å; C225-F242 HydrophobicContact CB-CZ 3.19Å; C225-F242 PolarHBondContact N-O 3.19Å; C225-F242 PolarHBondContact O-N 3.09Å
226	T	98.3	Very high	91.1	Very high	5 Å²	5	55.2 Å²	55.2	3%	0.031	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	138	-178.9	63.6	0	0	0	0	110.8	L176 E177 K224 W228 F238 E241	L176-T226 WeakPolarHBondContact CA-O 3.39Å; E177-T226 PolarHBondContact N-O 3.29Å; E177-T226 PolarHBondContact O-N 3.06Å; K224-T226 HydrophobicContact CG-CG2 4.4Å; T226-W228 PolarHBondContact OG1-NE1 2.92Å; T226-F238 HydrophobicContact CG2-CE2 4.23Å; T226-E241 HydrophobicContact CG2-CB 4.01Å
227	V	98.3	Very high	91.6	Very high	0 Å²	0	56.4 Å²	56.4	0%	0	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	130	177.2	-172.5	0	0	0	0	108.4	L163 P174 F175 L176 W204 I239 G240 V281	L163-V227 HydrophobicContact CD1-CG1 4.06Å; L163-V227 HydrophobicContact CD2-CG1 4.36Å; P174-V227 HydrophobicContact CB-CG1 4.25Å; F175-V227 WeakPolarHBondContact O-CA 3.23Å; L176-V227 HydrophobicContact CD1-CG2 4.05Å; W204-V227 HydrophobicContact CZ2-CG1 4.49Å; V227-I239 HydrophobicContact CB-CB 4.35Å; V227-I239 HydrophobicContact CG1-CB 4.28Å; V227-I239 HydrophobicContact CG1-CD1 4.17Å; V227-I239 WeakPolarHBondContact O-CA 3.27Å; V227-I239 WeakPolarHBondContact O-CB 3.39Å; V227-I239 PolarHBondContact O-N 3.47Å; V227-G240 PolarHBondContact N-O 3.22Å; V227-G240 PolarHBondContact O-N 3.01Å; V227-V281 HydrophobicContact CG2-CG2 3.88Å
228	W	97.2	Very high	92.5	Very high	66 Å²	66	56.9 Å²	56.9	25%	0.25	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	149.7	-175.2	-65.5	92.2	0	0	0	110.3	P174 F175 E177 T226 H236 F238	P174-W228 CarbonylContact C-O 3.51Å; P174-W228 WeakPolarHBondContact CA-O 3.48Å; F175-W228 HydrophobicContact CD1-CB 3.97Å; F175-W228 HydrophobicContact CD2-CB 4.31Å; F175-W228 HydrophobicContact CE1-CB 3.4Å; F175-W228 HydrophobicContact CE1-CG 4.35Å; F175-W228 HydrophobicContact CE2-CB 3.78Å; F175-W228 AromaticContact CE2-CD1 3.84Å; F175-W228 HydrophobicContact CE2-CG 4.01Å; F175-W228 HydrophobicContact CG-CB 4.41Å; F175-W228 HydrophobicContact CZ-CB 3.3Å; F175-W228 AromaticContact CZ-CG 3.78Å; F175-W228 HydrophobicContact CZ-CG 3.78Å; F175-W228 PolarHBondContact N-O 3.26Å; F175-W228 PolarHBondContact O-N 3.29Å; E177-W228 PolarHBondContact OE2-NE1 3.46Å; E177-W228 VanDerWaalsContact OE2-NE1 3.1Å; T226-W228 PolarHBondContact OG1-NE1 2.92Å; W228-H236 HydrophobicContact CB-CB 4.39Å; W228-H236 HydrophobicContact CE3-CB 4.07Å; W228-H236 WeakPolarHBondContact CZ3-O 3.36Å; W228-F238 HydrophobicContact CD2-CD2 4.09Å; W228-F238 AromaticContact CE2-CD2 3.86Å; W228-F238 HydrophobicContact CE3-CB 3.87Å; W228-F238 HydrophobicContact CE3-CD2 4.16Å; W228-F238 HydrophobicContact CH2-CB 4Å; W228-F238 AromaticContact CH2-CD2 3.77Å; W228-F238 HydrophobicContact CH2-CD2 3.77Å; W228-F238 HydrophobicContact CH2-CG 4.29Å; W228-F238 AromaticContact CZ2-CD2 3.69Å; W228-F238 HydrophobicContact CZ2-CD2 3.69Å; W228-F238 HydrophobicContact CZ2-CE2 4.35Å; W228-F238 HydrophobicContact CZ3-CB 3.54Å; W228-F238 HydrophobicContact CZ3-CD2 4.02Å; W228-F238 HydrophobicContact CZ3-CG 4.26Å
229	D	95.7	Very high	92.9	Very high	0 Å²	0	53.8 Å²	53.8	0%	0	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.7	125.1	166.4	-163.4	2.7	0	0	0	109.6	K166 S172 D173 H236 D237 I239	K166-D229 HydrophobicContact CB-CB 4.35Å; K166-D229 VanDerWaalsContact CB-OD2 3.26Å; K166-D229 WeakPolarHBondContact CB-OD2 3.49Å; K166-D229 HydrophobicContact CG-CB 4.05Å; S172-D229 VanDerWaalsContact CA-OD1 3.31Å; S172-D229 WeakPolarHBondContact CA-OD1 3.45Å; S172-D229 VanDerWaalsContact CA-OD2 3.3Å; S172-D229 WeakPolarHBondContact CA-OD2 3.15Å; S172-D229 VanDerWaalsContact CB-CG 3.42Å; S172-D229 WeakPolarHBondContact CB-OD1 3.25Å; S172-D229 WeakPolarHBondContact CB-OD2 3.33Å; S172-D229 PolarHBondContact OG-OD2 2.85Å; D173-D229 WeakPolarHBondContact CA-OD1 3.41Å; D173-D229 PolarHBondContact N-OD1 2.65Å; D229-H236 CarbonylContact O-C 3.55Å; D229-H236 WeakPolarHBondContact O-CA 3.3Å; D229-H236 WeakPolarHBondContact O-CB 3.17Å; D229-D237 HydrophobicContact CB-CB 4.04Å; D229-D237 PolarHBondContact N-O 3.01Å; D229-D237 PolarHBondContact O-N 3.46Å; D229-I239 HydrophobicContact CB-CD1 4.09Å; D229-I239 HydrophobicContact CB-CG1 4.19Å
230	W	94.5	Very high	93.2	Very high	87 Å²	87	50.3 Å²	50.3	33%	0.33	26%	0.259	S	S	.	.			trans	-76.4	141.5	-179.7	-178.6	87.6	0	0	0	111.1	D173 F175 T195 M197 S232 H236	D173-W230 HydrophobicContact CB-CB 4.09Å; D173-W230 WeakPolarHBondContact O-CB 3.44Å; D173-W230 PolarHBondContact O-N 3.49Å; F175-W230 HydrophobicContact CD1-CB 3.97Å; F175-W230 HydrophobicContact CE1-CB 4.06Å; T195-W230 HydrophobicContact CG2-CB 3.45Å; T195-W230 VanDerWaalsContact CG2-CB 3.45Å; T195-W230 HydrophobicContact CG2-CD2 4.48Å; T195-W230 HydrophobicContact CG2-CG 3.93Å; M197-W230 HydrophobicContact CE-CE3 4.01Å; M197-W230 HydrophobicContact CE-CZ3 3.98Å; M197-W230 HydrophobicContact SD-CE3 4.43Å; W230-S232 VanDerWaalsContact CH2-CA 3.48Å; W230-H236 AromaticContact CD1-CE1 3.22Å; W230-H236 AromaticContact CD1-ND1 3.81Å; W230-H236 AromaticContact CD1-NE2 3.83Å; W230-H236 AromaticContact CG-CE1 3.91Å; W230-H236 AromaticContact NE1-CE1 3.52Å
231	D	87.9	Confident	93.4	Very high	31 Å²	31	48.6 Å²	48.6	17%	0.166	25%	0.248	C	C	.	.			trans	-135	131	-177.5	-89	-63.4	0	0	0	109	N233 G234 K235 H236	D231-N233 PolarHBondContact O-N 2.84Å; D231-N233 VanDerWaalsContact O-N 3.07Å; D231-G234 PolarHBondContact O-N 3.1Å; D231-K235 VanDerWaalsContact OD2-O 3.12Å; D231-H236 PolarHBondContact N-ND1 3.17Å; D231-H236 PolarHBondContact O-CE1 3.48Å
232	S	83.4	Confident	93.6	Very high	107 Å²	107	47.6 Å²	47.6	75%	0.748	25%	0.245	S	C	*	.	T	Hydrogen-bonded Turn	trans	-60.5	-20.8	-180	61.3	0	0	0	0	114.3	W230 G234	W230-S232 VanDerWaalsContact CH2-CA 3.48Å; S232-G234 VanDerWaalsContact C-N 3.29Å
233	N	83.1	Confident	93.6	Very high	111 Å²	111	49.8 Å²	49.8	59%	0.594	26%	0.256	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.5	-2.3	177.2	68.7	29.2	0	0	0	113.5	D231 K235	D231-N233 PolarHBondContact O-N 2.84Å; D231-N233 VanDerWaalsContact O-N 3.07Å; N233-K235 VanDerWaalsContact C-N 3.32Å; N233-K235 PolarHBondContact O-N 3.23Å; N233-K235 WeakPolarHBondContact OD1-CA 3.47Å; N233-K235 WeakPolarHBondContact OD1-CB 3.03Å; N233-K235 PolarHBondContact OD1-N 2.64Å
234	G	78	Confident	93.6	Very high	52 Å²	52	50 Å²	50	54%	0.536	26%	0.256	S	S	.	.	S	Bend	trans	80.1	0.1	-179.8	0	0	0	0	0	115.7	D231 S232	D231-G234 PolarHBondContact O-N 3.1Å; S232-G234 VanDerWaalsContact C-N 3.29Å
235	K	87.1	Confident	93.6	Very high	168 Å²	168	49.4 Å²	49.4	73%	0.73	26%	0.257	S	S	*	.			trans	-101.2	72.6	176.5	-65.4	-177	178.3	178.4	0	110.6	D231 N233	D231-K235 VanDerWaalsContact OD2-O 3.12Å; N233-K235 VanDerWaalsContact C-N 3.32Å; N233-K235 PolarHBondContact O-N 3.23Å; N233-K235 WeakPolarHBondContact OD1-CA 3.47Å; N233-K235 WeakPolarHBondContact OD1-CB 3.03Å; N233-K235 PolarHBondContact OD1-N 2.64Å
236	H	89.3	Confident	93.4	Very high	56 Å²	56	49.4 Å²	49.4	26%	0.259	26%	0.257	S	S	.	.	P	Polyproline II helix	trans	-57.5	136.2	-178.9	-55.5	-36.2	0	0	0	112.6	F175 W228 D229 W230 D231	F175-H236 HydrophobicContact CE1-CB 4.15Å; F175-H236 AromaticContact CE1-CD2 3.95Å; F175-H236 AromaticContact CE1-CG 3.85Å; F175-H236 HydrophobicContact CZ-CB 4.16Å; F175-H236 AromaticContact CZ-CD2 3.65Å; F175-H236 AromaticContact CZ-CG 3.91Å; W228-H236 HydrophobicContact CB-CB 4.39Å; W228-H236 HydrophobicContact CE3-CB 4.07Å; W228-H236 WeakPolarHBondContact CZ3-O 3.36Å; D229-H236 CarbonylContact O-C 3.55Å; D229-H236 WeakPolarHBondContact O-CA 3.3Å; D229-H236 WeakPolarHBondContact O-CB 3.17Å; W230-H236 AromaticContact CD1-CE1 3.22Å; W230-H236 AromaticContact CD1-ND1 3.81Å; W230-H236 AromaticContact CD1-NE2 3.83Å; W230-H236 AromaticContact CG-CE1 3.91Å; W230-H236 AromaticContact NE1-CE1 3.52Å; D231-H236 PolarHBondContact N-ND1 3.17Å; D231-H236 PolarHBondContact O-CE1 3.48Å
237	D	93.3	Very high	93.2	Very high	79 Å²	79	54 Å²	54	42%	0.422	28%	0.276	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.6	126	-179.5	-93.8	-26.4	0	0	0	111.7	K166 D229 I239	K166-D237 HydrophobicContact CB-CB 4.12Å; K166-D237 HydrophobicContact CG-CB 4.07Å; D229-D237 HydrophobicContact CB-CB 4.04Å; D229-D237 PolarHBondContact N-O 3.01Å; D229-D237 PolarHBondContact O-N 3.46Å; D237-I239 PolarHBondContact O-N 3.43Å
238	F	96.4	Very high	93.1	Very high	44 Å²	44	57.8 Å²	57.8	19%	0.193	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.2	121	-178.9	-176.6	-108	0	0	0	111.6	K166 T226 W228 E241 N265	K166-F238 WeakPolarHBondContact CE-O 3.19Å; K166-F238 PolarHBondContact NZ-O 3.2Å; K166-F238 VanDerWaalsContact NZ-O 3.08Å; T226-F238 HydrophobicContact CG2-CE2 4.23Å; W228-F238 HydrophobicContact CD2-CD2 4.09Å; W228-F238 AromaticContact CE2-CD2 3.86Å; W228-F238 HydrophobicContact CE3-CB 3.87Å; W228-F238 HydrophobicContact CE3-CD2 4.16Å; W228-F238 HydrophobicContact CH2-CB 4Å; W228-F238 AromaticContact CH2-CD2 3.77Å; W228-F238 HydrophobicContact CH2-CD2 3.77Å; W228-F238 HydrophobicContact CH2-CG 4.29Å; W228-F238 AromaticContact CZ2-CD2 3.69Å; W228-F238 HydrophobicContact CZ2-CD2 3.69Å; W228-F238 HydrophobicContact CZ2-CE2 4.35Å; W228-F238 HydrophobicContact CZ3-CB 3.54Å; W228-F238 HydrophobicContact CZ3-CD2 4.02Å; W228-F238 HydrophobicContact CZ3-CG 4.26Å; F238-E241 HydrophobicContact CE2-CB 4.33Å; F238-E241 HydrophobicContact CZ-CB 3.84Å; F238-E241 HydrophobicContact CZ-CG 4.02Å; F238-N265 PolarHBondContact O-ND2 2.78Å
239	I	97.5	Very high	93	Very high	0 Å²	0	54.8 Å²	54.8	0%	0	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.3	-60.3	175.1	-60.8	179.4	0	0	0	109.3	L163 D164 K166 P174 V227 D229 D237 N265 S278	L163-I239 HydrophobicContact CB-CG2 4.44Å; L163-I239 HydrophobicContact CD2-CG2 4.26Å; D164-I239 HydrophobicContact CB-CG2 4.39Å; K166-I239 HydrophobicContact CG-CG1 4.19Å; P174-I239 HydrophobicContact CB-CD1 4.26Å; V227-I239 HydrophobicContact CB-CB 4.35Å; V227-I239 HydrophobicContact CG1-CB 4.28Å; V227-I239 HydrophobicContact CG1-CD1 4.17Å; V227-I239 WeakPolarHBondContact O-CA 3.27Å; V227-I239 WeakPolarHBondContact O-CB 3.39Å; V227-I239 PolarHBondContact O-N 3.47Å; D229-I239 HydrophobicContact CB-CD1 4.09Å; D229-I239 HydrophobicContact CB-CG1 4.19Å; D237-I239 PolarHBondContact O-N 3.43Å; I239-N265 WeakPolarHBondContact O-CB 3.41Å; I239-N265 PolarHBondContact O-ND2 3.48Å; I239-S278 WeakPolarHBondContact O-CB 3.03Å; I239-S278 PolarHBondContact O-OG 3.19Å
240	G	97.8	Very high	92.8	Very high	0 Å²	0	55.9 Å²	55.9	0%	0	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	179.8	179.4	178	0	0	0	0	0	113.2	V227 C263 I264	V227-G240 PolarHBondContact N-O 3.22Å; V227-G240 PolarHBondContact O-N 3.01Å; G240-C263 WeakPolarHBondContact CA-SG 3.36Å; G240-I264 CarbonylContact C-O 3.47Å; G240-I264 VanDerWaalsContact CA-O 3.23Å; G240-I264 WeakPolarHBondContact CA-O 3.26Å
241	E	98.3	Very high	92.7	Very high	57 Å²	57	59.2 Å²	59.2	27%	0.266	30%	0.3	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.1	161.6	-179.2	64.9	-171	177.4	0	0	112.3	K224 C225 T226 F238 I264 P266	K224-E241 WeakPolarHBondContact CE-OE2 3.27Å; K224-E241 IonicContact NZ-OE2 2.78Å; C225-E241 CarbonylContact O-C 3.56Å; C225-E241 WeakPolarHBondContact O-CA 3.36Å; C225-E241 WeakPolarHBondContact O-CB 3.38Å; T226-E241 HydrophobicContact CG2-CB 4.01Å; F238-E241 HydrophobicContact CE2-CB 4.33Å; F238-E241 HydrophobicContact CZ-CB 3.84Å; F238-E241 HydrophobicContact CZ-CG 4.02Å; E241-I264 PolarHBondContact N-O 3.15Å; E241-I264 PolarHBondContact O-N 3.06Å; E241-P266 WeakPolarHBondContact OE1-CG 3.5Å
242	F	98.2	Very high	92.8	Very high	13 Å²	13	58.2 Å²	58.2	6%	0.057	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.9	164.7	169	66.4	-82.6	0	0	0	110	L176 C225 T244 W261 V281	L176-F242 HydrophobicContact CD1-CE1 4.23Å; C225-F242 HydrophobicContact CB-CD1 3.66Å; C225-F242 HydrophobicContact CB-CD2 3.95Å; C225-F242 HydrophobicContact CB-CE1 3.23Å; C225-F242 HydrophobicContact CB-CE2 3.57Å; C225-F242 HydrophobicContact CB-CG 4.01Å; C225-F242 HydrophobicContact CB-CZ 3.19Å; C225-F242 PolarHBondContact N-O 3.19Å; C225-F242 PolarHBondContact O-N 3.09Å; F242-T244 HydrophobicContact CE2-CG2 4.25Å; F242-W261 HydrophobicContact CB-CB 3.78Å; F242-W261 HydrophobicContact CB-CG 4.43Å; F242-W261 HydrophobicContact CD1-CB 4.42Å; F242-W261 HydrophobicContact CD2-CB 3.45Å; F242-W261 VanDerWaalsContact CD2-CB 3.45Å; F242-W261 AromaticContact CD2-CD1 3.94Å; F242-W261 AromaticContact CD2-CD2 3.65Å; F242-W261 HydrophobicContact CD2-CD2 3.65Å; F242-W261 HydrophobicContact CD2-CE3 4.03Å; F242-W261 AromaticContact CD2-CG 3.39Å; F242-W261 HydrophobicContact CD2-CG 3.39Å; F242-W261 HydrophobicContact CE2-CB 4.09Å; F242-W261 AromaticContact CE2-CD2 3.56Å; F242-W261 HydrophobicContact CE2-CD2 3.56Å; F242-W261 AromaticContact CE2-CE3 3.49Å; F242-W261 HydrophobicContact CE2-CE3 3.49Å; F242-W261 VanDerWaalsContact CE2-CE3 3.49Å; F242-W261 AromaticContact CE2-CG 3.84Å; F242-W261 HydrophobicContact CE2-CG 3.84Å; F242-W261 HydrophobicContact CE2-CZ3 4.08Å; F242-W261 HydrophobicContact CG-CB 3.64Å; F242-W261 HydrophobicContact CG-CG 4.11Å; F242-W261 HydrophobicContact CZ-CE3 4.06Å; F242-V281 HydrophobicContact CD1-CB 4.29Å; F242-V281 HydrophobicContact CD1-CG2 4.17Å; F242-V281 HydrophobicContact CE1-CB 3.69Å; F242-V281 HydrophobicContact CE1-CG1 3.73Å; F242-V281 HydrophobicContact CE1-CG2 3.73Å; F242-V281 HydrophobicContact CZ-CB 4.06Å; F242-V281 HydrophobicContact CZ-CG1 3.73Å
243	Q	97.8	Very high	93.1	Very high	124 Å²	124	56.9 Å²	56.9	58%	0.579	28%	0.278	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-116.9	147	176.3	-70.5	165.6	-25.4	0	0	109.7	E222 L223	E222-Q243 HydrophobicContact CG-CG 4.48Å; E222-Q243 WeakPolarHBondContact OE1-CG 3.5Å; E222-Q243 PolarHBondContact OE1-NE2 3.25Å; L223-Q243 WeakPolarHBondContact O-CA 3.3Å
244	T	97.4	Very high	93.3	Very high	5 Å²	5	58.9 Å²	58.9	3%	0.031	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.7	-179.4	173	-171.8	0	0	0	0	110.1	L223 F242 E248 M249 W261	L223-T244 HydrophobicContact CB-CG2 4.14Å; L223-T244 HydrophobicContact CD1-CG2 4.46Å; L223-T244 PolarHBondContact N-O 3.36Å; L223-T244 PolarHBondContact O-N 2.91Å; F242-T244 HydrophobicContact CE2-CG2 4.25Å; T244-E248 WeakPolarHBondContact CB-OE2 3.4Å; T244-E248 PolarHBondContact OG1-OE2 3.47Å; T244-M249 HydrophobicContact CG2-SD 4.32Å; T244-W261 HydrophobicContact CG2-CZ2 4.23Å; T244-W261 WeakPolarHBondContact OG1-CZ2 3.43Å
245	T	97.3	Very high	93.9	Very high	31 Å²	31	60.3 Å²	60.3	19%	0.19	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.7	157.4	170.6	67.6	0	0	0	0	109.7	D220 K247 E248 M249	D220-T245 WeakPolarHBondContact O-CG2 3.33Å; T245-K247 PolarHBondContact O-N 2.9Å; T245-E248 WeakPolarHBondContact O-CB 3.32Å; T245-E248 PolarHBondContact O-N 3.39Å; T245-E248 VanDerWaalsContact O-N 3.16Å; T245-E248 PolarHBondContact OG1-N 3.39Å; T245-M249 PolarHBondContact O-N 2.99Å; T245-M249 VanDerWaalsContact O-N 3.17Å
246	Y	94.8	Very high	93.9	Very high	2 Å²	2	55.6 Å²	55.6	1%	0.008	28%	0.276	C	S	.	.	H	α-helix	trans	-58.6	-38.8	174.5	173.3	-115.7	0	0	0	112.3	V154 L211 L214 H219 E248 M249 M250 I288	V154-Y246 HydrophobicContact CB-CE2 4.14Å; V154-Y246 HydrophobicContact CG1-CE2 4.48Å; V154-Y246 HydrophobicContact CG2-CE2 3.93Å; L211-Y246 HydrophobicContact CD1-CE1 4.21Å; L211-Y246 HydrophobicContact CD2-CD1 4.12Å; L211-Y246 HydrophobicContact CD2-CD2 4.12Å; L211-Y246 HydrophobicContact CD2-CE1 3.64Å; L211-Y246 HydrophobicContact CD2-CE2 3.65Å; L211-Y246 HydrophobicContact CD2-CG 4.32Å; L214-Y246 HydrophobicContact CD2-CD2 4Å; L214-Y246 HydrophobicContact CD2-CG 4.41Å; H219-Y246 HydrophobicContact CB-CD1 3.93Å; H219-Y246 AromaticContact CD2-CD1 3.57Å; H219-Y246 AromaticContact CD2-CE1 3.75Å; H219-Y246 AromaticContact CE1-CE1 3.96Å; H219-Y246 AromaticContact CG-CD1 3.64Å; H219-Y246 AromaticContact CG-CE1 3.93Å; H219-Y246 AromaticContact NE2-CE1 3.76Å; Y246-E248 VanDerWaalsContact C-N 3.33Å; Y246-E248 PolarHBondContact O-N 3.44Å; Y246-M249 HydrophobicContact CD2-CE 4.37Å; Y246-M249 PolarHBondContact O-N 2.97Å; Y246-M250 HydrophobicContact CD1-CG 4.35Å; Y246-M250 HydrophobicContact CD2-CG 3.93Å; Y246-M250 HydrophobicContact CE1-CG 3.84Å; Y246-M250 HydrophobicContact CE2-CG 3.33Å; Y246-M250 HydrophobicContact CE2-SD 3.87Å; Y246-M250 HydrophobicContact CG-CG 4.41Å; Y246-M250 WeakPolarHBondContact O-CB 3.33Å; Y246-M250 PolarHBondContact O-N 3.33Å; Y246-I288 WeakPolarHBondContact OH-CD1 3.43Å; Y246-I288 WeakPolarHBondContact OH-CG1 3.44Å
247	K	95	Very high	93.9	Very high	102 Å²	102	59.2 Å²	59.2	44%	0.443	29%	0.291	S	S	.	.	H	α-helix	trans	-59.7	-39.8	175	-175.6	-178.1	-172.3	172.8	0	113.1	H219 D220 T245 R251	H219-K247 HydrophobicContact CB-CB 4.13Å; H219-K247 WeakPolarHBondContact O-CB 3.01Å; H219-K247 PolarHBondContact O-N 2.71Å; D220-K247 WeakPolarHBondContact OD1-CD 3.44Å; D220-K247 WeakPolarHBondContact OD1-CE 2.99Å; D220-K247 IonicContact OD1-NZ 2.75Å; D220-K247 PolarHBondContact OD1-NZ 3.47Å; D220-K247 WeakPolarHBondContact OD2-CD 3.3Å; D220-K247 IonicContact OD2-NZ 3.98Å; D220-K247 PolarHBondContact OD2-NZ 3.01Å; T245-K247 PolarHBondContact O-N 2.9Å; K247-R251 VanDerWaalsContact O-CB 3.27Å; K247-R251 WeakPolarHBondContact O-CB 3.34Å; K247-R251 PolarHBondContact O-N 3.41Å
248	E	95.5	Very high	93.7	Very high	78 Å²	78	61.2 Å²	61.2	36%	0.364	30%	0.298	S	S	.	.	H	α-helix	trans	-64	-48.4	176.4	-170.8	-173.7	-157.5	0	0	111	T244 T245 Y246 M250 R251 A252 I259 W261	T244-E248 WeakPolarHBondContact CB-OE2 3.4Å; T244-E248 PolarHBondContact OG1-OE2 3.47Å; T245-E248 WeakPolarHBondContact O-CB 3.32Å; T245-E248 PolarHBondContact O-N 3.39Å; T245-E248 VanDerWaalsContact O-N 3.16Å; T245-E248 PolarHBondContact OG1-N 3.39Å; Y246-E248 VanDerWaalsContact C-N 3.33Å; Y246-E248 PolarHBondContact O-N 3.44Å; E248-M250 PolarHBondContact O-N 3.31Å; E248-R251 PolarHBondContact O-N 3.46Å; E248-A252 PolarHBondContact O-N 2.69Å; E248-A252 VanDerWaalsContact O-N 3.09Å; E248-I259 VanDerWaalsContact CD-CD1 3.43Å; E248-I259 HydrophobicContact CG-CD1 3.46Å; E248-I259 VanDerWaalsContact CG-CD1 3.46Å; E248-I259 WeakPolarHBondContact OE1-CD1 3.29Å; E248-W261 PolarHBondContact OE2-NE1 2.87Å
249	M	95.1	Very high	93.6	Very high	3 Å²	3	60.3 Å²	60.3	2%	0.015	30%	0.295	C	S	.	.	H	α-helix	trans	-59.5	-46.8	177.9	-64.5	-169.4	-71.5	0	0	111.8	L156 F158 L214 L223 T244 T245 Y246 A252 E253 W261 L283 C286	L156-M249 HydrophobicContact CD1-CE 4.47Å; L156-M249 HydrophobicContact CD2-CE 4.41Å; L156-M249 HydrophobicContact CD2-SD 4.17Å; F158-M249 HydrophobicContact CZ-SD 4.02Å; L214-M249 HydrophobicContact CD2-CE 4.44Å; L223-M249 HydrophobicContact CD1-CE 3.68Å; T244-M249 HydrophobicContact CG2-SD 4.32Å; T245-M249 PolarHBondContact O-N 2.99Å; T245-M249 VanDerWaalsContact O-N 3.17Å; Y246-M249 HydrophobicContact CD2-CE 4.37Å; Y246-M249 PolarHBondContact O-N 2.97Å; M249-A252 PolarHBondContact O-N 3.01Å; M249-E253 PolarHBondContact O-N 2.79Å; M249-W261 HydrophobicContact CG-CH2 4.01Å; M249-W261 HydrophobicContact CG-CZ2 4.21Å; M249-W261 HydrophobicContact SD-CH2 4.48Å; M249-L283 HydrophobicContact CB-CD2 3.71Å; M249-L283 HydrophobicContact CG-CD2 3.9Å; M249-L283 HydrophobicContact SD-CD1 4.26Å; M249-L283 HydrophobicContact SD-CD2 4.41Å; M249-C286 HydrophobicContact CB-CB 4.32Å
250	M	92.3	Very high	93.5	Very high	23 Å²	23	65.6 Å²	65.6	11%	0.113	32%	0.32	C	S	.	.	H	α-helix	trans	-64.5	-40.8	178.9	-82.4	-58.6	-49.9	0	0	113.3	Y246 E248 A252 E253 Q254 I288	Y246-M250 HydrophobicContact CD1-CG 4.35Å; Y246-M250 HydrophobicContact CD2-CG 3.93Å; Y246-M250 HydrophobicContact CE1-CG 3.84Å; Y246-M250 HydrophobicContact CE2-CG 3.33Å; Y246-M250 HydrophobicContact CE2-SD 3.87Å; Y246-M250 HydrophobicContact CG-CG 4.41Å; Y246-M250 WeakPolarHBondContact O-CB 3.33Å; Y246-M250 PolarHBondContact O-N 3.33Å; E248-M250 PolarHBondContact O-N 3.31Å; M250-A252 VanDerWaalsContact C-N 3.32Å; M250-A252 PolarHBondContact O-N 3.15Å; M250-E253 PolarHBondContact O-N 2.76Å; M250-Q254 HydrophobicContact CE-CG 4.46Å; M250-Q254 WeakPolarHBondContact O-CG 3.21Å; M250-Q254 PolarHBondContact O-N 3.32Å; M250-I288 HydrophobicContact CE-CD1 3.42Å; M250-I288 VanDerWaalsContact CE-CD1 3.42Å; M250-I288 HydrophobicContact CE-CG1 3.62Å; M250-I288 HydrophobicContact SD-CD1 3.69Å; M250-I288 HydrophobicContact SD-CG1 3.43Å; M250-I288 WeakPolarHBondContact SD-CG1 3.32Å
251	R	92.1	Very high	93.5	Very high	157 Å²	157	66.6 Å²	66.6	59%	0.592	32%	0.323	S	S	*	.	H	α-helix	trans	-64	-40.6	177.9	-176.8	179.4	178.7	175.4	3	111.4	K247 E248 Q254 E255	K247-R251 VanDerWaalsContact O-CB 3.27Å; K247-R251 WeakPolarHBondContact O-CB 3.34Å; K247-R251 PolarHBondContact O-N 3.41Å; E248-R251 PolarHBondContact O-N 3.46Å; R251-Q254 PolarHBondContact O-N 3.49Å; R251-E255 HydrophobicContact CG-CG 4.39Å; R251-E255 WeakPolarHBondContact CG-OE1 3.5Å; R251-E255 IonicContact CZ-OE1 2.86Å; R251-E255 IonicContact NE-OE1 2.67Å; R251-E255 PolarHBondContact NE-OE1 3.37Å; R251-E255 IonicContact NH2-OE1 3.61Å; R251-E255 PolarHBondContact NH2-OE1 3.03Å; R251-E255 WeakPolarHBondContact O-CB 3.15Å; R251-E255 WeakPolarHBondContact O-CG 3.43Å; R251-E255 PolarHBondContact O-N 3.15Å
252	A	89.1	Confident	93.5	Very high	10 Å²	10	69.1 Å²	69.1	8%	0.083	34%	0.335	C	S	.	.	H	α-helix	trans	-60.9	-46.2	177.2	0	0	0	0	0	111.6	E248 M249 M250 E255 G256 K257 I259	E248-A252 PolarHBondContact O-N 2.69Å; E248-A252 VanDerWaalsContact O-N 3.09Å; M249-A252 PolarHBondContact O-N 3.01Å; M250-A252 VanDerWaalsContact C-N 3.32Å; M250-A252 PolarHBondContact O-N 3.15Å; A252-E255 PolarHBondContact O-N 2.95Å; A252-G256 PolarHBondContact O-N 3.34Å; A252-G256 VanDerWaalsContact O-N 3.17Å; A252-K257 CarbonylContact C-O 3.45Å; A252-K257 PolarHBondContact O-N 3.05Å; A252-I259 HydrophobicContact CB-CB 3.81Å; A252-I259 HydrophobicContact CB-CG2 3.8Å
253	E	88.9	Confident	93.4	Very high	79 Å²	79	68.5 Å²	68.5	37%	0.369	33%	0.333	S	S	.	.	H	α-helix	trans	-59.6	-48.7	175.7	-172.5	79.4	-160.6	0	0	111.7	M249 M250 E255 G256 C286	M249-E253 PolarHBondContact O-N 2.79Å; M250-E253 PolarHBondContact O-N 2.76Å; E253-E255 VanDerWaalsContact C-N 3.31Å; E253-E255 PolarHBondContact O-N 3.1Å; E253-G256 PolarHBondContact O-N 3.35Å; E253-C286 HydrophobicContact CB-CB 4.48Å; E253-C286 VanDerWaalsContact CG-O 3.3Å; E253-C286 WeakPolarHBondContact CG-O 3.3Å; E253-C286 PolarHBondContact OE2-N 3.02Å
254	Q	88.3	Confident	93.5	Very high	153 Å²	153	64.2 Å²	64.2	72%	0.715	31%	0.313	S	S	*	.	H	α-helix	trans	-62.5	-35.7	-179.3	-73.7	175.9	-3.5	0	0	113.2	M250 R251 G256	M250-Q254 HydrophobicContact CE-CG 4.46Å; M250-Q254 WeakPolarHBondContact O-CG 3.21Å; M250-Q254 PolarHBondContact O-N 3.32Å; R251-Q254 PolarHBondContact O-N 3.49Å; Q254-G256 PolarHBondContact O-N 3.49Å
255	E	90.8	Very high	93.5	Very high	82 Å²	82	64.2 Å²	64.2	38%	0.383	31%	0.313	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.9	-1.9	177.1	-66.9	-179.7	-173	0	0	112.7	R251 A252 E253 K257	R251-E255 HydrophobicContact CG-CG 4.39Å; R251-E255 WeakPolarHBondContact CG-OE1 3.5Å; R251-E255 IonicContact CZ-OE1 2.86Å; R251-E255 IonicContact NE-OE1 2.67Å; R251-E255 PolarHBondContact NE-OE1 3.37Å; R251-E255 IonicContact NH2-OE1 3.61Å; R251-E255 PolarHBondContact NH2-OE1 3.03Å; R251-E255 WeakPolarHBondContact O-CB 3.15Å; R251-E255 WeakPolarHBondContact O-CG 3.43Å; R251-E255 PolarHBondContact O-N 3.15Å; A252-E255 PolarHBondContact O-N 2.95Å; E253-E255 VanDerWaalsContact C-N 3.31Å; E253-E255 PolarHBondContact O-N 3.1Å; E255-K257 HydrophobicContact CB-CD 4.04Å; E255-K257 HydrophobicContact CB-CG 4.02Å; E255-K257 PolarHBondContact O-N 3.47Å; E255-K257 WeakPolarHBondContact OE2-CD 3.27Å; E255-K257 VanDerWaalsContact OE2-CE 3.24Å; E255-K257 WeakPolarHBondContact OE2-CE 3.42Å; E255-K257 IonicContact OE2-NZ 2.72Å; E255-K257 PolarHBondContact OE2-NZ 2.99Å
256	G	87.3	Confident	93.3	Very high	70 Å²	70	64.8 Å²	64.8	72%	0.722	32%	0.318	S	S	*	.	T	Hydrogen-bonded Turn	trans	63.6	26.7	-175.4	0	0	0	0	0	113.1	A252 E253 Q254	A252-G256 PolarHBondContact O-N 3.34Å; A252-G256 VanDerWaalsContact O-N 3.17Å; E253-G256 PolarHBondContact O-N 3.35Å; Q254-G256 PolarHBondContact O-N 3.49Å
257	K	88.7	Confident	93.3	Very high	131 Å²	131	71.6 Å²	71.6	57%	0.57	35%	0.347	S	S	*	.	P	Polyproline II helix	trans	-100.5	133.5	-177.8	-69.8	179.7	-176	165.8	0	110.2	A252 E255 I259	A252-K257 CarbonylContact C-O 3.45Å; A252-K257 PolarHBondContact O-N 3.05Å; E255-K257 HydrophobicContact CB-CD 4.04Å; E255-K257 HydrophobicContact CB-CG 4.02Å; E255-K257 PolarHBondContact O-N 3.47Å; E255-K257 WeakPolarHBondContact OE2-CD 3.27Å; E255-K257 VanDerWaalsContact OE2-CE 3.24Å; E255-K257 WeakPolarHBondContact OE2-CE 3.42Å; E255-K257 IonicContact OE2-NZ 2.72Å; E255-K257 PolarHBondContact OE2-NZ 2.99Å; K257-I259 PolarHBondContact O-N 2.97Å
258	Q	88.5	Confident	93.3	Very high	121 Å²	121	69.9 Å²	69.9	57%	0.565	34%	0.338	S	S	*	.	P	Polyproline II helix	trans	-74.2	121.3	167.2	179.7	166.8	76.4	0	0	109.2	I282	Q258-I282 HydrophobicContact CG-CG2 3.67Å
259	I	94.6	Very high	93.1	Very high	25 Å²	25	72 Å²	72	13%	0.128	35%	0.348	C	S	.	.	P	Polyproline II helix	trans	-97.3	141.8	171.7	-171.9	163.8	0	0	0	110.4	E248 A252 K257 W261 L283	E248-I259 VanDerWaalsContact CD-CD1 3.43Å; E248-I259 HydrophobicContact CG-CD1 3.46Å; E248-I259 VanDerWaalsContact CG-CD1 3.46Å; E248-I259 WeakPolarHBondContact OE1-CD1 3.29Å; A252-I259 HydrophobicContact CB-CB 3.81Å; A252-I259 HydrophobicContact CB-CG2 3.8Å; K257-I259 PolarHBondContact O-N 2.97Å; I259-W261 HydrophobicContact CB-CH2 4.43Å; I259-W261 HydrophobicContact CB-CZ2 4.41Å; I259-W261 HydrophobicContact CD1-CH2 4.2Å; I259-W261 HydrophobicContact CD1-CZ2 3.4Å; I259-W261 VanDerWaalsContact CD1-CZ2 3.4Å; I259-W261 HydrophobicContact CG1-CD2 4.42Å; I259-W261 HydrophobicContact CG1-CH2 4.08Å; I259-W261 HydrophobicContact CG1-CZ2 3.63Å; I259-W261 HydrophobicContact CG2-CH2 3.54Å; I259-W261 HydrophobicContact CG2-CZ2 3.9Å; I259-W261 HydrophobicContact CG2-CZ3 4.14Å; I259-L283 HydrophobicContact CG2-CB 3.51Å; I259-L283 HydrophobicContact CG2-CD2 3.58Å; I259-L283 HydrophobicContact CG2-CG 4.2Å; I259-L283 PolarHBondContact O-N 2.57Å; I259-L283 VanDerWaalsContact O-N 3.11Å
260	Q	96.3	Very high	92.9	Very high	111 Å²	111	80 Å²	80	52%	0.519	39%	0.387	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.5	142.7	178.5	63.2	175.3	44.1	0	0	109.8	T280 V281 I282	Q260-T280 HydrophobicContact CB-CG2 3.74Å; Q260-T280 HydrophobicContact CG-CG2 4.11Å; Q260-V281 CarbonylContact C-O 3.52Å; Q260-V281 WeakPolarHBondContact CA-O 3.42Å; Q260-V281 WeakPolarHBondContact CB-O 3.38Å; Q260-I282 HydrophobicContact CB-CG1 4Å
