A0A077Z022_TRITR Loading...

Kinesin domain containing protein

AlphaFold DB , UniProt , Accession A0A077Z022, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 439 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	55.5	Low	68.1	Low	214 Å²	214	128.8 Å²	128.8	100%	1.054	64%	0.642	S	S	*	*				0	-48.7	0	-143.2	178.4	-90.7	0	0	111.4	A3 R4	M1-A3 PolarHBondContact O-N 3.15Å; M1-R4 PolarHBondContact O-N 3.17Å; M1-R4 VanDerWaalsContact O-N 3.17Å
2	F	58	Low	69.5	Low	187 Å²	187	129.4 Å²	129.4	82%	0.82	64%	0.641	S	S	*	*	H	α-helix	trans	-53.2	-41.7	178.3	-82.8	-85	0	0	0	116.9	R4 T5 F6	F2-R4 VanDerWaalsContact C-N 3.26Å; F2-R4 PolarHBondContact O-N 3.33Å; F2-T5 PolarHBondContact O-N 3.17Å; F2-T5 PolarHBondContact O-OG1 3.32Å; F2-F6 PolarHBondContact O-N 3.3Å; F2-F6 VanDerWaalsContact O-N 3.15Å
3	A	60.1	Low	70.9	Confident	82 Å²	82	128.7 Å²	128.7	68%	0.678	63%	0.632	S	S	*	*	H	α-helix	trans	-66.5	-25.8	-179.6	0	0	0	0	0	113.6	M1	M1-A3 PolarHBondContact O-N 3.15Å
4	R	59.2	Low	72.1	Confident	223 Å²	223	124.6 Å²	124.6	84%	0.842	61%	0.614	S	S	*	*	H	α-helix	trans	-78.7	-22.7	179.1	-79.4	-171.1	177.1	179.9	-1	113.2	M1 F2 P8	M1-R4 PolarHBondContact O-N 3.17Å; M1-R4 VanDerWaalsContact O-N 3.17Å; F2-R4 VanDerWaalsContact C-N 3.26Å; F2-R4 PolarHBondContact O-N 3.33Å; R4-P8 WeakPolarHBondContact O-CD 3.45Å; R4-P8 VanDerWaalsContact O-CG 3.24Å; R4-P8 WeakPolarHBondContact O-CG 3.48Å
5	T	60.9	Low	73.3	Confident	86 Å²	86	122.4 Å²	122.4	53%	0.528	61%	0.605	S	S	.	*	H	α-helix	trans	-95.8	-29.3	177.8	36.3	0	0	0	0	113.5	F2 P8 L9	F2-T5 PolarHBondContact O-N 3.17Å; F2-T5 PolarHBondContact O-OG1 3.32Å; T5-P8 WeakPolarHBondContact O-CD 3.29Å; T5-L9 WeakPolarHBondContact O-CD1 3.33Å; T5-L9 WeakPolarHBondContact O-CG 3.45Å
6	F	64.1	Low	74.3	Confident	135 Å²	135	118.3 Å²	118.3	59%	0.592	59%	0.592	S	S	*	*	H	α-helix	trans	-71.3	-40.3	-179.7	-166.8	-93.9	0	0	0	113.2	F2 L9 Q10	F2-F6 PolarHBondContact O-N 3.3Å; F2-F6 VanDerWaalsContact O-N 3.15Å; F6-L9 PolarHBondContact O-N 3.06Å; F6-Q10 PolarHBondContact O-N 2.98Å
7	F	69	Low	75.3	Confident	154 Å²	154	116.2 Å²	116.2	68%	0.675	58%	0.583	S	S	*	*	H	α-helix	trans	-61.7	-45.7	-179.3	-133.9	-86.5	0	0	0	113.1	L9 Q10 V11	F7-L9 PolarHBondContact O-N 3.16Å; F7-Q10 PolarHBondContact O-N 3.01Å; F7-V11 HydrophobicContact CD1-CG2 4.36Å; F7-V11 WeakPolarHBondContact O-CG2 3.4Å; F7-V11 PolarHBondContact O-N 3.37Å; F7-V11 VanDerWaalsContact O-N 3.14Å
8	P	76.3	Confident	76.2	Confident	75 Å²	75	120.6 Å²	120.6	49%	0.487	59%	0.592	S	S	.	*	H	α-helix	trans	-58.1	-43.3	173	-24.3	31.9	0	0	0	113.7	R4 T5 V11 E12	R4-P8 WeakPolarHBondContact O-CD 3.45Å; R4-P8 VanDerWaalsContact O-CG 3.24Å; R4-P8 WeakPolarHBondContact O-CG 3.48Å; T5-P8 WeakPolarHBondContact O-CD 3.29Å; P8-V11 PolarHBondContact O-N 2.96Å; P8-E12 WeakPolarHBondContact O-CB 3.34Å; P8-E12 PolarHBondContact O-N 3.14Å
9	L	80	Confident	77.1	Confident	108 Å²	108	121.1 Å²	121.1	57%	0.565	59%	0.591	S	S	*	*	H	α-helix	trans	-65.3	-40.7	-179.5	-75.7	164.9	0	0	0	112.4	T5 F6 F7 E12 K13	T5-L9 WeakPolarHBondContact O-CD1 3.33Å; T5-L9 WeakPolarHBondContact O-CG 3.45Å; F6-L9 PolarHBondContact O-N 3.06Å; F7-L9 PolarHBondContact O-N 3.16Å; L9-E12 PolarHBondContact O-N 3.34Å; L9-K13 PolarHBondContact O-N 3.44Å
10	Q	82	Confident	77.8	Confident	78 Å²	78	119.5 Å²	119.5	36%	0.364	59%	0.585	S	S	.	*	H	α-helix	trans	-65.1	-43	176.9	-173.7	63.9	31.9	0	0	111.2	F6 F7 E12 K13 D14	F6-Q10 PolarHBondContact O-N 2.98Å; F7-Q10 PolarHBondContact O-N 3.01Å; Q10-E12 VanDerWaalsContact C-N 3.33Å; Q10-E12 PolarHBondContact O-N 3.44Å; Q10-K13 PolarHBondContact O-N 3.46Å; Q10-D14 PolarHBondContact NE2-OD1 3.02Å; Q10-D14 VanDerWaalsContact NE2-OD1 3.16Å; Q10-D14 PolarHBondContact O-N 3.46Å
11	V	83.8	Confident	78.5	Confident	75 Å²	75	116.6 Å²	116.6	46%	0.455	58%	0.58	S	S	.	*	H	α-helix	trans	-61.4	-42.6	175.8	172.9	0	0	0	0	110.8	F7 P8 D14 L15	F7-V11 HydrophobicContact CD1-CG2 4.36Å; F7-V11 WeakPolarHBondContact O-CG2 3.4Å; F7-V11 PolarHBondContact O-N 3.37Å; F7-V11 VanDerWaalsContact O-N 3.14Å; P8-V11 PolarHBondContact O-N 2.96Å; V11-D14 PolarHBondContact O-N 3.28Å; V11-L15 WeakPolarHBondContact O-CB 3.49Å; V11-L15 PolarHBondContact O-N 3.37Å