261	W	98	Very high	92.9	Very high	21 Å²	21	87.1 Å²	87.1	8%	0.08	42%	0.418	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	139	178.8	-56.8	-91.4	0	0	0	110	F158 F242 T244 E248 M249 I259 C263 T280 V281 L283	F158-W261 HydrophobicContact CD1-CZ3 4.45Å; F158-W261 HydrophobicContact CE1-CH2 4.38Å; F158-W261 AromaticContact CE1-CZ3 3.89Å; F158-W261 HydrophobicContact CE1-CZ3 3.89Å; F242-W261 HydrophobicContact CB-CB 3.78Å; F242-W261 HydrophobicContact CB-CG 4.43Å; F242-W261 HydrophobicContact CD1-CB 4.42Å; F242-W261 HydrophobicContact CD2-CB 3.45Å; F242-W261 VanDerWaalsContact CD2-CB 3.45Å; F242-W261 AromaticContact CD2-CD1 3.94Å; F242-W261 AromaticContact CD2-CD2 3.65Å; F242-W261 HydrophobicContact CD2-CD2 3.65Å; F242-W261 HydrophobicContact CD2-CE3 4.03Å; F242-W261 AromaticContact CD2-CG 3.39Å; F242-W261 HydrophobicContact CD2-CG 3.39Å; F242-W261 HydrophobicContact CE2-CB 4.09Å; F242-W261 AromaticContact CE2-CD2 3.56Å; F242-W261 HydrophobicContact CE2-CD2 3.56Å; F242-W261 AromaticContact CE2-CE3 3.49Å; F242-W261 HydrophobicContact CE2-CE3 3.49Å; F242-W261 VanDerWaalsContact CE2-CE3 3.49Å; F242-W261 AromaticContact CE2-CG 3.84Å; F242-W261 HydrophobicContact CE2-CG 3.84Å; F242-W261 HydrophobicContact CE2-CZ3 4.08Å; F242-W261 HydrophobicContact CG-CB 3.64Å; F242-W261 HydrophobicContact CG-CG 4.11Å; F242-W261 HydrophobicContact CZ-CE3 4.06Å; T244-W261 HydrophobicContact CG2-CZ2 4.23Å; T244-W261 WeakPolarHBondContact OG1-CZ2 3.43Å; E248-W261 PolarHBondContact OE2-NE1 2.87Å; M249-W261 HydrophobicContact CG-CH2 4.01Å; M249-W261 HydrophobicContact CG-CZ2 4.21Å; M249-W261 HydrophobicContact SD-CH2 4.48Å; I259-W261 HydrophobicContact CB-CH2 4.43Å; I259-W261 HydrophobicContact CB-CZ2 4.41Å; I259-W261 HydrophobicContact CD1-CH2 4.2Å; I259-W261 HydrophobicContact CD1-CZ2 3.4Å; I259-W261 VanDerWaalsContact CD1-CZ2 3.4Å; I259-W261 HydrophobicContact CG1-CD2 4.42Å; I259-W261 HydrophobicContact CG1-CH2 4.08Å; I259-W261 HydrophobicContact CG1-CZ2 3.63Å; I259-W261 HydrophobicContact CG2-CH2 3.54Å; I259-W261 HydrophobicContact CG2-CZ2 3.9Å; I259-W261 HydrophobicContact CG2-CZ3 4.14Å; W261-C263 PolarHBondContact O-N 2.92Å; W261-T280 CarbonylContact O-C 3.48Å; W261-T280 WeakPolarHBondContact O-CA 3.48Å; W261-T280 WeakPolarHBondContact O-CG2 3.49Å; W261-V281 PolarHBondContact N-O 2.91Å; W261-V281 PolarHBondContact O-N 3.22Å; W261-L283 HydrophobicContact CH2-CB 3.84Å; W261-L283 HydrophobicContact CH2-CD2 4.34Å; W261-L283 HydrophobicContact CZ3-CB 3.79Å
262	E	97.8	Very high	92.9	Very high	111 Å²	111	84.3 Å²	84.3	52%	0.519	41%	0.41	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69	126.3	169.2	-63.9	-161.4	121	0	0	109.1	I264 N277	E262-I264 HydrophobicContact CB-CD1 3.94Å; E262-I264 HydrophobicContact CB-CG1 4.45Å; E262-I264 PolarHBondContact O-N 3.04Å; E262-N277 HydrophobicContact CB-CB 3.98Å; E262-N277 HydrophobicContact CG-CB 4.47Å; E262-N277 PolarHBondContact OE1-ND2 3.31Å
263	C	96.8	Very high	92.7	Very high	0 Å²	0	94 Å²	94	0%	0	45%	0.45	C	S	.	.			trans	-81.4	114	175.6	-169.1	0	0	0	0	108.2	G240 W261 Y275 N277 S278 G279 V281	G240-C263 WeakPolarHBondContact CA-SG 3.36Å; W261-C263 PolarHBondContact O-N 2.92Å; C263-Y275 PolarHBondContact O-OH 3.02Å; C263-N277 WeakPolarHBondContact O-CB 3.48Å; C263-S278 PolarHBondContact O-N 3.48Å; C263-G279 WeakPolarHBondContact CB-O 3.29Å; C263-G279 PolarHBondContact N-O 3.22Å; C263-V281 HydrophobicContact CB-CG2 4.38Å
264	I	98.1	Very high	92.8	Very high	34 Å²	34	97.6 Å²	97.6	17%	0.174	47%	0.472	C	S	.	.	B	Isolated β-bridge	trans	-107.5	126.7	-172	-58.7	-56.5	0	0	0	110.8	G240 E241 E262 P266 Q269 Y275 N277	G240-I264 CarbonylContact C-O 3.47Å; G240-I264 VanDerWaalsContact CA-O 3.23Å; G240-I264 WeakPolarHBondContact CA-O 3.26Å; E241-I264 PolarHBondContact N-O 3.15Å; E241-I264 PolarHBondContact O-N 3.06Å; E262-I264 HydrophobicContact CB-CD1 3.94Å; E262-I264 HydrophobicContact CB-CG1 4.45Å; E262-I264 PolarHBondContact O-N 3.04Å; I264-P266 WeakPolarHBondContact O-CD 3.43Å; I264-Q269 HydrophobicContact CG2-CB 4.47Å; I264-Y275 WeakPolarHBondContact CA-OH 3.45Å; I264-Y275 HydrophobicContact CD1-CE1 4.37Å; I264-Y275 HydrophobicContact CG2-CE1 4.34Å; I264-N277 HydrophobicContact CD1-CB 4Å
265	N	97.3	Very high	93	Very high	5 Å²	5	92.2 Å²	92.2	3%	0.027	45%	0.445	C	S	.	.			trans	-95.3	108.1	167.5	-168	-58	0	0	0	109.6	F238 I239 K267 Y268 Q269 Y275	F238-N265 PolarHBondContact O-ND2 2.78Å; I239-N265 WeakPolarHBondContact O-CB 3.41Å; I239-N265 PolarHBondContact O-ND2 3.48Å; N265-K267 PolarHBondContact O-N 2.79Å; N265-K267 WeakPolarHBondContact OD1-CB 3.15Å; N265-K267 PolarHBondContact OD1-N 3Å; N265-Y268 HydrophobicContact CB-CD2 3.88Å; N265-Y268 HydrophobicContact CB-CG 4Å; N265-Y268 PolarHBondContact O-N 3.34Å; N265-Y268 PolarHBondContact OD1-N 2.83Å; N265-Q269 PolarHBondContact O-N 3.33Å; N265-Y275 PolarHBondContact N-OH 2.8Å
266	P	95.1	Very high	93.1	Very high	43 Å²	43	98.3 Å²	98.3	28%	0.279	47%	0.465	S	S	.	.	H	α-helix	trans	-59.5	-34.7	-175.7	-25.4	35.2	0	0	0	112.7	E241 I264 Y268 Q269 M270	E241-P266 WeakPolarHBondContact OE1-CG 3.5Å; I264-P266 WeakPolarHBondContact O-CD 3.43Å; P266-Y268 PolarHBondContact O-N 2.84Å; P266-Q269 PolarHBondContact O-N 3Å; P266-M270 WeakPolarHBondContact O-CG 3.07Å; P266-M270 PolarHBondContact O-N 3.49Å; P266-M270 VanDerWaalsContact O-N 3.1Å
267	K	94.4	Very high	93.5	Very high	145 Å²	145	97 Å²	97	63%	0.63	44%	0.442	S	S	*	.	H	α-helix	trans	-65.8	-38.6	177.3	-64	177	-178.9	169.1	0	111.4	N265 K271	N265-K267 PolarHBondContact O-N 2.79Å; N265-K267 WeakPolarHBondContact OD1-CB 3.15Å; N265-K267 PolarHBondContact OD1-N 3Å; K267-K271 VanDerWaalsContact O-CB 3.31Å; K267-K271 WeakPolarHBondContact O-CB 3.37Å; K267-K271 VanDerWaalsContact O-CG 3.24Å; K267-K271 WeakPolarHBondContact O-CG 3.21Å; K267-K271 PolarHBondContact O-N 3.23Å
268	Y	94.5	Very high	93.9	Very high	65 Å²	65	90.8 Å²	90.8	26%	0.255	41%	0.414	S	S	.	.	H	α-helix	trans	-74.7	-39.5	176.8	-68.7	-6.9	0	0	0	111.9	D164 K166 N265 P266 M270 K271 K272 Y275	D164-Y268 WeakPolarHBondContact OD2-CE2 3.48Å; K166-Y268 PolarHBondContact NZ-OH 2.57Å; K166-Y268 VanDerWaalsContact NZ-OH 3.1Å; N265-Y268 HydrophobicContact CB-CD2 3.88Å; N265-Y268 HydrophobicContact CB-CG 4Å; N265-Y268 PolarHBondContact O-N 3.34Å; N265-Y268 PolarHBondContact OD1-N 2.83Å; P266-Y268 PolarHBondContact O-N 2.84Å; Y268-M270 PolarHBondContact O-N 2.77Å; Y268-K271 PolarHBondContact O-N 3.47Å; Y268-K271 VanDerWaalsContact O-N 3.1Å; Y268-K272 HydrophobicContact CD1-CD 4.37Å; Y268-K272 HydrophobicContact CD2-CD 4.34Å; Y268-K272 VanDerWaalsContact CD2-NZ 3.27Å; Y268-K272 HydrophobicContact CG-CD 4Å; Y268-K272 WeakPolarHBondContact O-CB 3.48Å; Y268-K272 PolarHBondContact O-N 3.11Å; Y268-Y275 HydrophobicContact CD2-CD2 4.35Å; Y268-Y275 AromaticContact CD2-CE2 3.98Å; Y268-Y275 HydrophobicContact CD2-CE2 3.98Å; Y268-Y275 HydrophobicContact CG-CE2 4.41Å
269	Q	91.4	Very high	94.3	Very high	122 Å²	122	85 Å²	85	57%	0.57	39%	0.388	S	S	*	.	H	α-helix	trans	-57.2	-38.4	176.3	-165.2	177.7	30	0	0	112	I264 N265 P266 Y275	I264-Q269 HydrophobicContact CG2-CB 4.47Å; N265-Q269 PolarHBondContact O-N 3.33Å; P266-Q269 PolarHBondContact O-N 3Å; Q269-Y275 HydrophobicContact CB-CD1 3.98Å; Q269-Y275 HydrophobicContact CB-CE1 4.08Å; Q269-Y275 HydrophobicContact CG-CD1 4.34Å
270	M	90.7	Very high	94.5	Very high	171 Å²	171	85.1 Å²	85.1	84%	0.842	39%	0.389	S	S	*	.	H	α-helix	trans	-75.5	-32.8	175.4	-69.3	-176	170.1	0	0	114.2	P266 Y268	P266-M270 WeakPolarHBondContact O-CG 3.07Å; P266-M270 PolarHBondContact O-N 3.49Å; P266-M270 VanDerWaalsContact O-N 3.1Å; Y268-M270 PolarHBondContact O-N 2.77Å
271	K	92.8	Very high	94.6	Very high	173 Å²	173	79.8 Å²	79.8	75%	0.752	37%	0.365	S	S	*	.	H	α-helix	trans	-99.7	-29.6	-168.9	-69.5	-179.8	-179.8	-176	0	114.8	K267 Y268	K267-K271 VanDerWaalsContact O-CB 3.31Å; K267-K271 WeakPolarHBondContact O-CB 3.37Å; K267-K271 VanDerWaalsContact O-CG 3.24Å; K267-K271 WeakPolarHBondContact O-CG 3.21Å; K267-K271 PolarHBondContact O-N 3.23Å; Y268-K271 PolarHBondContact O-N 3.47Å; Y268-K271 VanDerWaalsContact O-N 3.1Å
272	K	91.4	Very high	94.6	Very high	98 Å²	98	78.9 Å²	78.9	43%	0.426	36%	0.361	S	S	.	.			trans	-105.4	114.4	-170.8	-68.2	-176.1	-177.2	173.5	0	110.2	Y268 N274 Y275	Y268-K272 HydrophobicContact CD1-CD 4.37Å; Y268-K272 HydrophobicContact CD2-CD 4.34Å; Y268-K272 VanDerWaalsContact CD2-NZ 3.27Å; Y268-K272 HydrophobicContact CG-CD 4Å; Y268-K272 WeakPolarHBondContact O-CB 3.48Å; Y268-K272 PolarHBondContact O-N 3.11Å; K272-N274 VanDerWaalsContact C-N 3.27Å; K272-N274 PolarHBondContact O-N 3.04Å; K272-N274 VanDerWaalsContact O-N 3.14Å; K272-Y275 HydrophobicContact CD-CD2 4.45Å; K272-Y275 WeakPolarHBondContact O-CB 3.37Å; K272-Y275 PolarHBondContact O-N 2.9Å
273	K	85.9	Confident	94.5	Very high	213 Å²	213	74 Å²	74	93%	0.926	34%	0.339	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.2	-30.2	-176.5	-88.1	-173.1	173.8	-178.1	0	115.9
274	N	89.5	Confident	94.4	Very high	156 Å²	156	76.1 Å²	76.1	83%	0.834	35%	0.35	S	S	*	.	T	Hydrogen-bonded Turn	trans	-117.4	22.5	-175.9	-65	-22.7	0	0	0	112.6	K272	K272-N274 VanDerWaalsContact C-N 3.27Å; K272-N274 PolarHBondContact O-N 3.04Å; K272-N274 VanDerWaalsContact O-N 3.14Å
275	Y	93.1	Very high	94.1	Very high	39 Å²	39	79.6 Å²	79.6	15%	0.153	37%	0.365	C	S	.	.			trans	-69.3	131.8	178.3	175.7	-97.8	0	0	0	110.8	C263 I264 N265 Y268 Q269 K272 N277 S278	C263-Y275 PolarHBondContact O-OH 3.02Å; I264-Y275 WeakPolarHBondContact CA-OH 3.45Å; I264-Y275 HydrophobicContact CD1-CE1 4.37Å; I264-Y275 HydrophobicContact CG2-CE1 4.34Å; N265-Y275 PolarHBondContact N-OH 2.8Å; Y268-Y275 HydrophobicContact CD2-CD2 4.35Å; Y268-Y275 AromaticContact CD2-CE2 3.98Å; Y268-Y275 HydrophobicContact CD2-CE2 3.98Å; Y268-Y275 HydrophobicContact CG-CE2 4.41Å; Q269-Y275 HydrophobicContact CB-CD1 3.98Å; Q269-Y275 HydrophobicContact CB-CE1 4.08Å; Q269-Y275 HydrophobicContact CG-CD1 4.34Å; K272-Y275 HydrophobicContact CD-CD2 4.45Å; K272-Y275 WeakPolarHBondContact O-CB 3.37Å; K272-Y275 PolarHBondContact O-N 2.9Å; Y275-N277 VanDerWaalsContact CE2-C 3.42Å; Y275-N277 WeakPolarHBondContact CE2-O 3.19Å; Y275-N277 VanDerWaalsContact CZ-C 3.45Å; Y275-N277 VanDerWaalsContact CZ-CA 3.47Å; Y275-N277 VanDerWaalsContact OH-CA 3.31Å; Y275-N277 WeakPolarHBondContact OH-CA 3.41Å; Y275-S278 WeakPolarHBondContact CE2-OG 3.32Å; Y275-S278 PolarHBondContact OH-N 2.91Å; Y275-S278 PolarHBondContact OH-OG 2.96Å; Y275-S278 VanDerWaalsContact OH-OG 3.07Å
276	R	92.4	Very high	93.9	Very high	210 Å²	210	79.4 Å²	79.4	79%	0.792	37%	0.365	S	S	*	.			trans	-105.9	-62.7	174	-68.7	-171.9	176.1	-167.9	-1.6	110.1
277	N	96.1	Very high	93.6	Very high	43 Å²	43	83.2 Å²	83.2	23%	0.23	38%	0.376	C	S	.	.			trans	-157.4	171.3	176.9	59.1	52.7	0	0	0	109.4	E262 C263 I264 Y275 G279	E262-N277 HydrophobicContact CB-CB 3.98Å; E262-N277 HydrophobicContact CG-CB 4.47Å; E262-N277 PolarHBondContact OE1-ND2 3.31Å; C263-N277 WeakPolarHBondContact O-CB 3.48Å; I264-N277 HydrophobicContact CD1-CB 4Å; Y275-N277 VanDerWaalsContact CE2-C 3.42Å; Y275-N277 WeakPolarHBondContact CE2-O 3.19Å; Y275-N277 VanDerWaalsContact CZ-C 3.45Å; Y275-N277 VanDerWaalsContact CZ-CA 3.47Å; Y275-N277 VanDerWaalsContact OH-CA 3.31Å; Y275-N277 WeakPolarHBondContact OH-CA 3.41Å; N277-G279 VanDerWaalsContact C-N 3.31Å; N277-G279 WeakPolarHBondContact OD1-CA 3.48Å; N277-G279 PolarHBondContact OD1-N 3.19Å; N277-G279 PolarHBondContact OD1-O 3.06Å
278	S	97.1	Very high	93.3	Very high	0 Å²	0	79.5 Å²	79.5	0%	0	36%	0.363	C	S	.	.	S	Bend	trans	-102.3	32.5	173.4	-72.9	0	0	0	0	110.1	L163 D164 I239 C263 Y275	L163-S278 WeakPolarHBondContact CA-O 3.2Å; D164-S278 PolarHBondContact N-O 3.41Å; D164-S278 VanDerWaalsContact N-O 3.13Å; D164-S278 VanDerWaalsContact OD2-CB 3.31Å; D164-S278 WeakPolarHBondContact OD2-CB 3.01Å; D164-S278 PolarHBondContact OD2-OG 2.89Å; I239-S278 WeakPolarHBondContact O-CB 3.03Å; I239-S278 PolarHBondContact O-OG 3.19Å; C263-S278 PolarHBondContact O-N 3.48Å; Y275-S278 WeakPolarHBondContact CE2-OG 3.32Å; Y275-S278 PolarHBondContact OH-N 2.91Å; Y275-S278 PolarHBondContact OH-OG 2.96Å; Y275-S278 VanDerWaalsContact OH-OG 3.07Å
279	G	97.3	Very high	92.9	Very high	1 Å²	1	78.1 Å²	78.1	1%	0.01	36%	0.36	C	S	.	.			trans	111.4	-175.9	-174.9	0	0	0	0	0	113.6	R161 K162 C263 N277	R161-G279 WeakPolarHBondContact O-CA 3.44Å; K162-G279 WeakPolarHBondContact O-CA 3.43Å; C263-G279 WeakPolarHBondContact CB-O 3.29Å; C263-G279 PolarHBondContact N-O 3.22Å; N277-G279 VanDerWaalsContact C-N 3.31Å; N277-G279 WeakPolarHBondContact OD1-CA 3.48Å; N277-G279 PolarHBondContact OD1-N 3.19Å; N277-G279 PolarHBondContact OD1-O 3.06Å
280	T	98.1	Very high	92.7	Very high	26 Å²	26	77.7 Å²	77.7	16%	0.16	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	130.8	-179.1	-53.3	0	0	0	0	109.4	A160 R161 Q260 W261 I282	A160-T280 CarbonylContact C-O 3.46Å; A160-T280 WeakPolarHBondContact CA-O 3.27Å; R161-T280 PolarHBondContact N-O 3.41Å; R161-T280 PolarHBondContact O-N 2.93Å; Q260-T280 HydrophobicContact CB-CG2 3.74Å; Q260-T280 HydrophobicContact CG-CG2 4.11Å; W261-T280 CarbonylContact O-C 3.48Å; W261-T280 WeakPolarHBondContact O-CA 3.48Å; W261-T280 WeakPolarHBondContact O-CG2 3.49Å; T280-I282 HydrophobicContact CG2-CG1 4.49Å
281	V	98.4	Very high	92.4	Very high	0 Å²	0	72.2 Å²	72.2	0%	0	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.6	138.9	173.6	-178.5	0	0	0	0	108.6	F158 S159 A160 V227 F242 Q260 W261 C263	F158-V281 HydrophobicContact CD1-CG1 3.98Å; S159-V281 CarbonylContact O-C 3.56Å; S159-V281 WeakPolarHBondContact O-CA 3.45Å; A160-V281 HydrophobicContact CB-CG2 4.23Å; V227-V281 HydrophobicContact CG2-CG2 3.88Å; F242-V281 HydrophobicContact CD1-CB 4.29Å; F242-V281 HydrophobicContact CD1-CG2 4.17Å; F242-V281 HydrophobicContact CE1-CB 3.69Å; F242-V281 HydrophobicContact CE1-CG1 3.73Å; F242-V281 HydrophobicContact CE1-CG2 3.73Å; F242-V281 HydrophobicContact CZ-CB 4.06Å; F242-V281 HydrophobicContact CZ-CG1 3.73Å; Q260-V281 CarbonylContact C-O 3.52Å; Q260-V281 WeakPolarHBondContact CA-O 3.42Å; Q260-V281 WeakPolarHBondContact CB-O 3.38Å; W261-V281 PolarHBondContact N-O 2.91Å; W261-V281 PolarHBondContact O-N 3.22Å; C263-V281 HydrophobicContact CB-CG2 4.38Å
282	I	97.9	Very high	92.3	Very high	1 Å²	1	65.6 Å²	65.6	1%	0.005	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	130.2	-172.7	-55.4	171.6	0	0	0	107.7	F158 S159 R161 Q258 Q260 T280	F158-I282 CarbonylContact C-O 3.05Å; F158-I282 VanDerWaalsContact CA-O 3.31Å; F158-I282 WeakPolarHBondContact CA-O 3.42Å; S159-I282 PolarHBondContact N-O 3.44Å; S159-I282 PolarHBondContact O-N 3.37Å; R161-I282 HydrophobicContact CG-CD1 3.9Å; Q258-I282 HydrophobicContact CG-CG2 3.67Å; Q260-I282 HydrophobicContact CB-CG1 4Å; T280-I282 HydrophobicContact CG2-CG1 4.49Å
283	L	96.9	Very high	92.3	Very high	8 Å²	8	62.3 Å²	62.3	4%	0.042	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80	118.4	165.6	-177.8	70.1	0	0	0	108.1	L156 F158 M249 I259 W261 H285 C286	L156-L283 HydrophobicContact CD2-CD1 4.1Å; F158-L283 HydrophobicContact CD1-CD1 4.19Å; F158-L283 HydrophobicContact CE1-CB 4.28Å; F158-L283 HydrophobicContact CE1-CD1 3.68Å; F158-L283 HydrophobicContact CE2-CD1 4.14Å; F158-L283 HydrophobicContact CZ-CD1 3.65Å; M249-L283 HydrophobicContact CB-CD2 3.71Å; M249-L283 HydrophobicContact CG-CD2 3.9Å; M249-L283 HydrophobicContact SD-CD1 4.26Å; M249-L283 HydrophobicContact SD-CD2 4.41Å; I259-L283 HydrophobicContact CG2-CB 3.51Å; I259-L283 HydrophobicContact CG2-CD2 3.58Å; I259-L283 HydrophobicContact CG2-CG 4.2Å; I259-L283 PolarHBondContact O-N 2.57Å; I259-L283 VanDerWaalsContact O-N 3.11Å; W261-L283 HydrophobicContact CH2-CB 3.84Å; W261-L283 HydrophobicContact CH2-CD2 4.34Å; W261-L283 HydrophobicContact CZ3-CB 3.79Å; L283-H285 WeakPolarHBondContact CD1-O 3.38Å; L283-C286 HydrophobicContact CD1-CB 4.34Å; L283-C286 HydrophobicContact CD2-CB 3.84Å; L283-C286 HydrophobicContact CG-CB 4.42Å
284	N	94.6	Very high	92.7	Very high	45 Å²	45	52.5 Å²	52.5	24%	0.241	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.3	-42.1	176.9	-54.4	-40.1	0	0	0	110.9	S157 F158 S159	S157-N284 PolarHBondContact O-N 3.4Å; S157-N284 PolarHBondContact OG-ND2 3.44Å; S157-N284 VanDerWaalsContact OG-ND2 3.14Å; F158-N284 PolarHBondContact O-ND2 3.48Å; S159-N284 PolarHBondContact N-ND2 3.47Å; S159-N284 PolarHBondContact OG-OD1 3.36Å
285	H	90.4	Very high	92.8	Very high	108 Å²	108	45 Å²	45	50%	0.5	21%	0.206	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.8	140.2	-177.7	-67.6	-64.1	0	0	0	111.1	L156 S157 L283	L156-H285 WeakPolarHBondContact CA-O 3.09Å; S157-H285 PolarHBondContact N-O 3.09Å; S157-H285 VanDerWaalsContact N-O 3.09Å; S157-H285 PolarHBondContact O-N 3.28Å; L283-H285 WeakPolarHBondContact CD1-O 3.38Å
286	C	93.1	Very high	92.8	Very high	1 Å²	1	45.6 Å²	45.6	1%	0.007	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.1	100.9	165.7	174	0	0	0	0	110.1	L156 M249 E253 L283	L156-C286 HydrophobicContact CD2-CB 3.87Å; M249-C286 HydrophobicContact CB-CB 4.32Å; E253-C286 HydrophobicContact CB-CB 4.48Å; E253-C286 VanDerWaalsContact CG-O 3.3Å; E253-C286 WeakPolarHBondContact CG-O 3.3Å; E253-C286 PolarHBondContact OE2-N 3.02Å; L283-C286 HydrophobicContact CD1-CB 4.34Å; L283-C286 HydrophobicContact CD2-CB 3.84Å; L283-C286 HydrophobicContact CG-CB 4.42Å
287	K	89.9	Confident	92.9	Very high	122 Å²	122	35.6 Å²	35.6	53%	0.53	17%	0.174	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	120.9	-174.3	-179.3	-176.9	175.2	-169.9	0	111.1	V154 E155 I289	V154-K287 WeakPolarHBondContact CA-O 3.31Å; E155-K287 HydrophobicContact CB-CB 4.37Å; E155-K287 PolarHBondContact N-O 3.3Å; E155-K287 PolarHBondContact O-N 2.93Å; K287-I289 PolarHBondContact O-N 3.4Å
288	I	87.3	Confident	92.8	Very high	67 Å²	67	33.6 Å²	33.6	34%	0.344	16%	0.164	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-71	127.9	169.1	-49.7	-171.3	0	0	0	109	D152 Y246 M250	D152-I288 HydrophobicContact CB-CG2 4.31Å; Y246-I288 WeakPolarHBondContact OH-CD1 3.43Å; Y246-I288 WeakPolarHBondContact OH-CG1 3.44Å; M250-I288 HydrophobicContact CE-CD1 3.42Å; M250-I288 VanDerWaalsContact CE-CD1 3.42Å; M250-I288 HydrophobicContact CE-CG1 3.62Å; M250-I288 HydrophobicContact SD-CD1 3.69Å; M250-I288 HydrophobicContact SD-CG1 3.43Å; M250-I288 WeakPolarHBondContact SD-CG1 3.32Å
289	I	87.3	Confident	92.5	Very high	37 Å²	37	34.4 Å²	34.4	19%	0.19	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	98.8	167.8	-57.9	174.5	0	0	0	105.5	Y153 E155 K208 K287 M291	Y153-I289 PolarHBondContact N-O 3.28Å; Y153-I289 PolarHBondContact O-N 3.36Å; E155-I289 HydrophobicContact CB-CD1 3.92Å; E155-I289 HydrophobicContact CB-CG1 4.48Å; K208-I289 HydrophobicContact CD-CD1 3.69Å; K208-I289 HydrophobicContact CG-CD1 4.16Å; K287-I289 PolarHBondContact O-N 3.4Å; I289-M291 HydrophobicContact CG2-SD 4.22Å; I289-M291 PolarHBondContact O-N 2.98Å
290	K	85.4	Confident	92.1	Very high	113 Å²	113	34.8 Å²	34.8	49%	0.491	17%	0.171	S	C	.	.	P	Polyproline II helix	trans	-67.1	124.9	177	-175.6	159.6	-175.1	172.6	0	109.2	D152 Y292	D152-K290 VanDerWaalsContact OD1-CA 3.27Å; D152-K290 WeakPolarHBondContact OD1-CA 3.17Å; K290-Y292 HydrophobicContact CB-CE2 4.37Å; K290-Y292 HydrophobicContact CD-CE1 3.76Å; K290-Y292 HydrophobicContact CG-CD1 4.42Å; K290-Y292 HydrophobicContact CG-CE1 3.95Å; K290-Y292 HydrophobicContact CG-CE2 4.15Å
291	M	85.8	Confident	91.8	Very high	56 Å²	56	35.2 Å²	35.2	28%	0.276	18%	0.181	S	C	.	.	P	Polyproline II helix	trans	-100.7	132.5	174.1	-63.6	-58.7	-65.8	0	0	108.1	D151 D152 Y153 I289 N534	D151-M291 WeakPolarHBondContact O-CG 3.31Å; D152-M291 PolarHBondContact OD1-N 3.44Å; Y153-M291 HydrophobicContact CD2-CG 3.69Å; Y153-M291 HydrophobicContact CD2-SD 4.29Å; Y153-M291 HydrophobicContact CE2-CG 4.22Å; I289-M291 HydrophobicContact CG2-SD 4.22Å; I289-M291 PolarHBondContact O-N 2.98Å; M291-N534 HydrophobicContact CE-CB 3.55Å; M291-N534 HydrophobicContact SD-CB 4.25Å
292	Y	89.5	Confident	91.6	Very high	34 Å²	34	35.4 Å²	35.4	13%	0.133	18%	0.182	C	C	.	.	P	Polyproline II helix	trans	-103.7	135.9	179.5	-61.3	-80.6	0	0	0	110	K290 D296 N534 K539 P540	K290-Y292 HydrophobicContact CB-CE2 4.37Å; K290-Y292 HydrophobicContact CD-CE1 3.76Å; K290-Y292 HydrophobicContact CG-CD1 4.42Å; K290-Y292 HydrophobicContact CG-CE1 3.95Å; K290-Y292 HydrophobicContact CG-CE2 4.15Å; Y292-D296 WeakPolarHBondContact CA-OD2 3.24Å; Y292-D296 HydrophobicContact CD1-CB 4.3Å; Y292-N534 PolarHBondContact N-OD1 2.9Å; Y292-N534 PolarHBondContact O-ND2 2.71Å; Y292-K539 HydrophobicContact CE2-CB 4.06Å; Y292-K539 HydrophobicContact CE2-CD 4.49Å; Y292-K539 HydrophobicContact CE2-CG 3.79Å; Y292-K539 WeakPolarHBondContact OH-CD 3.37Å; Y292-P540 HydrophobicContact CD1-CG 3.26Å; Y292-P540 HydrophobicContact CD2-CG 4.38Å; Y292-P540 HydrophobicContact CE1-CG 3.57Å; Y292-P540 HydrophobicContact CG-CG 3.68Å
293	S	91.8	Very high	91.4	Very high	29 Å²	29	37.9 Å²	37.9	20%	0.203	19%	0.193	C	C	.	.	P	Polyproline II helix	trans	-72.9	171.4	177.5	79.7	0	0	0	0	111.1	E146 L295 D296 Y297	E146-S293 PolarHBondContact OE1-OG 3.28Å; E146-S293 PolarHBondContact OE2-OG 3.32Å; S293-L295 VanDerWaalsContact C-N 3.33Å; S293-L295 PolarHBondContact OG-N 3.2Å; S293-D296 PolarHBondContact N-OD2 2.89Å; S293-D296 WeakPolarHBondContact O-CB 3.43Å; S293-D296 PolarHBondContact O-N 3.34Å; S293-D296 PolarHBondContact OG-N 3.31Å; S293-Y297 WeakPolarHBondContact O-CD2 3.38Å; S293-Y297 PolarHBondContact O-N 3.49Å
294	F	94	Very high	91.3	Very high	6 Å²	6	37.5 Å²	37.5	3%	0.026	19%	0.191	C	C	.	.	H	α-helix	trans	-59.8	-44.5	170.1	174.7	-107.1	0	0	0	111.8	L20 Y80 F82 D296 Y297 I298 I304 P526 V529 V530	L20-F294 HydrophobicContact CD2-CB 4.11Å; L20-F294 HydrophobicContact CD2-CD1 3.78Å; L20-F294 HydrophobicContact CD2-CG 4.3Å; Y80-F294 HydrophobicContact CE1-CD1 4.28Å; Y80-F294 HydrophobicContact CE1-CE1 4.38Å; F82-F294 HydrophobicContact CB-CE1 4.36Å; F82-F294 AromaticContact CD2-CE1 3.51Å; F82-F294 HydrophobicContact CD2-CE1 3.51Å; F82-F294 AromaticContact CD2-CZ 3.57Å; F82-F294 HydrophobicContact CD2-CZ 3.57Å; F82-F294 HydrophobicContact CE2-CE1 4.07Å; F82-F294 AromaticContact CE2-CZ 3.63Å; F82-F294 HydrophobicContact CE2-CZ 3.63Å; F82-F294 HydrophobicContact CG-CE1 4.09Å; F82-F294 HydrophobicContact CG-CZ 4.29Å; F82-F294 HydrophobicContact CZ-CZ 4.38Å; F294-D296 VanDerWaalsContact C-N 3.32Å; F294-D296 PolarHBondContact O-N 2.84Å; F294-Y297 PolarHBondContact O-N 3.25Å; F294-I298 HydrophobicContact CD1-CG1 4.17Å; F294-I298 HydrophobicContact CD2-CG1 4.39Å; F294-I298 HydrophobicContact CE1-CD1 4.4Å; F294-I298 HydrophobicContact CE1-CG1 3.69Å; F294-I298 HydrophobicContact CE2-CD1 4.03Å; F294-I298 HydrophobicContact CE2-CG1 3.93Å; F294-I298 HydrophobicContact CZ-CD1 3.78Å; F294-I298 HydrophobicContact CZ-CG1 3.56Å; F294-I298 WeakPolarHBondContact O-CG1 3.41Å; F294-I298 PolarHBondContact O-N 2.99Å; F294-I298 VanDerWaalsContact O-N 3.09Å; F294-I304 HydrophobicContact CE2-CD1 4.42Å; F294-P526 HydrophobicContact CB-CB 3.95Å; F294-P526 HydrophobicContact CD1-CB 4.24Å; F294-P526 HydrophobicContact CD2-CB 4.04Å; F294-P526 HydrophobicContact CG-CB 3.81Å; F294-P526 HydrophobicContact CG-CG 4.49Å; F294-V529 HydrophobicContact CD2-CB 4.02Å; F294-V529 HydrophobicContact CD2-CG1 4.03Å; F294-V529 HydrophobicContact CD2-CG2 4.3Å; F294-V529 HydrophobicContact CE2-CB 4.31Å; F294-V529 HydrophobicContact CE2-CG1 4.34Å; F294-V529 HydrophobicContact CE2-CG2 4.09Å; F294-V530 HydrophobicContact CB-CG2 4.04Å; F294-V530 VanDerWaalsContact N-CG2 3.32Å
295	L	92.8	Very high	91.4	Very high	0 Å²	0	36.6 Å²	36.6	0%	0	19%	0.186	C	C	.	.	H	α-helix	trans	-69.6	-28	179.5	-76.5	-168.7	0	0	0	112.8	T21 V23 Y80 V119 E146 S293 Y297 I298 M299	T21-L295 HydrophobicContact CG2-CD1 3.38Å; T21-L295 HydrophobicContact CG2-CG 4.09Å; V23-L295 HydrophobicContact CG2-CD1 3.7Å; Y80-L295 HydrophobicContact CD1-CD1 3.82Å; Y80-L295 HydrophobicContact CD1-CD2 4.13Å; Y80-L295 HydrophobicContact CD1-CG 4.04Å; Y80-L295 HydrophobicContact CE1-CD1 4.12Å; Y80-L295 HydrophobicContact CE1-CD2 3.56Å; Y80-L295 HydrophobicContact CE1-CG 3.87Å; Y80-L295 HydrophobicContact CE2-CD2 4.32Å; Y80-L295 HydrophobicContact CG-CD1 4.11Å; V119-L295 HydrophobicContact CB-CD2 4.04Å; V119-L295 HydrophobicContact CG1-CD1 4.44Å; V119-L295 HydrophobicContact CG1-CD2 4.48Å; V119-L295 HydrophobicContact CG2-CD2 3.94Å; E146-L295 HydrophobicContact CB-CB 4.43Å; E146-L295 HydrophobicContact CB-CD1 4.4Å; E146-L295 HydrophobicContact CG-CB 4.34Å; E146-L295 HydrophobicContact CG-CD1 4.14Å; E146-L295 WeakPolarHBondContact OE2-CB 3.38Å; S293-L295 VanDerWaalsContact C-N 3.33Å; S293-L295 PolarHBondContact OG-N 3.2Å; L295-Y297 VanDerWaalsContact C-N 3.27Å; L295-Y297 PolarHBondContact O-N 2.83Å; L295-I298 HydrophobicContact CD2-CB 4.4Å; L295-I298 PolarHBondContact O-N 3.31Å; L295-M299 HydrophobicContact CB-CE 4.4Å; L295-M299 HydrophobicContact CD1-CE 4.01Å; L295-M299 WeakPolarHBondContact O-CA 3.42Å; L295-M299 WeakPolarHBondContact O-CB 3.43Å; L295-M299 VanDerWaalsContact O-CG 3.25Å; L295-M299 WeakPolarHBondContact O-CG 3.45Å; L295-M299 PolarHBondContact O-N 2.88Å
296	D	91.9	Very high	91.6	Very high	50 Å²	50	31.5 Å²	31.5	27%	0.267	16%	0.162	S	C	.	.	H	α-helix	trans	-57.2	-42.5	170.5	-85.7	-39.1	0	0	0	111.2	Y292 S293 F294 G300 P540	Y292-D296 WeakPolarHBondContact CA-OD2 3.24Å; Y292-D296 HydrophobicContact CD1-CB 4.3Å; S293-D296 PolarHBondContact N-OD2 2.89Å; S293-D296 WeakPolarHBondContact O-CB 3.43Å; S293-D296 PolarHBondContact O-N 3.34Å; S293-D296 PolarHBondContact OG-N 3.31Å; F294-D296 VanDerWaalsContact C-N 3.32Å; F294-D296 PolarHBondContact O-N 2.84Å; D296-G300 WeakPolarHBondContact O-CA 3.48Å; D296-G300 PolarHBondContact O-N 2.79Å; D296-P540 HydrophobicContact CB-CB 4.45Å; D296-P540 HydrophobicContact CB-CG 4.14Å; D296-P540 WeakPolarHBondContact O-CB 3.29Å
297	Y	94.3	Very high	91.9	Very high	1 Å²	1	31.9 Å²	31.9	0%	0.004	17%	0.165	C	C	.	.	H	α-helix	trans	-69.7	-48.4	176.5	-70.3	-70.4	0	0	0	112	S293 F294 L295 G300 G301 C302 A431 Y533 I538 P540	S293-Y297 WeakPolarHBondContact O-CD2 3.38Å; S293-Y297 PolarHBondContact O-N 3.49Å; F294-Y297 PolarHBondContact O-N 3.25Å; L295-Y297 VanDerWaalsContact C-N 3.27Å; L295-Y297 PolarHBondContact O-N 2.83Å; Y297-G300 CarbonylContact O-C 3.59Å; Y297-G300 WeakPolarHBondContact O-CA 3.47Å; Y297-G300 PolarHBondContact O-N 2.71Å; Y297-G301 PolarHBondContact O-N 3.01Å; Y297-C302 WeakPolarHBondContact O-CB 3.43Å; Y297-C302 PolarHBondContact O-N 2.83Å; Y297-A431 HydrophobicContact CD1-CB 3.6Å; Y297-A431 HydrophobicContact CE1-CB 3.9Å; Y297-Y533 AromaticContact CD1-CD2 3.97Å; Y297-Y533 HydrophobicContact CD1-CD2 3.97Å; Y297-Y533 HydrophobicContact CD1-CG 4.23Å; Y297-Y533 HydrophobicContact CD2-CD2 4.37Å; Y297-Y533 AromaticContact CE1-CD2 3.97Å; Y297-Y533 HydrophobicContact CE1-CD2 3.97Å; Y297-Y533 AromaticContact CE1-CG 3.79Å; Y297-Y533 HydrophobicContact CE1-CG 3.79Å; Y297-Y533 HydrophobicContact CE2-CD2 4.38Å; Y297-Y533 HydrophobicContact CG-CD2 4.19Å; Y297-Y533 AromaticContact CZ-CG 3.98Å; Y297-Y533 WeakPolarHBondContact OH-CB 3.08Å; Y297-I538 PolarHBondContact OH-O 2.8Å; Y297-P540 HydrophobicContact CD1-CB 3.88Å; Y297-P540 HydrophobicContact CE1-CB 4.22Å; Y297-P540 HydrophobicContact CG-CB 4.45Å
298	I	94.3	Very high	92.3	Very high	1 Å²	1	26 Å²	26	1%	0.005	14%	0.139	C	C	.	.	H	α-helix	trans	-61.8	-50.3	179.3	-64	-57.1	0	0	0	111.3	F294 L295 G300 G301 I304 Y350	F294-I298 HydrophobicContact CD1-CG1 4.17Å; F294-I298 HydrophobicContact CD2-CG1 4.39Å; F294-I298 HydrophobicContact CE1-CD1 4.4Å; F294-I298 HydrophobicContact CE1-CG1 3.69Å; F294-I298 HydrophobicContact CE2-CD1 4.03Å; F294-I298 HydrophobicContact CE2-CG1 3.93Å; F294-I298 HydrophobicContact CZ-CD1 3.78Å; F294-I298 HydrophobicContact CZ-CG1 3.56Å; F294-I298 WeakPolarHBondContact O-CG1 3.41Å; F294-I298 PolarHBondContact O-N 2.99Å; F294-I298 VanDerWaalsContact O-N 3.09Å; L295-I298 HydrophobicContact CD2-CB 4.4Å; L295-I298 PolarHBondContact O-N 3.31Å; I298-G300 PolarHBondContact O-N 3.06Å; I298-G301 PolarHBondContact O-N 2.85Å; I298-I304 HydrophobicContact CD1-CD1 4.04Å; I298-I304 HydrophobicContact CD1-CG1 3.91Å; I298-Y350 HydrophobicContact CD1-CD1 4.2Å; I298-Y350 HydrophobicContact CG1-CD1 4.38Å; I298-Y350 HydrophobicContact CG2-CD1 3.92Å; I298-Y350 HydrophobicContact CG2-CE1 4.28Å
299	M	90.8	Very high	92.8	Very high	17 Å²	17	22.9 Å²	22.9	8%	0.084	12%	0.123	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68.8	-12.4	174	-64.7	-173.9	-176.4	0	0	112.5	V119 A144 E146 L295 G301 I543	V119-M299 HydrophobicContact CB-CE 3.97Å; V119-M299 HydrophobicContact CG1-CE 3.85Å; V119-M299 WeakPolarHBondContact O-CG 3.16Å; A144-M299 HydrophobicContact CB-CE 4.16Å; E146-M299 HydrophobicContact CB-CE 4.28Å; E146-M299 HydrophobicContact CB-SD 4.47Å; L295-M299 HydrophobicContact CB-CE 4.4Å; L295-M299 HydrophobicContact CD1-CE 4.01Å; L295-M299 WeakPolarHBondContact O-CA 3.42Å; L295-M299 WeakPolarHBondContact O-CB 3.43Å; L295-M299 VanDerWaalsContact O-CG 3.25Å; L295-M299 WeakPolarHBondContact O-CG 3.45Å; L295-M299 PolarHBondContact O-N 2.88Å; M299-G301 VanDerWaalsContact C-N 3.28Å; M299-I543 WeakPolarHBondContact O-CD1 3.23Å
300	G	90.3	Very high	93.3	Very high	8 Å²	8	21.1 Å²	21.1	8%	0.082	11%	0.114	C	C	.	.	T	Hydrogen-bonded Turn	trans	-81.4	-6.1	169	0	0	0	0	0	113.3	D296 Y297 I298 K541	D296-G300 WeakPolarHBondContact O-CA 3.48Å; D296-G300 PolarHBondContact O-N 2.79Å; Y297-G300 CarbonylContact O-C 3.59Å; Y297-G300 WeakPolarHBondContact O-CA 3.47Å; Y297-G300 PolarHBondContact O-N 2.71Å; I298-G300 PolarHBondContact O-N 3.06Å; G300-K541 WeakPolarHBondContact CA-O 3.32Å; G300-K541 WeakPolarHBondContact O-CB 3.42Å
301	G	91.3	Very high	93.9	Very high	35 Å²	35	15.7 Å²	15.7	36%	0.361	9%	0.09	S	C	.	.	T	Hydrogen-bonded Turn	trans	94.8	9.7	-178.1	0	0	0	0	0	114.7	Y297 I298 M299 Q303	Y297-G301 PolarHBondContact O-N 3.01Å; I298-G301 PolarHBondContact O-N 2.85Å; M299-G301 VanDerWaalsContact C-N 3.28Å; G301-Q303 PolarHBondContact O-N 2.89Å
302	C	94.4	Very high	94.5	Very high	5 Å²	5	13 Å²	13	3%	0.034	8%	0.077	C	C	.	.			trans	-64.6	127.2	169.4	-172.5	0	0	0	0	109.5	Y297 A431 M432	Y297-C302 WeakPolarHBondContact O-CB 3.43Å; Y297-C302 PolarHBondContact O-N 2.83Å; C302-A431 WeakPolarHBondContact CA-O 3.38Å; C302-A431 VanDerWaalsContact CB-O 3.3Å; C302-A431 WeakPolarHBondContact CB-O 3.24Å; C302-M432 CarbonylContact C-O 3.59Å; C302-M432 WeakPolarHBondContact CA-O 3.13Å
303	Q	93.7	Very high	94.9	Very high	52 Å²	52	11.5 Å²	11.5	24%	0.243	7%	0.072	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.6	148.2	177.1	-54.5	-166.7	22.6	0	0	110.5	G301 Y350 S352 M432 E433 Y434	G301-Q303 PolarHBondContact O-N 2.89Å; Q303-Y350 WeakPolarHBondContact CA-O 3.19Å; Q303-S352 PolarHBondContact NE2-OG 3Å; Q303-S352 PolarHBondContact OE1-OG 3.02Å; Q303-M432 PolarHBondContact N-O 3.08Å; Q303-E433 CarbonylContact O-C 3.55Å; Q303-E433 WeakPolarHBondContact O-CA 3.13Å; Q303-Y434 PolarHBondContact O-N 3.43Å
304	I	94.4	Very high	95.1	Very high	0 Å²	0	12.8 Å²	12.8	0%	0	8%	0.084	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.7	105.8	172.8	-59.6	-57.7	0	0	0	108.2	F294 I298 F306 Y350 Y434 I436	F294-I304 HydrophobicContact CE2-CD1 4.42Å; I298-I304 HydrophobicContact CD1-CD1 4.04Å; I298-I304 HydrophobicContact CD1-CG1 3.91Å; I304-F306 PolarHBondContact O-N 2.99Å; I304-Y350 HydrophobicContact CG1-CG 4.4Å; I304-Y350 PolarHBondContact N-O 2.66Å; I304-Y434 CarbonylContact C-O 3.41Å; I304-Y434 WeakPolarHBondContact CA-O 3.39Å; I304-I436 HydrophobicContact CG2-CB 4.5Å; I304-I436 HydrophobicContact CG2-CD1 3.3Å; I304-I436 HydrophobicContact CG2-CG1 3.79Å
305	Q	95.7	Very high	95.1	Very high	27 Å²	27	16.1 Å²	16.1	13%	0.126	11%	0.108	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.2	102.5	179	-71.2	-63.5	-24.1	0	0	109.6	E433 Y434 F435 I436	Q305-E433 HydrophobicContact CG-CB 4.05Å; Q305-E433 HydrophobicContact CG-CG 4.13Å; Q305-Y434 PolarHBondContact N-O 3.12Å; Q305-F435 HydrophobicContact CB-CD1 3.62Å; Q305-F435 HydrophobicContact CB-CE1 3.8Å; Q305-F435 HydrophobicContact CB-CG 4.13Å; Q305-F435 HydrophobicContact CB-CZ 4.44Å; Q305-F435 HydrophobicContact CG-CD1 4.28Å; Q305-F435 HydrophobicContact CG-CE1 3.97Å; Q305-F435 HydrophobicContact CG-CZ 4.23Å; Q305-F435 WeakPolarHBondContact O-CA 3.35Å; Q305-I436 PolarHBondContact O-N 3.18Å
306	F	96.5	Very high	95.3	Very high	0 Å²	0	16.2 Å²	16.2	0%	0	11%	0.108	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.5	112.8	-173.1	-176.4	-115.2	0	0	0	112	I304 V308 V343 C347 F356 I436 L438	I304-F306 PolarHBondContact O-N 2.99Å; F306-V308 HydrophobicContact CD1-CG2 4.17Å; F306-V308 HydrophobicContact CE1-CG2 3.51Å; F306-V308 HydrophobicContact CZ-CG2 3.89Å; F306-V343 HydrophobicContact CE2-CG1 3.82Å; F306-V343 HydrophobicContact CZ-CB 4.4Å; F306-V343 HydrophobicContact CZ-CG1 3.78Å; F306-C347 HydrophobicContact CB-CB 4.02Å; F306-C347 HydrophobicContact CD1-CB 4.15Å; F306-C347 HydrophobicContact CD2-CB 3.89Å; F306-C347 HydrophobicContact CE2-CB 4.38Å; F306-C347 HydrophobicContact CG-CB 3.76Å; F306-F356 HydrophobicContact CB-CD1 3.89Å; F306-F356 HydrophobicContact CB-CE1 4.11Å; F306-F356 HydrophobicContact CD1-CD1 4.13Å; F306-F356 HydrophobicContact CD1-CG 4.26Å; F306-F356 WeakPolarHBondContact O-CD1 3.35Å; F306-I436 HydrophobicContact CD2-CB 4.18Å; F306-I436 HydrophobicContact CD2-CG2 3.98Å; F306-I436 HydrophobicContact CE2-CG2 4.22Å; F306-L438 HydrophobicContact CE2-CB 3.74Å; F306-L438 HydrophobicContact CE2-CD2 4.31Å; F306-L438 HydrophobicContact CZ-CB 3.87Å; F306-L438 HydrophobicContact CZ-CD2 3.7Å; F306-L438 HydrophobicContact CZ-CG 4.44Å
307	T	98.1	Very high	95.5	Very high	9 Å²	9	15.2 Å²	15.2	6%	0.055	11%	0.11	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	138.2	176.4	-62.6	0	0	0	0	110.7	P357 F359 V418 I436 L437 L438	T307-P357 HydrophobicContact CG2-CB 4.16Å; T307-F359 HydrophobicContact CG2-CD2 3.66Å; T307-F359 HydrophobicContact CG2-CE2 3.78Å; T307-V418 HydrophobicContact CG2-CG2 3.75Å; T307-I436 PolarHBondContact N-O 3.3Å; T307-L437 HydrophobicContact CG2-CD1 3.97Å; T307-L437 WeakPolarHBondContact O-CA 3.34Å; T307-L438 PolarHBondContact O-N 3.49Å
308	V	98.3	Very high	95.5	Very high	0 Å²	0	18.5 Å²	18.5	0%	0	13%	0.127	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	136.6	178.2	175.4	0	0	0	0	110.2	F306 I310 L340 P357 F359 V392 L438	F306-V308 HydrophobicContact CD1-CG2 4.17Å; F306-V308 HydrophobicContact CE1-CG2 3.51Å; F306-V308 HydrophobicContact CZ-CG2 3.89Å; V308-I310 HydrophobicContact CG1-CD1 4.14Å; V308-I310 HydrophobicContact CG1-CG1 3.74Å; V308-L340 HydrophobicContact CB-CD2 4.37Å; V308-L340 HydrophobicContact CG1-CD2 3.29Å; V308-L340 HydrophobicContact CG2-CD2 4.15Å; V308-P357 PolarHBondContact N-O 3.38Å; V308-F359 PolarHBondContact O-N 2.83Å; V308-V392 HydrophobicContact CB-CG1 4.4Å; V308-V392 HydrophobicContact CG1-CG1 4.3Å; V308-V392 HydrophobicContact CG2-CG1 4.36Å; V308-L438 CarbonylContact C-O 3.38Å
309	A	98.4	Very high	95.6	Very high	0 Å²	0	19.9 Å²	19.9	0%	0	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	121.8	172.3	0	0	0	0	0	110.6	F359 F361 I414 L437 L438 I439 L440	A309-F359 CarbonylContact C-O 3.54Å; A309-F359 VanDerWaalsContact CA-O 3.3Å; A309-F359 WeakPolarHBondContact CA-O 3.41Å; A309-F361 HydrophobicContact CB-CD1 4.32Å; A309-F361 HydrophobicContact CB-CE1 4.23Å; A309-I414 HydrophobicContact CB-CG1 3.63Å; A309-I414 HydrophobicContact CB-CG2 4.24Å; A309-L437 HydrophobicContact CB-CD1 3.85Å; A309-L438 PolarHBondContact N-O 3.38Å; A309-I439 HydrophobicContact CB-CG1 4.23Å; A309-I439 WeakPolarHBondContact O-CA 3.47Å; A309-L440 PolarHBondContact O-N 3.36Å
310	I	98.6	Very high	95.7	Very high	0 Å²	0	29 Å²	29	0%	0	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	123.7	-174	-52.5	178.6	0	0	0	109.7	V308 F312 Y336 L340 F359 G360 F361 Y396	V308-I310 HydrophobicContact CG1-CD1 4.14Å; V308-I310 HydrophobicContact CG1-CG1 3.74Å; I310-F312 HydrophobicContact CB-CD2 4.27Å; I310-F312 HydrophobicContact CB-CE2 3.73Å; I310-F312 HydrophobicContact CB-CZ 4.22Å; I310-F312 HydrophobicContact CG2-CD2 4.22Å; I310-F312 HydrophobicContact CG2-CE1 4.36Å; I310-F312 HydrophobicContact CG2-CE2 3.79Å; I310-F312 HydrophobicContact CG2-CZ 3.9Å; I310-F312 WeakPolarHBondContact O-CD2 3.04Å; I310-F312 PolarHBondContact O-N 3.17Å; I310-Y336 HydrophobicContact CG2-CD1 3.78Å; I310-Y336 HydrophobicContact CG2-CE1 3.89Å; I310-L340 HydrophobicContact CD1-CD1 4.04Å; I310-L340 HydrophobicContact CD1-CD2 4.47Å; I310-F359 PolarHBondContact N-O 2.84Å; I310-G360 CarbonylContact O-C 3.59Å; I310-G360 VanDerWaalsContact O-CA 3.23Å; I310-G360 WeakPolarHBondContact O-CA 3.43Å; I310-F361 VanDerWaalsContact C-CE1 3.46Å; I310-F361 WeakPolarHBondContact O-CD1 3.21Å; I310-F361 PolarHBondContact O-N 2.92Å; I310-Y396 HydrophobicContact CD1-CD2 3.53Å; I310-Y396 HydrophobicContact CD1-CE2 4.31Å; I310-Y396 HydrophobicContact CD1-CG 4.08Å; I310-Y396 HydrophobicContact CG2-CD2 3.96Å; I310-Y396 HydrophobicContact CG2-CE2 3.78Å
311	D	97.9	Very high	95.9	Very high	0 Å²	0	32.6 Å²	32.6	0%	0	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.7	124.5	171.7	-171.5	-17.2	0	0	0	110.4	T313 H326 Y336 F361 L440 T441 D442	D311-T313 WeakPolarHBondContact OD1-CB 3.45Å; D311-T313 WeakPolarHBondContact OD1-CG2 3.49Å; D311-T313 PolarHBondContact OD1-N 2.87Å; D311-T313 PolarHBondContact OD1-OG1 2.68Å; D311-H326 PolarHBondContact O-CE1 3.18Å; D311-H326 PolarHBondContact O-NE2 2.66Å; D311-Y336 HydrophobicContact CB-CE1 4.37Å; D311-F361 VanDerWaalsContact CA-CZ 3.48Å; D311-F361 HydrophobicContact CB-CD2 4.47Å; D311-F361 HydrophobicContact CB-CE1 4Å; D311-F361 HydrophobicContact CB-CE2 3.65Å; D311-F361 HydrophobicContact CB-CZ 3.39Å; D311-F361 VanDerWaalsContact N-CE1 3.29Å; D311-L440 WeakPolarHBondContact CB-O 3.03Å; D311-L440 PolarHBondContact N-O 2.87Å; D311-T441 WeakPolarHBondContact OD2-CA 3.26Å; D311-T441 WeakPolarHBondContact OD2-CB 3.37Å; D311-T441 PolarHBondContact OD2-OG1 3.45Å; D311-D442 PolarHBondContact OD2-N 2.72Å
312	F	98	Very high	96.1	Very high	0 Å²	0	35 Å²	35	0%	0	20%	0.198	C	C	.	.			trans	-121.8	32.2	173.8	-69.2	-79.7	0	0	0	111.2	I310 H326 F361 A363 F375 V377 Y396 L400 I403 L405 Y406	I310-F312 HydrophobicContact CB-CD2 4.27Å; I310-F312 HydrophobicContact CB-CE2 3.73Å; I310-F312 HydrophobicContact CB-CZ 4.22Å; I310-F312 HydrophobicContact CG2-CD2 4.22Å; I310-F312 HydrophobicContact CG2-CE1 4.36Å; I310-F312 HydrophobicContact CG2-CE2 3.79Å; I310-F312 HydrophobicContact CG2-CZ 3.9Å; I310-F312 WeakPolarHBondContact O-CD2 3.04Å; I310-F312 PolarHBondContact O-N 3.17Å; F312-H326 AromaticContact CD1-CE1 3.86Å; F312-H326 AromaticContact CD1-NE2 3.85Å; F312-F361 PolarHBondContact N-O 2.8Å; F312-A363 HydrophobicContact CB-CB 3.76Å; F312-F375 HydrophobicContact CD2-CE1 4.18Å; F312-F375 AromaticContact CD2-CZ 3.67Å; F312-F375 HydrophobicContact CD2-CZ 3.67Å; F312-F375 AromaticContact CE2-CZ 3.92Å; F312-F375 HydrophobicContact CE2-CZ 3.92Å; F312-F375 HydrophobicContact CG-CZ 4.41Å; F312-V377 HydrophobicContact CE2-CG2 4.19Å; F312-Y396 AromaticContact CE1-CD2 3.96Å; F312-Y396 HydrophobicContact CE1-CD2 3.96Å; F312-Y396 AromaticContact CE1-CE2 3.86Å; F312-Y396 HydrophobicContact CE1-CE2 3.86Å; F312-Y396 AromaticContact CZ-CD2 3.69Å; F312-Y396 HydrophobicContact CZ-CD2 3.69Å; F312-Y396 HydrophobicContact CZ-CE2 4.02Å; F312-L400 HydrophobicContact CD1-CD1 3.84Å; F312-L400 HydrophobicContact CE1-CD1 3.7Å; F312-I403 HydrophobicContact CB-CD1 3.72Å; F312-I403 HydrophobicContact CD1-CD1 3.38Å; F312-I403 HydrophobicContact CD2-CD1 4.12Å; F312-I403 HydrophobicContact CE1-CD1 3.85Å; F312-I403 HydrophobicContact CG-CD1 3.49Å; F312-I403 VanDerWaalsContact CG-CD1 3.49Å; F312-I403 HydrophobicContact CZ-CD1 4.39Å; F312-L405 HydrophobicContact CB-CD2 3.79Å; F312-L405 HydrophobicContact CD1-CD2 4.02Å; F312-L405 HydrophobicContact CG-CD2 4.42Å; F312-L405 WeakPolarHBondContact O-CA 2.84Å; F312-L405 WeakPolarHBondContact O-CB 3.38Å; F312-L405 WeakPolarHBondContact O-CD2 3.29Å; F312-Y406 PolarHBondContact O-N 3.18Å
313	T	97.2	Very high	96.1	Very high	2 Å²	2	39.9 Å²	39.9	1%	0.012	23%	0.231	C	C	.	.	B	Isolated β-bridge	trans	-73.2	158.7	174.3	60	0	0	0	0	112	D311 S315 N316 Y406 T409 D442	D311-T313 WeakPolarHBondContact OD1-CB 3.45Å; D311-T313 WeakPolarHBondContact OD1-CG2 3.49Å; D311-T313 PolarHBondContact OD1-N 2.87Å; D311-T313 PolarHBondContact OD1-OG1 2.68Å; T313-S315 PolarHBondContact O-N 3.03Å; T313-S315 PolarHBondContact OG1-OG 2.72Å; T313-N316 WeakPolarHBondContact O-CB 3.31Å; T313-N316 PolarHBondContact O-N 2.94Å; T313-N316 PolarHBondContact O-ND2 3.39Å; T313-N316 PolarHBondContact OG1-ND2 3Å; T313-Y406 CarbonylContact C-O 3.58Å; T313-Y406 VanDerWaalsContact CA-O 3.3Å; T313-Y406 WeakPolarHBondContact CA-O 3.26Å; T313-T409 HydrophobicContact CG2-CG2 4.38Å; T313-D442 PolarHBondContact OG1-OD1 2.81Å
314	A	96.1	Very high	96.2	Very high	56 Å²	56	37.9 Å²	37.9	46%	0.463	22%	0.223	S	C	.	.	G	3₁₀ helix	trans	-70	-15.9	-175.4	0	0	0	0	0	113.7	N316 G317 L405 Y406	A314-N316 PolarHBondContact O-N 3.06Å; A314-G317 PolarHBondContact O-N 3.43Å; A314-L405 HydrophobicContact CB-CB 4.4Å; A314-Y406 WeakPolarHBondContact CB-O 3.4Å; A314-Y406 PolarHBondContact N-O 2.71Å
315	S	95.1	Very high	96.3	Very high	75 Å²	75	39.9 Å²	39.9	52%	0.524	23%	0.234	S	C	.	.	G	3₁₀ helix	trans	-56.8	-30.7	172.4	37.1	0	0	0	0	112.2	T313 G317 D442	T313-S315 PolarHBondContact O-N 3.03Å; T313-S315 PolarHBondContact OG1-OG 2.72Å; S315-G317 PolarHBondContact O-N 3.49Å; S315-G317 VanDerWaalsContact O-N 3.13Å; S315-D442 WeakPolarHBondContact CB-OD2 3.38Å; S315-D442 PolarHBondContact OG-OD1 2.78Å; S315-D442 PolarHBondContact OG-OD2 2.88Å; S315-D442 VanDerWaalsContact OG-OD2 3.14Å
316	N	96.5	Very high	96.4	Very high	3 Å²	3	38.6 Å²	38.6	2%	0.016	23%	0.228	C	C	.	.	G	3₁₀ helix	trans	-64.9	-16.1	176.8	-74.2	-78.6	0	0	0	114.3	T313 A314 S324 L325 H326 Y336 L405 D442	T313-N316 WeakPolarHBondContact O-CB 3.31Å; T313-N316 PolarHBondContact O-N 2.94Å; T313-N316 PolarHBondContact O-ND2 3.39Å; T313-N316 PolarHBondContact OG1-ND2 3Å; A314-N316 PolarHBondContact O-N 3.06Å; N316-S324 VanDerWaalsContact O-CA 3.26Å; N316-S324 WeakPolarHBondContact O-CA 3.35Å; N316-S324 WeakPolarHBondContact O-CB 3.19Å; N316-S324 PolarHBondContact O-OG 2.88Å; N316-L325 HydrophobicContact CB-CB 4.41Å; N316-L325 PolarHBondContact O-N 3.26Å; N316-L325 WeakPolarHBondContact OD1-CB 3.46Å; N316-L325 WeakPolarHBondContact OD1-CD1 3.22Å; N316-H326 WeakPolarHBondContact CB-CD2 3.44Å; N316-Y336 PolarHBondContact ND2-OH 3.26Å; N316-Y336 WeakPolarHBondContact OD1-CE2 3.49Å; N316-Y336 PolarHBondContact OD1-OH 2.87Å; N316-L405 HydrophobicContact CB-CD1 4.38Å; N316-D442 WeakPolarHBondContact CA-OD2 3.45Å; N316-D442 VanDerWaalsContact CG-CG 3.43Å; N316-D442 PolarHBondContact N-OD2 2.96Å; N316-D442 PolarHBondContact ND2-OD1 3.01Å; N316-D442 VanDerWaalsContact OD1-CB 3.32Å; N316-D442 WeakPolarHBondContact OD1-CB 3.4Å
317	G	95.5	Very high	96.5	Very high	29 Å²	29	41.8 Å²	41.8	30%	0.299	24%	0.24	S	C	.	.			trans	75.3	162.5	-176.6	0	0	0	0	0	113.8	A314 S315 P319 S324 L405	A314-G317 PolarHBondContact O-N 3.43Å; S315-G317 PolarHBondContact O-N 3.49Å; S315-G317 VanDerWaalsContact O-N 3.13Å; G317-P319 WeakPolarHBondContact O-CD 3.39Å; G317-S324 PolarHBondContact O-OG 2.62Å; G317-L405 VanDerWaalsContact O-CD1 3.26Å; G317-L405 WeakPolarHBondContact O-CD1 3.25Å
318	D	94.8	Very high	96.3	Very high	69 Å²	69	44.4 Å²	44.4	37%	0.369	25%	0.253	S	S	.	.			trans	-57.1	119.5	-177.6	-174	-28.9	0	0	0	111.8	R320 N321 S324	D318-R320 PolarHBondContact O-N 2.83Å; D318-R320 WeakPolarHBondContact OD1-CB 3.13Å; D318-R320 WeakPolarHBondContact OD1-CG 3.34Å; D318-R320 IonicContact OD1-CZ 2.94Å; D318-R320 PolarHBondContact OD1-N 2.84Å; D318-R320 IonicContact OD1-NE 3.5Å; D318-R320 PolarHBondContact OD1-NE 3.19Å; D318-R320 IonicContact OD1-NH2 3.52Å; D318-R320 IonicContact OD2-CZ 3.19Å; D318-R320 IonicContact OD2-NE 3.76Å; D318-R320 PolarHBondContact OD2-NE 3.15Å; D318-R320 IonicContact OD2-NH2 3.78Å; D318-R320 PolarHBondContact OD2-NH2 2.84Å; D318-N321 WeakPolarHBondContact O-CB 3.46Å; D318-N321 PolarHBondContact O-N 2.97Å; D318-S324 WeakPolarHBondContact O-CB 3.48Å
319	P	95.5	Very high	96.1	Very high	30 Å²	30	48.1 Å²	48.1	20%	0.195	27%	0.27	C	S	.	.	T	Hydrogen-bonded Turn	trans	-58.4	-15.9	-177.2	-27.9	36.8	0	0	0	115.6	G317 N321 H326 Y327 L400 L405	G317-P319 WeakPolarHBondContact O-CD 3.39Å; P319-N321 VanDerWaalsContact C-N 3.31Å; P319-H326 HydrophobicContact CB-CB 4.17Å; P319-H326 HydrophobicContact CG-CB 4.08Å; P319-Y327 WeakPolarHBondContact O-CD2 3.25Å; P319-L400 HydrophobicContact CB-CD1 4.15Å; P319-L400 HydrophobicContact CB-CD2 3.83Å; P319-L400 HydrophobicContact CB-CG 3.84Å; P319-L400 HydrophobicContact CG-CD1 3.68Å; P319-L400 HydrophobicContact CG-CD2 4.31Å; P319-L400 HydrophobicContact CG-CG 3.87Å; P319-L405 HydrophobicContact CG-CD1 3.87Å; P319-L405 HydrophobicContact CG-CG 4.32Å
320	R	93.2	Very high	95.7	Very high	209 Å²	209	52.8 Å²	52.8	79%	0.789	30%	0.301	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.8	-16.5	175.9	-59.9	171.4	-67.3	-174	1.2	112.6	D318	D318-R320 PolarHBondContact O-N 2.83Å; D318-R320 WeakPolarHBondContact OD1-CB 3.13Å; D318-R320 WeakPolarHBondContact OD1-CG 3.34Å; D318-R320 IonicContact OD1-CZ 2.94Å; D318-R320 PolarHBondContact OD1-N 2.84Å; D318-R320 IonicContact OD1-NE 3.5Å; D318-R320 PolarHBondContact OD1-NE 3.19Å; D318-R320 IonicContact OD1-NH2 3.52Å; D318-R320 IonicContact OD2-CZ 3.19Å; D318-R320 IonicContact OD2-NE 3.76Å; D318-R320 PolarHBondContact OD2-NE 3.15Å; D318-R320 IonicContact OD2-NH2 3.78Å; D318-R320 PolarHBondContact OD2-NH2 2.84Å
321	N	95.4	Very high	95.4	Very high	84 Å²	84	62.9 Å²	62.9	45%	0.449	34%	0.34	S	S	.	.	S	Bend	trans	-89.7	133.5	178.7	-172.9	-18.6	0	0	0	110.2	D318 P319 C323 S324 Y327	D318-N321 WeakPolarHBondContact O-CB 3.46Å; D318-N321 PolarHBondContact O-N 2.97Å; P319-N321 VanDerWaalsContact C-N 3.31Å; N321-C323 PolarHBondContact O-N 3.22Å; N321-C323 VanDerWaalsContact O-N 3.08Å; N321-C323 PolarHBondContact OD1-N 3.13Å; N321-S324 WeakPolarHBondContact O-CB 3.34Å; N321-S324 PolarHBondContact O-N 3.18Å; N321-Y327 WeakPolarHBondContact O-CB 3.2Å; N321-Y327 WeakPolarHBondContact O-CD2 3.2Å
322	S	94.6	Very high	95	Very high	84 Å²	84	68.5 Å²	68.5	59%	0.587	37%	0.367	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.1	-13.7	178.1	59.6	0	0	0	0	114.7
323	C	94.1	Very high	94.8	Very high	108 Å²	108	71.5 Å²	71.5	73%	0.73	39%	0.386	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.1	-7.4	173.8	-62.3	0	0	0	0	114	N321	N321-C323 PolarHBondContact O-N 3.22Å; N321-C323 VanDerWaalsContact O-N 3.08Å; N321-C323 PolarHBondContact OD1-N 3.13Å
324	S	96.9	Very high	94.8	Very high	10 Å²	10	72.2 Å²	72.2	7%	0.07	39%	0.39	C	S	.	.	S	Bend	trans	-71.2	143.6	177.8	170.9	0	0	0	0	111.3	N316 G317 D318 N321 H326 Y327	N316-S324 VanDerWaalsContact O-CA 3.26Å; N316-S324 WeakPolarHBondContact O-CA 3.35Å; N316-S324 WeakPolarHBondContact O-CB 3.19Å; N316-S324 PolarHBondContact O-OG 2.88Å; G317-S324 PolarHBondContact O-OG 2.62Å; D318-S324 WeakPolarHBondContact O-CB 3.48Å; N321-S324 WeakPolarHBondContact O-CB 3.34Å; N321-S324 PolarHBondContact O-N 3.18Å; S324-H326 PolarHBondContact O-N 3.32Å; S324-H326 PolarHBondContact OG-N 2.93Å; S324-Y327 VanDerWaalsContact O-CB 3.27Å; S324-Y327 WeakPolarHBondContact O-CB 3.38Å; S324-Y327 PolarHBondContact O-N 3.13Å; S324-Y327 VanDerWaalsContact O-N 3.14Å
325	L	96.9	Very high	94.8	Very high	42 Å²	42	71 Å²	71	22%	0.22	37%	0.374	C	S	.	.	T	Hydrogen-bonded Turn	trans	-67.8	-21.9	172.7	-63.7	175.9	0	0	0	112.1	N316 N334 Y336 D442 V470	N316-L325 HydrophobicContact CB-CB 4.41Å; N316-L325 PolarHBondContact O-N 3.26Å; N316-L325 WeakPolarHBondContact OD1-CB 3.46Å; N316-L325 WeakPolarHBondContact OD1-CD1 3.22Å; L325-N334 WeakPolarHBondContact O-CB 3.14Å; L325-N334 PolarHBondContact O-ND2 3.18Å; L325-Y336 HydrophobicContact CB-CE2 4.03Å; L325-D442 HydrophobicContact CD1-CB 3.4Å; L325-D442 VanDerWaalsContact CD1-CB 3.4Å; L325-V470 HydrophobicContact CD1-CG2 4.4Å
326	H	97.8	Very high	94.9	Very high	0 Å²	0	67.4 Å²	67.4	0%	0	35%	0.349	C	S	.	.	T	Hydrogen-bonded Turn	trans	-89.2	-0.5	173.5	-76.2	-56.6	0	0	0	114.1	D311 F312 N316 P319 S324 I328 N334 Y336 Y396 L400	D311-H326 PolarHBondContact O-CE1 3.18Å; D311-H326 PolarHBondContact O-NE2 2.66Å; F312-H326 AromaticContact CD1-CE1 3.86Å; F312-H326 AromaticContact CD1-NE2 3.85Å; N316-H326 WeakPolarHBondContact CB-CD2 3.44Å; P319-H326 HydrophobicContact CB-CB 4.17Å; P319-H326 HydrophobicContact CG-CB 4.08Å; S324-H326 PolarHBondContact O-N 3.32Å; S324-H326 PolarHBondContact OG-N 2.93Å; H326-I328 PolarHBondContact O-N 3.02Å; H326-I328 VanDerWaalsContact O-N 3.14Å; H326-N334 PolarHBondContact O-ND2 2.9Å; H326-Y336 AromaticContact CE1-CD2 3.95Å; H326-Y336 AromaticContact CE1-CE2 3.62Å; H326-Y336 AromaticContact CE1-CZ 3.7Å; H326-Y336 AromaticContact ND1-CD2 3.88Å; H326-Y336 AromaticContact ND1-CE2 3.89Å; H326-Y396 AromaticContact CE1-CE2 3.96Å; H326-Y396 AromaticContact ND1-CE2 3.65Å; H326-Y396 AromaticContact ND1-CZ 3.65Å; H326-Y396 PolarHBondContact ND1-OH 3.06Å; H326-L400 HydrophobicContact CB-CD1 3.76Å; H326-L400 HydrophobicContact CB-CD2 3.98Å; H326-L400 HydrophobicContact CB-CG 4.47Å; H326-L400 WeakPolarHBondContact O-CD2 3.28Å
327	Y	97.4	Very high	94.9	Very high	68 Å²	68	67.8 Å²	67.8	27%	0.267	35%	0.352	S	S	.	.			trans	-58.7	122	-176.8	-177.2	-110.8	0	0	0	111.8	P319 N321 S324 H329 N334	P319-Y327 WeakPolarHBondContact O-CD2 3.25Å; N321-Y327 WeakPolarHBondContact O-CB 3.2Å; N321-Y327 WeakPolarHBondContact O-CD2 3.2Å; S324-Y327 VanDerWaalsContact O-CB 3.27Å; S324-Y327 WeakPolarHBondContact O-CB 3.38Å; S324-Y327 PolarHBondContact O-N 3.13Å; S324-Y327 VanDerWaalsContact O-N 3.14Å; Y327-H329 HydrophobicContact CD1-CB 3.89Å; Y327-H329 HydrophobicContact CE1-CB 3.69Å; Y327-H329 AromaticContact CE1-CD2 3.9Å; Y327-H329 PolarHBondContact O-N 3.14Å; Y327-N334 PolarHBondContact O-ND2 2.77Å
328	I	95.1	Very high	94.9	Very high	63 Å²	63	69.6 Å²	69.6	32%	0.323	35%	0.351	S	S	.	.			trans	-88.4	90	178.2	-52.7	-59.3	0	0	0	108.6	H326 L337 Y396 Q397 L400	H326-I328 PolarHBondContact O-N 3.02Å; H326-I328 VanDerWaalsContact O-N 3.14Å; I328-L337 HydrophobicContact CD1-CD1 4.19Å; I328-Y396 HydrophobicContact CD1-CE1 3.8Å; I328-Q397 HydrophobicContact CD1-CG 4.26Å; I328-L400 HydrophobicContact CD1-CD2 4.08Å; I328-L400 HydrophobicContact CG1-CD2 3.87Å
329	H	93.4	Very high	95	Very high	78 Å²	78	66.3 Å²	66.3	36%	0.361	33%	0.334	S	S	.	.			trans	-77.1	139	178.5	-178.4	-91	0	0	0	111.2	Y327 Y331 Q332	Y327-H329 HydrophobicContact CD1-CB 3.89Å; Y327-H329 HydrophobicContact CE1-CB 3.69Å; Y327-H329 AromaticContact CE1-CD2 3.9Å; Y327-H329 PolarHBondContact O-N 3.14Å; H329-Y331 AromaticContact CE1-CD2 3.75Å; H329-Y331 PolarHBondContact ND1-N 3.3Å; H329-Y331 VanDerWaalsContact ND1-N 3.12Å; H329-Y331 PolarHBondContact O-N 3.48Å; H329-Y331 VanDerWaalsContact O-N 3.11Å; H329-Q332 WeakPolarHBondContact CB-O 3.37Å; H329-Q332 PolarHBondContact ND1-N 2.86Å; H329-Q332 VanDerWaalsContact ND1-N 3.12Å
330	P	90.4	Very high	95	Very high	99 Å²	99	64.9 Å²	64.9	64%	0.643	32%	0.324	S	S	*	.	S	Bend	trans	-61.9	-22.3	-175.3	-25.5	34.2	0	0	0	116
331	Y	90.7	Very high	95.1	Very high	211 Å²	211	57.4 Å²	57.4	83%	0.827	30%	0.302	S	S	*	.	S	Bend	trans	-124.4	-7.8	-173.9	-53.6	-73.9	0	0	0	114.6	H329	H329-Y331 AromaticContact CE1-CD2 3.75Å; H329-Y331 PolarHBondContact ND1-N 3.3Å; H329-Y331 VanDerWaalsContact ND1-N 3.12Å; H329-Y331 PolarHBondContact O-N 3.48Å; H329-Y331 VanDerWaalsContact O-N 3.11Å
332	Q	91.1	Very high	95	Very high	119 Å²	119	53.8 Å²	53.8	56%	0.556	28%	0.283	S	S	*	.	S	Bend	trans	-141.4	124	-173.1	-168.1	175.6	23.1	0	0	109.5	H329	H329-Q332 WeakPolarHBondContact CB-O 3.37Å; H329-Q332 PolarHBondContact ND1-N 2.86Å; H329-Q332 VanDerWaalsContact ND1-N 3.12Å
333	P	93.8	Very high	95	Very high	63 Å²	63	49.8 Å²	49.8	41%	0.409	26%	0.255	S	S	.	.			trans	-67.5	145.4	174.9	26.4	-32	0	0	0	110.6	L337 K338	P333-L337 HydrophobicContact CB-CB 3.71Å; P333-L337 HydrophobicContact CB-CD1 4.22Å; P333-K338 HydrophobicContact CB-CG 4.04Å; P333-K338 HydrophobicContact CG-CD 4.48Å; P333-K338 HydrophobicContact CG-CG 3.74Å; P333-K338 WeakPolarHBondContact O-CE 3.26Å
334	N	95.8	Very high	95	Very high	17 Å²	17	44.6 Å²	44.6	9%	0.091	22%	0.22	C	C	.	.			trans	-72.2	176.2	168.6	66.2	28	0	0	0	111	L325 H326 Y327 Y336 L337 K338 Y396	L325-N334 WeakPolarHBondContact O-CB 3.14Å; L325-N334 PolarHBondContact O-ND2 3.18Å; H326-N334 PolarHBondContact O-ND2 2.9Å; Y327-N334 PolarHBondContact O-ND2 2.77Å; N334-Y336 VanDerWaalsContact C-N 3.35Å; N334-Y336 PolarHBondContact O-N 2.83Å; N334-Y336 WeakPolarHBondContact OD1-CB 3.47Å; N334-Y336 PolarHBondContact OD1-N 2.89Å; N334-L337 PolarHBondContact O-N 2.74Å; N334-L337 WeakPolarHBondContact OD1-CB 3.3Å; N334-L337 WeakPolarHBondContact OD1-CG 3.27Å; N334-L337 PolarHBondContact OD1-N 2.79Å; N334-K338 WeakPolarHBondContact O-CG 3.4Å; N334-K338 PolarHBondContact O-N 2.65Å; N334-Y396 PolarHBondContact ND2-OH 3.29Å; N334-Y396 VanDerWaalsContact ND2-OH 3.15Å
335	E	96.3	Very high	94.8	Very high	29 Å²	29	47.5 Å²	47.5	14%	0.136	23%	0.233	C	C	.	.	H	α-helix	trans	-65.1	-37.3	-175.8	-60.4	-171.8	-174.5	0	0	112.3	K338 A339 V470 G471 F506 K510	E335-K338 PolarHBondContact O-N 2.95Å; E335-A339 WeakPolarHBondContact O-CB 3.29Å; E335-A339 PolarHBondContact O-N 2.97Å; E335-V470 HydrophobicContact CB-CB 4.08Å; E335-V470 HydrophobicContact CB-CG1 3.92Å; E335-G471 PolarHBondContact OE2-N 3.19Å; E335-F506 HydrophobicContact CB-CD1 3.83Å; E335-F506 HydrophobicContact CB-CE1 3.88Å; E335-F506 HydrophobicContact CB-CG 4.21Å; E335-F506 HydrophobicContact CB-CZ 4.25Å; E335-F506 HydrophobicContact CG-CD1 3.68Å; E335-F506 HydrophobicContact CG-CE1 3.58Å; E335-F506 HydrophobicContact CG-CZ 4.32Å; E335-F506 WeakPolarHBondContact OE2-CD1 3.42Å; E335-K510 WeakPolarHBondContact OE1-CE 3.5Å; E335-K510 IonicContact OE1-NZ 3.85Å; E335-K510 PolarHBondContact OE1-NZ 2.83Å
336	Y	97.7	Very high	94.6	Very high	0 Å²	0	45.9 Å²	45.9	0%	0	22%	0.224	C	C	.	.	H	α-helix	trans	-56.8	-54.3	172.8	-73.8	-88.4	0	0	0	111.9	I310 D311 N316 L325 H326 N334 K338 A339 L340 L440 V470	I310-Y336 HydrophobicContact CG2-CD1 3.78Å; I310-Y336 HydrophobicContact CG2-CE1 3.89Å; D311-Y336 HydrophobicContact CB-CE1 4.37Å; N316-Y336 PolarHBondContact ND2-OH 3.26Å; N316-Y336 WeakPolarHBondContact OD1-CE2 3.49Å; N316-Y336 PolarHBondContact OD1-OH 2.87Å; L325-Y336 HydrophobicContact CB-CE2 4.03Å; H326-Y336 AromaticContact CE1-CD2 3.95Å; H326-Y336 AromaticContact CE1-CE2 3.62Å; H326-Y336 AromaticContact CE1-CZ 3.7Å; H326-Y336 AromaticContact ND1-CD2 3.88Å; H326-Y336 AromaticContact ND1-CE2 3.89Å; N334-Y336 VanDerWaalsContact C-N 3.35Å; N334-Y336 PolarHBondContact O-N 2.83Å; N334-Y336 WeakPolarHBondContact OD1-CB 3.47Å; N334-Y336 PolarHBondContact OD1-N 2.89Å; Y336-K338 VanDerWaalsContact C-N 3.3Å; Y336-K338 PolarHBondContact O-N 3.04Å; Y336-A339 PolarHBondContact O-N 3.2Å; Y336-L340 WeakPolarHBondContact O-CB 3.5Å; Y336-L340 VanDerWaalsContact O-CG 3.3Å; Y336-L340 WeakPolarHBondContact O-CG 3.49Å; Y336-L340 PolarHBondContact O-N 2.88Å; Y336-L440 HydrophobicContact CD1-CB 3.57Å; Y336-L440 HydrophobicContact CD1-CD1 3.88Å; Y336-L440 HydrophobicContact CD1-CG 4.39Å; Y336-L440 HydrophobicContact CE1-CB 3.65Å; Y336-V470 HydrophobicContact CD2-CG2 4.17Å; Y336-V470 HydrophobicContact CE1-CG2 4.06Å; Y336-V470 HydrophobicContact CE2-CB 4.47Å; Y336-V470 HydrophobicContact CE2-CG2 3.5Å; Y336-V470 VanDerWaalsContact CE2-CG2 3.5Å; Y336-V470 VanDerWaalsContact CZ-CG2 3.41Å; Y336-V470 WeakPolarHBondContact OH-CG2 3.38Å
337	L	96.7	Very high	94.4	Very high	12 Å²	12	45.9 Å²	45.9	6%	0.063	22%	0.224	C	C	.	.	H	α-helix	trans	-60.6	-39.4	-180	-75	173.9	0	0	0	112.2	I328 P333 N334 V341 V393 Y396	I328-L337 HydrophobicContact CD1-CD1 4.19Å; P333-L337 HydrophobicContact CB-CB 3.71Å; P333-L337 HydrophobicContact CB-CD1 4.22Å; N334-L337 PolarHBondContact O-N 2.74Å; N334-L337 WeakPolarHBondContact OD1-CB 3.3Å; N334-L337 WeakPolarHBondContact OD1-CG 3.27Å; N334-L337 PolarHBondContact OD1-N 2.79Å; L337-V341 WeakPolarHBondContact O-CB 3.28Å; L337-V341 WeakPolarHBondContact O-CG2 3.4Å; L337-V341 PolarHBondContact O-N 2.85Å; L337-V393 HydrophobicContact CD2-CB 4.33Å; L337-V393 HydrophobicContact CD2-CG1 3.74Å; L337-V393 HydrophobicContact CD2-CG2 4.05Å; L337-Y396 HydrophobicContact CD1-CE1 4.41Å; L337-Y396 HydrophobicContact CD2-CD1 3.7Å; L337-Y396 HydrophobicContact CD2-CE1 3.87Å; L337-Y396 HydrophobicContact CG-CD1 4.22Å; L337-Y396 HydrophobicContact CG-CE1 3.85Å