12	E	85.3	Confident	80.3	Confident	136 Å²	136	113 Å²	113	64%	0.636	56%	0.559	S	S	*	*	H	α-helix	trans	-64.5	-40.3	178.4	-168.1	171.7	-164.8	0	0	112.4	P8 L9 Q10 L15 S16	P8-E12 WeakPolarHBondContact O-CB 3.34Å; P8-E12 PolarHBondContact O-N 3.14Å; L9-E12 PolarHBondContact O-N 3.34Å; Q10-E12 VanDerWaalsContact C-N 3.33Å; Q10-E12 PolarHBondContact O-N 3.44Å; E12-L15 PolarHBondContact O-N 3.03Å; E12-S16 WeakPolarHBondContact O-CB 3.39Å; E12-S16 PolarHBondContact O-N 3.32Å
13	K	87.4	Confident	82	Confident	120 Å²	120	109.3 Å²	109.3	52%	0.522	55%	0.547	S	S	.	.	H	α-helix	trans	-61.9	-51	173.7	-175.4	-176.8	174.8	-175.9	0	111.8	L9 Q10 L15 S16 D17	L9-K13 PolarHBondContact O-N 3.44Å; Q10-K13 PolarHBondContact O-N 3.46Å; K13-L15 PolarHBondContact O-N 3.01Å; K13-S16 WeakPolarHBondContact O-CA 3.48Å; K13-S16 WeakPolarHBondContact O-CB 3.43Å; K13-S16 PolarHBondContact O-N 2.99Å; K13-D17 PolarHBondContact O-N 3.11Å
14	D	88.2	Confident	83.6	Confident	72 Å²	72	111 Å²	111	39%	0.385	54%	0.54	S	S	.	.	H	α-helix	trans	-61	-34.5	-179.9	-67.8	-11.7	0	0	0	111.5	Q10 V11 R18	Q10-D14 PolarHBondContact NE2-OD1 3.02Å; Q10-D14 VanDerWaalsContact NE2-OD1 3.16Å; Q10-D14 PolarHBondContact O-N 3.46Å; V11-D14 PolarHBondContact O-N 3.28Å; D14-R18 WeakPolarHBondContact O-CB 3.14Å; D14-R18 VanDerWaalsContact O-CG 3.29Å; D14-R18 WeakPolarHBondContact O-CG 3.38Å; D14-R18 PolarHBondContact O-N 3.46Å
15	L	89.3	Confident	85.2	Confident	91 Å²	91	103.6 Å²	103.6	48%	0.476	52%	0.523	S	S	.	.	H	α-helix	trans	-70.5	-37.5	175.9	-136.6	146.3	0	0	0	111.7	V11 E12 K13 K19	V11-L15 WeakPolarHBondContact O-CB 3.49Å; V11-L15 PolarHBondContact O-N 3.37Å; E12-L15 PolarHBondContact O-N 3.03Å; K13-L15 PolarHBondContact O-N 3.01Å; L15-K19 HydrophobicContact CD2-CD 4.38Å; L15-K19 WeakPolarHBondContact O-CG 3.24Å; L15-K19 PolarHBondContact O-N 3.36Å; L15-K19 VanDerWaalsContact O-N 3.07Å
16	S	89.8	Confident	86.8	Confident	57 Å²	57	103.2 Å²	103.2	40%	0.399	52%	0.518	S	S	.	.	H	α-helix	trans	-67.2	-45.3	173.9	-164.3	0	0	0	0	111.8	E12 K13 R18 K19 N20	E12-S16 WeakPolarHBondContact O-CB 3.39Å; E12-S16 PolarHBondContact O-N 3.32Å; K13-S16 WeakPolarHBondContact O-CA 3.48Å; K13-S16 WeakPolarHBondContact O-CB 3.43Å; K13-S16 PolarHBondContact O-N 2.99Å; S16-R18 VanDerWaalsContact C-N 3.34Å; S16-R18 PolarHBondContact O-N 3.43Å; S16-K19 WeakPolarHBondContact O-CB 3.44Å; S16-K19 PolarHBondContact O-N 2.85Å; S16-K19 VanDerWaalsContact O-N 3.11Å; S16-N20 PolarHBondContact O-N 2.9Å
17	D	92.1	Very high	88.3	Confident	82 Å²	82	101.7 Å²	101.7	44%	0.439	52%	0.515	S	S	.	.	H	α-helix	trans	-63	-41.1	178.4	-70.8	-18	0	0	0	111.2	K13 N20 A21	K13-D17 PolarHBondContact O-N 3.11Å; D17-N20 PolarHBondContact O-N 3.07Å; D17-A21 WeakPolarHBondContact O-CB 3.44Å; D17-A21 PolarHBondContact O-N 3.26Å
18	R	91.3	Very high	89.5	Confident	196 Å²	196	99.5 Å²	99.5	74%	0.74	51%	0.507	S	S	*	.	H	α-helix	trans	-62.9	-40.1	172.2	-75.7	177.6	-174.9	-177.3	3.6	112.9	D14 S16 K22	D14-R18 WeakPolarHBondContact O-CB 3.14Å; D14-R18 VanDerWaalsContact O-CG 3.29Å; D14-R18 WeakPolarHBondContact O-CG 3.38Å; D14-R18 PolarHBondContact O-N 3.46Å; S16-R18 VanDerWaalsContact C-N 3.34Å; S16-R18 PolarHBondContact O-N 3.43Å; R18-K22 WeakPolarHBondContact O-CB 3.49Å; R18-K22 PolarHBondContact O-N 2.98Å
19	K	91.9	Very high	90.4	Very high	130 Å²	130	100.3 Å²	100.3	57%	0.565	51%	0.505	S	S	*	.	H	α-helix	trans	-64.5	-44.3	175.5	-79.7	174.7	177.8	177	0	111.2	L15 S16 K22 L23	L15-K19 HydrophobicContact CD2-CD 4.38Å; L15-K19 WeakPolarHBondContact O-CG 3.24Å; L15-K19 PolarHBondContact O-N 3.36Å; L15-K19 VanDerWaalsContact O-N 3.07Å; S16-K19 WeakPolarHBondContact O-CB 3.44Å; S16-K19 PolarHBondContact O-N 2.85Å; S16-K19 VanDerWaalsContact O-N 3.11Å; K19-K22 PolarHBondContact O-N 3.41Å; K19-L23 WeakPolarHBondContact O-CB 3.34Å; K19-L23 WeakPolarHBondContact O-CG 3.46Å; K19-L23 PolarHBondContact O-N 3.45Å
20	N	92	Very high	91.1	Very high	88 Å²	88	97 Å²	97	47%	0.471	50%	0.496	S	S	.	.	H	α-helix	trans	-64.3	-44.4	177.9	-75	-23.9	0	0	0	111.9	S16 D17 K22 L23 Q24	S16-N20 PolarHBondContact O-N 2.9Å; D17-N20 PolarHBondContact O-N 3.07Å; N20-K22 VanDerWaalsContact C-N 3.3Å; N20-K22 PolarHBondContact O-N 2.84Å; N20-L23 PolarHBondContact O-N 3.05Å; N20-Q24 WeakPolarHBondContact O-CB 3.49Å; N20-Q24 PolarHBondContact O-N 3.26Å
21	A	92.3	Very high	91.7	Very high	59 Å²	59	98.9 Å²	98.9	49%	0.488	51%	0.505	S	S	.	.	H	α-helix	trans	-60.4	-40.9	175.5	0	0	0	0	0	111.8	D17 Q24 S25	D17-A21 WeakPolarHBondContact O-CB 3.44Å; D17-A21 PolarHBondContact O-N 3.26Å; A21-Q24 PolarHBondContact O-N 2.94Å; A21-S25 PolarHBondContact O-N 3.41Å
22	K	92.9	Very high	92.3	Very high	139 Å²	139	100.3 Å²	100.3	60%	0.604	51%	0.509	S	S	*	.	H	α-helix	trans	-63.9	-47.3	174.4	-174.5	174.7	179.9	178.7	0	111.9	R18 K19 N20 Q24 S25 D26	R18-K22 WeakPolarHBondContact O-CB 3.49Å; R18-K22 PolarHBondContact O-N 2.98Å; K19-K22 PolarHBondContact O-N 3.41Å; N20-K22 VanDerWaalsContact C-N 3.3Å; N20-K22 PolarHBondContact O-N 2.84Å; K22-Q24 VanDerWaalsContact C-N 3.28Å; K22-Q24 PolarHBondContact O-N 3.49Å; K22-S25 WeakPolarHBondContact O-CB 3.32Å; K22-S25 PolarHBondContact O-N 3.45Å; K22-D26 WeakPolarHBondContact O-CB 3.12Å; K22-D26 PolarHBondContact O-N 2.62Å
23	L	93.3	Very high	92.8	Very high	109 Å²	109	99 Å²	99	57%	0.571	50%	0.501	S	S	*	.	H	α-helix	trans	-60.5	-38	177.6	-75	169.8	0	0	0	112.4	K19 N20 D26 L27	K19-L23 WeakPolarHBondContact O-CB 3.34Å; K19-L23 WeakPolarHBondContact O-CG 3.46Å; K19-L23 PolarHBondContact O-N 3.45Å; N20-L23 PolarHBondContact O-N 3.05Å; L23-D26 PolarHBondContact O-N 3.24Å; L23-L27 VanDerWaalsContact O-CB 3.32Å; L23-L27 WeakPolarHBondContact O-CB 3.42Å; L23-L27 PolarHBondContact O-N 2.95Å
24	Q	93.7	Very high	93.2	Very high	117 Å²	117	99.1 Å²	99.1	55%	0.547	50%	0.502	S	S	.	.	H	α-helix	trans	-67.7	-43.3	176.9	-172.2	171.2	-8.7	0	0	111.5	N20 A21 K22 D26 L27 E28	N20-Q24 WeakPolarHBondContact O-CB 3.49Å; N20-Q24 PolarHBondContact O-N 3.26Å; A21-Q24 PolarHBondContact O-N 2.94Å; K22-Q24 VanDerWaalsContact C-N 3.28Å; K22-Q24 PolarHBondContact O-N 3.49Å; Q24-D26 PolarHBondContact O-N 2.87Å; Q24-L27 WeakPolarHBondContact O-CB 3.42Å; Q24-L27 PolarHBondContact O-N 3.37Å; Q24-E28 WeakPolarHBondContact O-CG 3.5Å; Q24-E28 PolarHBondContact O-N 2.92Å
25	S	93.6	Very high	93.5	Very high	68 Å²	68	99 Å²	99	48%	0.476	51%	0.507	S	S	.	.	H	α-helix	trans	-60.1	-44.2	172.8	-174.6	0	0	0	0	111.9	A21 K22 L27 E28 E29	A21-S25 PolarHBondContact O-N 3.41Å; K22-S25 WeakPolarHBondContact O-CB 3.32Å; K22-S25 PolarHBondContact O-N 3.45Å; S25-L27 VanDerWaalsContact C-N 3.3Å; S25-L27 PolarHBondContact O-N 3.24Å; S25-E28 PolarHBondContact O-N 3.4Å; S25-E29 WeakPolarHBondContact O-CB 3.34Å; S25-E29 PolarHBondContact O-N 2.87Å
26	D	95	Very high	93.8	Very high	78 Å²	78	99.1 Å²	99.1	42%	0.417	51%	0.505	S	S	.	.	H	α-helix	trans	-64.8	-35.9	178.4	-67	-16	0	0	0	111.1	K22 L23 Q24 G30	K22-D26 WeakPolarHBondContact O-CB 3.12Å; K22-D26 PolarHBondContact O-N 2.62Å; L23-D26 PolarHBondContact O-N 3.24Å; Q24-D26 PolarHBondContact O-N 2.87Å; D26-G30 PolarHBondContact O-N 3.06Å
27	L	94.8	Very high	94.1	Very high	103 Å²	103	101.9 Å²	101.9	54%	0.539	52%	0.515	S	S	.	.	H	α-helix	trans	-67.6	-46.4	176.1	-179.1	64.9	0	0	0	111.9	L23 Q24 S25 G30 Q31	L23-L27 VanDerWaalsContact O-CB 3.32Å; L23-L27 WeakPolarHBondContact O-CB 3.42Å; L23-L27 PolarHBondContact O-N 2.95Å; Q24-L27 WeakPolarHBondContact O-CB 3.42Å; Q24-L27 PolarHBondContact O-N 3.37Å; S25-L27 VanDerWaalsContact C-N 3.3Å; S25-L27 PolarHBondContact O-N 3.24Å; L27-G30 PolarHBondContact O-N 3.42Å; L27-Q31 WeakPolarHBondContact O-CG 3.45Å; L27-Q31 PolarHBondContact O-N 2.98Å
28	E	94.6	Very high	94.2	Very high	109 Å²	109	103.1 Å²	103.1	51%	0.509	52%	0.518	S	S	.	.	H	α-helix	trans	-62.2	-42.8	176.9	-73.2	173.3	-167.8	0	0	111.2	Q24 S25 G30 Q31 L32	Q24-E28 WeakPolarHBondContact O-CG 3.5Å; Q24-E28 PolarHBondContact O-N 2.92Å; S25-E28 PolarHBondContact O-N 3.4Å; E28-G30 PolarHBondContact O-N 3.48Å; E28-Q31 PolarHBondContact O-N 2.98Å; E28-L32 WeakPolarHBondContact O-CB 3.35Å; E28-L32 PolarHBondContact O-N 2.98Å
29	E	94.4	Very high	94.4	Very high	92 Å²	92	99.3 Å²	99.3	43%	0.43	51%	0.509	S	S	.	.	H	α-helix	trans	-63.1	-41.7	174.3	-169.8	-174.9	164.3	0	0	111.6	S25 L32 K33	S25-E29 WeakPolarHBondContact O-CB 3.34Å; S25-E29 PolarHBondContact O-N 2.87Å; E29-L32 PolarHBondContact O-N 3.39Å; E29-K33 HydrophobicContact CG-CD 4.45Å; E29-K33 WeakPolarHBondContact O-CG 3.38Å; E29-K33 PolarHBondContact O-N 3.25Å; E29-K33 WeakPolarHBondContact OE1-CE 3.5Å; E29-K33 IonicContact OE1-NZ 3.56Å; E29-K33 PolarHBondContact OE1-NZ 2.89Å