338	K	95.9	Very high	94.2	Very high	67 Å²	67	44.7 Å²	44.7	29%	0.291	22%	0.221	S	C	.	.	H	α-helix	trans	-63.3	-44.9	176.3	-72.8	174.8	-176.1	167.9	0	111.6	P333 N334 E335 Y336 A342 F506	P333-K338 HydrophobicContact CB-CG 4.04Å; P333-K338 HydrophobicContact CG-CD 4.48Å; P333-K338 HydrophobicContact CG-CG 3.74Å; P333-K338 WeakPolarHBondContact O-CE 3.26Å; N334-K338 WeakPolarHBondContact O-CG 3.4Å; N334-K338 PolarHBondContact O-N 2.65Å; E335-K338 PolarHBondContact O-N 2.95Å; Y336-K338 VanDerWaalsContact C-N 3.3Å; Y336-K338 PolarHBondContact O-N 3.04Å; K338-A342 WeakPolarHBondContact O-CB 3.48Å; K338-A342 PolarHBondContact O-N 3.36Å; K338-F506 HydrophobicContact CB-CE2 3.79Å; K338-F506 HydrophobicContact CB-CZ 3.7Å; K338-F506 HydrophobicContact CD-CE1 4.41Å; K338-F506 HydrophobicContact CD-CZ 3.69Å; K338-F506 HydrophobicContact CG-CZ 4.37Å
339	A	96.1	Very high	94.1	Very high	0 Å²	0	42.3 Å²	42.3	0%	0	21%	0.209	C	C	.	.	H	α-helix	trans	-65.9	-46.1	178.2	0	0	0	0	0	111.8	E335 Y336 V341 A342 V343 L440 V468 F506 L517	E335-A339 WeakPolarHBondContact O-CB 3.29Å; E335-A339 PolarHBondContact O-N 2.97Å; Y336-A339 PolarHBondContact O-N 3.2Å; A339-V341 PolarHBondContact O-N 3.47Å; A339-A342 PolarHBondContact O-N 3.28Å; A339-V343 WeakPolarHBondContact O-CG2 3.31Å; A339-V343 PolarHBondContact O-N 3.35Å; A339-V343 VanDerWaalsContact O-N 3.09Å; A339-L440 HydrophobicContact CB-CD1 4.29Å; A339-L440 HydrophobicContact CB-CD2 3.78Å; A339-V468 HydrophobicContact CB-CG1 4.18Å; A339-F506 HydrophobicContact CB-CD2 4.25Å; A339-F506 HydrophobicContact CB-CE2 4.36Å; A339-L517 HydrophobicContact CB-CD2 4.38Å
340	L	96.1	Very high	94.1	Very high	0 Å²	0	39 Å²	39	0%	0	19%	0.194	C	C	.	.	H	α-helix	trans	-53.6	-54.3	176.2	-73.2	175.7	0	0	0	111.5	V308 I310 Y336 G344 I389 V392 L440	V308-L340 HydrophobicContact CB-CD2 4.37Å; V308-L340 HydrophobicContact CG1-CD2 3.29Å; V308-L340 HydrophobicContact CG2-CD2 4.15Å; I310-L340 HydrophobicContact CD1-CD1 4.04Å; I310-L340 HydrophobicContact CD1-CD2 4.47Å; Y336-L340 WeakPolarHBondContact O-CB 3.5Å; Y336-L340 VanDerWaalsContact O-CG 3.3Å; Y336-L340 WeakPolarHBondContact O-CG 3.49Å; Y336-L340 PolarHBondContact O-N 2.88Å; L340-G344 WeakPolarHBondContact O-CA 3.24Å; L340-G344 PolarHBondContact O-N 3.45Å; L340-I389 HydrophobicContact CB-CD1 4.31Å; L340-I389 WeakPolarHBondContact O-CD1 3.49Å; L340-V392 HydrophobicContact CD2-CG1 4.35Å; L340-L440 HydrophobicContact CD1-CD1 4.45Å; L340-L440 HydrophobicContact CD2-CD1 3.56Å; L340-L440 HydrophobicContact CG-CD1 3.59Å
341	V	95.1	Very high	94.1	Very high	52 Å²	52	34.6 Å²	34.6	32%	0.315	16%	0.164	S	C	.	.	H	α-helix	trans	-65.5	-44.8	-177.8	174.1	0	0	0	0	110.9	L337 A339 V343 E345 V393	L337-V341 WeakPolarHBondContact O-CB 3.28Å; L337-V341 WeakPolarHBondContact O-CG2 3.4Å; L337-V341 PolarHBondContact O-N 2.85Å; A339-V341 PolarHBondContact O-N 3.47Å; V341-V343 VanDerWaalsContact C-N 3.34Å; V341-V343 PolarHBondContact O-N 3.09Å; V341-E345 HydrophobicContact CG1-CG 4.01Å; V341-E345 VanDerWaalsContact O-CB 3.25Å; V341-E345 WeakPolarHBondContact O-CB 3.41Å; V341-E345 VanDerWaalsContact O-CG 3.28Å; V341-E345 WeakPolarHBondContact O-CG 3.3Å; V341-E345 PolarHBondContact O-N 3.03Å; V341-V393 HydrophobicContact CG2-CG2 4Å
342	A	93.5	Very high	93.9	Very high	7 Å²	7	27.3 Å²	27.3	6%	0.058	14%	0.144	C	C	.	.	H	α-helix	trans	-59.5	-42.5	-177.3	0	0	0	0	0	112.9	K338 A339 P514 L517 A518	K338-A342 WeakPolarHBondContact O-CB 3.48Å; K338-A342 PolarHBondContact O-N 3.36Å; A339-A342 PolarHBondContact O-N 3.28Å; A342-P514 HydrophobicContact CB-CB 4.15Å; A342-L517 HydrophobicContact CB-CD2 4.13Å; A342-A518 HydrophobicContact CB-CB 4.45Å; A342-A518 WeakPolarHBondContact O-CB 3.4Å
343	V	93.6	Very high	93.8	Very high	0 Å²	0	25.4 Å²	25.4	0%	0	14%	0.138	C	C	.	.	H	α-helix	trans	-83.9	-47.9	-178.3	-177.7	0	0	0	0	111	F306 A339 V341 E345 I346 C347 L438 V521 L522	F306-V343 HydrophobicContact CE2-CG1 3.82Å; F306-V343 HydrophobicContact CZ-CB 4.4Å; F306-V343 HydrophobicContact CZ-CG1 3.78Å; A339-V343 WeakPolarHBondContact O-CG2 3.31Å; A339-V343 PolarHBondContact O-N 3.35Å; A339-V343 VanDerWaalsContact O-N 3.09Å; V341-V343 VanDerWaalsContact C-N 3.34Å; V341-V343 PolarHBondContact O-N 3.09Å; V343-E345 VanDerWaalsContact C-N 3.28Å; V343-E345 PolarHBondContact O-N 3.09Å; V343-I346 PolarHBondContact O-N 3.19Å; V343-I346 VanDerWaalsContact O-N 3.11Å; V343-C347 PolarHBondContact O-N 3.39Å; V343-C347 VanDerWaalsContact O-N 3.15Å; V343-L438 HydrophobicContact CB-CD2 4.06Å; V343-L438 HydrophobicContact CG1-CD2 4.16Å; V343-L438 HydrophobicContact CG2-CD2 4.3Å; V343-V521 HydrophobicContact CG1-CG1 4.43Å; V343-V521 HydrophobicContact CG2-CB 4.2Å; V343-V521 HydrophobicContact CG2-CG1 3.61Å; V343-L522 HydrophobicContact CG1-CD1 4.44Å; V343-L522 HydrophobicContact CG1-CD2 4.04Å; V343-L522 HydrophobicContact CG1-CG 4.36Å
344	G	94.1	Very high	93.8	Very high	0 Å²	0	25.5 Å²	25.5	0%	0	13%	0.132	C	C	.	.	H	α-helix	trans	-66	-28.4	-175.8	0	0	0	0	0	113.6	L340 I346 Q348	L340-G344 WeakPolarHBondContact O-CA 3.24Å; L340-G344 PolarHBondContact O-N 3.45Å; G344-I346 PolarHBondContact O-N 3Å; G344-Q348 WeakPolarHBondContact O-CB 3.41Å; G344-Q348 WeakPolarHBondContact O-CG 3.35Å; G344-Q348 PolarHBondContact O-N 3.3Å
345	E	92.9	Very high	93.8	Very high	71 Å²	71	27 Å²	27	33%	0.332	14%	0.139	S	C	.	.	H	α-helix	trans	-63.2	-26.3	175	-82.8	-168.3	161.7	0	0	113.5	V85 V341 V343 Q348 I389	V85-E345 HydrophobicContact CG2-CB 4.13Å; V341-E345 HydrophobicContact CG1-CG 4.01Å; V341-E345 VanDerWaalsContact O-CB 3.25Å; V341-E345 WeakPolarHBondContact O-CB 3.41Å; V341-E345 VanDerWaalsContact O-CG 3.28Å; V341-E345 WeakPolarHBondContact O-CG 3.3Å; V341-E345 PolarHBondContact O-N 3.03Å; V343-E345 VanDerWaalsContact C-N 3.28Å; V343-E345 PolarHBondContact O-N 3.09Å; E345-Q348 WeakPolarHBondContact O-CG 3.4Å; E345-Q348 PolarHBondContact O-NE2 3.4Å; E345-I389 HydrophobicContact CG-CG2 4.27Å
346	I	93.3	Very high	93.9	Very high	7 Å²	7	25.6 Å²	25.6	4%	0.036	13%	0.132	C	C	.	.	H	α-helix	trans	-88.6	-52.9	178.6	-65.9	159	0	0	0	110.3	F82 E83 V85 V343 G344 Q348 D349 Y350 A518 L522	F82-I346 WeakPolarHBondContact O-CG2 3.15Å; E83-I346 WeakPolarHBondContact O-CD1 3.5Å; V85-I346 HydrophobicContact CG2-CG1 3.47Å; V85-I346 VanDerWaalsContact CG2-CG1 3.47Å; V343-I346 PolarHBondContact O-N 3.19Å; V343-I346 VanDerWaalsContact O-N 3.11Å; G344-I346 PolarHBondContact O-N 3Å; I346-Q348 PolarHBondContact O-N 3.05Å; I346-Q348 VanDerWaalsContact O-N 3.16Å; I346-D349 PolarHBondContact O-N 3Å; I346-Y350 HydrophobicContact CG2-CE2 4.24Å; I346-Y350 WeakPolarHBondContact O-CD2 3.18Å; I346-Y350 WeakPolarHBondContact O-CE2 3.4Å; I346-A518 HydrophobicContact CD1-CB 3.39Å; I346-L522 HydrophobicContact CB-CD1 3.91Å; I346-L522 HydrophobicContact CD1-CD1 3.73Å; I346-L522 HydrophobicContact CG1-CD1 4.46Å; I346-L522 HydrophobicContact CG2-CD1 3.68Å
347	C	92.8	Very high	93.9	Very high	0 Å²	0	26.5 Å²	26.5	0%	0	14%	0.138	C	C	.	.	H	α-helix	trans	-58.4	-33.4	-175.7	-65.9	0	0	0	0	112.4	F306 V343 D349 Y350	F306-C347 HydrophobicContact CB-CB 4.02Å; F306-C347 HydrophobicContact CD1-CB 4.15Å; F306-C347 HydrophobicContact CD2-CB 3.89Å; F306-C347 HydrophobicContact CE2-CB 4.38Å; F306-C347 HydrophobicContact CG-CB 3.76Å; V343-C347 PolarHBondContact O-N 3.39Å; V343-C347 VanDerWaalsContact O-N 3.15Å; C347-D349 PolarHBondContact O-N 3.3Å; C347-Y350 PolarHBondContact O-N 2.93Å
348	Q	93.6	Very high	94	Very high	44 Å²	44	26 Å²	26	21%	0.206	14%	0.135	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.8	-16.8	-178.8	68.6	174.6	-33.8	0	0	115.8	G344 E345 I346 Y350 K354 F356	G344-Q348 WeakPolarHBondContact O-CB 3.41Å; G344-Q348 WeakPolarHBondContact O-CG 3.35Å; G344-Q348 PolarHBondContact O-N 3.3Å; E345-Q348 WeakPolarHBondContact O-CG 3.4Å; E345-Q348 PolarHBondContact O-NE2 3.4Å; I346-Q348 PolarHBondContact O-N 3.05Å; I346-Q348 VanDerWaalsContact O-N 3.16Å; Q348-Y350 VanDerWaalsContact C-N 3.29Å; Q348-K354 PolarHBondContact O-NZ 3Å; Q348-F356 HydrophobicContact CB-CE2 3.82Å; Q348-F356 HydrophobicContact CB-CZ 3.47Å; Q348-F356 VanDerWaalsContact CB-CZ 3.47Å
349	D	93.4	Very high	94.1	Very high	12 Å²	12	23.4 Å²	23.4	6%	0.064	12%	0.124	C	C	.	.	T	Hydrogen-bonded Turn	trans	-83	-11.4	178	-77.8	-23.9	0	0	0	112.9	T114 Q117 S120 I346 C347 K354	T114-D349 VanDerWaalsContact CB-OD2 3.25Å; T114-D349 WeakPolarHBondContact CB-OD2 3.19Å; T114-D349 WeakPolarHBondContact CG2-OD2 3.21Å; T114-D349 VanDerWaalsContact OG1-CG 3.26Å; T114-D349 PolarHBondContact OG1-OD2 3.36Å; Q117-D349 HydrophobicContact CG-CB 4.27Å; Q117-D349 VanDerWaalsContact CG-OD1 3.29Å; Q117-D349 WeakPolarHBondContact CG-OD1 3.1Å; Q117-D349 PolarHBondContact NE2-OD1 3.11Å; S120-D349 VanDerWaalsContact CB-O 3.32Å; S120-D349 WeakPolarHBondContact CB-O 3.3Å; S120-D349 PolarHBondContact OG-O 3.15Å; I346-D349 PolarHBondContact O-N 3Å; C347-D349 PolarHBondContact O-N 3.3Å; D349-K354 IonicContact OD1-NZ 2.71Å
350	Y	93.3	Very high	94.2	Very high	10 Å²	10	23.4 Å²	23.4	4%	0.039	12%	0.124	C	C	.	.	S	Bend	trans	-107.9	4.1	179.7	-53.9	-83	0	0	0	113	Y80 F82 V119 I298 Q303 I304 I346 C347 Q348	Y80-Y350 WeakPolarHBondContact CE2-OH 3.5Å; Y80-Y350 WeakPolarHBondContact OH-CE1 3.2Å; Y80-Y350 PolarHBondContact OH-OH 2.75Å; F82-Y350 HydrophobicContact CD2-CD2 4.45Å; F82-Y350 HydrophobicContact CD2-CE1 4.35Å; F82-Y350 AromaticContact CD2-CE2 3.85Å; F82-Y350 HydrophobicContact CD2-CE2 3.85Å; F82-Y350 AromaticContact CD2-CZ 3.8Å; F82-Y350 AromaticContact CE2-CD2 3.88Å; F82-Y350 HydrophobicContact CE2-CD2 3.88Å; F82-Y350 AromaticContact CE2-CE2 3.7Å; F82-Y350 HydrophobicContact CE2-CE2 3.7Å; F82-Y350 HydrophobicContact CE2-CG 4.36Å; V119-Y350 HydrophobicContact CG2-CE1 4.1Å; I298-Y350 HydrophobicContact CD1-CD1 4.2Å; I298-Y350 HydrophobicContact CG1-CD1 4.38Å; I298-Y350 HydrophobicContact CG2-CD1 3.92Å; I298-Y350 HydrophobicContact CG2-CE1 4.28Å; Q303-Y350 WeakPolarHBondContact CA-O 3.19Å; I304-Y350 HydrophobicContact CG1-CG 4.4Å; I304-Y350 PolarHBondContact N-O 2.66Å; I346-Y350 HydrophobicContact CG2-CE2 4.24Å; I346-Y350 WeakPolarHBondContact O-CD2 3.18Å; I346-Y350 WeakPolarHBondContact O-CE2 3.4Å; C347-Y350 PolarHBondContact O-N 2.93Å; Q348-Y350 VanDerWaalsContact C-N 3.29Å
351	D	90.3	Very high	94.3	Very high	5 Å²	5	23.4 Å²	23.4	3%	0.027	13%	0.125	C	C	.	.			trans	-110.6	129.4	172	-170.2	-46.2	0	0	0	108.8	D353 K354 F356	D351-D353 PolarHBondContact OD1-N 3.02Å; D351-D353 VanDerWaalsContact OD1-N 3.08Å; D351-K354 PolarHBondContact OD1-N 3.43Å; D351-F356 HydrophobicContact CB-CE1 3.81Å; D351-F356 HydrophobicContact CB-CZ 4.34Å; D351-F356 WeakPolarHBondContact OD2-CE1 3.19Å
352	S	86.8	Confident	94.4	Very high	58 Å²	58	21 Å²	21	41%	0.406	11%	0.11	S	C	.	.	S	Bend	trans	-79.3	-33.5	-172.5	71.2	0	0	0	0	114.2	Q303	Q303-S352 PolarHBondContact NE2-OG 3Å; Q303-S352 PolarHBondContact OE1-OG 3.02Å
353	D	89.4	Confident	94.6	Very high	79 Å²	79	20.6 Å²	20.6	42%	0.422	11%	0.107	S	C	.	.	S	Bend	trans	-97.7	-17.7	179.3	60.8	33.2	0	0	0	112.1	D351 M355	D351-D353 PolarHBondContact OD1-N 3.02Å; D351-D353 VanDerWaalsContact OD1-N 3.08Å; D353-M355 HydrophobicContact CB-CG 4.12Å; D353-M355 PolarHBondContact O-N 3.1Å; D353-M355 VanDerWaalsContact OD1-CB 3.3Å; D353-M355 WeakPolarHBondContact OD1-CB 3.38Å; D353-M355 PolarHBondContact OD1-N 2.87Å
354	K	93.8	Very high	94.8	Very high	65 Å²	65	21.7 Å²	21.7	28%	0.283	11%	0.112	S	C	.	.			trans	59	33.7	-179.9	-53	174	175.4	-83.8	0	111.3	Q348 D349 D351 F356 G388	Q348-K354 PolarHBondContact O-NZ 3Å; D349-K354 IonicContact OD1-NZ 2.71Å; D351-K354 PolarHBondContact OD1-N 3.43Å; K354-F356 HydrophobicContact CB-CZ 4.18Å; K354-G388 WeakPolarHBondContact O-CA 3.44Å; K354-G388 PolarHBondContact O-N 3.35Å
355	M	96.1	Very high	94.9	Very high	48 Å²	48	22.7 Å²	22.7	24%	0.236	12%	0.117	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102	107.6	177.6	-65.8	-58.6	-60.2	0	0	109	D353 P357 E385 C386 A387	D353-M355 HydrophobicContact CB-CG 4.12Å; D353-M355 PolarHBondContact O-N 3.1Å; D353-M355 VanDerWaalsContact OD1-CB 3.3Å; D353-M355 WeakPolarHBondContact OD1-CB 3.38Å; D353-M355 PolarHBondContact OD1-N 2.87Å; M355-P357 WeakPolarHBondContact O-CD 3.3Å; M355-E385 HydrophobicContact CB-CB 4.06Å; M355-E385 HydrophobicContact CB-CG 4.25Å; M355-E385 HydrophobicContact CE-CB 3.68Å; M355-C386 WeakPolarHBondContact CA-O 3.3Å; M355-A387 HydrophobicContact SD-CB 4.05Å
356	F	97.1	Very high	94.9	Very high	0 Å²	0	21.4 Å²	21.4	0%	0	12%	0.115	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	118.6	-172.8	-55.6	-50	0	0	0	111.8	F306 Q348 D351 K354 A358 C386 G388 V392	F306-F356 HydrophobicContact CB-CD1 3.89Å; F306-F356 HydrophobicContact CB-CE1 4.11Å; F306-F356 HydrophobicContact CD1-CD1 4.13Å; F306-F356 HydrophobicContact CD1-CG 4.26Å; F306-F356 WeakPolarHBondContact O-CD1 3.35Å; Q348-F356 HydrophobicContact CB-CE2 3.82Å; Q348-F356 HydrophobicContact CB-CZ 3.47Å; Q348-F356 VanDerWaalsContact CB-CZ 3.47Å; D351-F356 HydrophobicContact CB-CE1 3.81Å; D351-F356 HydrophobicContact CB-CZ 4.34Å; D351-F356 WeakPolarHBondContact OD2-CE1 3.19Å; K354-F356 HydrophobicContact CB-CZ 4.18Å; F356-A358 PolarHBondContact O-N 3.19Å; F356-C386 PolarHBondContact N-O 3.17Å; F356-C386 WeakPolarHBondContact O-CB 3.23Å; F356-C386 PolarHBondContact O-N 2.88Å; F356-G388 VanDerWaalsContact CD2-C 3.46Å; F356-V392 HydrophobicContact CB-CG2 3.83Å; F356-V392 HydrophobicContact CD2-CG2 4.36Å
357	P	97.9	Very high	94.9	Very high	20 Å²	20	26.6 Å²	26.6	13%	0.13	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-60.7	127.6	168.8	-22.9	34.4	0	0	0	110.7	T307 V308 M355 F359 P384 E385	T307-P357 HydrophobicContact CG2-CB 4.16Å; V308-P357 PolarHBondContact N-O 3.38Å; M355-P357 WeakPolarHBondContact O-CD 3.3Å; P357-F359 HydrophobicContact CB-CD2 4.39Å; P357-F359 HydrophobicContact CB-CE2 3.62Å; P357-F359 HydrophobicContact CB-CZ 4.16Å; P357-P384 WeakPolarHBondContact CA-O 3.39Å; P357-P384 HydrophobicContact CB-CB 4.48Å; P357-P384 HydrophobicContact CB-CG 4.23Å; P357-E385 HydrophobicContact CG-CG 4.4Å
358	A	98.3	Very high	94.9	Very high	0 Å²	0	31.1 Å²	31.1	0%	0	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	117.3	177.7	0	0	0	0	0	110.7	F356 V377 P384 V392	F356-A358 PolarHBondContact O-N 3.19Å; A358-V377 HydrophobicContact CB-CB 4.16Å; A358-V377 HydrophobicContact CB-CG2 4.37Å; A358-V377 WeakPolarHBondContact O-CB 3.37Å; A358-V377 WeakPolarHBondContact O-CG2 3.27Å; A358-V377 PolarHBondContact O-N 3.48Å; A358-P384 PolarHBondContact N-O 2.96Å; A358-P384 VanDerWaalsContact N-O 3.13Å; A358-V392 HydrophobicContact CB-CG1 4.01Å; A358-V392 HydrophobicContact CB-CG2 4.35Å
359	F	98.7	Very high	94.9	Very high	13 Å²	13	33.5 Å²	33.5	6%	0.057	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	153	-179.4	-60	-76.8	0	0	0	112.1	T307 V308 A309 I310 P357 D374 F375 V377 P384 I414 K417	T307-F359 HydrophobicContact CG2-CD2 3.66Å; T307-F359 HydrophobicContact CG2-CE2 3.78Å; V308-F359 PolarHBondContact O-N 2.83Å; A309-F359 CarbonylContact C-O 3.54Å; A309-F359 VanDerWaalsContact CA-O 3.3Å; A309-F359 WeakPolarHBondContact CA-O 3.41Å; I310-F359 PolarHBondContact N-O 2.84Å; P357-F359 HydrophobicContact CB-CD2 4.39Å; P357-F359 HydrophobicContact CB-CE2 3.62Å; P357-F359 HydrophobicContact CB-CZ 4.16Å; F359-D374 VanDerWaalsContact CD1-O 3.26Å; F359-D374 WeakPolarHBondContact CD1-O 3.4Å; F359-F375 CarbonylContact C-O 3.53Å; F359-F375 WeakPolarHBondContact CA-O 3.48Å; F359-V377 WeakPolarHBondContact O-CG2 3.48Å; F359-P384 HydrophobicContact CD1-CB 4.43Å; F359-P384 HydrophobicContact CE1-CB 3.62Å; F359-P384 HydrophobicContact CE1-CG 3.93Å; F359-P384 HydrophobicContact CZ-CB 3.68Å; F359-P384 HydrophobicContact CZ-CG 3.6Å; F359-I414 HydrophobicContact CB-CD1 3.63Å; F359-I414 HydrophobicContact CB-CG1 4.46Å; F359-I414 HydrophobicContact CD2-CD1 3.61Å; F359-I414 HydrophobicContact CE2-CD1 4.38Å; F359-I414 HydrophobicContact CG-CD1 3.66Å; F359-K417 HydrophobicContact CD1-CD 4.26Å; F359-K417 HydrophobicContact CE1-CD 3.78Å; F359-K417 HydrophobicContact CE2-CD 4.15Å; F359-K417 HydrophobicContact CZ-CD 3.7Å
360	G	98.1	Very high	95.1	Very high	0 Å²	0	39.5 Å²	39.5	0%	0	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	156.6	171.2	0	0	0	0	0	111.3	I310 H373 D374 F375	I310-G360 CarbonylContact O-C 3.59Å; I310-G360 VanDerWaalsContact O-CA 3.23Å; I310-G360 WeakPolarHBondContact O-CA 3.43Å; G360-H373 CarbonylContact O-C 3.46Å; G360-D374 CarbonylContact O-C 3.56Å; G360-D374 WeakPolarHBondContact O-CA 3.4Å; G360-D374 PolarHBondContact O-N 3.37Å; G360-F375 VanDerWaalsContact C-CD1 3.45Å; G360-F375 VanDerWaalsContact CA-CE1 3.45Å; G360-F375 PolarHBondContact N-O 2.86Å; G360-F375 WeakPolarHBondContact O-CD1 3.41Å; G360-F375 VanDerWaalsContact O-CE1 3.3Å; G360-F375 WeakPolarHBondContact O-CE1 3.3Å; G360-F375 PolarHBondContact O-N 3.37Å
361	F	98	Very high	95.2	Very high	1 Å²	1	41.9 Å²	41.9	0%	0.004	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.9	152.7	176.1	63.6	-90.1	0	0	0	112.9	A309 I310 D311 F312 H373 T409 I411 I439	A309-F361 HydrophobicContact CB-CD1 4.32Å; A309-F361 HydrophobicContact CB-CE1 4.23Å; I310-F361 VanDerWaalsContact C-CE1 3.46Å; I310-F361 WeakPolarHBondContact O-CD1 3.21Å; I310-F361 PolarHBondContact O-N 2.92Å; D311-F361 VanDerWaalsContact CA-CZ 3.48Å; D311-F361 HydrophobicContact CB-CD2 4.47Å; D311-F361 HydrophobicContact CB-CE1 4Å; D311-F361 HydrophobicContact CB-CE2 3.65Å; D311-F361 HydrophobicContact CB-CZ 3.39Å; D311-F361 VanDerWaalsContact N-CE1 3.29Å; F312-F361 PolarHBondContact N-O 2.8Å; F361-H373 VanDerWaalsContact CB-C 3.44Å; F361-H373 HydrophobicContact CB-CB 4.3Å; F361-H373 WeakPolarHBondContact CB-O 3.38Å; F361-T409 HydrophobicContact CE2-CG2 3.93Å; F361-I411 HydrophobicContact CD2-CG2 4.29Å; F361-I411 HydrophobicContact CE1-CG2 4.48Å; F361-I411 HydrophobicContact CE2-CG2 3.67Å; F361-I411 HydrophobicContact CZ-CG2 3.76Å; F361-I439 HydrophobicContact CE1-CG2 3.91Å; F361-I439 HydrophobicContact CZ-CG2 3.91Å
362	G	97.2	Very high	95.6	Very high	0 Å²	0	42.9 Å²	42.9	0%	0	23%	0.232	C	C	.	.	S	Bend	trans	82	22.1	174.3	0	0	0	0	0	115.2	S372 Y406 G407	G362-S372 PolarHBondContact N-O 3.36Å; G362-Y406 CarbonylContact O-C 3.55Å; G362-Y406 WeakPolarHBondContact O-CA 3.25Å; G362-Y406 PolarHBondContact O-N 2.84Å; G362-G407 PolarHBondContact O-N 2.99Å
363	A	97.8	Very high	96.1	Very high	0 Å²	0	41.6 Å²	41.6	0%	0	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	157.9	-179.7	0	0	0	0	0	112.9	F312 I365 V371 S372 F375 I403 Q404	F312-A363 HydrophobicContact CB-CB 3.76Å; A363-I365 HydrophobicContact CB-CD1 3.9Å; A363-V371 WeakPolarHBondContact O-CA 3.26Å; A363-S372 PolarHBondContact N-O 2.87Å; A363-S372 PolarHBondContact O-N 2.94Å; A363-F375 HydrophobicContact CB-CE1 4.1Å; A363-F375 HydrophobicContact CB-CZ 4.43Å; A363-I403 HydrophobicContact CB-CB 4.37Å; A363-I403 HydrophobicContact CB-CD1 3.9Å; A363-Q404 WeakPolarHBondContact CA-O 3.42Å
364	L	98.1	Very high	96.4	Very high	23 Å²	23	40.2 Å²	40.2	12%	0.12	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.1	121	169.4	-60.6	159.9	0	0	0	108.9	F369 K370 V371 Q404 Y406	L364-F369 HydrophobicContact CB-CB 4.11Å; L364-F369 HydrophobicContact CB-CD1 4.13Å; L364-F369 WeakPolarHBondContact CD2-O 3.37Å; L364-K370 WeakPolarHBondContact CA-O 3.13Å; L364-V371 HydrophobicContact CD2-CB 4.4Å; L364-V371 HydrophobicContact CD2-CG2 3.46Å; L364-V371 VanDerWaalsContact CD2-CG2 3.46Å; L364-V371 HydrophobicContact CG-CG2 4.45Å; L364-Q404 HydrophobicContact CB-CB 4.18Å; L364-Q404 HydrophobicContact CD1-CB 4.3Å; L364-Q404 HydrophobicContact CD1-CG 4.01Å; L364-Q404 PolarHBondContact N-O 2.82Å; L364-Q404 PolarHBondContact O-N 2.7Å; L364-Q404 VanDerWaalsContact O-N 3.1Å; L364-Y406 HydrophobicContact CD1-CD2 3.95Å; L364-Y406 HydrophobicContact CD1-CG 3.94Å; L364-Y406 HydrophobicContact CD2-CD1 4.16Å; L364-Y406 HydrophobicContact CD2-CG 4.3Å; L364-Y406 HydrophobicContact CG-CD1 4.2Å; L364-Y406 HydrophobicContact CG-CD2 4.39Å; L364-Y406 HydrophobicContact CG-CG 3.87Å
365	I	96.9	Very high	96.6	Very high	20 Å²	20	37.2 Å²	37.2	10%	0.103	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	131.8	-170.4	-50	-54.3	0	0	0	111	A363 F369 K370 F375 F379 I403	A363-I365 HydrophobicContact CB-CD1 3.9Å; I365-F369 WeakPolarHBondContact O-CA 3.33Å; I365-F369 PolarHBondContact O-N 2.78Å; I365-K370 PolarHBondContact N-O 2.84Å; I365-F375 HydrophobicContact CD1-CB 4.44Å; I365-F375 HydrophobicContact CD1-CD1 3.4Å; I365-F375 VanDerWaalsContact CD1-CD1 3.4Å; I365-F375 HydrophobicContact CD1-CD2 3.67Å; I365-F375 HydrophobicContact CD1-CE1 3.37Å; I365-F375 HydrophobicContact CD1-CE2 3.64Å; I365-F375 HydrophobicContact CD1-CG 3.56Å; I365-F375 HydrophobicContact CD1-CZ 3.49Å; I365-F375 VanDerWaalsContact CD1-CZ 3.49Å; I365-F375 HydrophobicContact CG1-CB 4.05Å; I365-F375 HydrophobicContact CG1-CD1 3.73Å; I365-F375 HydrophobicContact CG1-CD2 4.17Å; I365-F375 HydrophobicContact CG1-CE1 4.21Å; I365-F375 HydrophobicContact CG1-CG 3.7Å; I365-F379 HydrophobicContact CG2-CD1 4.33Å; I365-F379 HydrophobicContact CG2-CE1 4.2Å; I365-I403 HydrophobicContact CD1-CB 4.2Å; I365-I403 HydrophobicContact CD1-CG2 3.61Å
366	P	92.6	Very high	96.7	Very high	45 Å²	45	35 Å²	35	29%	0.292	19%	0.188	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.2	159.5	175	28.3	-36.2	0	0	0	111.7	F369 F379	P366-F369 HydrophobicContact CB-CE1 4.46Å; P366-F369 HydrophobicContact CB-CE2 4.39Å; P366-F369 HydrophobicContact CB-CZ 4.13Å; P366-F379 HydrophobicContact CG-CE1 4.28Å
367	P	92.7	Very high	96.7	Very high	115 Å²	115	35 Å²	35	75%	0.747	19%	0.188	S	C	*	.	T	Hydrogen-bonded Turn	cis	-84.6	-21.5	3.5	32.8	-35.4	0	0	0	114.4	F369	P367-F369 WeakPolarHBondContact O-CD2 3.32Å
368	D	93.2	Very high	96.7	Very high	95 Å²	95	36.4 Å²	36.4	51%	0.508	19%	0.194	S	C	.	.	T	Hydrogen-bonded Turn	trans	-94.5	-1.7	-172.6	42.1	-43	0	0	0	114.1	K370	D368-K370 VanDerWaalsContact C-N 3.31Å; D368-K370 PolarHBondContact O-N 2.86Å; D368-K370 WeakPolarHBondContact OD2-CD 3.43Å; D368-K370 WeakPolarHBondContact OD2-CE 3.34Å; D368-K370 IonicContact OD2-NZ 3.56Å; D368-K370 PolarHBondContact OD2-NZ 2.89Å
369	F	94.4	Very high	96.6	Very high	95 Å²	95	39.7 Å²	39.7	42%	0.417	21%	0.209	S	C	.	.	T	Hydrogen-bonded Turn	trans	51.8	50.5	176	-68.9	-82.9	0	0	0	111.6	L364 I365 P366 P367 Q404	L364-F369 HydrophobicContact CB-CB 4.11Å; L364-F369 HydrophobicContact CB-CD1 4.13Å; L364-F369 WeakPolarHBondContact CD2-O 3.37Å; I365-F369 WeakPolarHBondContact O-CA 3.33Å; I365-F369 PolarHBondContact O-N 2.78Å; P366-F369 HydrophobicContact CB-CE1 4.46Å; P366-F369 HydrophobicContact CB-CE2 4.39Å; P366-F369 HydrophobicContact CB-CZ 4.13Å; P367-F369 WeakPolarHBondContact O-CD2 3.32Å; F369-Q404 HydrophobicContact CD1-CB 4.48Å
370	K	95.7	Very high	96.5	Very high	138 Å²	138	42.5 Å²	42.5	60%	0.6	22%	0.224	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-88.3	146.6	169.7	-71.5	-178.1	-176.2	135.8	0	110	L364 I365 D368 S372	L364-K370 WeakPolarHBondContact CA-O 3.13Å; I365-K370 PolarHBondContact N-O 2.84Å; D368-K370 VanDerWaalsContact C-N 3.31Å; D368-K370 PolarHBondContact O-N 2.86Å; D368-K370 WeakPolarHBondContact OD2-CD 3.43Å; D368-K370 WeakPolarHBondContact OD2-CE 3.34Å; D368-K370 IonicContact OD2-NZ 3.56Å; D368-K370 PolarHBondContact OD2-NZ 2.89Å; K370-S372 PolarHBondContact O-N 3.33Å
371	V	97	Very high	96.2	Very high	60 Å²	60	47.7 Å²	47.7	36%	0.364	25%	0.249	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-64.7	129.8	174.9	-173.9	0	0	0	0	108.3	A363 L364 Y406	A363-V371 WeakPolarHBondContact O-CA 3.26Å; L364-V371 HydrophobicContact CD2-CB 4.4Å; L364-V371 HydrophobicContact CD2-CG2 3.46Å; L364-V371 VanDerWaalsContact CD2-CG2 3.46Å; L364-V371 HydrophobicContact CG-CG2 4.45Å; V371-Y406 HydrophobicContact CB-CD1 4.48Å; V371-Y406 HydrophobicContact CG1-CD1 4.27Å; V371-Y406 HydrophobicContact CG2-CD1 3.42Å; V371-Y406 VanDerWaalsContact CG2-CD1 3.42Å; V371-Y406 HydrophobicContact CG2-CE1 3.53Å
372	S	97.3	Very high	96.1	Very high	25 Å²	25	56.8 Å²	56.8	18%	0.175	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	148.8	171	-178.6	0	0	0	0	110.8	G362 A363 K370 D374 F375	G362-S372 PolarHBondContact N-O 3.36Å; A363-S372 PolarHBondContact N-O 2.87Å; A363-S372 PolarHBondContact O-N 2.94Å; K370-S372 PolarHBondContact O-N 3.33Å; S372-D374 PolarHBondContact OG-N 3.06Å; S372-D374 PolarHBondContact OG-OD1 3.2Å; S372-F375 WeakPolarHBondContact OG-CB 3.44Å; S372-F375 PolarHBondContact OG-N 3.41Å
373	H	97.1	Very high	96	Very high	32 Å²	32	59.9 Å²	59.9	15%	0.148	31%	0.308	C	S	.	.	S	Bend	trans	-120.4	11.9	178.8	-65.4	-69.6	0	0	0	112.9	G360 F361 P408 P413	G360-H373 CarbonylContact O-C 3.46Å; F361-H373 VanDerWaalsContact CB-C 3.44Å; F361-H373 HydrophobicContact CB-CB 4.3Å; F361-H373 WeakPolarHBondContact CB-O 3.38Å; H373-P408 PolarHBondContact CE1-O 3.41Å; H373-P413 HydrophobicContact CB-CB 4.06Å; H373-P413 HydrophobicContact CB-CG 3.83Å
374	D	96.5	Very high	96	Very high	50 Å²	50	61 Å²	61	27%	0.267	32%	0.315	S	S	.	.	S	Bend	trans	-165.8	28.1	-175.3	67.2	-32.5	0	0	0	113.3	F359 G360 S372 I414 K417	F359-D374 VanDerWaalsContact CD1-O 3.26Å; F359-D374 WeakPolarHBondContact CD1-O 3.4Å; G360-D374 CarbonylContact O-C 3.56Å; G360-D374 WeakPolarHBondContact O-CA 3.4Å; G360-D374 PolarHBondContact O-N 3.37Å; S372-D374 PolarHBondContact OG-N 3.06Å; S372-D374 PolarHBondContact OG-OD1 3.2Å; D374-I414 HydrophobicContact CB-CD1 4.35Å; D374-K417 HydrophobicContact CB-CD 4.47Å; D374-K417 PolarHBondContact O-NZ 2.89Å; D374-K417 WeakPolarHBondContact OD2-CE 3.36Å; D374-K417 IonicContact OD2-NZ 3.06Å; D374-K417 PolarHBondContact OD2-NZ 2.97Å
375	F	97.8	Very high	95.9	Very high	2 Å²	2	63.5 Å²	63.5	1%	0.009	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.3	150.1	-176.8	68.6	-84.3	0	0	0	112.1	F312 F359 G360 A363 I365 S372 V377 E381 I403	F312-F375 HydrophobicContact CD2-CE1 4.18Å; F312-F375 AromaticContact CD2-CZ 3.67Å; F312-F375 HydrophobicContact CD2-CZ 3.67Å; F312-F375 AromaticContact CE2-CZ 3.92Å; F312-F375 HydrophobicContact CE2-CZ 3.92Å; F312-F375 HydrophobicContact CG-CZ 4.41Å; F359-F375 CarbonylContact C-O 3.53Å; F359-F375 WeakPolarHBondContact CA-O 3.48Å; G360-F375 VanDerWaalsContact C-CD1 3.45Å; G360-F375 VanDerWaalsContact CA-CE1 3.45Å; G360-F375 PolarHBondContact N-O 2.86Å; G360-F375 WeakPolarHBondContact O-CD1 3.41Å; G360-F375 VanDerWaalsContact O-CE1 3.3Å; G360-F375 WeakPolarHBondContact O-CE1 3.3Å; G360-F375 PolarHBondContact O-N 3.37Å; A363-F375 HydrophobicContact CB-CE1 4.1Å; A363-F375 HydrophobicContact CB-CZ 4.43Å; I365-F375 HydrophobicContact CD1-CB 4.44Å; I365-F375 HydrophobicContact CD1-CD1 3.4Å; I365-F375 VanDerWaalsContact CD1-CD1 3.4Å; I365-F375 HydrophobicContact CD1-CD2 3.67Å; I365-F375 HydrophobicContact CD1-CE1 3.37Å; I365-F375 HydrophobicContact CD1-CE2 3.64Å; I365-F375 HydrophobicContact CD1-CG 3.56Å; I365-F375 HydrophobicContact CD1-CZ 3.49Å; I365-F375 VanDerWaalsContact CD1-CZ 3.49Å; I365-F375 HydrophobicContact CG1-CB 4.05Å; I365-F375 HydrophobicContact CG1-CD1 3.73Å; I365-F375 HydrophobicContact CG1-CD2 4.17Å; I365-F375 HydrophobicContact CG1-CE1 4.21Å; I365-F375 HydrophobicContact CG1-CG 3.7Å; S372-F375 WeakPolarHBondContact OG-CB 3.44Å; S372-F375 PolarHBondContact OG-N 3.41Å; F375-V377 PolarHBondContact O-N 3.3Å; F375-E381 WeakPolarHBondContact CA-OE1 3.48Å; F375-I403 HydrophobicContact CE2-CG2 4.34Å; F375-I403 HydrophobicContact CZ-CD1 4.15Å; F375-I403 HydrophobicContact CZ-CG2 4.44Å
376	A	98.1	Very high	96	Very high	0 Å²	0	63 Å²	63	0%	0	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.9	123.4	176.1	0	0	0	0	0	111.1	N378 F379 D380 E381 P384	A376-N378 WeakPolarHBondContact CB-OD1 3.45Å; A376-N378 PolarHBondContact O-N 2.83Å; A376-F379 WeakPolarHBondContact O-CA 3.46Å; A376-F379 PolarHBondContact O-N 2.98Å; A376-D380 WeakPolarHBondContact CB-O 3.34Å; A376-E381 PolarHBondContact N-OE1 3.33Å; A376-P384 HydrophobicContact CB-CB 3.92Å