30	G	95.3	Very high	94.5	Very high	37 Å²	37	99.5 Å²	99.5	38%	0.381	51%	0.509	S	S	.	.	H	α-helix	trans	-61.8	-44.5	175.9	0	0	0	0	0	112.8	D26 L27 E28 K33 F34	D26-G30 PolarHBondContact O-N 3.06Å; L27-G30 PolarHBondContact O-N 3.42Å; E28-G30 PolarHBondContact O-N 3.48Å; G30-K33 PolarHBondContact O-N 2.92Å; G30-F34 WeakPolarHBondContact O-CB 3.33Å; G30-F34 PolarHBondContact O-N 3.41Å
31	Q	95.6	Very high	94.5	Very high	118 Å²	118	101.4 Å²	101.4	55%	0.551	52%	0.519	S	S	*	.	H	α-helix	trans	-64	-42	176.6	-74.3	178	-7.2	0	0	111.9	L27 E28 F34 S35	L27-Q31 WeakPolarHBondContact O-CG 3.45Å; L27-Q31 PolarHBondContact O-N 2.98Å; E28-Q31 PolarHBondContact O-N 2.98Å; Q31-F34 PolarHBondContact O-N 3.34Å; Q31-S35 PolarHBondContact O-N 3.39Å
32	L	95.2	Very high	94.4	Very high	105 Å²	105	105.1 Å²	105.1	55%	0.55	52%	0.524	S	S	.	.	H	α-helix	trans	-62.4	-45.5	176.2	-176.1	65.6	0	0	0	111.5	E28 E29 F34 S35 Q36	E28-L32 WeakPolarHBondContact O-CB 3.35Å; E28-L32 PolarHBondContact O-N 2.98Å; E29-L32 PolarHBondContact O-N 3.39Å; L32-F34 VanDerWaalsContact C-N 3.34Å; L32-F34 PolarHBondContact O-N 2.88Å; L32-S35 PolarHBondContact O-N 2.93Å; L32-Q36 WeakPolarHBondContact O-CG 3.39Å; L32-Q36 PolarHBondContact O-N 3.5Å
33	K	95.5	Very high	94.3	Very high	108 Å²	108	102.4 Å²	102.4	47%	0.47	51%	0.513	S	S	.	.	H	α-helix	trans	-62	-41.3	176.1	-75.5	175.3	-176	167.4	0	112.1	E29 G30 Q36 L37	E29-K33 HydrophobicContact CG-CD 4.45Å; E29-K33 WeakPolarHBondContact O-CG 3.38Å; E29-K33 PolarHBondContact O-N 3.25Å; E29-K33 WeakPolarHBondContact OE1-CE 3.5Å; E29-K33 IonicContact OE1-NZ 3.56Å; E29-K33 PolarHBondContact OE1-NZ 2.89Å; G30-K33 PolarHBondContact O-N 2.92Å; K33-Q36 PolarHBondContact O-N 3.33Å; K33-L37 WeakPolarHBondContact O-CG 3.49Å; K33-L37 PolarHBondContact O-N 3.37Å
34	F	95.9	Very high	94.2	Very high	124 Å²	124	99.8 Å²	99.8	54%	0.544	51%	0.508	S	S	.	.	H	α-helix	trans	-61.8	-48.8	177.7	-176.9	-98.7	0	0	0	111.4	G30 Q31 L32 Q36 L37 E38	G30-F34 WeakPolarHBondContact O-CB 3.33Å; G30-F34 PolarHBondContact O-N 3.41Å; Q31-F34 PolarHBondContact O-N 3.34Å; L32-F34 VanDerWaalsContact C-N 3.34Å; L32-F34 PolarHBondContact O-N 2.88Å; F34-Q36 VanDerWaalsContact C-N 3.31Å; F34-Q36 PolarHBondContact O-N 3.2Å; F34-L37 PolarHBondContact O-N 2.99Å; F34-L37 VanDerWaalsContact O-N 3.08Å; F34-E38 HydrophobicContact CD1-CG 4.25Å; F34-E38 HydrophobicContact CE1-CG 3.84Å; F34-E38 WeakPolarHBondContact CE1-OE1 3.46Å; F34-E38 HydrophobicContact CZ-CG 4.02Å; F34-E38 VanDerWaalsContact CZ-OE1 3.31Å; F34-E38 WeakPolarHBondContact CZ-OE1 3.36Å; F34-E38 PolarHBondContact O-N 2.98Å
35	S	95.6	Very high	93.8	Very high	69 Å²	69	96.7 Å²	96.7	48%	0.483	49%	0.491	S	S	.	.	H	α-helix	trans	-59.3	-40.5	177.1	-176.7	0	0	0	0	112.5	Q31 L32 L37 E38 Q39	Q31-S35 PolarHBondContact O-N 3.39Å; L32-S35 PolarHBondContact O-N 2.93Å; S35-L37 PolarHBondContact O-N 3.07Å; S35-E38 PolarHBondContact O-N 3.48Å; S35-Q39 PolarHBondContact O-N 3.08Å; S35-Q39 VanDerWaalsContact O-N 3.08Å
36	Q	95.4	Very high	93.5	Very high	93 Å²	93	97.5 Å²	97.5	44%	0.435	49%	0.487	S	S	.	.	H	α-helix	trans	-64.6	-37.9	175	-71.9	176.3	4.2	0	0	112.9	L32 K33 F34 K40	L32-Q36 WeakPolarHBondContact O-CG 3.39Å; L32-Q36 PolarHBondContact O-N 3.5Å; K33-Q36 PolarHBondContact O-N 3.33Å; F34-Q36 VanDerWaalsContact C-N 3.31Å; F34-Q36 PolarHBondContact O-N 3.2Å; Q36-K40 WeakPolarHBondContact O-CG 3.37Å; Q36-K40 PolarHBondContact O-N 3.49Å
37	L	95.9	Very high	93.2	Very high	115 Å²	115	100.6 Å²	100.6	60%	0.602	50%	0.497	S	S	*	.	H	α-helix	trans	-68.7	-41.5	177.1	-75.5	169.3	0	0	0	111.7	K33 F34 S35 Q39 K40 L41	K33-L37 WeakPolarHBondContact O-CG 3.49Å; K33-L37 PolarHBondContact O-N 3.37Å; F34-L37 PolarHBondContact O-N 2.99Å; F34-L37 VanDerWaalsContact O-N 3.08Å; S35-L37 PolarHBondContact O-N 3.07Å; L37-Q39 VanDerWaalsContact C-N 3.34Å; L37-Q39 PolarHBondContact O-N 3.43Å; L37-K40 PolarHBondContact O-N 3.08Å; L37-L41 WeakPolarHBondContact O-CB 3.27Å; L37-L41 PolarHBondContact O-N 3Å
38	E	94.8	Very high	92.9	Very high	108 Å²	108	100 Å²	100	51%	0.505	49%	0.494	S	S	.	.	H	α-helix	trans	-60.8	-43.1	175.1	-72.5	-171.6	136.8	0	0	111.9	F34 S35 L41 K42	F34-E38 HydrophobicContact CD1-CG 4.25Å; F34-E38 HydrophobicContact CE1-CG 3.84Å; F34-E38 WeakPolarHBondContact CE1-OE1 3.46Å; F34-E38 HydrophobicContact CZ-CG 4.02Å; F34-E38 VanDerWaalsContact CZ-OE1 3.31Å; F34-E38 WeakPolarHBondContact CZ-OE1 3.36Å; F34-E38 PolarHBondContact O-N 2.98Å; S35-E38 PolarHBondContact O-N 3.48Å; E38-L41 PolarHBondContact O-N 3.39Å; E38-K42 PolarHBondContact O-N 2.99Å
39	Q	94.6	Very high	92.4	Very high	117 Å²	117	97.5 Å²	97.5	55%	0.547	48%	0.482	S	S	.	.	H	α-helix	trans	-62.3	-47.9	175.9	-176.7	179	-6.9	0	0	111.6	S35 L37 L41 K42 E43	S35-Q39 PolarHBondContact O-N 3.08Å; S35-Q39 VanDerWaalsContact O-N 3.08Å; L37-Q39 VanDerWaalsContact C-N 3.34Å; L37-Q39 PolarHBondContact O-N 3.43Å; Q39-L41 VanDerWaalsContact C-N 3.29Å; Q39-L41 PolarHBondContact O-N 2.95Å; Q39-K42 WeakPolarHBondContact O-CB 3.5Å; Q39-K42 PolarHBondContact O-N 3.34Å; Q39-E43 WeakPolarHBondContact CG-OE1 3.29Å; Q39-E43 PolarHBondContact NE2-OE1 3.49Å; Q39-E43 WeakPolarHBondContact O-CG 3.4Å; Q39-E43 PolarHBondContact O-N 3.38Å
40	K	94.4	Very high	92	Very high	133 Å²	133	99.3 Å²	99.3	58%	0.578	49%	0.491	S	S	*	.	H	α-helix	trans	-60.6	-39	177.6	-76.2	177.6	179.6	177.8	0	112.2	Q36 L37 E43 A44	Q36-K40 WeakPolarHBondContact O-CG 3.37Å; Q36-K40 PolarHBondContact O-N 3.49Å; L37-K40 PolarHBondContact O-N 3.08Å; K40-E43 PolarHBondContact O-N 2.93Å; K40-A44 VanDerWaalsContact O-CB 3.29Å; K40-A44 WeakPolarHBondContact O-CB 3.41Å; K40-A44 PolarHBondContact O-N 2.98Å
41	L	91.6	Very high	91.8	Very high	128 Å²	128	99.4 Å²	99.4	67%	0.67	49%	0.492	S	S	*	.	H	α-helix	trans	-64.2	-43.2	177	-176.4	64.4	0	0	0	111.2	L37 E38 Q39 A44 Y45	L37-L41 WeakPolarHBondContact O-CB 3.27Å; L37-L41 PolarHBondContact O-N 3Å; E38-L41 PolarHBondContact O-N 3.39Å; Q39-L41 VanDerWaalsContact C-N 3.29Å; Q39-L41 PolarHBondContact O-N 2.95Å; L41-A44 PolarHBondContact O-N 2.98Å; L41-Y45 WeakPolarHBondContact O-CB 3.47Å; L41-Y45 PolarHBondContact O-N 3.07Å
42	K	90.1	Very high	91.4	Very high	137 Å²	137	95 Å²	95	60%	0.596	47%	0.472	S	S	*	.	H	α-helix	trans	-61.3	-48.7	176.1	-174.2	-178.5	175.6	-174.3	0	111.7	E38 Q39 A44 Y45 E46	E38-K42 PolarHBondContact O-N 2.99Å; Q39-K42 WeakPolarHBondContact O-CB 3.5Å; Q39-K42 PolarHBondContact O-N 3.34Å; K42-A44 VanDerWaalsContact C-N 3.33Å; K42-A44 PolarHBondContact O-N 3.24Å; K42-Y45 PolarHBondContact O-N 3.44Å; K42-E46 VanDerWaalsContact CE-OE1 3.27Å; K42-E46 WeakPolarHBondContact CE-OE1 3.31Å; K42-E46 WeakPolarHBondContact O-CG 3.35Å; K42-E46 PolarHBondContact O-N 3.4Å
43	E	92	Very high	91	Very high	82 Å²	82	94.8 Å²	94.8	38%	0.383	47%	0.474	S	S	.	.	H	α-helix	trans	-62.3	-39.7	178.1	-70.9	175	-166.7	0	0	112.2	Q39 K40 E46 K47	Q39-E43 WeakPolarHBondContact CG-OE1 3.29Å; Q39-E43 PolarHBondContact NE2-OE1 3.49Å; Q39-E43 WeakPolarHBondContact O-CG 3.4Å; Q39-E43 PolarHBondContact O-N 3.38Å; K40-E43 PolarHBondContact O-N 2.93Å; E43-E46 PolarHBondContact O-N 2.89Å; E43-K47 WeakPolarHBondContact O-CG 3.11Å; E43-K47 PolarHBondContact O-N 2.92Å
44	A	89.7	Confident	90.9	Very high	54 Å²	54	94.3 Å²	94.3	45%	0.446	48%	0.476	S	S	.	.	H	α-helix	trans	-63.7	-42.7	176.1	0	0	0	0	0	111.6	K40 L41 K42 K47 L48	K40-A44 VanDerWaalsContact O-CB 3.29Å; K40-A44 WeakPolarHBondContact O-CB 3.41Å; K40-A44 PolarHBondContact O-N 2.98Å; L41-A44 PolarHBondContact O-N 2.98Å; K42-A44 VanDerWaalsContact C-N 3.33Å; K42-A44 PolarHBondContact O-N 3.24Å; A44-K47 PolarHBondContact O-N 3.34Å; A44-L48 WeakPolarHBondContact O-CB 3.41Å; A44-L48 PolarHBondContact O-N 3.02Å
45	Y	86.1	Confident	90.7	Very high	52 Å²	52	91.9 Å²	91.9	20%	0.204	46%	0.464	C	S	.	.	H	α-helix	trans	-65.8	-41	178.5	-169.3	-101	0	0	0	112.2	L41 K42 L48 Q49 L212 K322	L41-Y45 WeakPolarHBondContact O-CB 3.47Å; L41-Y45 PolarHBondContact O-N 3.07Å; K42-Y45 PolarHBondContact O-N 3.44Å; Y45-L48 PolarHBondContact O-N 3.39Å; Y45-Q49 HydrophobicContact CD1-CG 4.45Å; Y45-Q49 HydrophobicContact CE1-CG 4.25Å; Y45-Q49 WeakPolarHBondContact O-CG 3.35Å; Y45-Q49 PolarHBondContact O-N 3.35Å; Y45-L212 PolarHBondContact OH-O 3.36Å; Y45-K322 HydrophobicContact CE1-CD 4.27Å