377	V	97.8	Very high	96.2	Very high	1 Å²	1	64.1 Å²	64.1	1%	0.006	34%	0.337	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65.3	-28.1	-176	174.9	0	0	0	0	111.8	F312 A358 F359 F375 F379 A395 C399	F312-V377 HydrophobicContact CE2-CG2 4.19Å; A358-V377 HydrophobicContact CB-CB 4.16Å; A358-V377 HydrophobicContact CB-CG2 4.37Å; A358-V377 WeakPolarHBondContact O-CB 3.37Å; A358-V377 WeakPolarHBondContact O-CG2 3.27Å; A358-V377 PolarHBondContact O-N 3.48Å; F359-V377 WeakPolarHBondContact O-CG2 3.48Å; F375-V377 PolarHBondContact O-N 3.3Å; V377-F379 VanDerWaalsContact C-N 3.26Å; V377-F379 PolarHBondContact O-N 2.72Å; V377-A395 HydrophobicContact CG1-CB 3.97Å; V377-C399 HydrophobicContact CG1-CB 3.61Å; V377-C399 WeakPolarHBondContact O-CB 3.45Å
378	N	97.1	Very high	96.3	Very high	50 Å²	50	59.3 Å²	59.3	27%	0.267	31%	0.308	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.2	-4	174.1	67.8	-0.8	0	0	0	113.6	A376 D380 N383 E385 A395	A376-N378 WeakPolarHBondContact CB-OD1 3.45Å; A376-N378 PolarHBondContact O-N 2.83Å; N378-D380 PolarHBondContact O-N 3.19Å; N378-D380 PolarHBondContact OD1-N 3.17Å; N378-D380 PolarHBondContact OD1-O 3.22Å; N378-N383 PolarHBondContact ND2-O 3.21Å; N378-E385 PolarHBondContact ND2-O 2.89Å; N378-A395 HydrophobicContact CB-CB 4.38Å
379	F	96.3	Very high	96.4	Very high	68 Å²	68	55.4 Å²	55.4	30%	0.298	29%	0.287	S	S	.	.	S	Bend	trans	60.9	22.7	-172.1	-52.5	-81.3	0	0	0	115.4	I365 P366 A376 V377 C399 K402 I403	I365-F379 HydrophobicContact CG2-CD1 4.33Å; I365-F379 HydrophobicContact CG2-CE1 4.2Å; P366-F379 HydrophobicContact CG-CE1 4.28Å; A376-F379 WeakPolarHBondContact O-CA 3.46Å; A376-F379 PolarHBondContact O-N 2.98Å; V377-F379 VanDerWaalsContact C-N 3.26Å; V377-F379 PolarHBondContact O-N 2.72Å; F379-C399 HydrophobicContact CE2-CB 4.14Å; F379-C399 HydrophobicContact CZ-CB 4.22Å; F379-C399 VanDerWaalsContact CZ-SG 3.57Å; F379-K402 HydrophobicContact CD2-CD 4.25Å; F379-K402 HydrophobicContact CE2-CB 4.24Å; F379-K402 HydrophobicContact CE2-CD 3.52Å; F379-K402 HydrophobicContact CZ-CB 3.82Å; F379-K402 HydrophobicContact CZ-CD 3.99Å; F379-I403 HydrophobicContact CE1-CG2 3.85Å; F379-I403 HydrophobicContact CZ-CG2 3.84Å
380	D	96	Very high	96.5	Very high	72 Å²	72	56.2 Å²	56.2	39%	0.385	29%	0.292	S	S	.	.			trans	-111.9	93.6	169.5	-170.4	-16.3	0	0	0	108.8	A376 N378 E382 N383	A376-D380 WeakPolarHBondContact CB-O 3.34Å; N378-D380 PolarHBondContact O-N 3.19Å; N378-D380 PolarHBondContact OD1-N 3.17Å; N378-D380 PolarHBondContact OD1-O 3.22Å; D380-E382 PolarHBondContact O-N 3.38Å; D380-E382 PolarHBondContact OD1-N 2.93Å; D380-E382 VanDerWaalsContact OD1-N 3.13Å; D380-N383 WeakPolarHBondContact CB-O 3.44Å; D380-N383 CarbonylContact O-C 3.06Å; D380-N383 PolarHBondContact O-N 3.47Å; D380-N383 PolarHBondContact OD1-N 3.36Å
381	E	93	Very high	96.6	Very high	110 Å²	110	50.3 Å²	50.3	51%	0.514	27%	0.271	S	S	.	.	S	Bend	trans	-69.9	-19.8	-179.9	-65.9	-65.9	155.5	0	0	112.8	F375 A376	F375-E381 WeakPolarHBondContact CA-OE1 3.48Å; A376-E381 PolarHBondContact N-OE1 3.33Å
382	E	95.1	Very high	96.7	Very high	191 Å²	191	47.5 Å²	47.5	89%	0.893	25%	0.254	S	S	*	.	S	Bend	trans	-80.4	-30.1	174.4	-64.2	-172.1	169.2	0	0	111	D380	D380-E382 PolarHBondContact O-N 3.38Å; D380-E382 PolarHBondContact OD1-N 2.93Å; D380-E382 VanDerWaalsContact OD1-N 3.13Å
383	N	96.1	Very high	96.7	Very high	66 Å²	66	46.9 Å²	46.9	35%	0.353	25%	0.249	S	C	.	.			trans	-138.7	89	176.9	-174.6	15.5	0	0	0	112.5	N378 D380 E385	N378-N383 PolarHBondContact ND2-O 3.21Å; D380-N383 WeakPolarHBondContact CB-O 3.44Å; D380-N383 CarbonylContact O-C 3.06Å; D380-N383 PolarHBondContact O-N 3.47Å; D380-N383 PolarHBondContact OD1-N 3.36Å; N383-E385 PolarHBondContact O-N 3.26Å; N383-E385 VanDerWaalsContact O-N 3.17Å; N383-E385 VanDerWaalsContact OD1-CB 3.24Å; N383-E385 WeakPolarHBondContact OD1-CB 3.43Å; N383-E385 VanDerWaalsContact OD1-CG 3.3Å; N383-E385 WeakPolarHBondContact OD1-CG 3.33Å; N383-E385 PolarHBondContact OD1-N 3.18Å
384	P	96.9	Very high	96.7	Very high	23 Å²	23	50.2 Å²	50.2	15%	0.149	27%	0.265	C	S	.	.			trans	-75.6	1.4	-179.9	32.1	-36	0	0	0	113.8	P357 A358 F359 A376	P357-P384 WeakPolarHBondContact CA-O 3.39Å; P357-P384 HydrophobicContact CB-CB 4.48Å; P357-P384 HydrophobicContact CB-CG 4.23Å; A358-P384 PolarHBondContact N-O 2.96Å; A358-P384 VanDerWaalsContact N-O 3.13Å; F359-P384 HydrophobicContact CD1-CB 4.43Å; F359-P384 HydrophobicContact CE1-CB 3.62Å; F359-P384 HydrophobicContact CE1-CG 3.93Å; F359-P384 HydrophobicContact CZ-CB 3.68Å; F359-P384 HydrophobicContact CZ-CG 3.6Å; A376-P384 HydrophobicContact CB-CB 3.92Å
385	E	97.1	Very high	96.8	Very high	76 Å²	76	48.4 Å²	48.4	36%	0.355	26%	0.257	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.3	139.1	-173.3	-62.7	178.4	171.6	0	0	113.2	M355 P357 N378 N383	M355-E385 HydrophobicContact CB-CB 4.06Å; M355-E385 HydrophobicContact CB-CG 4.25Å; M355-E385 HydrophobicContact CE-CB 3.68Å; P357-E385 HydrophobicContact CG-CG 4.4Å; N378-E385 PolarHBondContact ND2-O 2.89Å; N383-E385 PolarHBondContact O-N 3.26Å; N383-E385 VanDerWaalsContact O-N 3.17Å; N383-E385 VanDerWaalsContact OD1-CB 3.24Å; N383-E385 WeakPolarHBondContact OD1-CB 3.43Å; N383-E385 VanDerWaalsContact OD1-CG 3.3Å; N383-E385 WeakPolarHBondContact OD1-CG 3.33Å; N383-E385 PolarHBondContact OD1-N 3.18Å
386	C	97.6	Very high	96.8	Very high	8 Å²	8	48.3 Å²	48.3	5%	0.054	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	135.3	177	-65.1	0	0	0	0	110.3	M355 F356 G388 V392	M355-C386 WeakPolarHBondContact CA-O 3.3Å; F356-C386 PolarHBondContact N-O 3.17Å; F356-C386 WeakPolarHBondContact O-CB 3.23Å; F356-C386 PolarHBondContact O-N 2.88Å; C386-G388 PolarHBondContact O-N 2.95Å; C386-G388 VanDerWaalsContact O-N 3.08Å; C386-V392 HydrophobicContact CB-CB 4.43Å; C386-V392 HydrophobicContact CB-CG2 3.68Å
387	A	96.6	Very high	96.8	Very high	69 Å²	69	52 Å²	52	57%	0.57	27%	0.274	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-72.6	102.6	-178.9	0	0	0	0	0	111.9	M355 G391	M355-A387 HydrophobicContact SD-CB 4.05Å; A387-G391 WeakPolarHBondContact O-CA 3.34Å; A387-G391 PolarHBondContact O-N 3.23Å
388	G	96	Very high	96.7	Very high	14 Å²	14	56.5 Å²	56.5	14%	0.144	30%	0.298	C	S	.	.	H	α-helix	trans	67.8	175.3	-178.5	0	0	0	0	0	113.5	K354 F356 C386 Q390 G391 V392	K354-G388 WeakPolarHBondContact O-CA 3.44Å; K354-G388 PolarHBondContact O-N 3.35Å; F356-G388 VanDerWaalsContact CD2-C 3.46Å; C386-G388 PolarHBondContact O-N 2.95Å; C386-G388 VanDerWaalsContact O-N 3.08Å; G388-Q390 PolarHBondContact O-N 2.87Å; G388-G391 PolarHBondContact O-N 3.46Å; G388-V392 PolarHBondContact O-N 3.46Å
389	I	95.8	Very high	96.7	Very high	13 Å²	13	54.1 Å²	54.1	7%	0.067	29%	0.285	C	S	.	.	H	α-helix	trans	-63	-27.8	177.4	-170.3	54	0	0	0	112	L340 E345 V392 V393	L340-I389 HydrophobicContact CB-CD1 4.31Å; L340-I389 WeakPolarHBondContact O-CD1 3.49Å; E345-I389 HydrophobicContact CG-CG2 4.27Å; I389-V392 HydrophobicContact CD1-CB 4.22Å; I389-V392 PolarHBondContact O-N 3.11Å; I389-V393 WeakPolarHBondContact O-CG2 3.46Å; I389-V393 PolarHBondContact O-N 3.42Å
390	Q	96.5	Very high	96.7	Very high	112 Å²	112	51.4 Å²	51.4	52%	0.523	27%	0.274	S	S	.	.	H	α-helix	trans	-66.6	-40.4	173.4	-116.4	-59.3	42.4	0	0	112.1	G388 V392 V393 E394	G388-Q390 PolarHBondContact O-N 2.87Å; Q390-V392 VanDerWaalsContact C-N 3.26Å; Q390-V392 PolarHBondContact O-N 3.38Å; Q390-V393 PolarHBondContact O-N 3.03Å; Q390-V393 VanDerWaalsContact O-N 3.16Å; Q390-E394 WeakPolarHBondContact O-CG 3.38Å; Q390-E394 PolarHBondContact O-N 2.81Å
391	G	97.8	Very high	96.7	Very high	15 Å²	15	53 Å²	53	16%	0.155	29%	0.288	C	S	.	.	H	α-helix	trans	-57.8	-40.7	174.1	0	0	0	0	0	112.1	A387 G388 E394 A395	A387-G391 WeakPolarHBondContact O-CA 3.34Å; A387-G391 PolarHBondContact O-N 3.23Å; G388-G391 PolarHBondContact O-N 3.46Å; G391-E394 PolarHBondContact O-N 3.29Å; G391-A395 VanDerWaalsContact O-CB 3.31Å; G391-A395 WeakPolarHBondContact O-CB 3.4Å; G391-A395 PolarHBondContact O-N 3.06Å
392	V	98.1	Very high	96.8	Very high	0 Å²	0	53.2 Å²	53.2	0%	0	29%	0.287	C	S	.	.	H	α-helix	trans	-64.6	-43.6	176.3	179	0	0	0	0	111.2	V308 L340 F356 A358 C386 G388 I389 Q390 A395 Y396	V308-V392 HydrophobicContact CB-CG1 4.4Å; V308-V392 HydrophobicContact CG1-CG1 4.3Å; V308-V392 HydrophobicContact CG2-CG1 4.36Å; L340-V392 HydrophobicContact CD2-CG1 4.35Å; F356-V392 HydrophobicContact CB-CG2 3.83Å; F356-V392 HydrophobicContact CD2-CG2 4.36Å; A358-V392 HydrophobicContact CB-CG1 4.01Å; A358-V392 HydrophobicContact CB-CG2 4.35Å; C386-V392 HydrophobicContact CB-CB 4.43Å; C386-V392 HydrophobicContact CB-CG2 3.68Å; G388-V392 PolarHBondContact O-N 3.46Å; I389-V392 HydrophobicContact CD1-CB 4.22Å; I389-V392 PolarHBondContact O-N 3.11Å; Q390-V392 VanDerWaalsContact C-N 3.26Å; Q390-V392 PolarHBondContact O-N 3.38Å; V392-A395 PolarHBondContact O-N 3.42Å; V392-Y396 WeakPolarHBondContact O-CB 3.32Å; V392-Y396 PolarHBondContact O-N 3.46Å
393	V	97.8	Very high	96.9	Very high	13 Å²	13	45 Å²	45	8%	0.079	25%	0.249	C	C	.	.	H	α-helix	trans	-61.4	-46.1	177	164.6	0	0	0	0	111.2	L337 V341 I389 Q390 Y396 Q397	L337-V393 HydrophobicContact CD2-CB 4.33Å; L337-V393 HydrophobicContact CD2-CG1 3.74Å; L337-V393 HydrophobicContact CD2-CG2 4.05Å; V341-V393 HydrophobicContact CG2-CG2 4Å; I389-V393 WeakPolarHBondContact O-CG2 3.46Å; I389-V393 PolarHBondContact O-N 3.42Å; Q390-V393 PolarHBondContact O-N 3.03Å; Q390-V393 VanDerWaalsContact O-N 3.16Å; V393-Y396 PolarHBondContact O-N 3.06Å; V393-Q397 WeakPolarHBondContact O-CG 3.49Å; V393-Q397 PolarHBondContact O-N 2.98Å
394	E	97.6	Very high	97	Very high	102 Å²	102	46.9 Å²	46.9	48%	0.477	26%	0.256	S	S	.	.	H	α-helix	trans	-62.7	-44.6	176.4	-71.7	177.7	-169.1	0	0	111.3	Q390 G391 Q397 N398	Q390-E394 WeakPolarHBondContact O-CG 3.38Å; Q390-E394 PolarHBondContact O-N 2.81Å; G391-E394 PolarHBondContact O-N 3.29Å; E394-Q397 PolarHBondContact O-N 3.49Å; E394-N398 VanDerWaalsContact O-CB 3.28Å; E394-N398 WeakPolarHBondContact O-CB 3.43Å; E394-N398 PolarHBondContact O-N 3.43Å; E394-N398 PolarHBondContact O-ND2 3.28Å
395	A	98.1	Very high	97	Very high	12 Å²	12	47 Å²	47	10%	0.099	26%	0.255	C	S	.	.	H	α-helix	trans	-59.8	-47.9	176.5	0	0	0	0	0	111.3	V377 N378 G391 V392 Q397 N398 C399	V377-A395 HydrophobicContact CG1-CB 3.97Å; N378-A395 HydrophobicContact CB-CB 4.38Å; G391-A395 VanDerWaalsContact O-CB 3.31Å; G391-A395 WeakPolarHBondContact O-CB 3.4Å; G391-A395 PolarHBondContact O-N 3.06Å; V392-A395 PolarHBondContact O-N 3.42Å; A395-Q397 PolarHBondContact O-N 3.21Å; A395-N398 PolarHBondContact O-N 2.62Å; A395-C399 WeakPolarHBondContact O-CB 3.38Å; A395-C399 PolarHBondContact O-N 2.85Å
396	Y	98.3	Very high	97	Very high	0 Å²	0	49.2 Å²	49.2	0%	0	26%	0.261	C	S	.	.	H	α-helix	trans	-56.3	-49.7	176.6	165.8	-102.7	0	0	0	112.4	I310 F312 H326 I328 N334 L337 V392 V393 N398 C399 L400	I310-Y396 HydrophobicContact CD1-CD2 3.53Å; I310-Y396 HydrophobicContact CD1-CE2 4.31Å; I310-Y396 HydrophobicContact CD1-CG 4.08Å; I310-Y396 HydrophobicContact CG2-CD2 3.96Å; I310-Y396 HydrophobicContact CG2-CE2 3.78Å; F312-Y396 AromaticContact CE1-CD2 3.96Å; F312-Y396 HydrophobicContact CE1-CD2 3.96Å; F312-Y396 AromaticContact CE1-CE2 3.86Å; F312-Y396 HydrophobicContact CE1-CE2 3.86Å; F312-Y396 AromaticContact CZ-CD2 3.69Å; F312-Y396 HydrophobicContact CZ-CD2 3.69Å; F312-Y396 HydrophobicContact CZ-CE2 4.02Å; H326-Y396 AromaticContact CE1-CE2 3.96Å; H326-Y396 AromaticContact ND1-CE2 3.65Å; H326-Y396 AromaticContact ND1-CZ 3.65Å; H326-Y396 PolarHBondContact ND1-OH 3.06Å; I328-Y396 HydrophobicContact CD1-CE1 3.8Å; N334-Y396 PolarHBondContact ND2-OH 3.29Å; N334-Y396 VanDerWaalsContact ND2-OH 3.15Å; L337-Y396 HydrophobicContact CD1-CE1 4.41Å; L337-Y396 HydrophobicContact CD2-CD1 3.7Å; L337-Y396 HydrophobicContact CD2-CE1 3.87Å; L337-Y396 HydrophobicContact CG-CD1 4.22Å; L337-Y396 HydrophobicContact CG-CE1 3.85Å; V392-Y396 WeakPolarHBondContact O-CB 3.32Å; V392-Y396 PolarHBondContact O-N 3.46Å; V393-Y396 PolarHBondContact O-N 3.06Å; Y396-N398 VanDerWaalsContact C-N 3.31Å; Y396-N398 PolarHBondContact O-N 2.81Å; Y396-C399 PolarHBondContact O-N 3.42Å; Y396-L400 PolarHBondContact O-N 2.93Å
397	Q	96.8	Very high	96.8	Very high	78 Å²	78	49.5 Å²	49.5	36%	0.364	27%	0.266	S	S	.	.	H	α-helix	trans	-63	-37.7	179.2	-71.6	176.2	-12.5	0	0	112.2	I328 V393 E394 A395 P401	I328-Q397 HydrophobicContact CD1-CG 4.26Å; V393-Q397 WeakPolarHBondContact O-CG 3.49Å; V393-Q397 PolarHBondContact O-N 2.98Å; E394-Q397 PolarHBondContact O-N 3.49Å; A395-Q397 PolarHBondContact O-N 3.21Å; Q397-P401 VanDerWaalsContact O-CD 3.24Å; Q397-P401 WeakPolarHBondContact O-CD 3.25Å
398	N	96.8	Very high	96.8	Very high	95 Å²	95	49.1 Å²	49.1	51%	0.508	26%	0.257	S	S	.	.	H	α-helix	trans	-76.5	-24.6	178.6	-73	-36.1	0	0	0	113.5	E394 A395 Y396 K402	E394-N398 VanDerWaalsContact O-CB 3.28Å; E394-N398 WeakPolarHBondContact O-CB 3.43Å; E394-N398 PolarHBondContact O-N 3.43Å; E394-N398 PolarHBondContact O-ND2 3.28Å; A395-N398 PolarHBondContact O-N 2.62Å; Y396-N398 VanDerWaalsContact C-N 3.31Å; Y396-N398 PolarHBondContact O-N 2.81Å; N398-K402 WeakPolarHBondContact O-CD 3.32Å; N398-K402 VanDerWaalsContact O-CE 3.25Å; N398-K402 WeakPolarHBondContact O-CE 3.32Å
399	C	96.9	Very high	96.7	Very high	0 Å²	0	49 Å²	49	0%	0	25%	0.254	C	S	.	.	H	α-helix	trans	-75	-49.2	179.8	-177	0	0	0	0	112.4	V377 F379 A395 Y396 P401 K402 I403	V377-C399 HydrophobicContact CG1-CB 3.61Å; V377-C399 WeakPolarHBondContact O-CB 3.45Å; F379-C399 HydrophobicContact CE2-CB 4.14Å; F379-C399 HydrophobicContact CZ-CB 4.22Å; F379-C399 VanDerWaalsContact CZ-SG 3.57Å; A395-C399 WeakPolarHBondContact O-CB 3.38Å; A395-C399 PolarHBondContact O-N 2.85Å; Y396-C399 PolarHBondContact O-N 3.42Å; C399-P401 VanDerWaalsContact C-CD 3.46Å; C399-K402 WeakPolarHBondContact O-CB 3.35Å; C399-K402 PolarHBondContact O-N 3.06Å; C399-I403 PolarHBondContact O-N 2.83Å
400	L	95.5	Very high	96.7	Very high	11 Å²	11	50 Å²	50	6%	0.058	26%	0.26	C	S	.	.	T	Hydrogen-bonded Turn	trans	-49.4	-43.3	-172.1	-168.5	68.2	0	0	0	115.6	F312 P319 H326 I328 Y396 K402 L405	F312-L400 HydrophobicContact CD1-CD1 3.84Å; F312-L400 HydrophobicContact CE1-CD1 3.7Å; P319-L400 HydrophobicContact CB-CD1 4.15Å; P319-L400 HydrophobicContact CB-CD2 3.83Å; P319-L400 HydrophobicContact CB-CG 3.84Å; P319-L400 HydrophobicContact CG-CD1 3.68Å; P319-L400 HydrophobicContact CG-CD2 4.31Å; P319-L400 HydrophobicContact CG-CG 3.87Å; H326-L400 HydrophobicContact CB-CD1 3.76Å; H326-L400 HydrophobicContact CB-CD2 3.98Å; H326-L400 HydrophobicContact CB-CG 4.47Å; H326-L400 WeakPolarHBondContact O-CD2 3.28Å; I328-L400 HydrophobicContact CD1-CD2 4.08Å; I328-L400 HydrophobicContact CG1-CD2 3.87Å; Y396-L400 PolarHBondContact O-N 2.93Å; L400-K402 VanDerWaalsContact C-N 3.28Å; L400-K402 PolarHBondContact O-N 2.99Å; L400-L405 HydrophobicContact CD1-CD2 4.39Å
401	P	95.4	Very high	96.7	Very high	106 Å²	106	44.7 Å²	44.7	69%	0.688	24%	0.235	S	C	*	.	T	Hydrogen-bonded Turn	trans	-76.6	-8.4	179.1	30.3	-36.3	0	0	0	114.8	Q397 C399	Q397-P401 VanDerWaalsContact O-CD 3.24Å; Q397-P401 WeakPolarHBondContact O-CD 3.25Å; C399-P401 VanDerWaalsContact C-CD 3.46Å
402	K	96.3	Very high	96.7	Very high	113 Å²	113	44.1 Å²	44.1	49%	0.491	23%	0.228	S	C	.	.	T	Hydrogen-bonded Turn	trans	-101.4	-19.6	-174.2	-62.6	172.5	-174.8	167.8	0	113.5	F379 N398 C399 L400	F379-K402 HydrophobicContact CD2-CD 4.25Å; F379-K402 HydrophobicContact CE2-CB 4.24Å; F379-K402 HydrophobicContact CE2-CD 3.52Å; F379-K402 HydrophobicContact CZ-CB 3.82Å; F379-K402 HydrophobicContact CZ-CD 3.99Å; N398-K402 WeakPolarHBondContact O-CD 3.32Å; N398-K402 VanDerWaalsContact O-CE 3.25Å; N398-K402 WeakPolarHBondContact O-CE 3.32Å; C399-K402 WeakPolarHBondContact O-CB 3.35Å; C399-K402 PolarHBondContact O-N 3.06Å; L400-K402 VanDerWaalsContact C-N 3.28Å; L400-K402 PolarHBondContact O-N 2.99Å
403	I	97.3	Very high	96.7	Very high	20 Å²	20	46 Å²	46	10%	0.103	24%	0.24	C	C	.	.	S	Bend	trans	-99.5	167.2	-179.9	64.1	174.2	0	0	0	110.9	F312 A363 I365 F375 F379 C399 L405	F312-I403 HydrophobicContact CB-CD1 3.72Å; F312-I403 HydrophobicContact CD1-CD1 3.38Å; F312-I403 HydrophobicContact CD2-CD1 4.12Å; F312-I403 HydrophobicContact CE1-CD1 3.85Å; F312-I403 HydrophobicContact CG-CD1 3.49Å; F312-I403 VanDerWaalsContact CG-CD1 3.49Å; F312-I403 HydrophobicContact CZ-CD1 4.39Å; A363-I403 HydrophobicContact CB-CB 4.37Å; A363-I403 HydrophobicContact CB-CD1 3.9Å; I365-I403 HydrophobicContact CD1-CB 4.2Å; I365-I403 HydrophobicContact CD1-CG2 3.61Å; F375-I403 HydrophobicContact CE2-CG2 4.34Å; F375-I403 HydrophobicContact CZ-CD1 4.15Å; F375-I403 HydrophobicContact CZ-CG2 4.44Å; F379-I403 HydrophobicContact CE1-CG2 3.85Å; F379-I403 HydrophobicContact CZ-CG2 3.84Å; C399-I403 PolarHBondContact O-N 2.83Å; I403-L405 HydrophobicContact CD1-CD2 4.27Å
404	Q	97.8	Very high	96.7	Very high	104 Å²	104	45.4 Å²	45.4	49%	0.486	24%	0.237	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	119.4	167.3	174	-178.5	-18	0	0	109.6	A363 L364 F369 Y406	A363-Q404 WeakPolarHBondContact CA-O 3.42Å; L364-Q404 HydrophobicContact CB-CB 4.18Å; L364-Q404 HydrophobicContact CD1-CB 4.3Å; L364-Q404 HydrophobicContact CD1-CG 4.01Å; L364-Q404 PolarHBondContact N-O 2.82Å; L364-Q404 PolarHBondContact O-N 2.7Å; L364-Q404 VanDerWaalsContact O-N 3.1Å; F369-Q404 HydrophobicContact CD1-CB 4.48Å; Q404-Y406 PolarHBondContact O-N 2.77Å
405	L	97.4	Very high	96.8	Very high	25 Å²	25	40.6 Å²	40.6	13%	0.131	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-59.1	134.8	176.2	-51.5	-174.7	0	0	0	110.3	F312 A314 N316 G317 P319 L400 I403	F312-L405 HydrophobicContact CB-CD2 3.79Å; F312-L405 HydrophobicContact CD1-CD2 4.02Å; F312-L405 HydrophobicContact CG-CD2 4.42Å; F312-L405 WeakPolarHBondContact O-CA 2.84Å; F312-L405 WeakPolarHBondContact O-CB 3.38Å; F312-L405 WeakPolarHBondContact O-CD2 3.29Å; A314-L405 HydrophobicContact CB-CB 4.4Å; N316-L405 HydrophobicContact CB-CD1 4.38Å; G317-L405 VanDerWaalsContact O-CD1 3.26Å; G317-L405 WeakPolarHBondContact O-CD1 3.25Å; P319-L405 HydrophobicContact CG-CD1 3.87Å; P319-L405 HydrophobicContact CG-CG 4.32Å; L400-L405 HydrophobicContact CD1-CD2 4.39Å; I403-L405 HydrophobicContact CD1-CD2 4.27Å
406	Y	96.6	Very high	96.8	Very high	123 Å²	123	44.8 Å²	44.8	48%	0.482	23%	0.232	S	C	.	.	B	Isolated β-bridge	trans	-147.2	-129.8	-173.5	-167.3	-112.6	0	0	0	111.9	F312 T313 A314 G362 L364 V371 Q404	F312-Y406 PolarHBondContact O-N 3.18Å; T313-Y406 CarbonylContact C-O 3.58Å; T313-Y406 VanDerWaalsContact CA-O 3.3Å; T313-Y406 WeakPolarHBondContact CA-O 3.26Å; A314-Y406 WeakPolarHBondContact CB-O 3.4Å; A314-Y406 PolarHBondContact N-O 2.71Å; G362-Y406 CarbonylContact O-C 3.55Å; G362-Y406 WeakPolarHBondContact O-CA 3.25Å; G362-Y406 PolarHBondContact O-N 2.84Å; L364-Y406 HydrophobicContact CD1-CD2 3.95Å; L364-Y406 HydrophobicContact CD1-CG 3.94Å; L364-Y406 HydrophobicContact CD2-CD1 4.16Å; L364-Y406 HydrophobicContact CD2-CG 4.3Å; L364-Y406 HydrophobicContact CG-CD1 4.2Å; L364-Y406 HydrophobicContact CG-CD2 4.39Å; L364-Y406 HydrophobicContact CG-CG 3.87Å; V371-Y406 HydrophobicContact CB-CD1 4.48Å; V371-Y406 HydrophobicContact CG1-CD1 4.27Å; V371-Y406 HydrophobicContact CG2-CD1 3.42Å; V371-Y406 VanDerWaalsContact CG2-CD1 3.42Å; V371-Y406 HydrophobicContact CG2-CE1 3.53Å; Q404-Y406 PolarHBondContact O-N 2.77Å
407	G	94.2	Very high	96.7	Very high	15 Å²	15	47.6 Å²	47.6	16%	0.155	24%	0.244	C	C	.	.			trans	177.4	-179.7	179.9	0	0	0	0	0	111.3	G362	G362-G407 PolarHBondContact O-N 2.99Å
408	P	95.3	Very high	96.8	Very high	60 Å²	60	44.1 Å²	44.1	39%	0.39	23%	0.228	S	C	.	.			cis	-83.7	-176.6	2.3	40.2	-41.8	0	0	0	112.5	H373 N410 T446	H373-P408 PolarHBondContact CE1-O 3.41Å; P408-N410 PolarHBondContact O-N 2.94Å; P408-T446 HydrophobicContact CB-CG2 4.01Å; P408-T446 VanDerWaalsContact CB-OG1 3.31Å; P408-T446 WeakPolarHBondContact CB-OG1 3.2Å
409	T	94.5	Very high	96.9	Very high	13 Å²	13	39.7 Å²	39.7	8%	0.08	21%	0.205	C	C	.	.			trans	-86.4	79.5	178.6	-44.8	0	0	0	0	110.2	T313 F361 V444 T446	T313-T409 HydrophobicContact CG2-CG2 4.38Å; F361-T409 HydrophobicContact CE2-CG2 3.93Å; T409-V444 WeakPolarHBondContact CB-O 3.26Å; T409-T446 PolarHBondContact N-OG1 3.13Å; T409-T446 PolarHBondContact O-N 2.85Å; T409-T446 PolarHBondContact O-OG1 2.73Å
410	N	95.9	Very high	96.8	Very high	34 Å²	34	43.2 Å²	43.2	18%	0.182	23%	0.23	C	C	.	.			trans	-103.4	123.2	180	-70.2	-5.6	0	0	0	111	P408 T446 D447	P408-N410 PolarHBondContact O-N 2.94Å; N410-T446 PolarHBondContact OD1-OG1 3.24Å; N410-D447 VanDerWaalsContact CA-CG 3.47Å; N410-D447 WeakPolarHBondContact CA-OD1 3.3Å; N410-D447 WeakPolarHBondContact CA-OD2 3.47Å; N410-D447 HydrophobicContact CB-CB 4.19Å; N410-D447 VanDerWaalsContact CB-OD2 3.24Å; N410-D447 WeakPolarHBondContact CB-OD2 3.2Å; N410-D447 WeakPolarHBondContact OD1-CB 3.45Å; N410-D447 PolarHBondContact OD1-N 2.84Å
411	I	96.6	Very high	96.8	Very high	0 Å²	0	45.3 Å²	45.3	0%	0	25%	0.245	C	C	.	.			trans	-114.8	-10.6	-178.3	69.6	167.9	0	0	0	113.6	F361 P413 I414 I415 I439 I445 D447 T451 I467	F361-I411 HydrophobicContact CD2-CG2 4.29Å; F361-I411 HydrophobicContact CE1-CG2 4.48Å; F361-I411 HydrophobicContact CE2-CG2 3.67Å; F361-I411 HydrophobicContact CZ-CG2 3.76Å; I411-P413 VanDerWaalsContact C-CD 3.41Å; I411-P413 VanDerWaalsContact C-N 3.32Å; I411-I414 HydrophobicContact CB-CG2 4.36Å; I411-I414 WeakPolarHBondContact O-CG2 3.34Å; I411-I414 PolarHBondContact O-N 2.86Å; I411-I415 HydrophobicContact CD1-CD1 4.16Å; I411-I415 HydrophobicContact CG1-CD1 4.2Å; I411-I415 WeakPolarHBondContact O-CG1 3.41Å; I411-I415 PolarHBondContact O-N 2.86Å; I411-I439 HydrophobicContact CB-CD1 4.36Å; I411-I439 HydrophobicContact CD1-CD1 4.09Å; I411-I439 HydrophobicContact CG2-CG2 4.25Å; I411-I445 HydrophobicContact CD1-CD1 3.4Å; I411-I445 HydrophobicContact CD1-CG1 3.9Å; I411-I445 HydrophobicContact CG1-CD1 4.06Å; I411-I445 HydrophobicContact CG1-CG1 4.15Å; I411-I445 HydrophobicContact CG1-CG2 4.15Å; I411-D447 PolarHBondContact N-OD1 2.92Å; I411-D447 VanDerWaalsContact N-OD1 3.15Å; I411-D447 PolarHBondContact N-OD2 2.88Å; I411-T451 HydrophobicContact CD1-CG2 3.9Å; I411-T451 HydrophobicContact CG1-CG2 3.87Å; I411-T451 WeakPolarHBondContact CG1-OG1 3.47Å; I411-I467 HydrophobicContact CD1-CD1 4.24Å
412	A	97.7	Very high	96.9	Very high	3 Å²	3	40.3 Å²	40.3	3%	0.025	21%	0.212	C	C	.	.	H	α-helix	trans	-56.8	-39.9	175.6	0	0	0	0	0	113.1	I414 I415 Q416 D447 D450 T451 A454	A412-I414 PolarHBondContact O-N 2.95Å; A412-I415 PolarHBondContact O-N 3.06Å; A412-Q416 WeakPolarHBondContact O-CB 3.34Å; A412-Q416 VanDerWaalsContact O-CG 3.3Å; A412-Q416 WeakPolarHBondContact O-CG 3.39Å; A412-Q416 PolarHBondContact O-N 2.89Å; A412-D447 WeakPolarHBondContact CB-OD2 3.26Å; A412-D447 PolarHBondContact N-OD2 3.11Å; A412-D450 HydrophobicContact CB-CB 3.75Å; A412-T451 PolarHBondContact N-OG1 3.16Å; A412-A454 HydrophobicContact CB-CB 4.42Å
413	P	98.1	Very high	96.9	Very high	39 Å²	39	36.3 Å²	36.3	25%	0.253	20%	0.199	S	C	.	.	H	α-helix	trans	-59.9	-43	179.7	-26.9	37.4	0	0	0	113.4	H373 I411 Q416 K417	H373-P413 HydrophobicContact CB-CB 4.06Å; H373-P413 HydrophobicContact CB-CG 3.83Å; I411-P413 VanDerWaalsContact C-CD 3.41Å; I411-P413 VanDerWaalsContact C-N 3.32Å; P413-Q416 PolarHBondContact O-N 2.75Å; P413-K417 PolarHBondContact O-N 3.33Å
414	I	98	Very high	96.8	Very high	1 Å²	1	42.3 Å²	42.3	1%	0.005	23%	0.227	C	C	.	.	H	α-helix	trans	-73.2	-35	-178.3	-170	55.7	0	0	0	112.2	A309 F359 D374 I411 A412 K417 V418 L437 I439	A309-I414 HydrophobicContact CB-CG1 3.63Å; A309-I414 HydrophobicContact CB-CG2 4.24Å; F359-I414 HydrophobicContact CB-CD1 3.63Å; F359-I414 HydrophobicContact CB-CG1 4.46Å; F359-I414 HydrophobicContact CD2-CD1 3.61Å; F359-I414 HydrophobicContact CE2-CD1 4.38Å; F359-I414 HydrophobicContact CG-CD1 3.66Å; D374-I414 HydrophobicContact CB-CD1 4.35Å; I411-I414 HydrophobicContact CB-CG2 4.36Å; I411-I414 WeakPolarHBondContact O-CG2 3.34Å; I411-I414 PolarHBondContact O-N 2.86Å; A412-I414 PolarHBondContact O-N 2.95Å; I414-K417 HydrophobicContact CD1-CB 4.39Å; I414-K417 HydrophobicContact CD1-CD 4.23Å; I414-K417 PolarHBondContact O-N 2.82Å; I414-V418 PolarHBondContact O-N 3.36Å; I414-L437 HydrophobicContact CG1-CD1 4.13Å; I414-L437 HydrophobicContact CG1-CD2 4.42Å; I414-I439 HydrophobicContact CG2-CD1 4.37Å
415	I	98.5	Very high	96.5	Very high	0 Å²	0	38 Å²	38	0%	0	21%	0.206	C	C	.	.	H	α-helix	trans	-61.4	-46.1	171.5	-63.8	169.7	0	0	0	110	I411 A412 K417 V418 A419 L437 I439 T451 A454 I455 A458 V465	I411-I415 HydrophobicContact CD1-CD1 4.16Å; I411-I415 HydrophobicContact CG1-CD1 4.2Å; I411-I415 WeakPolarHBondContact O-CG1 3.41Å; I411-I415 PolarHBondContact O-N 2.86Å; A412-I415 PolarHBondContact O-N 3.06Å; I415-K417 PolarHBondContact O-N 2.85Å; I415-V418 PolarHBondContact O-N 2.79Å; I415-A419 WeakPolarHBondContact O-CB 3.38Å; I415-A419 PolarHBondContact O-N 3.08Å; I415-L437 HydrophobicContact CB-CD2 4.44Å; I415-L437 HydrophobicContact CG1-CD2 3.96Å; I415-I439 HydrophobicContact CD1-CD1 4.34Å; I415-I439 HydrophobicContact CG1-CD1 4.03Å; I415-T451 HydrophobicContact CD1-CG2 4.15Å; I415-A454 HydrophobicContact CB-CB 4.12Å; I415-A454 HydrophobicContact CG2-CB 3.78Å; I415-I455 HydrophobicContact CD1-CD1 4.46Å; I415-I455 HydrophobicContact CD1-CG1 4.09Å; I415-A458 HydrophobicContact CG2-CB 4.39Å; I415-V465 HydrophobicContact CG2-CG2 4.47Å
416	Q	98.4	Very high	96.2	Very high	100 Å²	100	39.6 Å²	39.6	47%	0.467	21%	0.214	S	C	.	.	H	α-helix	trans	-64.7	-37	178.7	-72.5	174.9	1	0	0	113	A412 P413 A419 S420 A454	A412-Q416 WeakPolarHBondContact O-CB 3.34Å; A412-Q416 VanDerWaalsContact O-CG 3.3Å; A412-Q416 WeakPolarHBondContact O-CG 3.39Å; A412-Q416 PolarHBondContact O-N 2.89Å; P413-Q416 PolarHBondContact O-N 2.75Å; Q416-A419 PolarHBondContact O-N 2.95Å; Q416-S420 PolarHBondContact O-N 2.84Å; Q416-S420 PolarHBondContact O-OG 2.85Å; Q416-A454 HydrophobicContact CG-CB 3.99Å
417	K	97.4	Very high	95.9	Very high	60 Å²	60	40.1 Å²	40.1	26%	0.261	22%	0.22	S	C	.	.	H	α-helix	trans	-59	-53.5	175.8	176.8	172.3	-76.6	-175.9	0	110.9	F359 D374 P413 I414 I415 S420	F359-K417 HydrophobicContact CD1-CD 4.26Å; F359-K417 HydrophobicContact CE1-CD 3.78Å; F359-K417 HydrophobicContact CE2-CD 4.15Å; F359-K417 HydrophobicContact CZ-CD 3.7Å; D374-K417 HydrophobicContact CB-CD 4.47Å; D374-K417 PolarHBondContact O-NZ 2.89Å; D374-K417 WeakPolarHBondContact OD2-CE 3.36Å; D374-K417 IonicContact OD2-NZ 3.06Å; D374-K417 PolarHBondContact OD2-NZ 2.97Å; P413-K417 PolarHBondContact O-N 3.33Å; I414-K417 HydrophobicContact CD1-CB 4.39Å; I414-K417 HydrophobicContact CD1-CD 4.23Å; I414-K417 PolarHBondContact O-N 2.82Å; I415-K417 PolarHBondContact O-N 2.85Å; K417-S420 WeakPolarHBondContact O-CB 3.37Å; K417-S420 PolarHBondContact O-N 3.26Å
418	V	98.1	Very high	95.7	Very high	5 Å²	5	42.6 Å²	42.6	3%	0.03	23%	0.232	C	C	.	.	H	α-helix	trans	-70.5	-34.9	-179.5	-175.8	0	0	0	0	111.8	T307 I414 I415 S420 S421 A422 F435 L437 M463	T307-V418 HydrophobicContact CG2-CG2 3.75Å; I414-V418 PolarHBondContact O-N 3.36Å; I415-V418 PolarHBondContact O-N 2.79Å; V418-S420 PolarHBondContact O-N 3.45Å; V418-S421 PolarHBondContact O-N 2.98Å; V418-S421 VanDerWaalsContact O-N 3.17Å; V418-A422 PolarHBondContact O-N 3.04Å; V418-F435 HydrophobicContact CG1-CB 4.03Å; V418-F435 HydrophobicContact CG1-CD1 4.21Å; V418-F435 HydrophobicContact CG1-CG 4.47Å; V418-L437 HydrophobicContact CB-CD2 4.49Å; V418-L437 HydrophobicContact CG2-CB 4.46Å; V418-L437 HydrophobicContact CG2-CD1 4.13Å; V418-L437 HydrophobicContact CG2-CD2 4.21Å; V418-L437 HydrophobicContact CG2-CG 4.5Å; V418-M463 HydrophobicContact CB-CE 3.48Å; V418-M463 VanDerWaalsContact CB-CE 3.48Å; V418-M463 HydrophobicContact CB-SD 4.22Å; V418-M463 HydrophobicContact CG1-CE 3.41Å; V418-M463 VanDerWaalsContact CG1-CE 3.41Å; V418-M463 HydrophobicContact CG1-SD 3.98Å; V418-M463 HydrophobicContact CG2-CE 4.47Å
419	A	98.2	Very high	95.4	Very high	2 Å²	2	47.7 Å²	47.7	2%	0.017	25%	0.248	C	C	.	.	H	α-helix	trans	-59.6	-31.8	172.6	0	0	0	0	0	112.3	I415 Q416 A422 S423 A458 L461 M463	I415-A419 WeakPolarHBondContact O-CB 3.38Å; I415-A419 PolarHBondContact O-N 3.08Å; Q416-A419 PolarHBondContact O-N 2.95Å; A419-A422 PolarHBondContact O-N 3.44Å; A419-S423 WeakPolarHBondContact O-CB 3.49Å; A419-S423 PolarHBondContact O-N 3.36Å; A419-A458 HydrophobicContact CB-CB 4.43Å; A419-L461 HydrophobicContact CB-CD1 3.76Å; A419-L461 WeakPolarHBondContact O-CD1 3.33Å; A419-M463 HydrophobicContact CB-SD 4.21Å