46	E	86.5	Confident	90.5	Very high	85 Å²	85	89.3 Å²	89.3	40%	0.397	44%	0.443	S	S	.	.	H	α-helix	trans	-61.9	-44.5	174.5	-73.5	174.8	-172.3	0	0	112	K42 E43 L48 Q49 Q50	K42-E46 VanDerWaalsContact CE-OE1 3.27Å; K42-E46 WeakPolarHBondContact CE-OE1 3.31Å; K42-E46 WeakPolarHBondContact O-CG 3.35Å; K42-E46 PolarHBondContact O-N 3.4Å; E43-E46 PolarHBondContact O-N 2.89Å; E46-L48 VanDerWaalsContact C-N 3.29Å; E46-L48 PolarHBondContact O-N 3.33Å; E46-Q49 PolarHBondContact O-N 2.88Å; E46-Q50 WeakPolarHBondContact O-CG 3.38Å; E46-Q50 PolarHBondContact O-N 3.49Å
47	K	89.8	Confident	90.2	Very high	144 Å²	144	94 Å²	94	63%	0.626	46%	0.457	S	S	*	.	H	α-helix	trans	-61.2	-39.1	174.9	-75.7	176.8	-179.9	173	0	112.2	E43 A44 Q50 G51	E43-K47 WeakPolarHBondContact O-CG 3.11Å; E43-K47 PolarHBondContact O-N 2.92Å; A44-K47 PolarHBondContact O-N 3.34Å; K47-Q50 PolarHBondContact O-N 3.01Å; K47-G51 PolarHBondContact O-N 3.39Å
48	L	87.3	Confident	90.1	Very high	89 Å²	89	92.9 Å²	92.9	47%	0.466	45%	0.451	S	S	.	.	H	α-helix	trans	-66.6	-41.1	179.5	-169.5	54.1	0	0	0	111.8	A44 Y45 E46 G51 E52 L212	A44-L48 WeakPolarHBondContact O-CB 3.41Å; A44-L48 PolarHBondContact O-N 3.02Å; Y45-L48 PolarHBondContact O-N 3.39Å; E46-L48 VanDerWaalsContact C-N 3.29Å; E46-L48 PolarHBondContact O-N 3.33Å; L48-G51 PolarHBondContact O-N 2.86Å; L48-E52 PolarHBondContact O-N 3.37Å; L48-L212 HydrophobicContact CD1-CD2 4.28Å; L48-L212 HydrophobicContact CD2-CD2 3.15Å; L48-L212 HydrophobicContact CG-CD1 4.46Å; L48-L212 HydrophobicContact CG-CD2 3.49Å; L48-L212 VanDerWaalsContact CG-CD2 3.49Å
49	Q	84	Confident	90.1	Very high	57 Å²	57	89.4 Å²	89.4	27%	0.266	44%	0.435	S	S	.	.	H	α-helix	trans	-64.6	-41.1	173.5	-72.5	-174.9	-20.2	0	0	112.9	Y45 E46 G51 E52 T53 H320	Y45-Q49 HydrophobicContact CD1-CG 4.45Å; Y45-Q49 HydrophobicContact CE1-CG 4.25Å; Y45-Q49 WeakPolarHBondContact O-CG 3.35Å; Y45-Q49 PolarHBondContact O-N 3.35Å; E46-Q49 PolarHBondContact O-N 2.88Å; Q49-G51 VanDerWaalsContact C-N 3.35Å; Q49-E52 PolarHBondContact O-N 3.41Å; Q49-T53 WeakPolarHBondContact O-CB 3.39Å; Q49-T53 PolarHBondContact O-N 3.32Å; Q49-T53 PolarHBondContact O-OG1 3.5Å; Q49-H320 PolarHBondContact NE2-CE1 2.99Å; Q49-H320 VanDerWaalsContact NE2-CE1 3.34Å; Q49-H320 PolarHBondContact NE2-NE2 2.84Å; Q49-H320 VanDerWaalsContact NE2-NE2 3.13Å
50	Q	87.5	Confident	89.9	Confident	131 Å²	131	84.6 Å²	84.6	61%	0.612	41%	0.413	S	S	*	.	H	α-helix	trans	-62.9	-43.3	174.4	-71.1	174.5	13.2	0	0	111.2	E46 K47 T53 L54	E46-Q50 WeakPolarHBondContact O-CG 3.38Å; E46-Q50 PolarHBondContact O-N 3.49Å; K47-Q50 PolarHBondContact O-N 3.01Å; Q50-T53 PolarHBondContact O-N 3.26Å; Q50-L54 WeakPolarHBondContact O-CB 3.48Å; Q50-L54 PolarHBondContact O-N 2.99Å
51	G	90.9	Very high	89.6	Confident	39 Å²	39	82.3 Å²	82.3	40%	0.402	41%	0.407	S	S	.	.	H	α-helix	trans	-58.9	-46.5	175.4	0	0	0	0	0	112.4	K47 L48 Q49 T53 L54 R55	K47-G51 PolarHBondContact O-N 3.39Å; L48-G51 PolarHBondContact O-N 2.86Å; Q49-G51 VanDerWaalsContact C-N 3.35Å; G51-T53 PolarHBondContact O-N 2.89Å; G51-L54 PolarHBondContact O-N 2.99Å; G51-R55 WeakPolarHBondContact O-CB 3.49Å; G51-R55 PolarHBondContact O-N 3.44Å
52	E	87.5	Confident	89.6	Confident	26 Å²	26	79.8 Å²	79.8	12%	0.121	40%	0.396	C	S	.	.	H	α-helix	trans	-65.6	-39.4	178.1	176.6	54.9	-164.5	0	0	112.4	L48 Q49 R55 R56 L209 L212	L48-E52 PolarHBondContact O-N 3.37Å; Q49-E52 PolarHBondContact O-N 3.41Å; E52-R55 PolarHBondContact O-N 3.2Å; E52-R55 IonicContact OE1-CZ 3.48Å; E52-R55 IonicContact OE1-NE 3.43Å; E52-R55 IonicContact OE1-NH2 3.61Å; E52-R55 PolarHBondContact OE1-NH2 2.73Å; E52-R55 IonicContact OE2-CZ 2.87Å; E52-R55 IonicContact OE2-NE 2.69Å; E52-R55 PolarHBondContact OE2-NE 3.13Å; E52-R55 IonicContact OE2-NH2 3.53Å; E52-R56 WeakPolarHBondContact O-CG 3.4Å; E52-R56 PolarHBondContact O-N 3.46Å; E52-R56 IonicContact OE1-CZ 2.77Å; E52-R56 VanDerWaalsContact OE1-CZ 3.26Å; E52-R56 IonicContact OE1-NE 2.62Å; E52-R56 PolarHBondContact OE1-NE 3.17Å; E52-R56 IonicContact OE1-NH2 3.26Å; E52-R56 PolarHBondContact OE1-NH2 2.79Å; E52-L209 HydrophobicContact CG-CD2 4.29Å; E52-L212 HydrophobicContact CB-CD1 4.47Å; E52-L212 HydrophobicContact CG-CD1 4.47Å
53	T	86.9	Confident	89.6	Confident	99 Å²	99	73.5 Å²	73.5	61%	0.607	37%	0.369	S	S	*	.	H	α-helix	trans	-63.6	-43.5	175.3	-57.7	0	0	0	0	111.4	Q49 Q50 G51 R56 R57	Q49-T53 WeakPolarHBondContact O-CB 3.39Å; Q49-T53 PolarHBondContact O-N 3.32Å; Q49-T53 PolarHBondContact O-OG1 3.5Å; Q50-T53 PolarHBondContact O-N 3.26Å; G51-T53 PolarHBondContact O-N 2.89Å; T53-R56 PolarHBondContact O-N 3.16Å; T53-R57 PolarHBondContact O-N 3.48Å; T53-R57 VanDerWaalsContact O-N 3.16Å
54	L	91.6	Very high	89.4	Confident	98 Å²	98	72.4 Å²	72.4	51%	0.513	36%	0.364	S	S	.	.	H	α-helix	trans	-65.6	-42.9	176.6	-177.6	61.8	0	0	0	111.3	Q50 G51 R56 R57 L58	Q50-L54 WeakPolarHBondContact O-CB 3.48Å; Q50-L54 PolarHBondContact O-N 2.99Å; G51-L54 PolarHBondContact O-N 2.99Å; L54-R56 PolarHBondContact O-N 3.02Å; L54-R57 PolarHBondContact O-N 3.38Å; L54-L58 HydrophobicContact CD1-CD1 4.02Å; L54-L58 HydrophobicContact CD1-CD2 4.47Å; L54-L58 HydrophobicContact CD1-CG 3.95Å; L54-L58 HydrophobicContact CD2-CD1 4.37Å; L54-L58 HydrophobicContact CG-CD1 3.83Å; L54-L58 HydrophobicContact CG-CG 4.18Å; L54-L58 WeakPolarHBondContact O-CB 3.39Å; L54-L58 WeakPolarHBondContact O-CG 3.41Å; L54-L58 PolarHBondContact O-N 3.04Å
55	R	93.4	Very high	89.3	Confident	74 Å²	74	76.5 Å²	76.5	28%	0.279	38%	0.378	S	S	.	.	H	α-helix	trans	-55.7	-50.1	175.5	-174.4	-149.3	57.9	74.7	-6.7	110.8	G51 E52 R57 L58 H59 D162	G51-R55 WeakPolarHBondContact O-CB 3.49Å; G51-R55 PolarHBondContact O-N 3.44Å; E52-R55 PolarHBondContact O-N 3.2Å; E52-R55 IonicContact OE1-CZ 3.48Å; E52-R55 IonicContact OE1-NE 3.43Å; E52-R55 IonicContact OE1-NH2 3.61Å; E52-R55 PolarHBondContact OE1-NH2 2.73Å; E52-R55 IonicContact OE2-CZ 2.87Å; E52-R55 IonicContact OE2-NE 2.69Å; E52-R55 PolarHBondContact OE2-NE 3.13Å; E52-R55 IonicContact OE2-NH2 3.53Å; R55-R57 VanDerWaalsContact C-N 3.31Å; R55-R57 PolarHBondContact O-N 3.21Å; R55-L58 PolarHBondContact O-N 3.08Å; R55-H59 WeakPolarHBondContact O-CB 3.37Å; R55-H59 PolarHBondContact O-N 2.96Å; R55-D162 IonicContact CZ-OD1 3.72Å; R55-D162 IonicContact CZ-OD2 3.6Å; R55-D162 IonicContact NH1-OD1 2.66Å; R55-D162 PolarHBondContact NH1-OD1 3.36Å; R55-D162 IonicContact NH1-OD2 2.91Å; R55-D162 PolarHBondContact NH1-OD2 3.34Å; R55-D162 IonicContact NH2-OD1 3.63Å; R55-D162 PolarHBondContact NH2-OD1 2.83Å; R55-D162 IonicContact NH2-OD2 2.76Å; R55-D162 PolarHBondContact NH2-OD2 2.94Å
56	R	90.5	Very high	89.3	Confident	14 Å²	14	78.8 Å²	78.8	5%	0.053	39%	0.389	C	S	.	.	H	α-helix	trans	-55.8	-45.8	176.9	-71.6	177	-169.5	-177	5.4	112.1	E52 T53 L54 N60 D162 W214	E52-R56 WeakPolarHBondContact O-CG 3.4Å; E52-R56 PolarHBondContact O-N 3.46Å; E52-R56 IonicContact OE1-CZ 2.77Å; E52-R56 VanDerWaalsContact OE1-CZ 3.26Å; E52-R56 IonicContact OE1-NE 2.62Å; E52-R56 PolarHBondContact OE1-NE 3.17Å; E52-R56 IonicContact OE1-NH2 3.26Å; E52-R56 PolarHBondContact OE1-NH2 2.79Å; T53-R56 PolarHBondContact O-N 3.16Å; L54-R56 PolarHBondContact O-N 3.02Å; R56-N60 WeakPolarHBondContact O-CB 3.44Å; R56-N60 PolarHBondContact O-N 3.48Å; R56-D162 HydrophobicContact CG-CB 4.4Å; R56-W214 VanDerWaalsContact NH1-CH2 3.31Å
57	R	89.9	Confident	89.3	Confident	193 Å²	193	75.8 Å²	75.8	73%	0.728	38%	0.38	S	S	*	.	H	α-helix	trans	-64.9	-48.9	-179.7	-175.2	179.6	-179.7	177	0.7	112.1	T53 L54 R55 N60 L61	T53-R57 PolarHBondContact O-N 3.48Å; T53-R57 VanDerWaalsContact O-N 3.16Å; L54-R57 PolarHBondContact O-N 3.38Å; R55-R57 VanDerWaalsContact C-N 3.31Å; R55-R57 PolarHBondContact O-N 3.21Å; R57-N60 PolarHBondContact O-N 3.46Å; R57-L61 WeakPolarHBondContact O-CB 3.36Å; R57-L61 PolarHBondContact O-N 3.47Å
58	L	94.2	Very high	89.1	Confident	90 Å²	90	69.5 Å²	69.5	47%	0.471	35%	0.354	S	S	.	.	H	α-helix	trans	-66.9	-41.8	-179.8	-69.1	178.7	0	0	0	111.3	L54 R55 N60 L61 V62	L54-L58 HydrophobicContact CD1-CD1 4.02Å; L54-L58 HydrophobicContact CD1-CD2 4.47Å; L54-L58 HydrophobicContact CD1-CG 3.95Å; L54-L58 HydrophobicContact CD2-CD1 4.37Å; L54-L58 HydrophobicContact CG-CD1 3.83Å; L54-L58 HydrophobicContact CG-CG 4.18Å; L54-L58 WeakPolarHBondContact O-CB 3.39Å; L54-L58 WeakPolarHBondContact O-CG 3.41Å; L54-L58 PolarHBondContact O-N 3.04Å; R55-L58 PolarHBondContact O-N 3.08Å; L58-N60 PolarHBondContact O-N 3.12Å; L58-L61 PolarHBondContact O-N 3.44Å; L58-V62 WeakPolarHBondContact O-CG2 3.47Å; L58-V62 PolarHBondContact O-N 3.01Å