420	S	96.6	Very high	95.2	Very high	74 Å²	74	51.1 Å²	51.1	52%	0.517	26%	0.264	S	S	.	.	H	α-helix	trans	-64.4	-45.1	176.2	-59	0	0	0	0	111.1	Q416 K417 V418 S423 E424	Q416-S420 PolarHBondContact O-N 2.84Å; Q416-S420 PolarHBondContact O-OG 2.85Å; K417-S420 WeakPolarHBondContact O-CB 3.37Å; K417-S420 PolarHBondContact O-N 3.26Å; V418-S420 PolarHBondContact O-N 3.45Å; S420-S423 WeakPolarHBondContact O-CB 3.14Å; S420-S423 PolarHBondContact O-N 2.88Å; S420-E424 PolarHBondContact O-N 3.14Å
421	S	94.8	Very high	95.1	Very high	55 Å²	55	49.6 Å²	49.6	39%	0.385	26%	0.256	S	S	.	.	H	α-helix	trans	-63.2	-46.6	173.7	-56	0	0	0	0	112.1	V418 S423 E424 E425	V418-S421 PolarHBondContact O-N 2.98Å; V418-S421 VanDerWaalsContact O-N 3.17Å; S421-S423 PolarHBondContact O-N 2.91Å; S421-E424 WeakPolarHBondContact O-CB 3.39Å; S421-E424 PolarHBondContact O-N 3.15Å; S421-E425 PolarHBondContact O-N 2.87Å
422	A	97.2	Very high	94.9	Very high	0 Å²	0	52.4 Å²	52.4	0%	0	27%	0.27	C	S	.	.	H	α-helix	trans	-61	-31.4	176.8	0	0	0	0	0	112.6	V418 A419 E424 E425 M426 F435 L461 P462 M463	V418-A422 PolarHBondContact O-N 3.04Å; A419-A422 PolarHBondContact O-N 3.44Å; A422-E424 VanDerWaalsContact C-N 3.3Å; A422-E424 PolarHBondContact O-N 3.43Å; A422-E425 PolarHBondContact O-N 3.38Å; A422-M426 PolarHBondContact O-N 3.05Å; A422-M426 VanDerWaalsContact O-N 3.11Å; A422-F435 HydrophobicContact CB-CB 4.3Å; A422-F435 HydrophobicContact CB-CD2 3.6Å; A422-F435 HydrophobicContact CB-CE2 4.15Å; A422-F435 HydrophobicContact CB-CG 3.97Å; A422-L461 HydrophobicContact CB-CB 4.09Å; A422-L461 HydrophobicContact CB-CD1 4.45Å; A422-P462 HydrophobicContact CB-CG 4.23Å; A422-P462 VanDerWaalsContact O-CD 3.23Å; A422-P462 WeakPolarHBondContact O-CD 3.1Å; A422-P462 WeakPolarHBondContact O-CG 3.4Å; A422-M463 HydrophobicContact CB-CB 4.04Å
423	S	96.6	Very high	94.8	Very high	30 Å²	30	55.6 Å²	55.6	21%	0.21	28%	0.284	C	S	.	.	H	α-helix	trans	-66.4	-30.4	174.3	-174.1	0	0	0	0	112.6	A419 S420 S421 H427	A419-S423 WeakPolarHBondContact O-CB 3.49Å; A419-S423 PolarHBondContact O-N 3.36Å; S420-S423 WeakPolarHBondContact O-CB 3.14Å; S420-S423 PolarHBondContact O-N 2.88Å; S421-S423 PolarHBondContact O-N 2.91Å; S423-H427 PolarHBondContact O-CE1 3.06Å; S423-H427 VanDerWaalsContact O-CE1 3.3Å; S423-H427 PolarHBondContact O-ND1 3.28Å
424	E	94.3	Very high	94.7	Very high	146 Å²	146	53.7 Å²	53.7	68%	0.682	27%	0.272	S	S	*	.	H	α-helix	trans	-66.4	-45.5	175.6	-63.7	-175.7	178.6	0	0	110.6	S420 S421 A422 M426 H427	S420-E424 PolarHBondContact O-N 3.14Å; S421-E424 WeakPolarHBondContact O-CB 3.39Å; S421-E424 PolarHBondContact O-N 3.15Å; A422-E424 VanDerWaalsContact C-N 3.3Å; A422-E424 PolarHBondContact O-N 3.43Å; E424-M426 VanDerWaalsContact C-N 3.32Å; E424-M426 PolarHBondContact O-N 2.85Å; E424-H427 WeakPolarHBondContact O-CB 3.33Å; E424-H427 PolarHBondContact O-N 3.01Å
425	E	92.6	Very high	94.7	Very high	13 Å²	13	54.3 Å²	54.3	6%	0.061	28%	0.275	C	S	.	.	H	α-helix	trans	-61.5	-38.1	176.4	172.1	59.8	173	0	0	112.4	S421 A422 H427 T428 M432 E433 F435 P462	S421-E425 PolarHBondContact O-N 2.87Å; A422-E425 PolarHBondContact O-N 3.38Å; E425-H427 PolarHBondContact O-N 3.19Å; E425-T428 WeakPolarHBondContact O-CB 3.33Å; E425-T428 PolarHBondContact O-N 3.42Å; E425-T428 PolarHBondContact O-OG1 2.95Å; E425-T428 VanDerWaalsContact OE2-CG2 3.26Å; E425-T428 WeakPolarHBondContact OE2-CG2 3.43Å; E425-T428 PolarHBondContact OE2-OG1 3.16Å; E425-M432 WeakPolarHBondContact OE1-CA 3.48Å; E425-M432 WeakPolarHBondContact OE1-CB 3.33Å; E425-M432 PolarHBondContact OE1-N 3.22Å; E425-E433 HydrophobicContact CG-CB 4.13Å; E425-E433 WeakPolarHBondContact CG-O 3.42Å; E425-E433 PolarHBondContact OE1-N 2.94Å; E425-F435 HydrophobicContact CB-CE2 3.96Å; E425-F435 HydrophobicContact CG-CE2 4.5Å; E425-P462 HydrophobicContact CB-CG 4.16Å; E425-P462 HydrophobicContact CG-CG 3.95Å
426	M	91.8	Very high	94.7	Very high	58 Å²	58	54.3 Å²	54.3	29%	0.286	28%	0.275	S	S	.	.	H	α-helix	trans	-53.9	-31.3	175.2	-175.6	-174.8	62.8	0	0	113	A422 E424 L461	A422-M426 PolarHBondContact O-N 3.05Å; A422-M426 VanDerWaalsContact O-N 3.11Å; E424-M426 VanDerWaalsContact C-N 3.32Å; E424-M426 PolarHBondContact O-N 2.85Å; M426-L461 HydrophobicContact CE-CD2 4.02Å; M426-L461 HydrophobicContact SD-CD2 3.77Å
427	H	89.9	Confident	94.7	Very high	135 Å²	135	49.6 Å²	49.6	63%	0.625	25%	0.252	S	S	*	.	H	α-helix	trans	-77.3	-20.9	-179.6	-66.4	94.7	0	0	0	113.7	S423 E424 E425 K429	S423-H427 PolarHBondContact O-CE1 3.06Å; S423-H427 VanDerWaalsContact O-CE1 3.3Å; S423-H427 PolarHBondContact O-ND1 3.28Å; E424-H427 WeakPolarHBondContact O-CB 3.33Å; E424-H427 PolarHBondContact O-N 3.01Å; E425-H427 PolarHBondContact O-N 3.19Å; H427-K429 PolarHBondContact O-N 3.04Å
428	T	90.3	Very high	94.8	Very high	66 Å²	66	46.7 Å²	46.7	41%	0.405	24%	0.24	S	C	.	.	H	α-helix	trans	-67.6	-29.7	177.1	73.3	0	0	0	0	110.9	E425 E430	E425-T428 WeakPolarHBondContact O-CB 3.33Å; E425-T428 PolarHBondContact O-N 3.42Å; E425-T428 PolarHBondContact O-OG1 2.95Å; E425-T428 VanDerWaalsContact OE2-CG2 3.26Å; E425-T428 WeakPolarHBondContact OE2-CG2 3.43Å; E425-T428 PolarHBondContact OE2-OG1 3.16Å; T428-E430 PolarHBondContact O-N 3.19Å; T428-E430 PolarHBondContact OG1-N 3.04Å
429	K	88.1	Confident	94.8	Very high	167 Å²	167	46.5 Å²	46.5	73%	0.726	24%	0.238	S	C	*	.			trans	58.3	22.5	-172.1	-54.6	-179.6	-180	178.2	0	112.8	H427	H427-K429 PolarHBondContact O-N 3.04Å
430	E	91.3	Very high	94.8	Very high	85 Å²	85	46.4 Å²	46.4	40%	0.397	24%	0.238	S	C	.	.	S	Bend	trans	-110	165.6	172.7	-59.7	-170.1	133.7	0	0	108.4	T428 M432 K541	T428-E430 PolarHBondContact O-N 3.19Å; T428-E430 PolarHBondContact OG1-N 3.04Å; E430-M432 HydrophobicContact CB-CG 3.73Å; E430-M432 HydrophobicContact CB-SD 4.45Å; E430-K541 WeakPolarHBondContact OE1-CE 3.47Å; E430-K541 IonicContact OE1-NZ 2.67Å; E430-K541 PolarHBondContact OE1-NZ 2.86Å; E430-K541 VanDerWaalsContact OE2-CE 3.29Å; E430-K541 WeakPolarHBondContact OE2-CE 3.43Å; E430-K541 IonicContact OE2-NZ 3.33Å; E430-K541 PolarHBondContact OE2-NZ 3.36Å
431	A	93.1	Very high	94.7	Very high	2 Å²	2	42.9 Å²	42.9	2%	0.017	21%	0.213	C	C	.	.			trans	-105.5	71.2	172.9	0	0	0	0	0	108.2	Y297 C302 Y533 I538	Y297-A431 HydrophobicContact CD1-CB 3.6Å; Y297-A431 HydrophobicContact CE1-CB 3.9Å; C302-A431 WeakPolarHBondContact CA-O 3.38Å; C302-A431 VanDerWaalsContact CB-O 3.3Å; C302-A431 WeakPolarHBondContact CB-O 3.24Å; A431-Y533 HydrophobicContact CB-CD1 3.81Å; A431-Y533 HydrophobicContact CB-CD2 4.3Å; A431-Y533 HydrophobicContact CB-CE1 3.51Å; A431-Y533 HydrophobicContact CB-CE2 4.03Å; A431-Y533 HydrophobicContact CB-CG 4.2Å; A431-I538 HydrophobicContact CB-CG2 3.94Å
432	M	92.6	Very high	94.6	Very high	60 Å²	60	40.9 Å²	40.9	30%	0.296	20%	0.198	S	C	.	.	S	Bend	trans	-98	-39	-177.7	-59.4	-61.5	-99.4	0	0	111.2	C302 Q303 E425 E430 K541	C302-M432 CarbonylContact C-O 3.59Å; C302-M432 WeakPolarHBondContact CA-O 3.13Å; Q303-M432 PolarHBondContact N-O 3.08Å; E425-M432 WeakPolarHBondContact OE1-CA 3.48Å; E425-M432 WeakPolarHBondContact OE1-CB 3.33Å; E425-M432 PolarHBondContact OE1-N 3.22Å; E430-M432 HydrophobicContact CB-CG 3.73Å; E430-M432 HydrophobicContact CB-SD 4.45Å; M432-K541 HydrophobicContact CE-CD 4.2Å; M432-K541 HydrophobicContact SD-CD 3.51Å; M432-K541 VanDerWaalsContact SD-CD 3.51Å; M432-K541 WeakPolarHBondContact SD-CE 3.34Å; M432-K541 HydrophobicContact SD-CG 4.48Å; M432-K541 PolarHBondContact SD-NZ 2.97Å
433	E	94.8	Very high	93.6	Very high	69 Å²	69	41.1 Å²	41.1	32%	0.322	20%	0.201	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.1	135.7	-174.2	-65.1	-180	165.1	0	0	111	Q303 Q305 E425 F435 Y533	Q303-E433 CarbonylContact O-C 3.55Å; Q303-E433 WeakPolarHBondContact O-CA 3.13Å; Q305-E433 HydrophobicContact CG-CB 4.05Å; Q305-E433 HydrophobicContact CG-CG 4.13Å; E425-E433 HydrophobicContact CG-CB 4.13Å; E425-E433 WeakPolarHBondContact CG-O 3.42Å; E425-E433 PolarHBondContact OE1-N 2.94Å; E433-F435 HydrophobicContact CB-CE2 3.88Å; E433-F435 HydrophobicContact CB-CZ 4.15Å; E433-Y533 PolarHBondContact O-OH 3.38Å
434	Y	97.4	Very high	92.7	Very high	0 Å²	0	43.3 Å²	43.3	0%	0	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	129.9	169.5	-167.3	-81.7	0	0	0	109.1	Q303 I304 Q305 I436 P462 M463 S464 R498 Q528 V529 Y532 Y533	Q303-Y434 PolarHBondContact O-N 3.43Å; I304-Y434 CarbonylContact C-O 3.41Å; I304-Y434 WeakPolarHBondContact CA-O 3.39Å; Q305-Y434 PolarHBondContact N-O 3.12Å; Y434-I436 HydrophobicContact CD1-CG1 4.44Å; Y434-P462 HydrophobicContact CD2-CB 3.88Å; Y434-P462 HydrophobicContact CE2-CB 4.31Å; Y434-M463 PolarHBondContact OH-O 3.12Å; Y434-S464 WeakPolarHBondContact CE1-OG 3.17Å; Y434-S464 PolarHBondContact OH-OG 2.53Å; Y434-R498 PolarHBondContact OH-NH1 2.74Å; Y434-R498 VanDerWaalsContact OH-NH1 3.1Å; Y434-Q528 VanDerWaalsContact OH-C 3.31Å; Y434-Q528 PolarHBondContact OH-O 2.99Å; Y434-V529 HydrophobicContact CD1-CG2 3.63Å; Y434-V529 HydrophobicContact CD2-CB 4.37Å; Y434-V529 HydrophobicContact CD2-CG1 4.32Å; Y434-V529 HydrophobicContact CD2-CG2 3.89Å; Y434-V529 HydrophobicContact CE1-CG2 3.64Å; Y434-V529 HydrophobicContact CE2-CB 4.24Å; Y434-V529 HydrophobicContact CE2-CG2 3.88Å; Y434-V529 HydrophobicContact CG-CG2 3.74Å; Y434-Y532 HydrophobicContact CE2-CD1 4.34Å; Y434-Y532 HydrophobicContact CE2-CG 4.35Å; Y434-Y533 AromaticContact CD2-CE2 3.81Å; Y434-Y533 HydrophobicContact CD2-CE2 3.81Å
435	F	98	Very high	92.4	Very high	14 Å²	14	36.6 Å²	36.6	6%	0.061	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.3	130.8	-168.8	-65	-98.6	0	0	0	110.9	Q305 V418 A422 E425 E433 P462 M463 S464	Q305-F435 HydrophobicContact CB-CD1 3.62Å; Q305-F435 HydrophobicContact CB-CE1 3.8Å; Q305-F435 HydrophobicContact CB-CG 4.13Å; Q305-F435 HydrophobicContact CB-CZ 4.44Å; Q305-F435 HydrophobicContact CG-CD1 4.28Å; Q305-F435 HydrophobicContact CG-CE1 3.97Å; Q305-F435 HydrophobicContact CG-CZ 4.23Å; Q305-F435 WeakPolarHBondContact O-CA 3.35Å; V418-F435 HydrophobicContact CG1-CB 4.03Å; V418-F435 HydrophobicContact CG1-CD1 4.21Å; V418-F435 HydrophobicContact CG1-CG 4.47Å; A422-F435 HydrophobicContact CB-CB 4.3Å; A422-F435 HydrophobicContact CB-CD2 3.6Å; A422-F435 HydrophobicContact CB-CE2 4.15Å; A422-F435 HydrophobicContact CB-CG 3.97Å; E425-F435 HydrophobicContact CB-CE2 3.96Å; E425-F435 HydrophobicContact CG-CE2 4.5Å; E433-F435 HydrophobicContact CB-CE2 3.88Å; E433-F435 HydrophobicContact CB-CZ 4.15Å; F435-P462 PolarHBondContact N-O 3.46Å; F435-M463 HydrophobicContact CB-CB 4.25Å; F435-M463 HydrophobicContact CB-CG 4.16Å; F435-M463 CarbonylContact O-C 3.58Å; F435-M463 WeakPolarHBondContact O-CA 3.49Å; F435-S464 PolarHBondContact O-N 2.98Å
436	I	97.7	Very high	92.4	Very high	0 Å²	0	39.8 Å²	39.8	0%	0	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	119.8	171.6	-61.1	-178.7	0	0	0	107.9	I304 Q305 F306 T307 Y434 I466 V525	I304-I436 HydrophobicContact CG2-CB 4.5Å; I304-I436 HydrophobicContact CG2-CD1 3.3Å; I304-I436 HydrophobicContact CG2-CG1 3.79Å; Q305-I436 PolarHBondContact O-N 3.18Å; F306-I436 HydrophobicContact CD2-CB 4.18Å; F306-I436 HydrophobicContact CD2-CG2 3.98Å; F306-I436 HydrophobicContact CE2-CG2 4.22Å; T307-I436 PolarHBondContact N-O 3.3Å; Y434-I436 HydrophobicContact CD1-CG1 4.44Å; I436-I466 HydrophobicContact CG2-CD1 3.59Å; I436-I466 HydrophobicContact CG2-CG1 4.19Å; I436-V525 HydrophobicContact CD1-CG1 3.54Å; I436-V525 HydrophobicContact CD1-CG2 4.2Å; I436-V525 HydrophobicContact CG1-CG1 4.43Å
437	L	98.5	Very high	92.5	Very high	0 Å²	0	37.6 Å²	37.6	0%	0	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.6	110.8	171.5	171.1	58	0	0	0	109.7	T307 A309 I414 I415 V418 I439 M463 S464 I466	T307-L437 HydrophobicContact CG2-CD1 3.97Å; T307-L437 WeakPolarHBondContact O-CA 3.34Å; A309-L437 HydrophobicContact CB-CD1 3.85Å; I414-L437 HydrophobicContact CG1-CD1 4.13Å; I414-L437 HydrophobicContact CG1-CD2 4.42Å; I415-L437 HydrophobicContact CB-CD2 4.44Å; I415-L437 HydrophobicContact CG1-CD2 3.96Å; V418-L437 HydrophobicContact CB-CD2 4.49Å; V418-L437 HydrophobicContact CG2-CB 4.46Å; V418-L437 HydrophobicContact CG2-CD1 4.13Å; V418-L437 HydrophobicContact CG2-CD2 4.21Å; V418-L437 HydrophobicContact CG2-CG 4.5Å; L437-I439 HydrophobicContact CD1-CG1 4.2Å; L437-I439 HydrophobicContact CD2-CD1 4.02Å; L437-I439 HydrophobicContact CD2-CG1 4.13Å; L437-I439 HydrophobicContact CG-CD1 4.25Å; L437-I439 HydrophobicContact CG-CG1 3.81Å; L437-M463 HydrophobicContact CB-CE 3.49Å; L437-M463 VanDerWaalsContact CB-CE 3.49Å; L437-M463 HydrophobicContact CD2-CE 3.81Å; L437-M463 HydrophobicContact CG-CE 4.3Å; L437-S464 PolarHBondContact N-O 3.39Å; L437-I466 PolarHBondContact O-N 2.82Å
438	L	98.4	Very high	92.7	Very high	0 Å²	0	32.8 Å²	32.8	0%	0	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.9	115.6	169.7	175.2	66.1	0	0	0	110.3	F306 T307 V308 A309 V343 L440 I466 V468	F306-L438 HydrophobicContact CE2-CB 3.74Å; F306-L438 HydrophobicContact CE2-CD2 4.31Å; F306-L438 HydrophobicContact CZ-CB 3.87Å; F306-L438 HydrophobicContact CZ-CD2 3.7Å; F306-L438 HydrophobicContact CZ-CG 4.44Å; T307-L438 PolarHBondContact O-N 3.49Å; V308-L438 CarbonylContact C-O 3.38Å; A309-L438 PolarHBondContact N-O 3.38Å; V343-L438 HydrophobicContact CB-CD2 4.06Å; V343-L438 HydrophobicContact CG1-CD2 4.16Å; V343-L438 HydrophobicContact CG2-CD2 4.3Å; L438-L440 HydrophobicContact CD1-CD2 3.93Å; L438-L440 HydrophobicContact CD2-CD2 4.09Å; L438-L440 HydrophobicContact CG-CD2 3.94Å; L438-L440 HydrophobicContact CG-CG 4.36Å; L438-I466 CarbonylContact C-O 3.56Å; L438-I466 WeakPolarHBondContact CA-O 3.12Å; L438-I466 HydrophobicContact CD1-CB 4.16Å; L438-I466 HydrophobicContact CD1-CG2 3.66Å; L438-V468 HydrophobicContact CD1-CG2 3.79Å
439	I	98.4	Very high	92.9	Very high	0 Å²	0	32 Å²	32	0%	0	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.5	122.8	174.9	-52.4	-177.3	0	0	0	108.9	A309 F361 I411 I414 I415 L437 V465 I466 I467 V468	A309-I439 HydrophobicContact CB-CG1 4.23Å; A309-I439 WeakPolarHBondContact O-CA 3.47Å; F361-I439 HydrophobicContact CE1-CG2 3.91Å; F361-I439 HydrophobicContact CZ-CG2 3.91Å; I411-I439 HydrophobicContact CB-CD1 4.36Å; I411-I439 HydrophobicContact CD1-CD1 4.09Å; I411-I439 HydrophobicContact CG2-CG2 4.25Å; I414-I439 HydrophobicContact CG2-CD1 4.37Å; I415-I439 HydrophobicContact CD1-CD1 4.34Å; I415-I439 HydrophobicContact CG1-CD1 4.03Å; L437-I439 HydrophobicContact CD1-CG1 4.2Å; L437-I439 HydrophobicContact CD2-CD1 4.02Å; L437-I439 HydrophobicContact CD2-CG1 4.13Å; L437-I439 HydrophobicContact CG-CD1 4.25Å; L437-I439 HydrophobicContact CG-CG1 3.81Å; I439-V465 HydrophobicContact CD1-CG1 3.86Å; I439-V465 HydrophobicContact CG1-CG1 4.41Å; I439-I466 PolarHBondContact N-O 3.49Å; I439-I467 HydrophobicContact CB-CG1 4.33Å; I439-I467 HydrophobicContact CD1-CG1 4.46Å; I439-I467 CarbonylContact O-C 3.57Å; I439-I467 WeakPolarHBondContact O-CA 3.39Å; I439-V468 PolarHBondContact O-N 2.79Å
440	L	98.1	Very high	93.3	Very high	0 Å²	0	28.2 Å²	28.2	0%	0	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	120.5	172.8	-55	-176.4	0	0	0	108.8	A309 D311 Y336 A339 L340 L438 V468	A309-L440 PolarHBondContact O-N 3.36Å; D311-L440 WeakPolarHBondContact CB-O 3.03Å; D311-L440 PolarHBondContact N-O 2.87Å; Y336-L440 HydrophobicContact CD1-CB 3.57Å; Y336-L440 HydrophobicContact CD1-CD1 3.88Å; Y336-L440 HydrophobicContact CD1-CG 4.39Å; Y336-L440 HydrophobicContact CE1-CB 3.65Å; A339-L440 HydrophobicContact CB-CD1 4.29Å; A339-L440 HydrophobicContact CB-CD2 3.78Å; L340-L440 HydrophobicContact CD1-CD1 4.45Å; L340-L440 HydrophobicContact CD2-CD1 3.56Å; L340-L440 HydrophobicContact CG-CD1 3.59Å; L438-L440 HydrophobicContact CD1-CD2 3.93Å; L438-L440 HydrophobicContact CD2-CD2 4.09Å; L438-L440 HydrophobicContact CG-CD2 3.94Å; L438-L440 HydrophobicContact CG-CG 4.36Å; L440-V468 HydrophobicContact CD2-CB 3.63Å; L440-V468 HydrophobicContact CD2-CG1 4.31Å; L440-V468 HydrophobicContact CD2-CG2 4.11Å
441	T	96	Very high	93.6	Very high	0 Å²	0	24.2 Å²	24.2	0%	0	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.7	148.3	-175.5	178.5	0	0	0	0	112.6	D311 G443 I467 V468 G469 V470 M478	D311-T441 WeakPolarHBondContact OD2-CA 3.26Å; D311-T441 WeakPolarHBondContact OD2-CB 3.37Å; D311-T441 PolarHBondContact OD2-OG1 3.45Å; T441-G443 PolarHBondContact OG1-N 2.86Å; T441-I467 HydrophobicContact CG2-CG2 3.95Å; T441-V468 PolarHBondContact N-O 3.35Å; T441-G469 CarbonylContact O-C 3.56Å; T441-G469 WeakPolarHBondContact O-CA 3.45Å; T441-V470 VanDerWaalsContact O-CG2 3.31Å; T441-V470 WeakPolarHBondContact O-CG2 3.37Å; T441-V470 PolarHBondContact O-N 2.96Å; T441-M478 HydrophobicContact CG2-CE 3.53Å
442	D	91.4	Very high	93.7	Very high	13 Å²	13	27.7 Å²	27.7	7%	0.07	15%	0.151	C	C	.	.	S	Bend	trans	-93.3	2.7	178.2	81.6	-41.3	0	0	0	114.7	D311 T313 S315 N316 L325 V470 A473	D311-D442 PolarHBondContact OD2-N 2.72Å; T313-D442 PolarHBondContact OG1-OD1 2.81Å; S315-D442 WeakPolarHBondContact CB-OD2 3.38Å; S315-D442 PolarHBondContact OG-OD1 2.78Å; S315-D442 PolarHBondContact OG-OD2 2.88Å; S315-D442 VanDerWaalsContact OG-OD2 3.14Å; N316-D442 WeakPolarHBondContact CA-OD2 3.45Å; N316-D442 VanDerWaalsContact CG-CG 3.43Å; N316-D442 PolarHBondContact N-OD2 2.96Å; N316-D442 PolarHBondContact ND2-OD1 3.01Å; N316-D442 VanDerWaalsContact OD1-CB 3.32Å; N316-D442 WeakPolarHBondContact OD1-CB 3.4Å; L325-D442 HydrophobicContact CD1-CB 3.4Å; L325-D442 VanDerWaalsContact CD1-CB 3.4Å; D442-V470 WeakPolarHBondContact CA-O 2.95Å; D442-V470 HydrophobicContact CB-CG2 3.86Å; D442-A473 WeakPolarHBondContact O-CB 3.22Å
443	G	76.1	Confident	94	Very high	6 Å²	6	28.2 Å²	28.2	6%	0.062	15%	0.153	C	C	.	.	S	Bend	trans	138.7	177.9	163.8	0	0	0	0	0	115.2	T441	T441-G443 PolarHBondContact OG1-N 2.86Å
444	V	79.1	Confident	94.1	Very high	76 Å²	76	25.1 Å²	25.1	46%	0.461	14%	0.14	S	C	.	.			trans	33.2	97	176	-168.5	0	0	0	0	115.3	T409 T446	T409-V444 WeakPolarHBondContact CB-O 3.26Å; V444-T446 PolarHBondContact O-N 2.92Å
445	I	88.1	Confident	94.1	Very high	5 Å²	5	25.2 Å²	25.2	3%	0.026	14%	0.14	C	C	.	.			trans	-68.6	124.4	169.6	-64	161.8	0	0	0	109.1	I411 D447 T451 M478 L481	I411-I445 HydrophobicContact CD1-CD1 3.4Å; I411-I445 HydrophobicContact CD1-CG1 3.9Å; I411-I445 HydrophobicContact CG1-CD1 4.06Å; I411-I445 HydrophobicContact CG1-CG1 4.15Å; I411-I445 HydrophobicContact CG1-CG2 4.15Å; I445-D447 WeakPolarHBondContact CG2-OD1 3.35Å; I445-T451 HydrophobicContact CD1-CG2 4.45Å; I445-M478 HydrophobicContact CD1-CE 3.52Å; I445-M478 HydrophobicContact CD1-SD 3.34Å; I445-M478 WeakPolarHBondContact CD1-SD 3.18Å; I445-M478 HydrophobicContact CG1-CE 3.4Å; I445-M478 VanDerWaalsContact CG1-CE 3.4Å; I445-M478 HydrophobicContact CG1-SD 3.98Å; I445-L481 HydrophobicContact CD1-CD1 3.51Å
446	T	91.5	Very high	94.1	Very high	80 Å²	80	24.9 Å²	24.9	49%	0.491	14%	0.139	S	C	.	.	S	Bend	trans	-85.2	-28	177.8	32.6	0	0	0	0	113.5	P408 T409 N410 V444 M448	P408-T446 HydrophobicContact CB-CG2 4.01Å; P408-T446 VanDerWaalsContact CB-OG1 3.31Å; P408-T446 WeakPolarHBondContact CB-OG1 3.2Å; T409-T446 PolarHBondContact N-OG1 3.13Å; T409-T446 PolarHBondContact O-N 2.85Å; T409-T446 PolarHBondContact O-OG1 2.73Å; N410-T446 PolarHBondContact OD1-OG1 3.24Å; V444-T446 PolarHBondContact O-N 2.92Å; T446-M448 PolarHBondContact O-N 3.5Å
447	D	94.9	Very high	94.1	Very high	12 Å²	12	29.8 Å²	29.8	6%	0.064	16%	0.162	C	C	.	.			trans	-98.2	41.1	-179.6	66.9	-13.4	0	0	0	112.6	N410 I411 A412 I445 A449 D450 T451	N410-D447 VanDerWaalsContact CA-CG 3.47Å; N410-D447 WeakPolarHBondContact CA-OD1 3.3Å; N410-D447 WeakPolarHBondContact CA-OD2 3.47Å; N410-D447 HydrophobicContact CB-CB 4.19Å; N410-D447 VanDerWaalsContact CB-OD2 3.24Å; N410-D447 WeakPolarHBondContact CB-OD2 3.2Å; N410-D447 WeakPolarHBondContact OD1-CB 3.45Å; N410-D447 PolarHBondContact OD1-N 2.84Å; I411-D447 PolarHBondContact N-OD1 2.92Å; I411-D447 VanDerWaalsContact N-OD1 3.15Å; I411-D447 PolarHBondContact N-OD2 2.88Å; A412-D447 WeakPolarHBondContact CB-OD2 3.26Å; A412-D447 PolarHBondContact N-OD2 3.11Å; I445-D447 WeakPolarHBondContact CG2-OD1 3.35Å; D447-A449 PolarHBondContact O-N 2.83Å; D447-A449 VanDerWaalsContact O-N 3.1Å; D447-D450 HydrophobicContact CB-CB 4.33Å; D447-D450 PolarHBondContact O-N 3.12Å; D447-T451 WeakPolarHBondContact O-CB 3.43Å; D447-T451 PolarHBondContact O-N 3.43Å; D447-T451 PolarHBondContact O-OG1 2.77Å; D447-T451 PolarHBondContact OD1-OG1 3.38Å
448	M	92.9	Very high	94	Very high	34 Å²	34	29.8 Å²	29.8	17%	0.167	16%	0.162	C	C	.	.	H	α-helix	trans	-55.6	-34.6	-173.2	-171.9	58.8	170.3	0	0	113.8	T446 R452 D477 I480 L481	T446-M448 PolarHBondContact O-N 3.5Å; M448-R452 HydrophobicContact CE-CG 4.4Å; M448-R452 WeakPolarHBondContact O-CB 3.29Å; M448-R452 WeakPolarHBondContact O-CD 3.47Å; M448-R452 WeakPolarHBondContact O-CG 3.21Å; M448-R452 PolarHBondContact O-N 2.86Å; M448-R452 HydrophobicContact SD-CG 4.49Å; M448-D477 HydrophobicContact CE-CB 4.49Å; M448-D477 WeakPolarHBondContact CE-O 3.32Å; M448-I480 HydrophobicContact CE-CB 4.13Å; M448-I480 HydrophobicContact CE-CG2 3.9Å; M448-L481 HydrophobicContact CE-CD2 3.42Å; M448-L481 VanDerWaalsContact CE-CD2 3.42Å; M448-L481 HydrophobicContact CE-CG 3.8Å; M448-L481 HydrophobicContact SD-CD1 4.39Å; M448-L481 HydrophobicContact SD-CD2 3.85Å; M448-L481 HydrophobicContact SD-CG 4.25Å
449	A	94.9	Very high	94	Very high	50 Å²	50	29.8 Å²	29.8	41%	0.413	16%	0.162	S	C	.	.	H	α-helix	trans	-65.9	-46.3	177	0	0	0	0	0	112.1	D447 R452 E453 P491	D447-A449 PolarHBondContact O-N 2.83Å; D447-A449 VanDerWaalsContact O-N 3.1Å; A449-R452 PolarHBondContact O-N 2.88Å; A449-E453 PolarHBondContact O-N 3.06Å; A449-E453 VanDerWaalsContact O-N 3.17Å; A449-P491 HydrophobicContact CB-CG 3.88Å; A449-P491 WeakPolarHBondContact O-CG 3.24Å
450	D	97.2	Very high	93.9	Very high	87 Å²	87	33.2 Å²	33.2	47%	0.465	18%	0.178	S	C	.	.	H	α-helix	trans	-71.9	-37	179.8	-60.1	-34.7	0	0	0	110.8	A412 D447 E453 A454	A412-D450 HydrophobicContact CB-CB 3.75Å; D447-D450 HydrophobicContact CB-CB 4.33Å; D447-D450 PolarHBondContact O-N 3.12Å; D450-E453 PolarHBondContact O-N 2.99Å; D450-A454 WeakPolarHBondContact O-CB 3.21Å; D450-A454 PolarHBondContact O-N 2.75Å
451	T	96.8	Very high	93.9	Very high	0 Å²	0	33.4 Å²	33.4	0%	0	18%	0.179	C	C	.	.	H	α-helix	trans	-60.7	-45.3	174.4	-71.9	0	0	0	0	111.1	I411 A412 I415 I445 D447 E453 A454 I455 L481	I411-T451 HydrophobicContact CD1-CG2 3.9Å; I411-T451 HydrophobicContact CG1-CG2 3.87Å; I411-T451 WeakPolarHBondContact CG1-OG1 3.47Å; A412-T451 PolarHBondContact N-OG1 3.16Å; I415-T451 HydrophobicContact CD1-CG2 4.15Å; I445-T451 HydrophobicContact CD1-CG2 4.45Å; D447-T451 WeakPolarHBondContact O-CB 3.43Å; D447-T451 PolarHBondContact O-N 3.43Å; D447-T451 PolarHBondContact O-OG1 2.77Å; D447-T451 PolarHBondContact OD1-OG1 3.38Å; T451-E453 VanDerWaalsContact C-N 3.32Å; T451-E453 PolarHBondContact O-N 2.96Å; T451-A454 PolarHBondContact O-N 2.8Å; T451-I455 HydrophobicContact CG2-CD1 3.73Å; T451-I455 WeakPolarHBondContact O-CG1 3.34Å; T451-I455 PolarHBondContact O-N 2.96Å; T451-L481 HydrophobicContact CG2-CD1 3.87Å; T451-L481 HydrophobicContact CG2-CD2 4.33Å
452	R	96.1	Very high	94	Very high	75 Å²	75	33.4 Å²	33.4	28%	0.283	18%	0.179	S	C	.	.	H	α-helix	trans	-61.6	-39.2	174.2	-74.6	169.1	61.4	-167.9	-0.5	112.5	M448 A449 V456 L481 L488 R489 S490	M448-R452 HydrophobicContact CE-CG 4.4Å; M448-R452 WeakPolarHBondContact O-CB 3.29Å; M448-R452 WeakPolarHBondContact O-CD 3.47Å; M448-R452 WeakPolarHBondContact O-CG 3.21Å; M448-R452 PolarHBondContact O-N 2.86Å; M448-R452 HydrophobicContact SD-CG 4.49Å; A449-R452 PolarHBondContact O-N 2.88Å; R452-V456 WeakPolarHBondContact O-CB 3.45Å; R452-V456 VanDerWaalsContact O-CG2 3.27Å; R452-V456 WeakPolarHBondContact O-CG2 3.47Å; R452-V456 PolarHBondContact O-N 2.78Å; R452-L481 HydrophobicContact CG-CD2 4.12Å; R452-L488 HydrophobicContact CG-CD1 4.12Å; R452-R489 PolarHBondContact NE-O 3.02Å; R452-R489 PolarHBondContact NH2-O 3.01Å; R452-S490 PolarHBondContact NH2-O 2.94Å
453	E	97.1	Very high	94.3	Very high	72 Å²	72	32.8 Å²	32.8	34%	0.336	18%	0.175	S	C	.	.	H	α-helix	trans	-66.5	-41.8	175.5	-172.6	159.2	-160.4	0	0	111.5	A449 D450 T451 V456 H457 K492	A449-E453 PolarHBondContact O-N 3.06Å; A449-E453 VanDerWaalsContact O-N 3.17Å; D450-E453 PolarHBondContact O-N 2.99Å; T451-E453 VanDerWaalsContact C-N 3.32Å; T451-E453 PolarHBondContact O-N 2.96Å; E453-V456 PolarHBondContact O-N 3.38Å; E453-H457 WeakPolarHBondContact O-CB 3.38Å; E453-H457 PolarHBondContact O-N 2.92Å; E453-K492 IonicContact OE1-NZ 3.31Å; E453-K492 PolarHBondContact OE1-NZ 2.9Å
454	A	97.9	Very high	95.3	Very high	4 Å²	4	32.5 Å²	32.5	3%	0.033	17%	0.172	C	C	.	.	H	α-helix	trans	-63.2	-42.7	176.4	0	0	0	0	0	112.5	A412 I415 Q416 D450 T451 H457 A458	A412-A454 HydrophobicContact CB-CB 4.42Å; I415-A454 HydrophobicContact CB-CB 4.12Å; I415-A454 HydrophobicContact CG2-CB 3.78Å; Q416-A454 HydrophobicContact CG-CB 3.99Å; D450-A454 WeakPolarHBondContact O-CB 3.21Å; D450-A454 PolarHBondContact O-N 2.75Å; T451-A454 PolarHBondContact O-N 2.8Å; A454-H457 PolarHBondContact O-N 2.69Å; A454-A458 VanDerWaalsContact O-CB 3.29Å; A454-A458 WeakPolarHBondContact O-CB 3.32Å; A454-A458 PolarHBondContact O-N 2.85Å
455	I	97.5	Very high	96.2	Very high	1 Å²	1	28.9 Å²	28.9	1%	0.005	15%	0.15	C	C	.	.	H	α-helix	trans	-66.6	-44.1	177.4	-68.8	162.7	0	0	0	111.2	I415 T451 H457 A458 S459 L481 L488 V496 I500 V501	I415-I455 HydrophobicContact CD1-CD1 4.46Å; I415-I455 HydrophobicContact CD1-CG1 4.09Å; T451-I455 HydrophobicContact CG2-CD1 3.73Å; T451-I455 WeakPolarHBondContact O-CG1 3.34Å; T451-I455 PolarHBondContact O-N 2.96Å; I455-H457 VanDerWaalsContact C-N 3.3Å; I455-H457 PolarHBondContact O-N 3.45Å; I455-A458 PolarHBondContact O-N 3.47Å; I455-S459 PolarHBondContact O-N 2.98Å; I455-L481 HydrophobicContact CD1-CB 4.42Å; I455-L481 HydrophobicContact CD1-CD1 4.07Å; I455-L481 HydrophobicContact CD1-CD2 3.73Å; I455-L481 HydrophobicContact CD1-CG 4.29Å; I455-L488 HydrophobicContact CB-CD2 4.06Å; I455-L488 HydrophobicContact CD1-CD2 4.2Å; I455-L488 HydrophobicContact CG2-CD2 3.53Å; I455-V496 HydrophobicContact CG2-CG1 4.09Å; I455-I500 HydrophobicContact CG2-CD1 4.03Å; I455-I500 HydrophobicContact CG2-CG1 4.01Å; I455-V501 HydrophobicContact CD1-CG2 3.97Å; I455-V501 HydrophobicContact CG1-CG2 4.19Å; I455-V501 HydrophobicContact CG2-CG2 3.73Å
456	V	97.1	Very high	96.6	Very high	8 Å²	8	28.6 Å²	28.6	5%	0.048	15%	0.149	C	C	.	.	H	α-helix	trans	-59.8	-42.8	175.8	170	0	0	0	0	111	R452 E453 S459 H460 E494 V496	R452-V456 WeakPolarHBondContact O-CB 3.45Å; R452-V456 VanDerWaalsContact O-CG2 3.27Å; R452-V456 WeakPolarHBondContact O-CG2 3.47Å; R452-V456 PolarHBondContact O-N 2.78Å; E453-V456 PolarHBondContact O-N 3.38Å; V456-S459 PolarHBondContact O-N 3.4Å; V456-S459 PolarHBondContact O-OG 2.85Å; V456-H460 PolarHBondContact O-CE1 2.78Å; V456-H460 PolarHBondContact O-ND1 3.05Å; V456-E494 HydrophobicContact CG1-CB 4.39Å; V456-V496 HydrophobicContact CG2-CG1 3.74Å
457	H	97.3	Very high	96.9	Very high	102 Å²	102	24.8 Å²	24.8	47%	0.472	13%	0.126	S	C	.	.	H	α-helix	trans	-61.6	-51.6	173.1	177.6	-106.8	0	0	0	111.9	E453 A454 I455 S459 H460	E453-H457 WeakPolarHBondContact O-CB 3.38Å; E453-H457 PolarHBondContact O-N 2.92Å; A454-H457 PolarHBondContact O-N 2.69Å; I455-H457 VanDerWaalsContact C-N 3.3Å; I455-H457 PolarHBondContact O-N 3.45Å; H457-S459 PolarHBondContact O-N 3.05Å; H457-H460 WeakPolarHBondContact O-CB 3.45Å; H457-H460 PolarHBondContact O-N 3.47Å; H457-H460 VanDerWaalsContact O-N 3.13Å; H457-H460 PolarHBondContact O-ND1 3.49Å
458	A	97.9	Very high	97	Very high	0 Å²	0	24.2 Å²	24.2	0%	0	12%	0.123	C	C	.	.	H	α-helix	trans	-60.5	-26.8	-179.3	0	0	0	0	0	113.4	I415 A419 A454 I455 H460 L461 M463 I500	I415-A458 HydrophobicContact CG2-CB 4.39Å; A419-A458 HydrophobicContact CB-CB 4.43Å; A454-A458 VanDerWaalsContact O-CB 3.29Å; A454-A458 WeakPolarHBondContact O-CB 3.32Å; A454-A458 PolarHBondContact O-N 2.85Å; I455-A458 PolarHBondContact O-N 3.47Å; A458-H460 PolarHBondContact O-N 3.26Å; A458-L461 WeakPolarHBondContact O-CB 3.42Å; A458-L461 PolarHBondContact O-N 3.38Å; A458-M463 HydrophobicContact CB-SD 4.32Å; A458-I500 HydrophobicContact CB-CD1 3.64Å
459	S	96.9	Very high	97.1	Very high	0 Å²	0	22.6 Å²	22.6	0%	0	12%	0.115	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60	-18.2	177.2	75.4	0	0	0	0	113.7	I455 V456 H457 L497 R498	I455-S459 PolarHBondContact O-N 2.98Å; V456-S459 PolarHBondContact O-N 3.4Å; V456-S459 PolarHBondContact O-OG 2.85Å; H457-S459 PolarHBondContact O-N 3.05Å; S459-L497 PolarHBondContact OG-N 3.5Å; S459-R498 WeakPolarHBondContact O-CG 3.49Å; S459-R498 PolarHBondContact O-NE 2.71Å
460	H	96.8	Very high	97.2	Very high	73 Å²	73	20.2 Å²	20.2	34%	0.338	10%	0.095	S	C	.	.	T	Hydrogen-bonded Turn	trans	-87.8	-7.1	176.9	-63.4	80.4	0	0	0	114.4	V456 H457 A458	V456-H460 PolarHBondContact O-CE1 2.78Å; V456-H460 PolarHBondContact O-ND1 3.05Å; H457-H460 WeakPolarHBondContact O-CB 3.45Å; H457-H460 PolarHBondContact O-N 3.47Å; H457-H460 VanDerWaalsContact O-N 3.13Å; H457-H460 PolarHBondContact O-ND1 3.49Å; A458-H460 PolarHBondContact O-N 3.26Å
461	L	98.1	Very high	97	Very high	3 Å²	3	16.2 Å²	16.2	2%	0.016	7%	0.074	C	C	.	.	S	Bend	trans	-111.6	163.6	-169.9	-55.5	-177.9	0	0	0	111.4	A419 A422 M426 A458 M463 R498 Y532	A419-L461 HydrophobicContact CB-CD1 3.76Å; A419-L461 WeakPolarHBondContact O-CD1 3.33Å; A422-L461 HydrophobicContact CB-CB 4.09Å; A422-L461 HydrophobicContact CB-CD1 4.45Å; M426-L461 HydrophobicContact CE-CD2 4.02Å; M426-L461 HydrophobicContact SD-CD2 3.77Å; A458-L461 WeakPolarHBondContact O-CB 3.42Å; A458-L461 PolarHBondContact O-N 3.38Å; L461-M463 PolarHBondContact O-N 3.19Å; L461-R498 PolarHBondContact O-NH2 2.86Å; L461-Y532 WeakPolarHBondContact O-CD2 3.38Å; L461-Y532 WeakPolarHBondContact O-CE2 3.36Å
462	P	97.6	Very high	96.7	Very high	0 Å²	0	22.3 Å²	22.3	0%	0	11%	0.107	C	C	.	.	S	Bend	trans	-75.7	66.7	176.3	30.6	-33	0	0	0	111.5	A422 E425 Y434 F435 Y532	A422-P462 HydrophobicContact CB-CG 4.23Å; A422-P462 VanDerWaalsContact O-CD 3.23Å; A422-P462 WeakPolarHBondContact O-CD 3.1Å; A422-P462 WeakPolarHBondContact O-CG 3.4Å; E425-P462 HydrophobicContact CB-CG 4.16Å; E425-P462 HydrophobicContact CG-CG 3.95Å; Y434-P462 HydrophobicContact CD2-CB 3.88Å; Y434-P462 HydrophobicContact CE2-CB 4.31Å; F435-P462 PolarHBondContact N-O 3.46Å; P462-Y532 HydrophobicContact CB-CD1 3.91Å; P462-Y532 HydrophobicContact CB-CE1 3.47Å; P462-Y532 VanDerWaalsContact CB-CE1 3.47Å; P462-Y532 HydrophobicContact CB-CE2 4.48Å; P462-Y532 WeakPolarHBondContact CD-OH 3.44Å; P462-Y532 HydrophobicContact CG-CE1 4.27Å
463	M	97.7	Very high	96.4	Very high	0 Å²	0	20.3 Å²	20.3	0%	0	11%	0.106	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.3	144.1	-171.2	-178.5	179.5	-175.2	0	0	113.4	V418 A419 A422 Y434 F435 L437 A458 L461 V465 R498	V418-M463 HydrophobicContact CB-CE 3.48Å; V418-M463 VanDerWaalsContact CB-CE 3.48Å; V418-M463 HydrophobicContact CB-SD 4.22Å; V418-M463 HydrophobicContact CG1-CE 3.41Å; V418-M463 VanDerWaalsContact CG1-CE 3.41Å; V418-M463 HydrophobicContact CG1-SD 3.98Å; V418-M463 HydrophobicContact CG2-CE 4.47Å; A419-M463 HydrophobicContact CB-SD 4.21Å; A422-M463 HydrophobicContact CB-CB 4.04Å; Y434-M463 PolarHBondContact OH-O 3.12Å; F435-M463 HydrophobicContact CB-CB 4.25Å; F435-M463 HydrophobicContact CB-CG 4.16Å; F435-M463 CarbonylContact O-C 3.58Å; F435-M463 WeakPolarHBondContact O-CA 3.49Å; L437-M463 HydrophobicContact CB-CE 3.49Å; L437-M463 VanDerWaalsContact CB-CE 3.49Å; L437-M463 HydrophobicContact CD2-CE 3.81Å; L437-M463 HydrophobicContact CG-CE 4.3Å; A458-M463 HydrophobicContact CB-SD 4.32Å; L461-M463 PolarHBondContact O-N 3.19Å; M463-V465 HydrophobicContact CE-CG2 4.02Å; M463-R498 PolarHBondContact O-NH2 3.41Å
464	S	97.9	Very high	95.9	Very high	0 Å²	0	22 Å²	22	0%	0	12%	0.118	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	149.5	166	-65.8	0	0	0	0	111	Y434 F435 L437 Q528	Y434-S464 WeakPolarHBondContact CE1-OG 3.17Å; Y434-S464 PolarHBondContact OH-OG 2.53Å; F435-S464 PolarHBondContact O-N 2.98Å; L437-S464 PolarHBondContact N-O 3.39Å; S464-Q528 PolarHBondContact OG-OE1 2.87Å
465	V	97.9	Very high	95.5	Very high	0 Å²	0	22.2 Å²	22.2	0%	0	12%	0.118	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	122.7	174.4	-178.3	0	0	0	0	108	I415 I439 M463 I467 I500 V501 Q502	I415-V465 HydrophobicContact CG2-CG2 4.47Å; I439-V465 HydrophobicContact CD1-CG1 3.86Å; I439-V465 HydrophobicContact CG1-CG1 4.41Å; M463-V465 HydrophobicContact CE-CG2 4.02Å; V465-I467 HydrophobicContact CG1-CD1 4.46Å; V465-I467 HydrophobicContact CG1-CG1 4.08Å; V465-I500 HydrophobicContact CG2-CD1 4.37Å; V465-I500 PolarHBondContact N-O 2.97Å; V465-V501 HydrophobicContact CB-CG2 4.4Å; V465-V501 CarbonylContact O-C 3.58Å; V465-V501 WeakPolarHBondContact O-CA 3.23Å; V465-Q502 PolarHBondContact O-N 3.36Å
466	I	97.4	Very high	95.1	Very high	0 Å²	0	25.4 Å²	25.4	0%	0	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	126.9	178.4	-63.1	178	0	0	0	107.2	I436 L437 L438 I439 V468 Q502 V521 L522 V525	I436-I466 HydrophobicContact CG2-CD1 3.59Å; I436-I466 HydrophobicContact CG2-CG1 4.19Å; L437-I466 PolarHBondContact O-N 2.82Å; L438-I466 CarbonylContact C-O 3.56Å; L438-I466 WeakPolarHBondContact CA-O 3.12Å; L438-I466 HydrophobicContact CD1-CB 4.16Å; L438-I466 HydrophobicContact CD1-CG2 3.66Å; I439-I466 PolarHBondContact N-O 3.49Å; I466-V468 HydrophobicContact CG2-CG2 4.46Å; I466-Q502 CarbonylContact C-O 3.54Å; I466-Q502 WeakPolarHBondContact CA-O 3.47Å; I466-V521 HydrophobicContact CD1-CG1 4.41Å; I466-V521 HydrophobicContact CG2-CG1 3.31Å; I466-L522 HydrophobicContact CD1-CD2 3.88Å; I466-V525 HydrophobicContact CD1-CG2 3.85Å
467	I	96.4	Very high	94.5	Very high	0 Å²	0	27.6 Å²	27.6	0%	0	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	119.9	-179.8	-52.5	178.3	0	0	0	108.8	I411 I439 T441 V465 M478 L481 V501 Q502 F503 V504	I411-I467 HydrophobicContact CD1-CD1 4.24Å; I439-I467 HydrophobicContact CB-CG1 4.33Å; I439-I467 HydrophobicContact CD1-CG1 4.46Å; I439-I467 CarbonylContact O-C 3.57Å; I439-I467 WeakPolarHBondContact O-CA 3.39Å; T441-I467 HydrophobicContact CG2-CG2 3.95Å; V465-I467 HydrophobicContact CG1-CD1 4.46Å; V465-I467 HydrophobicContact CG1-CG1 4.08Å; I467-M478 HydrophobicContact CD1-SD 4.21Å; I467-M478 HydrophobicContact CG2-CE 4.42Å; I467-M478 HydrophobicContact CG2-SD 3.83Å; I467-L481 HydrophobicContact CD1-CD1 3.98Å; I467-V501 HydrophobicContact CD1-CG1 4.13Å; I467-V501 HydrophobicContact CG1-CG1 4.47Å; I467-Q502 PolarHBondContact N-O 3.1Å; I467-F503 HydrophobicContact CB-CD2 4.08Å; I467-F503 HydrophobicContact CG2-CD2 4Å; I467-F503 HydrophobicContact CG2-CE2 4.44Å; I467-F503 CarbonylContact O-C 3.57Å; I467-F503 WeakPolarHBondContact O-CA 3.3Å; I467-F503 WeakPolarHBondContact O-CD2 3.24Å; I467-V504 PolarHBondContact O-N 3.47Å
468	V	97	Very high	94.1	Very high	0 Å²	0	22.8 Å²	22.8	0%	0	13%	0.127	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	115.2	173.1	-179.2	0	0	0	0	109.4	A339 L438 I439 L440 T441 I466 V470 V504 F506 V521	A339-V468 HydrophobicContact CB-CG1 4.18Å; L438-V468 HydrophobicContact CD1-CG2 3.79Å; I439-V468 PolarHBondContact O-N 2.79Å; L440-V468 HydrophobicContact CD2-CB 3.63Å; L440-V468 HydrophobicContact CD2-CG1 4.31Å; L440-V468 HydrophobicContact CD2-CG2 4.11Å; T441-V468 PolarHBondContact N-O 3.35Å; I466-V468 HydrophobicContact CG2-CG2 4.46Å; V468-V470 PolarHBondContact O-N 2.67Å; V468-V504 VanDerWaalsContact CA-O 3.29Å; V468-V504 WeakPolarHBondContact CA-O 3.28Å; V468-F506 HydrophobicContact CG1-CB 4.05Å; V468-F506 HydrophobicContact CG1-CD2 4.31Å; V468-V521 HydrophobicContact CG2-CG1 4.18Å; V468-V521 HydrophobicContact CG2-CG2 3.9Å
469	G	96.4	Very high	93.5	Very high	0 Å²	0	27.6 Å²	27.6	0%	0	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.3	111.1	177.9	0	0	0	0	0	111.4	T441 F475 V504 F506	T441-G469 CarbonylContact O-C 3.56Å; T441-G469 WeakPolarHBondContact O-CA 3.45Å; G469-F475 VanDerWaalsContact C-CZ 3.49Å; G469-V504 PolarHBondContact N-O 2.66Å; G469-F506 VanDerWaalsContact O-CB 3.27Å; G469-F506 WeakPolarHBondContact O-CB 3.42Å; G469-F506 PolarHBondContact O-N 3.06Å
470	V	95.7	Very high	93.1	Very high	0 Å²	0	31.9 Å²	31.9	0%	0	17%	0.171	C	C	.	.			trans	-93.7	153.9	177.4	-62.8	0	0	0	0	112	L325 E335 Y336 T441 D442 V468 F475 F506	L325-V470 HydrophobicContact CD1-CG2 4.4Å; E335-V470 HydrophobicContact CB-CB 4.08Å; E335-V470 HydrophobicContact CB-CG1 3.92Å; Y336-V470 HydrophobicContact CD2-CG2 4.17Å; Y336-V470 HydrophobicContact CE1-CG2 4.06Å; Y336-V470 HydrophobicContact CE2-CB 4.47Å; Y336-V470 HydrophobicContact CE2-CG2 3.5Å; Y336-V470 VanDerWaalsContact CE2-CG2 3.5Å; Y336-V470 VanDerWaalsContact CZ-CG2 3.41Å; Y336-V470 WeakPolarHBondContact OH-CG2 3.38Å; T441-V470 VanDerWaalsContact O-CG2 3.31Å; T441-V470 WeakPolarHBondContact O-CG2 3.37Å; T441-V470 PolarHBondContact O-N 2.96Å; D442-V470 WeakPolarHBondContact CA-O 2.95Å; D442-V470 HydrophobicContact CB-CG2 3.86Å; V468-V470 PolarHBondContact O-N 2.67Å; V470-F475 WeakPolarHBondContact O-CZ 3.47Å; V470-F506 HydrophobicContact CG1-CB 4.42Å
471	G	93.5	Very high	92.7	Very high	2 Å²	2	28.4 Å²	28.4	2%	0.021	16%	0.155	C	C	.	.	T	Hydrogen-bonded Turn	trans	78.6	-151.5	-178.6	0	0	0	0	0	113.2	E335	E335-G471 PolarHBondContact OE2-N 3.19Å
472	N	90.4	Very high	92.1	Very high	128 Å²	128	29 Å²	29	68%	0.684	16%	0.158	S	C	*	.	T	Hydrogen-bonded Turn	trans	-127.9	24.7	-171.8	-54.1	-56.1	0	0	0	112.8	K510	N472-K510 PolarHBondContact OD1-NZ 2.94Å
473	A	89.1	Confident	91.2	Very high	34 Å²	34	29.7 Å²	29.7	28%	0.281	17%	0.166	S	C	.	.			trans	-66.4	172.7	177.1	0	0	0	0	0	112.4	D442 F475	D442-A473 WeakPolarHBondContact O-CB 3.22Å; A473-F475 HydrophobicContact CB-CE1 4.31Å; A473-F475 HydrophobicContact CB-CZ 4.34Å
474	D	88	Confident	90.3	Very high	108 Å²	108	35 Å²	35	58%	0.578	19%	0.194	S	C	*	.			trans	-77.2	122.7	167.2	-172.9	-2.4	0	0	0	109.2	T476	D474-T476 WeakPolarHBondContact OD1-CB 3.35Å; D474-T476 PolarHBondContact OD1-N 3.13Å; D474-T476 PolarHBondContact OD1-OG1 3.42Å
475	F	89.6	Confident	89.2	Confident	7 Å²	7	42.5 Å²	42.5	3%	0.031	23%	0.234	C	C	.	.			trans	-109.5	17.6	-178.1	-62.1	-61.9	0	0	0	112.8	G469 V470 A473 D477 M478 Q479 F503 P505 K507	G469-F475 VanDerWaalsContact C-CZ 3.49Å; V470-F475 WeakPolarHBondContact O-CZ 3.47Å; A473-F475 HydrophobicContact CB-CE1 4.31Å; A473-F475 HydrophobicContact CB-CZ 4.34Å; F475-D477 PolarHBondContact O-N 3.16Å; F475-M478 HydrophobicContact CB-CB 4.4Å; F475-M478 HydrophobicContact CB-CG 4.34Å; F475-M478 HydrophobicContact CD1-CG 4.18Å; F475-M478 WeakPolarHBondContact O-CB 3.21Å; F475-M478 PolarHBondContact O-N 3.06Å; F475-Q479 PolarHBondContact O-N 3.35Å; F475-Q479 VanDerWaalsContact O-N 3.13Å; F475-F503 HydrophobicContact CB-CE1 3.78Å; F475-F503 HydrophobicContact CB-CE2 4.36Å; F475-F503 HydrophobicContact CB-CZ 3.4Å; F475-F503 VanDerWaalsContact CB-CZ 3.4Å; F475-F503 HydrophobicContact CD1-CE2 4.28Å; F475-F503 AromaticContact CD1-CZ 3.95Å; F475-F503 HydrophobicContact CD1-CZ 3.95Å; F475-F503 HydrophobicContact CD2-CZ 4.04Å; F475-F503 HydrophobicContact CG-CE1 4.37Å; F475-F503 HydrophobicContact CG-CE2 4.33Å; F475-F503 AromaticContact CG-CZ 3.55Å; F475-F503 HydrophobicContact CG-CZ 3.55Å; F475-P505 HydrophobicContact CD2-CB 4.18Å; F475-P505 HydrophobicContact CE2-CB 4.42Å; F475-K507 HydrophobicContact CE2-CD 4.38Å
476	T	87.6	Confident	88.3	Confident	68 Å²	68	44.5 Å²	44.5	42%	0.417	26%	0.255	S	S	.	.	H	α-helix	trans	-52.6	-41.7	178.6	-59.4	0	0	0	0	111.9	D474 M478 Q479 I480	D474-T476 WeakPolarHBondContact OD1-CB 3.35Å; D474-T476 PolarHBondContact OD1-N 3.13Å; D474-T476 PolarHBondContact OD1-OG1 3.42Å; T476-M478 VanDerWaalsContact C-N 3.28Å; T476-M478 PolarHBondContact O-N 3.1Å; T476-Q479 PolarHBondContact O-N 3.14Å; T476-I480 WeakPolarHBondContact O-CG1 3.37Å; T476-I480 PolarHBondContact O-N 3.03Å
477	D	85.1	Confident	87.8	Confident	54 Å²	54	49.9 Å²	49.9	29%	0.289	28%	0.283	S	S	.	.	H	α-helix	trans	-63	-33.7	177.7	-69.8	-26.9	0	0	0	112.8	M448 F475 I480 L481	M448-D477 HydrophobicContact CE-CB 4.49Å; M448-D477 WeakPolarHBondContact CE-O 3.32Å; F475-D477 PolarHBondContact O-N 3.16Å; D477-I480 WeakPolarHBondContact O-CB 3.11Å; D477-I480 PolarHBondContact O-N 3.08Å; D477-L481 PolarHBondContact O-N 2.95Å
478	M	88.4	Confident	87.6	Confident	1 Å²	1	50.4 Å²	50.4	1%	0.005	29%	0.285	C	S	.	.	H	α-helix	trans	-73.2	-37.7	179.3	-55.3	-62.5	179.5	0	0	111.8	T441 I445 I467 F475 T476 I480 L481 D482 F503	T441-M478 HydrophobicContact CG2-CE 3.53Å; I445-M478 HydrophobicContact CD1-CE 3.52Å; I445-M478 HydrophobicContact CD1-SD 3.34Å; I445-M478 WeakPolarHBondContact CD1-SD 3.18Å; I445-M478 HydrophobicContact CG1-CE 3.4Å; I445-M478 VanDerWaalsContact CG1-CE 3.4Å; I445-M478 HydrophobicContact CG1-SD 3.98Å; I467-M478 HydrophobicContact CD1-SD 4.21Å; I467-M478 HydrophobicContact CG2-CE 4.42Å; I467-M478 HydrophobicContact CG2-SD 3.83Å; F475-M478 HydrophobicContact CB-CB 4.4Å; F475-M478 HydrophobicContact CB-CG 4.34Å; F475-M478 HydrophobicContact CD1-CG 4.18Å; F475-M478 WeakPolarHBondContact O-CB 3.21Å; F475-M478 PolarHBondContact O-N 3.06Å; T476-M478 VanDerWaalsContact C-N 3.28Å; T476-M478 PolarHBondContact O-N 3.1Å; M478-I480 PolarHBondContact O-N 2.73Å; M478-L481 WeakPolarHBondContact O-CB 3.44Å; M478-L481 PolarHBondContact O-N 3.41Å; M478-D482 PolarHBondContact O-N 3.36Å; M478-F503 HydrophobicContact CB-CB 4.35Å; M478-F503 HydrophobicContact CB-CD1 3.8Å; M478-F503 HydrophobicContact CB-CD2 3.35Å; M478-F503 HydrophobicContact CB-CE1 3.91Å; M478-F503 HydrophobicContact CB-CE2 3.47Å; M478-F503 VanDerWaalsContact CB-CE2 3.47Å; M478-F503 HydrophobicContact CB-CG 3.53Å; M478-F503 HydrophobicContact CB-CZ 3.77Å; M478-F503 HydrophobicContact CG-CD2 3.95Å; M478-F503 HydrophobicContact CG-CE2 3.72Å; M478-F503 HydrophobicContact CG-CZ 4.19Å
479	Q	87	Confident	87.4	Confident	101 Å²	101	55.8 Å²	55.8	47%	0.472	31%	0.305	S	S	.	.	H	α-helix	trans	-62.3	-32.6	174.3	-66.4	176.8	-35.5	0	0	111.6	F475 T476 L481 D482 F503	F475-Q479 PolarHBondContact O-N 3.35Å; F475-Q479 VanDerWaalsContact O-N 3.13Å; T476-Q479 PolarHBondContact O-N 3.14Å; Q479-L481 VanDerWaalsContact C-N 3.27Å; Q479-L481 PolarHBondContact O-N 2.89Å; Q479-D482 PolarHBondContact O-N 2.92Å; Q479-F503 HydrophobicContact CG-CD1 4.06Å; Q479-F503 HydrophobicContact CG-CE1 4.12Å
480	I	87	Confident	87.3	Confident	90 Å²	90	55.9 Å²	55.9	46%	0.462	31%	0.306	S	S	.	.	H	α-helix	trans	-65.3	-32.9	173.3	-65.9	168.2	0	0	0	111.4	M448 T476 D477 M478 L488	M448-I480 HydrophobicContact CE-CB 4.13Å; M448-I480 HydrophobicContact CE-CG2 3.9Å; T476-I480 WeakPolarHBondContact O-CG1 3.37Å; T476-I480 PolarHBondContact O-N 3.03Å; D477-I480 WeakPolarHBondContact O-CB 3.11Å; D477-I480 PolarHBondContact O-N 3.08Å; M478-I480 PolarHBondContact O-N 2.73Å; I480-L488 HydrophobicContact CG2-CD1 4.36Å; I480-L488 WeakPolarHBondContact O-CD1 3.32Å
481	L	89.3	Confident	87.1	Confident	1 Å²	1	59.3 Å²	59.3	1%	0.005	33%	0.328	C	S	.	.	H	α-helix	trans	-76.2	-29	-179.5	-63.1	-178.6	0	0	0	113.3	I445 M448 T451 R452 I455 I467 D477 M478 Q479 G483 L488 V501	I445-L481 HydrophobicContact CD1-CD1 3.51Å; M448-L481 HydrophobicContact CE-CD2 3.42Å; M448-L481 VanDerWaalsContact CE-CD2 3.42Å; M448-L481 HydrophobicContact CE-CG 3.8Å; M448-L481 HydrophobicContact SD-CD1 4.39Å; M448-L481 HydrophobicContact SD-CD2 3.85Å; M448-L481 HydrophobicContact SD-CG 4.25Å; T451-L481 HydrophobicContact CG2-CD1 3.87Å; T451-L481 HydrophobicContact CG2-CD2 4.33Å; R452-L481 HydrophobicContact CG-CD2 4.12Å; I455-L481 HydrophobicContact CD1-CB 4.42Å; I455-L481 HydrophobicContact CD1-CD1 4.07Å; I455-L481 HydrophobicContact CD1-CD2 3.73Å; I455-L481 HydrophobicContact CD1-CG 4.29Å; I467-L481 HydrophobicContact CD1-CD1 3.98Å; D477-L481 PolarHBondContact O-N 2.95Å; M478-L481 WeakPolarHBondContact O-CB 3.44Å; M478-L481 PolarHBondContact O-N 3.41Å; Q479-L481 VanDerWaalsContact C-N 3.27Å; Q479-L481 PolarHBondContact O-N 2.89Å; L481-G483 PolarHBondContact O-N 3.11Å; L481-G483 VanDerWaalsContact O-N 3.13Å; L481-L488 HydrophobicContact CD2-CD1 4.1Å; L481-L488 HydrophobicContact CD2-CD2 4.14Å; L481-V501 HydrophobicContact CB-CG1 4.06Å; L481-V501 WeakPolarHBondContact O-CB 3.45Å
482	D	85.9	Confident	87.1	Confident	14 Å²	14	66.1 Å²	66.1	8%	0.075	36%	0.358	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.6	-9.7	-174.3	-151.9	21	0	0	0	114.8	M478 Q479 D484 Q502 F503	M478-D482 PolarHBondContact O-N 3.36Å; Q479-D482 PolarHBondContact O-N 2.92Å; D482-D484 PolarHBondContact O-N 3.04Å; D482-Q502 WeakPolarHBondContact OD1-CA 3.41Å; D482-F503 HydrophobicContact CB-CB 4.05Å; D482-F503 PolarHBondContact OD1-N 2.95Å
483	G	77.9	Confident	87.2	Confident	16 Å²	16	61.8 Å²	61.8	17%	0.165	34%	0.343	C	S	.	.	S	Bend	trans	72	-20.2	173.4	0	0	0	0	0	116.6	L481 D485 G486	L481-G483 PolarHBondContact O-N 3.11Å; L481-G483 VanDerWaalsContact O-N 3.13Å; G483-D485 VanDerWaalsContact C-N 3.32Å; G483-D485 PolarHBondContact O-N 3.22Å; G483-G486 CarbonylContact C-O 3.57Å; G483-G486 CarbonylContact O-C 3.53Å; G483-G486 PolarHBondContact O-N 2.79Å
484	D	78.3	Confident	87.5	Confident	111 Å²	111	65.5 Å²	65.5	59%	0.594	36%	0.355	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.4	-40.3	-178.8	-89.2	-15.4	0	0	0	114.1	D482 G486	D482-D484 PolarHBondContact O-N 3.04Å; D484-G486 VanDerWaalsContact C-N 3.34Å
485	D	74.4	Confident	87.9	Confident	158 Å²	158	63.1 Å²	63.1	85%	0.845	35%	0.345	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.1	4.7	-179.4	-76.3	-40.1	0	0	0	113.5	G483	G483-D485 VanDerWaalsContact C-N 3.32Å; G483-D485 PolarHBondContact O-N 3.22Å
486	G	79.3	Confident	88.1	Confident	42 Å²	42	64 Å²	64	43%	0.433	35%	0.351	S	S	.	.	S	Bend	trans	147.6	167.1	173.8	0	0	0	0	0	114.9	G483 D484 L488	G483-G486 CarbonylContact C-O 3.57Å; G483-G486 CarbonylContact O-C 3.53Å; G483-G486 PolarHBondContact O-N 2.79Å; D484-G486 VanDerWaalsContact C-N 3.34Å; G486-L488 PolarHBondContact O-N 2.84Å; G486-L488 VanDerWaalsContact O-N 3.07Å
487	I	87.8	Confident	88.4	Confident	113 Å²	113	65.8 Å²	65.8	58%	0.579	36%	0.357	S	S	*	.			trans	-65.9	112.1	-175.7	-57.9	173.4	0	0	0	110.9	P495 V496	I487-P495 HydrophobicContact CG2-CB 3.53Å; I487-V496 HydrophobicContact CG2-CG2 4.1Å
488	L	91.6	Very high	88.8	Confident	11 Å²	11	64.6 Å²	64.6	6%	0.058	35%	0.349	C	S	.	.			trans	-58.5	138.2	171.9	-171.4	70.6	0	0	0	110.5	R452 I455 I480 L481 G486 P495 V496	R452-L488 HydrophobicContact CG-CD1 4.12Å; I455-L488 HydrophobicContact CB-CD2 4.06Å; I455-L488 HydrophobicContact CD1-CD2 4.2Å; I455-L488 HydrophobicContact CG2-CD2 3.53Å; I480-L488 HydrophobicContact CG2-CD1 4.36Å; I480-L488 WeakPolarHBondContact O-CD1 3.32Å; L481-L488 HydrophobicContact CD2-CD1 4.1Å; L481-L488 HydrophobicContact CD2-CD2 4.14Å; G486-L488 PolarHBondContact O-N 2.84Å; G486-L488 VanDerWaalsContact O-N 3.07Å; L488-P495 WeakPolarHBondContact O-CA 3.18Å; L488-V496 HydrophobicContact CB-CG1 3.91Å; L488-V496 HydrophobicContact CB-CG2 4.25Å; L488-V496 HydrophobicContact CD2-CG1 4.09Å; L488-V496 HydrophobicContact CG-CG1 4.33Å; L488-V496 PolarHBondContact O-N 3.31Å
489	R	93.3	Very high	89	Confident	112 Å²	112	67.2 Å²	67.2	42%	0.423	36%	0.363	S	S	.	.	B	Isolated β-bridge	trans	-126.9	152.3	179.1	-67.4	176.4	-179.4	-81.7	-7.2	111.4	R452 G493 E494 P495	R452-R489 PolarHBondContact NE-O 3.02Å; R452-R489 PolarHBondContact NH2-O 3.01Å; R489-G493 PolarHBondContact NH1-O 2.77Å; R489-E494 CarbonylContact C-O 3.6Å; R489-E494 WeakPolarHBondContact CA-O 3.38Å; R489-P495 HydrophobicContact CG-CB 4.32Å
490	S	93.6	Very high	89.4	Confident	2 Å²	2	62.4 Å²	62.4	1%	0.014	34%	0.341	C	S	.	.			trans	-68.7	166.1	167.8	74.7	0	0	0	0	110.7	R452 K492 G493 E494	R452-S490 PolarHBondContact NH2-O 2.94Å; S490-K492 PolarHBondContact O-N 2.83Å; S490-K492 VanDerWaalsContact O-N 3.11Å; S490-K492 PolarHBondContact OG-N 2.83Å; S490-G493 PolarHBondContact O-N 3.45Å; S490-E494 PolarHBondContact N-O 3.36Å; S490-E494 WeakPolarHBondContact OG-CB 3.46Å; S490-E494 PolarHBondContact OG-N 2.85Å
491	P	92.4	Very high	89.8	Confident	72 Å²	72	58.1 Å²	58.1	47%	0.468	32%	0.319	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.4	-22.8	170.3	-26.2	35.8	0	0	0	113.9	A449 G493	A449-P491 HydrophobicContact CB-CG 3.88Å; A449-P491 WeakPolarHBondContact O-CG 3.24Å; P491-G493 VanDerWaalsContact C-N 3.33Å
492	K	93.6	Very high	90.1	Very high	146 Å²	146	58.9 Å²	58.9	64%	0.635	32%	0.322	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.8	-5.3	176.4	-62.2	166.3	-175.8	154.2	0	113.2	E453 S490	E453-K492 IonicContact OE1-NZ 3.31Å; E453-K492 PolarHBondContact OE1-NZ 2.9Å; S490-K492 PolarHBondContact O-N 2.83Å; S490-K492 VanDerWaalsContact O-N 3.11Å; S490-K492 PolarHBondContact OG-N 2.83Å
493	G	93	Very high	90.5	Very high	37 Å²	37	58.7 Å²	58.7	38%	0.381	32%	0.32	S	S	.	.	S	Bend	trans	91.9	0.3	178.5	0	0	0	0	0	115.2	R489 S490 P491	R489-G493 PolarHBondContact NH1-O 2.77Å; S490-G493 PolarHBondContact O-N 3.45Å; P491-G493 VanDerWaalsContact C-N 3.33Å
494	E	94.8	Very high	91.3	Very high	111 Å²	111	58 Å²	58	52%	0.519	31%	0.313	S	S	.	.	P	Polyproline II helix	trans	-70.9	126.4	178.2	-62.5	173.4	157.7	0	0	109.9	V456 R489 S490	V456-E494 HydrophobicContact CG1-CB 4.39Å; R489-E494 CarbonylContact C-O 3.6Å; R489-E494 WeakPolarHBondContact CA-O 3.38Å; S490-E494 PolarHBondContact N-O 3.36Å; S490-E494 WeakPolarHBondContact OG-CB 3.46Å; S490-E494 PolarHBondContact OG-N 2.85Å
495	P	95.3	Very high	92.2	Very high	59 Å²	59	53.7 Å²	53.7	38%	0.383	29%	0.291	S	S	.	.	B	Isolated β-bridge	trans	-76	155.5	178.2	32.3	-33.3	0	0	0	112	I487 L488 R489	I487-P495 HydrophobicContact CG2-CB 3.53Å; L488-P495 WeakPolarHBondContact O-CA 3.18Å; R489-P495 HydrophobicContact CG-CB 4.32Å
496	V	94.6	Very high	93.2	Very high	25 Å²	25	46.6 Å²	46.6	15%	0.152	25%	0.253	C	S	.	.	P	Polyproline II helix	trans	-57.6	145.6	162.1	-67.6	0	0	0	0	110.3	I455 V456 I487 L488	I455-V496 HydrophobicContact CG2-CG1 4.09Å; V456-V496 HydrophobicContact CG2-CG1 3.74Å; I487-V496 HydrophobicContact CG2-CG2 4.1Å; L488-V496 HydrophobicContact CB-CG1 3.91Å; L488-V496 HydrophobicContact CB-CG2 4.25Å; L488-V496 HydrophobicContact CD2-CG1 4.09Å; L488-V496 HydrophobicContact CG-CG1 4.33Å; L488-V496 PolarHBondContact O-N 3.31Å
497	L	93.7	Very high	93.8	Very high	105 Å²	105	48.4 Å²	48.4	55%	0.55	25%	0.249	S	C	.	.	S	Bend	trans	-75.8	-32.8	178.3	-177.1	64.3	0	0	0	112.1	S459	S459-L497 PolarHBondContact OG-N 3.5Å
498	R	93.7	Very high	94.1	Very high	30 Å²	30	48.3 Å²	48.3	11%	0.113	25%	0.25	C	C	.	.	S	Bend	trans	-154.1	159.8	179.8	62.4	-175.7	-179	87.8	8.6	108.2	Y434 S459 L461 M463 I500 Q528	Y434-R498 PolarHBondContact OH-NH1 2.74Å; Y434-R498 VanDerWaalsContact OH-NH1 3.1Å; S459-R498 WeakPolarHBondContact O-CG 3.49Å; S459-R498 PolarHBondContact O-NE 2.71Å; L461-R498 PolarHBondContact O-NH2 2.86Å; M463-R498 PolarHBondContact O-NH2 3.41Å; R498-I500 HydrophobicContact CG-CG2 3.83Å; R498-I500 VanDerWaalsContact NH1-CG2 3.29Å; R498-Q528 PolarHBondContact NH1-O 2.62Å
499	D	92.6	Very high	94.2	Very high	55 Å²	55	49.7 Å²	49.7	29%	0.294	26%	0.255	S	S	.	.			trans	-71.1	137.5	170.3	-149.2	-23	0	0	0	110.7	V501	D499-V501 PolarHBondContact OD1-N 2.91Å
500	I	95.6	Very high	93.8	Very high	1 Å²	1	47.8 Å²	47.8	1%	0.005	25%	0.25	C	C	.	.			trans	-139.7	-6.9	-178.9	73.5	170.6	0	0	0	112.7	I455 A458 V465 R498	I455-I500 HydrophobicContact CG2-CD1 4.03Å; I455-I500 HydrophobicContact CG2-CG1 4.01Å; A458-I500 HydrophobicContact CB-CD1 3.64Å; V465-I500 HydrophobicContact CG2-CD1 4.37Å; V465-I500 PolarHBondContact N-O 2.97Å; R498-I500 HydrophobicContact CG-CG2 3.83Å; R498-I500 VanDerWaalsContact NH1-CG2 3.29Å
501	V	95.9	Very high	93.4	Very high	0 Å²	0	57 Å²	57	0%	0	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	129.4	-173.2	-177.4	0	0	0	0	107.8	I455 V465 I467 L481 D499	I455-V501 HydrophobicContact CD1-CG2 3.97Å; I455-V501 HydrophobicContact CG1-CG2 4.19Å; I455-V501 HydrophobicContact CG2-CG2 3.73Å; V465-V501 HydrophobicContact CB-CG2 4.4Å; V465-V501 CarbonylContact O-C 3.58Å; V465-V501 WeakPolarHBondContact O-CA 3.23Å; I467-V501 HydrophobicContact CD1-CG1 4.13Å; I467-V501 HydrophobicContact CG1-CG1 4.47Å; L481-V501 HydrophobicContact CB-CG1 4.06Å; L481-V501 WeakPolarHBondContact O-CB 3.45Å; D499-V501 PolarHBondContact OD1-N 2.91Å
502	Q	95.3	Very high	93.1	Very high	16 Å²	16	55.9 Å²	55.9	8%	0.075	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	123.2	164.3	177.2	71.5	73.2	0	0	108.7	V465 I466 I467 D482 V504 E524	V465-Q502 PolarHBondContact O-N 3.36Å; I466-Q502 CarbonylContact C-O 3.54Å; I466-Q502 WeakPolarHBondContact CA-O 3.47Å; I467-Q502 PolarHBondContact N-O 3.1Å; D482-Q502 WeakPolarHBondContact OD1-CA 3.41Å; Q502-V504 HydrophobicContact CG-CG2 4Å; Q502-E524 VanDerWaalsContact OE1-CG 3.23Å; Q502-E524 PolarHBondContact OE1-OE1 2.84Å
503	F	94.8	Very high	92.7	Very high	10 Å²	10	52 Å²	52	4%	0.044	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	132.2	170.8	174.7	-113.7	0	0	0	111.6	I467 F475 M478 Q479 D482 P505	I467-F503 HydrophobicContact CB-CD2 4.08Å; I467-F503 HydrophobicContact CG2-CD2 4Å; I467-F503 HydrophobicContact CG2-CE2 4.44Å; I467-F503 CarbonylContact O-C 3.57Å; I467-F503 WeakPolarHBondContact O-CA 3.3Å; I467-F503 WeakPolarHBondContact O-CD2 3.24Å; F475-F503 HydrophobicContact CB-CE1 3.78Å; F475-F503 HydrophobicContact CB-CE2 4.36Å; F475-F503 HydrophobicContact CB-CZ 3.4Å; F475-F503 VanDerWaalsContact CB-CZ 3.4Å; F475-F503 HydrophobicContact CD1-CE2 4.28Å; F475-F503 AromaticContact CD1-CZ 3.95Å; F475-F503 HydrophobicContact CD1-CZ 3.95Å; F475-F503 HydrophobicContact CD2-CZ 4.04Å; F475-F503 HydrophobicContact CG-CE1 4.37Å; F475-F503 HydrophobicContact CG-CE2 4.33Å; F475-F503 AromaticContact CG-CZ 3.55Å; F475-F503 HydrophobicContact CG-CZ 3.55Å; M478-F503 HydrophobicContact CB-CB 4.35Å; M478-F503 HydrophobicContact CB-CD1 3.8Å; M478-F503 HydrophobicContact CB-CD2 3.35Å; M478-F503 HydrophobicContact CB-CE1 3.91Å; M478-F503 HydrophobicContact CB-CE2 3.47Å; M478-F503 VanDerWaalsContact CB-CE2 3.47Å; M478-F503 HydrophobicContact CB-CG 3.53Å; M478-F503 HydrophobicContact CB-CZ 3.77Å; M478-F503 HydrophobicContact CG-CD2 3.95Å; M478-F503 HydrophobicContact CG-CE2 3.72Å; M478-F503 HydrophobicContact CG-CZ 4.19Å; Q479-F503 HydrophobicContact CG-CD1 4.06Å; Q479-F503 HydrophobicContact CG-CE1 4.12Å; D482-F503 HydrophobicContact CB-CB 4.05Å; D482-F503 PolarHBondContact OD1-N 2.95Å; F503-P505 HydrophobicContact CE1-CB 4.16Å; F503-P505 HydrophobicContact CE1-CG 4.24Å; F503-P505 HydrophobicContact CZ-CB 3.92Å; F503-P505 HydrophobicContact CZ-CG 4.47Å
504	V	95	Very high	92.4	Very high	1 Å²	1	54.6 Å²	54.6	1%	0.006	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.4	116.8	174.3	-176.1	0	0	0	0	110.8	I467 V468 G469 Q502 F506 F509 L517 V521	I467-V504 PolarHBondContact O-N 3.47Å; V468-V504 VanDerWaalsContact CA-O 3.29Å; V468-V504 WeakPolarHBondContact CA-O 3.28Å; G469-V504 PolarHBondContact N-O 2.66Å; Q502-V504 HydrophobicContact CG-CG2 4Å; V504-F506 PolarHBondContact O-N 3.43Å; V504-F509 HydrophobicContact CG1-CD2 4.07Å; V504-F509 HydrophobicContact CG1-CE2 3.46Å; V504-F509 VanDerWaalsContact CG1-CE2 3.46Å; V504-F509 HydrophobicContact CG1-CZ 4.23Å; V504-L517 HydrophobicContact CG1-CD1 4.07Å; V504-V521 HydrophobicContact CB-CG2 3.84Å; V504-V521 HydrophobicContact CG1-CG2 3.98Å; V504-V521 HydrophobicContact CG2-CB 4.37Å; V504-V521 HydrophobicContact CG2-CG2 3.78Å
505	P	95.3	Very high	91.9	Very high	21 Å²	21	51.8 Å²	51.8	14%	0.136	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76	116.3	172.9	31.6	-34.8	0	0	0	110.5	F475 F503 K507 D508	F475-P505 HydrophobicContact CD2-CB 4.18Å; F475-P505 HydrophobicContact CE2-CB 4.42Å; F503-P505 HydrophobicContact CE1-CB 4.16Å; F503-P505 HydrophobicContact CE1-CG 4.24Å; F503-P505 HydrophobicContact CZ-CB 3.92Å; F503-P505 HydrophobicContact CZ-CG 4.47Å; P505-K507 HydrophobicContact CB-CG 4.23Å; P505-K507 PolarHBondContact O-N 3.26Å; P505-D508 VanDerWaalsContact CG-OD2 3.26Å; P505-D508 WeakPolarHBondContact CG-OD2 3.31Å; P505-D508 PolarHBondContact O-N 2.91Å
506	F	95.4	Very high	91.7	Very high	9 Å²	9	50.6 Å²	50.6	4%	0.039	28%	0.281	C	S	.	.	G	3₁₀ helix	trans	-57	-29.8	-179.3	-172.1	-83.5	0	0	0	112.6	E335 K338 A339 V468 G469 V470 V504 D508 F509 K510 L517	E335-F506 HydrophobicContact CB-CD1 3.83Å; E335-F506 HydrophobicContact CB-CE1 3.88Å; E335-F506 HydrophobicContact CB-CG 4.21Å; E335-F506 HydrophobicContact CB-CZ 4.25Å; E335-F506 HydrophobicContact CG-CD1 3.68Å; E335-F506 HydrophobicContact CG-CE1 3.58Å; E335-F506 HydrophobicContact CG-CZ 4.32Å; E335-F506 WeakPolarHBondContact OE2-CD1 3.42Å; K338-F506 HydrophobicContact CB-CE2 3.79Å; K338-F506 HydrophobicContact CB-CZ 3.7Å; K338-F506 HydrophobicContact CD-CE1 4.41Å; K338-F506 HydrophobicContact CD-CZ 3.69Å; K338-F506 HydrophobicContact CG-CZ 4.37Å; A339-F506 HydrophobicContact CB-CD2 4.25Å; A339-F506 HydrophobicContact CB-CE2 4.36Å; V468-F506 HydrophobicContact CG1-CB 4.05Å; V468-F506 HydrophobicContact CG1-CD2 4.31Å; G469-F506 VanDerWaalsContact O-CB 3.27Å; G469-F506 WeakPolarHBondContact O-CB 3.42Å; G469-F506 PolarHBondContact O-N 3.06Å; V470-F506 HydrophobicContact CG1-CB 4.42Å; V504-F506 PolarHBondContact O-N 3.43Å; F506-D508 PolarHBondContact O-N 3.19Å; F506-D508 VanDerWaalsContact O-N 3.09Å; F506-F509 PolarHBondContact O-N 2.88Å; F506-K510 HydrophobicContact CD1-CG 4.38Å; F506-K510 HydrophobicContact CE1-CG 4.34Å; F506-K510 PolarHBondContact O-N 2.92Å; F506-L517 HydrophobicContact CD2-CD1 4.25Å; F506-L517 HydrophobicContact CD2-CD2 3.66Å; F506-L517 HydrophobicContact CE2-CD2 3.44Å; F506-L517 VanDerWaalsContact CE2-CD2 3.44Å
507	K	93.5	Very high	91.6	Very high	81 Å²	81	49.6 Å²	49.6	35%	0.352	28%	0.275	S	S	.	.	G	3₁₀ helix	trans	-56.7	-27.6	-178.3	71.8	-169.3	175.1	-174.6	0	113.9	F475 P505 F509	F475-K507 HydrophobicContact CE2-CD 4.38Å; P505-K507 HydrophobicContact CB-CG 4.23Å; P505-K507 PolarHBondContact O-N 3.26Å; K507-F509 PolarHBondContact O-N 3.37Å
508	D	93.1	Very high	91.5	Very high	111 Å²	111	44.6 Å²	44.6	59%	0.594	25%	0.249	S	C	*	.	G	3₁₀ helix	trans	-74.9	-13.1	179.6	-63.6	-5.9	0	0	0	112	P505 F506	P505-D508 VanDerWaalsContact CG-OD2 3.26Å; P505-D508 WeakPolarHBondContact CG-OD2 3.31Å; P505-D508 PolarHBondContact O-N 2.91Å; F506-D508 PolarHBondContact O-N 3.19Å; F506-D508 VanDerWaalsContact O-N 3.09Å
509	F	93.6	Very high	91.4	Very high	39 Å²	39	45.9 Å²	45.9	17%	0.171	26%	0.255	C	S	.	.	G	3₁₀ helix	trans	-116.5	9	-176.1	-59.3	-89.4	0	0	0	113.8	V504 F506 K507 H511 A512 A516 L517 S520	V504-F509 HydrophobicContact CG1-CD2 4.07Å; V504-F509 HydrophobicContact CG1-CE2 3.46Å; V504-F509 VanDerWaalsContact CG1-CE2 3.46Å; V504-F509 HydrophobicContact CG1-CZ 4.23Å; F506-F509 PolarHBondContact O-N 2.88Å; K507-F509 PolarHBondContact O-N 3.37Å; F509-H511 PolarHBondContact O-N 3.48Å; F509-A512 HydrophobicContact CB-CB 4.08Å; F509-A512 HydrophobicContact CD1-CB 4.03Å; F509-A512 PolarHBondContact O-N 3.25Å; F509-A516 HydrophobicContact CD1-CB 4.21Å; F509-A516 HydrophobicContact CE1-CB 4.46Å; F509-A516 VanDerWaalsContact CE1-O 3.3Å; F509-A516 WeakPolarHBondContact CE1-O 3.39Å; F509-L517 HydrophobicContact CB-CB 4.17Å; F509-L517 HydrophobicContact CB-CD1 4.22Å; F509-L517 HydrophobicContact CD1-CB 4.25Å; F509-L517 HydrophobicContact CD2-CD1 3.83Å; F509-L517 HydrophobicContact CE2-CD1 4.41Å; F509-L517 HydrophobicContact CG-CB 4.16Å; F509-L517 HydrophobicContact CG-CD1 3.99Å; F509-S520 VanDerWaalsContact CZ-CB 3.48Å
510	K	84.3	Confident	91.4	Very high	72 Å²	72	45.3 Å²	45.3	31%	0.313	26%	0.256	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53.2	-31.2	-177.3	-77.8	-179.1	-177.9	-167.5	0	114.6	E335 N472 F506	E335-K510 WeakPolarHBondContact OE1-CE 3.5Å; E335-K510 IonicContact OE1-NZ 3.85Å; E335-K510 PolarHBondContact OE1-NZ 2.83Å; N472-K510 PolarHBondContact OD1-NZ 2.94Å; F506-K510 HydrophobicContact CD1-CG 4.38Å; F506-K510 HydrophobicContact CE1-CG 4.34Å; F506-K510 PolarHBondContact O-N 2.92Å
511	H	85.8	Confident	91.3	Very high	196 Å²	196	45.2 Å²	45.2	91%	0.907	26%	0.255	S	S	*	.	T	Hydrogen-bonded Turn	trans	-112.7	5.2	179.5	-56.6	-54.2	0	0	0	113.2	F509	F509-H511 PolarHBondContact O-N 3.48Å
512	A	86.9	Confident	91.2	Very high	48 Å²	48	45.2 Å²	45.2	40%	0.397	26%	0.255	S	S	.	.	S	Bend	trans	-88	167.5	178.2	0	0	0	0	0	111	F509 A516	F509-A512 HydrophobicContact CB-CB 4.08Å; F509-A512 HydrophobicContact CD1-CB 4.03Å; F509-A512 PolarHBondContact O-N 3.25Å; A512-A516 HydrophobicContact CB-CB 3.91Å
513	S	85.2	Confident	90.9	Very high	65 Å²	65	47 Å²	47	46%	0.455	27%	0.273	S	S	.	.			trans	-70.5	153.8	171.4	63.3	0	0	0	0	110.5	A515 A516 L517	S513-A515 PolarHBondContact O-N 2.83Å; S513-A516 WeakPolarHBondContact O-CB 3.3Å; S513-A516 PolarHBondContact O-N 3.4Å; S513-A516 PolarHBondContact OG-N 3.23Å; S513-L517 PolarHBondContact O-N 3.45Å
514	P	85.5	Confident	90.7	Very high	92 Å²	92	48.6 Å²	48.6	60%	0.597	28%	0.281	S	S	*	.	H	α-helix	trans	-53.9	-35	171.2	-27.2	35.5	0	0	0	113	A342 A516 L517 A518	A342-P514 HydrophobicContact CB-CB 4.15Å; P514-A516 VanDerWaalsContact C-N 3.33Å; P514-A516 PolarHBondContact O-N 3.17Å; P514-L517 PolarHBondContact O-N 3.4Å; P514-A518 PolarHBondContact O-N 3.27Å
515	A	85.9	Confident	90.7	Very high	52 Å²	52	48.6 Å²	48.6	43%	0.43	28%	0.281	S	S	.	.	H	α-helix	trans	-61.8	-37.3	175.5	0	0	0	0	0	112.7	S513 A518 K519	S513-A515 PolarHBondContact O-N 2.83Å; A515-A518 PolarHBondContact O-N 3.32Å; A515-K519 WeakPolarHBondContact O-CB 3.37Å; A515-K519 PolarHBondContact O-N 3.34Å
516	A	90	Very high	90.7	Very high	33 Å²	33	47.8 Å²	47.8	27%	0.273	28%	0.275	S	S	.	.	H	α-helix	trans	-67.8	-38	177.6	0	0	0	0	0	112.4	F509 A512 S513 P514 S520	F509-A516 HydrophobicContact CD1-CB 4.21Å; F509-A516 HydrophobicContact CE1-CB 4.46Å; F509-A516 VanDerWaalsContact CE1-O 3.3Å; F509-A516 WeakPolarHBondContact CE1-O 3.39Å; A512-A516 HydrophobicContact CB-CB 3.91Å; S513-A516 WeakPolarHBondContact O-CB 3.3Å; S513-A516 PolarHBondContact O-N 3.4Å; S513-A516 PolarHBondContact OG-N 3.23Å; P514-A516 VanDerWaalsContact C-N 3.33Å; P514-A516 PolarHBondContact O-N 3.17Å; A516-S520 PolarHBondContact O-N 2.96Å
517	L	92.1	Very high	90.6	Very high	4 Å²	4	52 Å²	52	2%	0.021	30%	0.298	C	S	.	.	H	α-helix	trans	-63.6	-54.4	172.9	173.5	66.8	0	0	0	110.2	A339 A342 V504 F506 F509 S513 P514 K519 S520 V521	A339-L517 HydrophobicContact CB-CD2 4.38Å; A342-L517 HydrophobicContact CB-CD2 4.13Å; V504-L517 HydrophobicContact CG1-CD1 4.07Å; F506-L517 HydrophobicContact CD2-CD1 4.25Å; F506-L517 HydrophobicContact CD2-CD2 3.66Å; F506-L517 HydrophobicContact CE2-CD2 3.44Å; F506-L517 VanDerWaalsContact CE2-CD2 3.44Å; F509-L517 HydrophobicContact CB-CB 4.17Å; F509-L517 HydrophobicContact CB-CD1 4.22Å; F509-L517 HydrophobicContact CD1-CB 4.25Å; F509-L517 HydrophobicContact CD2-CD1 3.83Å; F509-L517 HydrophobicContact CE2-CD1 4.41Å; F509-L517 HydrophobicContact CG-CB 4.16Å; F509-L517 HydrophobicContact CG-CD1 3.99Å; S513-L517 PolarHBondContact O-N 3.45Å; P514-L517 PolarHBondContact O-N 3.4Å; L517-K519 PolarHBondContact O-N 2.98Å; L517-S520 PolarHBondContact O-N 2.88Å; L517-V521 HydrophobicContact CD1-CG2 3.78Å; L517-V521 HydrophobicContact CG-CG2 4.09Å; L517-V521 WeakPolarHBondContact O-CB 3.39Å; L517-V521 WeakPolarHBondContact O-CG2 3.45Å; L517-V521 PolarHBondContact O-N 3.08Å
518	A	92.3	Very high	90.7	Very high	1 Å²	1	48.3 Å²	48.3	1%	0.008	28%	0.282	C	S	.	.	H	α-helix	trans	-56.6	-38.6	-179	0	0	0	0	0	112.2	A342 I346 P514 A515 S520 V521 L522	A342-A518 HydrophobicContact CB-CB 4.45Å; A342-A518 WeakPolarHBondContact O-CB 3.4Å; I346-A518 HydrophobicContact CD1-CB 3.39Å; P514-A518 PolarHBondContact O-N 3.27Å; A515-A518 PolarHBondContact O-N 3.32Å; A518-S520 PolarHBondContact O-N 3.45Å; A518-V521 PolarHBondContact O-N 2.87Å; A518-L522 WeakPolarHBondContact O-CB 3.26Å; A518-L522 PolarHBondContact O-N 3.37Å
519	K	91.1	Very high	90.9	Very high	56 Å²	56	43 Å²	43	24%	0.243	25%	0.254	C	S	.	.	H	α-helix	trans	-55.9	-47.9	174.4	175	157	-163.8	151.5	0	113.7	S17 E83 A515 L517 A523	S17-K519 WeakPolarHBondContact OG-CE 3.24Å; S17-K519 PolarHBondContact OG-NZ 3.14Å; E83-K519 HydrophobicContact CG-CB 3.84Å; E83-K519 HydrophobicContact CG-CD 4.34Å; E83-K519 HydrophobicContact CG-CG 3.79Å; E83-K519 IonicContact OE1-NZ 2.73Å; A515-K519 WeakPolarHBondContact O-CB 3.37Å; A515-K519 PolarHBondContact O-N 3.34Å; L517-K519 PolarHBondContact O-N 2.98Å; K519-A523 WeakPolarHBondContact O-CB 3.27Å; K519-A523 PolarHBondContact O-N 3.3Å
520	S	92	Very high	90.9	Very high	43 Å²	43	42.4 Å²	42.4	30%	0.301	25%	0.253	S	S	.	.	H	α-helix	trans	-69.6	-36.6	177.2	-164.8	0	0	0	0	111.9	F509 A516 L517 A518	F509-S520 VanDerWaalsContact CZ-CB 3.48Å; A516-S520 PolarHBondContact O-N 2.96Å; L517-S520 PolarHBondContact O-N 2.88Å; A518-S520 PolarHBondContact O-N 3.45Å
521	V	93.4	Very high	91.3	Very high	0 Å²	0	43.3 Å²	43.3	0%	0	26%	0.261	C	S	.	.	H	α-helix	trans	-73	-34.4	-174.4	174.2	0	0	0	0	112.6	V343 I466 V468 V504 L517 A518	V343-V521 HydrophobicContact CG1-CG1 4.43Å; V343-V521 HydrophobicContact CG2-CB 4.2Å; V343-V521 HydrophobicContact CG2-CG1 3.61Å; I466-V521 HydrophobicContact CD1-CG1 4.41Å; I466-V521 HydrophobicContact CG2-CG1 3.31Å; V468-V521 HydrophobicContact CG2-CG1 4.18Å; V468-V521 HydrophobicContact CG2-CG2 3.9Å; V504-V521 HydrophobicContact CB-CG2 3.84Å; V504-V521 HydrophobicContact CG1-CG2 3.98Å; V504-V521 HydrophobicContact CG2-CB 4.37Å; V504-V521 HydrophobicContact CG2-CG2 3.78Å; L517-V521 HydrophobicContact CD1-CG2 3.78Å; L517-V521 HydrophobicContact CG-CG2 4.09Å; L517-V521 WeakPolarHBondContact O-CB 3.39Å; L517-V521 WeakPolarHBondContact O-CG2 3.45Å; L517-V521 PolarHBondContact O-N 3.08Å; A518-V521 PolarHBondContact O-N 2.87Å
522	L	94.3	Very high	91.8	Very high	0 Å²	0	34.2 Å²	34.2	0%	0	22%	0.219	C	C	.	.	S	Bend	trans	-103.6	3.1	-175.4	-67.8	174.8	0	0	0	113.5	F82 E83 V343 I346 I466 A518 E524 V525	F82-L522 HydrophobicContact CD1-CB 4.12Å; F82-L522 HydrophobicContact CE1-CB 3.82Å; F82-L522 HydrophobicContact CE1-CD1 4.3Å; F82-L522 HydrophobicContact CE1-CD2 4.03Å; F82-L522 HydrophobicContact CE1-CG 4.27Å; F82-L522 HydrophobicContact CZ-CD2 4.46Å; E83-L522 HydrophobicContact CB-CB 3.91Å; V343-L522 HydrophobicContact CG1-CD1 4.44Å; V343-L522 HydrophobicContact CG1-CD2 4.04Å; V343-L522 HydrophobicContact CG1-CG 4.36Å; I346-L522 HydrophobicContact CB-CD1 3.91Å; I346-L522 HydrophobicContact CD1-CD1 3.73Å; I346-L522 HydrophobicContact CG1-CD1 4.46Å; I346-L522 HydrophobicContact CG2-CD1 3.68Å; I466-L522 HydrophobicContact CD1-CD2 3.88Å; A518-L522 WeakPolarHBondContact O-CB 3.26Å; A518-L522 PolarHBondContact O-N 3.37Å; L522-E524 VanDerWaalsContact C-N 3.29Å; L522-E524 PolarHBondContact O-N 2.85Å; L522-V525 HydrophobicContact CD2-CG2 4.14Å; L522-V525 PolarHBondContact O-N 2.88Å
523	A	89.3	Confident	92.2	Very high	54 Å²	54	32 Å²	32	45%	0.446	20%	0.2	S	C	.	.	T	Hydrogen-bonded Turn	trans	-54.6	-41.6	-171.1	0	0	0	0	0	113.4	K519	K519-A523 WeakPolarHBondContact O-CB 3.27Å; K519-A523 PolarHBondContact O-N 3.3Å
524	E	91.4	Very high	92.5	Very high	43 Å²	43	30.1 Å²	30.1	20%	0.201	19%	0.185	C	C	.	.	T	Hydrogen-bonded Turn	trans	-92	-17.4	-172.6	-68.8	-171.1	-178.2	0	0	114.8	Q502 L522 N527 Q528	Q502-E524 VanDerWaalsContact OE1-CG 3.23Å; Q502-E524 PolarHBondContact OE1-OE1 2.84Å; L522-E524 VanDerWaalsContact C-N 3.29Å; L522-E524 PolarHBondContact O-N 2.85Å; E524-N527 PolarHBondContact O-N 3.06Å; E524-Q528 HydrophobicContact CB-CG 4.22Å; E524-Q528 WeakPolarHBondContact O-CG 3.37Å; E524-Q528 PolarHBondContact O-N 2.75Å; E524-Q528 PolarHBondContact OE2-NE2 3.39Å
525	V	94.8	Very high	92.8	Very high	1 Å²	1	30 Å²	30	1%	0.006	19%	0.192	C	C	.	.	H	α-helix	trans	-53.2	-46.7	-173.1	171.1	0	0	0	0	112.2	F82 I436 I466 L522 N527 Q528 V529	F82-V525 HydrophobicContact CD1-CB 4.46Å; F82-V525 HydrophobicContact CE1-CB 3.7Å; F82-V525 HydrophobicContact CE1-CG1 3.71Å; F82-V525 HydrophobicContact CE1-CG2 4.37Å; F82-V525 HydrophobicContact CZ-CB 4.33Å; F82-V525 HydrophobicContact CZ-CG1 3.82Å; I436-V525 HydrophobicContact CD1-CG1 3.54Å; I436-V525 HydrophobicContact CD1-CG2 4.2Å; I436-V525 HydrophobicContact CG1-CG1 4.43Å; I466-V525 HydrophobicContact CD1-CG2 3.85Å; L522-V525 HydrophobicContact CD2-CG2 4.14Å; L522-V525 PolarHBondContact O-N 2.88Å; V525-N527 VanDerWaalsContact C-N 3.3Å; V525-N527 PolarHBondContact O-N 2.9Å; V525-Q528 PolarHBondContact O-N 3.33Å; V525-V529 HydrophobicContact CG1-CG2 4.35Å; V525-V529 VanDerWaalsContact O-CG2 3.29Å; V525-V529 WeakPolarHBondContact O-CG2 3.39Å; V525-V529 PolarHBondContact O-N 3.02Å
526	P	94.9	Very high	93.1	Very high	4 Å²	4	32.1 Å²	32.1	3%	0.026	19%	0.191	C	C	.	.	H	α-helix	trans	-56.7	-42.5	178.3	-27.1	37.1	0	0	0	113.4	L20 F82 F294 V529 V530	L20-P526 HydrophobicContact CD1-CB 3.94Å; L20-P526 HydrophobicContact CD1-CG 4.4Å; L20-P526 HydrophobicContact CD2-CB 4Å; L20-P526 HydrophobicContact CD2-CG 4.21Å; F82-P526 HydrophobicContact CB-CG 3.84Å; F82-P526 HydrophobicContact CD1-CG 3.62Å; F82-P526 HydrophobicContact CE1-CG 4.4Å; F82-P526 HydrophobicContact CG-CG 3.83Å; F294-P526 HydrophobicContact CB-CB 3.95Å; F294-P526 HydrophobicContact CD1-CB 4.24Å; F294-P526 HydrophobicContact CD2-CB 4.04Å; F294-P526 HydrophobicContact CG-CB 3.81Å; F294-P526 HydrophobicContact CG-CG 4.49Å; P526-V529 PolarHBondContact O-N 2.9Å; P526-V530 WeakPolarHBondContact O-CB 3.43Å; P526-V530 VanDerWaalsContact O-CG2 3.26Å; P526-V530 WeakPolarHBondContact O-CG2 3.32Å; P526-V530 PolarHBondContact O-N 3.45Å; P526-V530 VanDerWaalsContact O-N 3.11Å
527	N	92.9	Very high	93.1	Very high	96 Å²	96	33.2 Å²	33.2	51%	0.513	21%	0.206	S	C	.	.	H	α-helix	trans	-69.4	-43.7	178.6	-69.2	-25.6	0	0	0	111	E524 V525 V529 V530 D531	E524-N527 PolarHBondContact O-N 3.06Å; V525-N527 VanDerWaalsContact C-N 3.3Å; V525-N527 PolarHBondContact O-N 2.9Å; N527-V529 PolarHBondContact O-N 3.04Å; N527-V530 PolarHBondContact O-N 3.25Å; N527-V530 VanDerWaalsContact O-N 3.15Å; N527-D531 VanDerWaalsContact O-CB 3.3Å; N527-D531 WeakPolarHBondContact O-CB 3.19Å; N527-D531 VanDerWaalsContact O-CG 3.27Å; N527-D531 PolarHBondContact O-N 3.07Å
528	Q	95.8	Very high	93.2	Very high	5 Å²	5	34 Å²	34	2%	0.023	21%	0.211	C	C	.	.	H	α-helix	trans	-61.5	-31.6	178.8	-66.4	177.2	1.3	0	0	112.5	Y434 S464 R498 E524 V525 Y532	Y434-Q528 VanDerWaalsContact OH-C 3.31Å; Y434-Q528 PolarHBondContact OH-O 2.99Å; S464-Q528 PolarHBondContact OG-OE1 2.87Å; R498-Q528 PolarHBondContact NH1-O 2.62Å; E524-Q528 HydrophobicContact CB-CG 4.22Å; E524-Q528 WeakPolarHBondContact O-CG 3.37Å; E524-Q528 PolarHBondContact O-N 2.75Å; E524-Q528 PolarHBondContact OE2-NE2 3.39Å; V525-Q528 PolarHBondContact O-N 3.33Å; Q528-Y532 WeakPolarHBondContact O-CB 3.38Å; Q528-Y532 PolarHBondContact O-N 3.22Å
529	V	96.4	Very high	93.2	Very high	0 Å²	0	40.6 Å²	40.6	0%	0	24%	0.239	C	C	.	.	H	α-helix	trans	-69.2	-52.2	172.1	172.5	0	0	0	0	111.2	F294 Y434 V525 P526 N527 D531 Y532 Y533	F294-V529 HydrophobicContact CD2-CB 4.02Å; F294-V529 HydrophobicContact CD2-CG1 4.03Å; F294-V529 HydrophobicContact CD2-CG2 4.3Å; F294-V529 HydrophobicContact CE2-CB 4.31Å; F294-V529 HydrophobicContact CE2-CG1 4.34Å; F294-V529 HydrophobicContact CE2-CG2 4.09Å; Y434-V529 HydrophobicContact CD1-CG2 3.63Å; Y434-V529 HydrophobicContact CD2-CB 4.37Å; Y434-V529 HydrophobicContact CD2-CG1 4.32Å; Y434-V529 HydrophobicContact CD2-CG2 3.89Å; Y434-V529 HydrophobicContact CE1-CG2 3.64Å; Y434-V529 HydrophobicContact CE2-CB 4.24Å; Y434-V529 HydrophobicContact CE2-CG2 3.88Å; Y434-V529 HydrophobicContact CG-CG2 3.74Å; V525-V529 HydrophobicContact CG1-CG2 4.35Å; V525-V529 VanDerWaalsContact O-CG2 3.29Å; V525-V529 WeakPolarHBondContact O-CG2 3.39Å; V525-V529 PolarHBondContact O-N 3.02Å; P526-V529 PolarHBondContact O-N 2.9Å; N527-V529 PolarHBondContact O-N 3.04Å; V529-D531 VanDerWaalsContact C-N 3.35Å; V529-D531 PolarHBondContact O-N 3.43Å; V529-Y532 PolarHBondContact O-N 2.72Å; V529-Y533 HydrophobicContact CG1-CD2 3.87Å; V529-Y533 HydrophobicContact CG1-CE2 3.99Å; V529-Y533 WeakPolarHBondContact O-CD2 3.36Å; V529-Y533 PolarHBondContact O-N 2.96Å; V529-Y533 VanDerWaalsContact O-N 3.15Å
530	V	93.9	Very high	93.2	Very high	26 Å²	26	39 Å²	39	16%	0.158	23%	0.234	C	C	.	.	H	α-helix	trans	-59.8	-45.3	-179.2	165.9	0	0	0	0	110.9	F294 P526 N527 Y532 N534	F294-V530 HydrophobicContact CB-CG2 4.04Å; F294-V530 VanDerWaalsContact N-CG2 3.32Å; P526-V530 WeakPolarHBondContact O-CB 3.43Å; P526-V530 VanDerWaalsContact O-CG2 3.26Å; P526-V530 WeakPolarHBondContact O-CG2 3.32Å; P526-V530 PolarHBondContact O-N 3.45Å; P526-V530 VanDerWaalsContact O-N 3.11Å; N527-V530 PolarHBondContact O-N 3.25Å; N527-V530 VanDerWaalsContact O-N 3.15Å; V530-Y532 PolarHBondContact O-N 3.08Å; V530-N534 WeakPolarHBondContact CG1-ND2 3.42Å; V530-N534 VanDerWaalsContact O-CB 3.23Å; V530-N534 WeakPolarHBondContact O-CB 3.48Å; V530-N534 PolarHBondContact O-N 3.48Å; V530-N534 PolarHBondContact O-ND2 2.85Å
531	D	93.2	Very high	92.8	Very high	90 Å²	90	40.3 Å²	40.3	48%	0.481	24%	0.235	S	C	.	.	H	α-helix	trans	-61.8	-44.8	-180	-76.6	-16.3	0	0	0	111.4	N527 V529 A535	N527-D531 VanDerWaalsContact O-CB 3.3Å; N527-D531 WeakPolarHBondContact O-CB 3.19Å; N527-D531 VanDerWaalsContact O-CG 3.27Å; N527-D531 PolarHBondContact O-N 3.07Å; V529-D531 VanDerWaalsContact C-N 3.35Å; V529-D531 PolarHBondContact O-N 3.43Å; D531-A535 WeakPolarHBondContact O-CB 3.25Å; D531-A535 PolarHBondContact O-N 3.24Å
532	Y	96.2	Very high	91.5	Very high	6 Å²	6	44.7 Å²	44.7	2%	0.024	26%	0.264	C	S	.	.	H	α-helix	trans	-61	-57.4	178.3	174	-97.4	0	0	0	111.7	Y434 L461 P462 Q528 V529 V530 A535 K536	Y434-Y532 HydrophobicContact CE2-CD1 4.34Å; Y434-Y532 HydrophobicContact CE2-CG 4.35Å; L461-Y532 WeakPolarHBondContact O-CD2 3.38Å; L461-Y532 WeakPolarHBondContact O-CE2 3.36Å; P462-Y532 HydrophobicContact CB-CD1 3.91Å; P462-Y532 HydrophobicContact CB-CE1 3.47Å; P462-Y532 VanDerWaalsContact CB-CE1 3.47Å; P462-Y532 HydrophobicContact CB-CE2 4.48Å; P462-Y532 WeakPolarHBondContact CD-OH 3.44Å; P462-Y532 HydrophobicContact CG-CE1 4.27Å; Q528-Y532 WeakPolarHBondContact O-CB 3.38Å; Q528-Y532 PolarHBondContact O-N 3.22Å; V529-Y532 PolarHBondContact O-N 2.72Å; V530-Y532 PolarHBondContact O-N 3.08Å; Y532-A535 PolarHBondContact O-N 3.44Å; Y532-K536 HydrophobicContact CE2-CG 4.19Å; Y532-K536 VanDerWaalsContact O-CG 3.3Å; Y532-K536 WeakPolarHBondContact O-CG 3.33Å; Y532-K536 PolarHBondContact O-N 3.47Å; Y532-K536 VanDerWaalsContact O-N 3.15Å
533	Y	95.6	Very high	89.6	Confident	1 Å²	1	47.8 Å²	47.8	0%	0.004	28%	0.28	C	S	.	.	H	α-helix	trans	-71.5	-40.2	-171.5	-73.4	-60.4	0	0	0	112.6	Y297 A431 E433 Y434 V529 K536 G537 I538	Y297-Y533 AromaticContact CD1-CD2 3.97Å; Y297-Y533 HydrophobicContact CD1-CD2 3.97Å; Y297-Y533 HydrophobicContact CD1-CG 4.23Å; Y297-Y533 HydrophobicContact CD2-CD2 4.37Å; Y297-Y533 AromaticContact CE1-CD2 3.97Å; Y297-Y533 HydrophobicContact CE1-CD2 3.97Å; Y297-Y533 AromaticContact CE1-CG 3.79Å; Y297-Y533 HydrophobicContact CE1-CG 3.79Å; Y297-Y533 HydrophobicContact CE2-CD2 4.38Å; Y297-Y533 HydrophobicContact CG-CD2 4.19Å; Y297-Y533 AromaticContact CZ-CG 3.98Å; Y297-Y533 WeakPolarHBondContact OH-CB 3.08Å; A431-Y533 HydrophobicContact CB-CD1 3.81Å; A431-Y533 HydrophobicContact CB-CD2 4.3Å; A431-Y533 HydrophobicContact CB-CE1 3.51Å; A431-Y533 HydrophobicContact CB-CE2 4.03Å; A431-Y533 HydrophobicContact CB-CG 4.2Å; E433-Y533 PolarHBondContact O-OH 3.38Å; Y434-Y533 AromaticContact CD2-CE2 3.81Å; Y434-Y533 HydrophobicContact CD2-CE2 3.81Å; V529-Y533 HydrophobicContact CG1-CD2 3.87Å; V529-Y533 HydrophobicContact CG1-CE2 3.99Å; V529-Y533 WeakPolarHBondContact O-CD2 3.36Å; V529-Y533 PolarHBondContact O-N 2.96Å; V529-Y533 VanDerWaalsContact O-N 3.15Å; Y533-K536 CarbonylContact O-C 3.55Å; Y533-K536 PolarHBondContact O-N 2.99Å; Y533-G537 PolarHBondContact O-N 2.64Å; Y533-I538 HydrophobicContact CD1-CB 3.88Å; Y533-I538 HydrophobicContact CD1-CD1 4.04Å; Y533-I538 HydrophobicContact CD1-CG2 3.78Å; Y533-I538 HydrophobicContact CE1-CD1 4.44Å; Y533-I538 HydrophobicContact CE1-CG2 4.27Å; Y533-I538 PolarHBondContact O-N 3.43Å
534	N	92.3	Very high	87.6	Confident	26 Å²	26	49.7 Å²	49.7	14%	0.139	29%	0.29	C	S	.	.	H	α-helix	trans	-67.3	-39.4	176.7	-72.6	-66	0	0	0	111.7	M291 Y292 V530 K536 G537	M291-N534 HydrophobicContact CE-CB 3.55Å; M291-N534 HydrophobicContact SD-CB 4.25Å; Y292-N534 PolarHBondContact N-OD1 2.9Å; Y292-N534 PolarHBondContact O-ND2 2.71Å; V530-N534 WeakPolarHBondContact CG1-ND2 3.42Å; V530-N534 VanDerWaalsContact O-CB 3.23Å; V530-N534 WeakPolarHBondContact O-CB 3.48Å; V530-N534 PolarHBondContact O-N 3.48Å; V530-N534 PolarHBondContact O-ND2 2.85Å; N534-K536 PolarHBondContact O-N 3.27Å; N534-G537 PolarHBondContact O-N 2.74Å
535	A	90.7	Very high	84.8	Confident	89 Å²	89	54.4 Å²	54.4	74%	0.736	32%	0.316	S	S	*	.	H	α-helix	trans	-63.6	-31.7	176.4	0	0	0	0	0	112.5	D531 Y532 G537	D531-A535 WeakPolarHBondContact O-CB 3.25Å; D531-A535 PolarHBondContact O-N 3.24Å; Y532-A535 PolarHBondContact O-N 3.44Å; A535-G537 VanDerWaalsContact C-N 3.33Å
536	K	91.9	Very high	82.1	Confident	96 Å²	96	61.7 Å²	61.7	42%	0.417	35%	0.345	S	S	.	.	H	α-helix	trans	-82.8	-7.9	173.7	-63.2	-68.3	-175.2	173.1	0	113.5	Y532 Y533 N534 I538	Y532-K536 HydrophobicContact CE2-CG 4.19Å; Y532-K536 VanDerWaalsContact O-CG 3.3Å; Y532-K536 WeakPolarHBondContact O-CG 3.33Å; Y532-K536 PolarHBondContact O-N 3.47Å; Y532-K536 VanDerWaalsContact O-N 3.15Å; Y533-K536 CarbonylContact O-C 3.55Å; Y533-K536 PolarHBondContact O-N 2.99Å; N534-K536 PolarHBondContact O-N 3.27Å; K536-I538 HydrophobicContact CB-CD1 3.75Å; K536-I538 HydrophobicContact CB-CG1 3.82Å; K536-I538 HydrophobicContact CG-CD1 4.43Å; K536-I538 PolarHBondContact O-N 3.13Å
537	G	90.7	Very high	79.1	Confident	57 Å²	57	70.6 Å²	70.6	59%	0.588	39%	0.386	S	S	*	.	T	Hydrogen-bonded Turn	trans	66.1	23.3	-174.7	0	0	0	0	0	113.6	Y533 N534 A535	Y533-G537 PolarHBondContact O-N 2.64Å; N534-G537 PolarHBondContact O-N 2.74Å; A535-G537 VanDerWaalsContact C-N 3.33Å
538	I	93.3	Very high	76.4	Confident	21 Å²	21	69.1 Å²	69.1	11%	0.108	38%	0.383	C	S	.	.	P	Polyproline II helix	trans	-83.1	127.5	177.8	-63	171.1	0	0	0	108	Y297 A431 Y533 K536	Y297-I538 PolarHBondContact OH-O 2.8Å; A431-I538 HydrophobicContact CB-CG2 3.94Å; Y533-I538 HydrophobicContact CD1-CB 3.88Å; Y533-I538 HydrophobicContact CD1-CD1 4.04Å; Y533-I538 HydrophobicContact CD1-CG2 3.78Å; Y533-I538 HydrophobicContact CE1-CD1 4.44Å; Y533-I538 HydrophobicContact CE1-CG2 4.27Å; Y533-I538 PolarHBondContact O-N 3.43Å; K536-I538 HydrophobicContact CB-CD1 3.75Å; K536-I538 HydrophobicContact CB-CG1 3.82Å; K536-I538 HydrophobicContact CG-CD1 4.43Å; K536-I538 PolarHBondContact O-N 3.13Å
539	K	92.5	Very high	73.2	Confident	138 Å²	138	73.5 Å²	73.5	60%	0.6	41%	0.414	S	S	*	.	P	Polyproline II helix	trans	-95.2	146.9	-176	-58.1	-178.1	176.6	179.5	0	110.3	Y292	Y292-K539 HydrophobicContact CE2-CB 4.06Å; Y292-K539 HydrophobicContact CE2-CD 4.49Å; Y292-K539 HydrophobicContact CE2-CG 3.79Å; Y292-K539 WeakPolarHBondContact OH-CD 3.37Å
540	P	90.7	Very high	70.1	Confident	22 Å²	22	83.3 Å²	83.3	14%	0.143	45%	0.451	C	S	.	.	P	Polyproline II helix	trans	-60.3	148.9	166.2	30.3	-37.7	0	0	0	109.8	Y292 D296 Y297	Y292-P540 HydrophobicContact CD1-CG 3.26Å; Y292-P540 HydrophobicContact CD2-CG 4.38Å; Y292-P540 HydrophobicContact CE1-CG 3.57Å; Y292-P540 HydrophobicContact CG-CG 3.68Å; D296-P540 HydrophobicContact CB-CB 4.45Å; D296-P540 HydrophobicContact CB-CG 4.14Å; D296-P540 WeakPolarHBondContact O-CB 3.29Å; Y297-P540 HydrophobicContact CD1-CB 3.88Å; Y297-P540 HydrophobicContact CE1-CB 4.22Å; Y297-P540 HydrophobicContact CG-CB 4.45Å
541	K	85.1	Confident	66.9	Low	72 Å²	72	88.6 Å²	88.6	31%	0.313	48%	0.484	S	S	.	.	P	Polyproline II helix	trans	-73.4	148.3	176.5	-69.5	-170.1	172.2	-173.8	0	111.2	G300 E430 M432	G300-K541 WeakPolarHBondContact CA-O 3.32Å; G300-K541 WeakPolarHBondContact O-CB 3.42Å; E430-K541 WeakPolarHBondContact OE1-CE 3.47Å; E430-K541 IonicContact OE1-NZ 2.67Å; E430-K541 PolarHBondContact OE1-NZ 2.86Å; E430-K541 VanDerWaalsContact OE2-CE 3.29Å; E430-K541 WeakPolarHBondContact OE2-CE 3.43Å; E430-K541 IonicContact OE2-NZ 3.33Å; E430-K541 PolarHBondContact OE2-NZ 3.36Å; M432-K541 HydrophobicContact CE-CD 4.2Å; M432-K541 HydrophobicContact SD-CD 3.51Å; M432-K541 VanDerWaalsContact SD-CD 3.51Å; M432-K541 WeakPolarHBondContact SD-CE 3.34Å; M432-K541 HydrophobicContact SD-CG 4.48Å; M432-K541 PolarHBondContact SD-NZ 2.97Å
542	C	65.9	Low	64	Low	91 Å²	91	90.7 Å²	90.7	62%	0.615	49%	0.489	S	S	*	.	P	Polyproline II helix	trans	-91.7	116.4	171.5	-153.4	0	0	0	0	108.6	S544	C542-S544 PolarHBondContact O-N 3.39Å
543	I	54.2	Low	60.7	Low	66 Å²	66	95.7 Å²	95.7	34%	0.338	53%	0.525	S	S	.	.	G	3₁₀ helix	trans	-65.8	1.3	-178.3	-60.8	167.1	0	0	0	113.3	R122 M299 D545 Y546	R122-I543 HydrophobicContact CB-CD1 4.32Å; M299-I543 WeakPolarHBondContact O-CD1 3.23Å; I543-D545 PolarHBondContact O-N 3.42Å; I543-Y546 PolarHBondContact O-N 2.81Å
544	S	46.2	Very low	57.6	Low	94 Å²	94	105.3 Å²	105.3	66%	0.657	59%	0.588	S	S	*	*	G	3₁₀ helix	trans	-58.3	-15.9	172.8	58.2	0	0	0	0	113.7	C542	C542-S544 PolarHBondContact O-N 3.39Å
545	D	33.7	Very low	55.8	Low	141 Å²	141	109.3 Å²	109.3	75%	0.754	61%	0.61	S	S	*	*	G	3₁₀ helix	trans	-114.6	15.3	-173	-60.4	-20	0	0	0	114.9	I543	I543-D545 PolarHBondContact O-N 3.42Å
546	Y	37.7	Very low	54	Low	154 Å²	154	110.4 Å²	110.4	60%	0.604	60%	0.603	S	S	*	*			trans	-126.9	106.9	177.9	-138.9	-107.2	0	0	0	114.5	I543 S549	I543-Y546 PolarHBondContact O-N 2.81Å; Y546-S549 PolarHBondContact OH-OG 3.3Å
547	E	33.1	Very low	51.9	Low	192 Å²	192	111.2 Å²	111.2	90%	0.897	61%	0.614	S	S	*	*			trans	-80.5	114.5	145.2	-76.1	-177.6	155.4	0	0	106.7	S549	E547-S549 PolarHBondContact O-N 3.28Å; E547-S549 VanDerWaalsContact O-N 3.11Å
548	S	35.1	Very low	49.6	Very low	64 Å²	64	114.4 Å²	114.4	45%	0.448	62%	0.615	S	S	.	*			trans	-55.3	119.8	178.2	-179.2	0	0	0	0	111.2	R550	S548-R550 VanDerWaalsContact C-N 3.3Å; S548-R550 PolarHBondContact OG-N 3.22Å; S548-R550 PolarHBondContact OG-O 3.11Å
549	S	29	Very low	46.9	Very low	97 Å²	97	120.2 Å²	120.2	68%	0.678	65%	0.647	S	S	*	*	S	Bend	trans	-84	-2.4	173.4	60.8	0	0	0	0	113.4	Y546 E547	Y546-S549 PolarHBondContact OH-OG 3.3Å; E547-S549 PolarHBondContact O-N 3.28Å; E547-S549 VanDerWaalsContact O-N 3.11Å
550	R	31.9	Very low	43.8	Very low	206 Å²	206	119 Å²	119	78%	0.777	65%	0.65	S	S	*	*	S	Bend	trans	-113.1	115.9	173.4	-69.8	-174.2	-175.6	179.7	2.7	109.4	S548 F552	S548-R550 VanDerWaalsContact C-N 3.3Å; S548-R550 PolarHBondContact OG-N 3.22Å; S548-R550 PolarHBondContact OG-O 3.11Å; R550-F552 PolarHBondContact O-N 2.97Å
551	T	26.3	Very low	40.5	Very low	137 Å²	137	125.9 Å²	125.9	84%	0.84	69%	0.686	S	S	*	*	P	Polyproline II helix	trans	-63.8	116	172.5	42.1	0	0	0	0	109	S553	T551-S553 PolarHBondContact O-N 3Å
552	F	32.5	Very low	37	Very low	135 Å²	135	130.1 Å²	130.1	59%	0.592	72%	0.715	S	S	*	*	P	Polyproline II helix	trans	-53.3	124.9	163.2	-65.9	-83.4	0	0	0	108.6	R550	R550-F552 PolarHBondContact O-N 2.97Å
553	S	25.5	Very low	34.6	Very low	110 Å²	110	133.3 Å²	133.3	77%	0.769	72%	0.723	S	S	*	*	P	Polyproline II helix	trans	-68.1	146.2	168.9	-73.7	0	0	0	0	109.3	T551	T551-S553 PolarHBondContact O-N 3Å
554	P	30.5	Very low	32.9	Very low	204 Å²	204	139.5 Å²	139.5	100%	1.325	76%	0.758	S	S	*	*			trans	-62.3	0	-168.8	23.1	-33.4	0	0	0	115.5

Retrieved 554 of 554 residues in 223.1 ms (Link to these results)

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