59	H	93.2	Very high	89.2	Confident	35 Å²	35	65.8 Å²	65.8	16%	0.162	33%	0.334	C	S	.	.	H	α-helix	trans	-57.4	-49.1	174.9	-173.7	71.7	0	0	0	111.1	R55 L61 V62 M63 P155 S159 D162	R55-H59 WeakPolarHBondContact O-CB 3.37Å; R55-H59 PolarHBondContact O-N 2.96Å; H59-L61 PolarHBondContact O-N 2.91Å; H59-V62 PolarHBondContact O-N 3.44Å; H59-M63 VanDerWaalsContact O-CG 3.29Å; H59-M63 WeakPolarHBondContact O-CG 3.43Å; H59-M63 PolarHBondContact O-N 2.88Å; H59-P155 PolarHBondContact CE1-O 3.38Å; H59-P155 PolarHBondContact NE2-O 2.9Å; H59-S159 PolarHBondContact NE2-OG 2.77Å; H59-D162 IonicContact CD2-OD2 3.57Å; H59-D162 PolarHBondContact CD2-OD2 3.1Å
60	N	89.9	Confident	89.6	Confident	17 Å²	17	63.5 Å²	63.5	9%	0.091	32%	0.323	C	S	.	.	H	α-helix	trans	-60.6	-44.9	176.8	-171.7	59.5	0	0	0	112.4	R56 R57 L58 V62 M63 E64 Y164 K399	R56-N60 WeakPolarHBondContact O-CB 3.44Å; R56-N60 PolarHBondContact O-N 3.48Å; R57-N60 PolarHBondContact O-N 3.46Å; L58-N60 PolarHBondContact O-N 3.12Å; N60-V62 VanDerWaalsContact C-N 3.34Å; N60-V62 PolarHBondContact O-N 3.19Å; N60-M63 PolarHBondContact O-N 3.37Å; N60-E64 PolarHBondContact ND2-OE1 3.41Å; N60-E64 WeakPolarHBondContact O-CG 3.23Å; N60-E64 PolarHBondContact O-N 2.93Å; N60-Y164 HydrophobicContact CB-CE2 4.2Å; N60-Y164 WeakPolarHBondContact CB-OH 3.42Å; N60-Y164 PolarHBondContact ND2-OH 3.35Å; N60-Y164 WeakPolarHBondContact OD1-CE1 3.47Å; N60-Y164 PolarHBondContact OD1-OH 2.96Å; N60-K399 VanDerWaalsContact OD1-CE 3.24Å; N60-K399 WeakPolarHBondContact OD1-CE 3.47Å; N60-K399 PolarHBondContact OD1-NZ 3.21Å
61	L	89.7	Confident	90	Very high	85 Å²	85	57.3 Å²	57.3	45%	0.445	29%	0.294	S	S	.	.	H	α-helix	trans	-59.6	-44.8	178.3	-178.1	66.1	0	0	0	111.7	R57 L58 H59 M63 E64 L65	R57-L61 WeakPolarHBondContact O-CB 3.36Å; R57-L61 PolarHBondContact O-N 3.47Å; L58-L61 PolarHBondContact O-N 3.44Å; H59-L61 PolarHBondContact O-N 2.91Å; L61-M63 VanDerWaalsContact C-N 3.33Å; L61-M63 PolarHBondContact O-N 3.32Å; L61-E64 PolarHBondContact O-N 3.26Å; L61-L65 HydrophobicContact CD1-CD1 4.48Å; L61-L65 HydrophobicContact CD1-CG 4.49Å; L61-L65 HydrophobicContact CG-CD1 4.11Å; L61-L65 WeakPolarHBondContact O-CB 3.42Å; L61-L65 VanDerWaalsContact O-CG 3.23Å; L61-L65 WeakPolarHBondContact O-CG 3.48Å; L61-L65 PolarHBondContact O-N 3.48Å
62	V	91.4	Very high	90.4	Very high	75 Å²	75	55.4 Å²	55.4	46%	0.455	28%	0.275	S	S	.	.	H	α-helix	trans	-62.1	-42	176.6	170.6	0	0	0	0	111	L58 H59 N60 L65 K66	L58-V62 WeakPolarHBondContact O-CG2 3.47Å; L58-V62 PolarHBondContact O-N 3.01Å; H59-V62 PolarHBondContact O-N 3.44Å; N60-V62 VanDerWaalsContact C-N 3.34Å; N60-V62 PolarHBondContact O-N 3.19Å; V62-L65 PolarHBondContact O-N 3.44Å; V62-K66 WeakPolarHBondContact O-CG 3.21Å; V62-K66 PolarHBondContact O-N 2.98Å
63	M	90.8	Very high	90.9	Very high	4 Å²	4	54.2 Å²	54.2	2%	0.02	27%	0.269	C	S	.	.	H	α-helix	trans	-64.8	-41.6	177.5	-68.7	-57.1	-59.7	0	0	112.3	H59 N60 L61 K66 G67 P155 I156 K399	H59-M63 VanDerWaalsContact O-CG 3.29Å; H59-M63 WeakPolarHBondContact O-CG 3.43Å; H59-M63 PolarHBondContact O-N 2.88Å; N60-M63 PolarHBondContact O-N 3.37Å; L61-M63 VanDerWaalsContact C-N 3.33Å; L61-M63 PolarHBondContact O-N 3.32Å; M63-K66 PolarHBondContact O-N 3.37Å; M63-G67 PolarHBondContact O-N 2.91Å; M63-P155 HydrophobicContact SD-CB 3.74Å; M63-I156 HydrophobicContact CE-CB 3.95Å; M63-I156 HydrophobicContact CE-CD1 4.44Å; M63-I156 HydrophobicContact CE-CG1 3.78Å; M63-K399 HydrophobicContact CB-CD 4.25Å
64	E	86.7	Confident	91.4	Very high	60 Å²	60	50 Å²	50	28%	0.28	24%	0.242	S	C	.	.	H	α-helix	trans	-65.4	-40.2	175.7	-74.5	176.2	179.9	0	0	112.1	N60 L61 K66 G67	N60-E64 PolarHBondContact ND2-OE1 3.41Å; N60-E64 WeakPolarHBondContact O-CG 3.23Å; N60-E64 PolarHBondContact O-N 2.93Å; L61-E64 PolarHBondContact O-N 3.26Å; E64-K66 VanDerWaalsContact C-N 3.29Å; E64-K66 PolarHBondContact O-N 2.77Å; E64-G67 PolarHBondContact O-N 2.91Å
65	L	86.8	Confident	91.6	Very high	140 Å²	140	45.5 Å²	45.5	73%	0.733	22%	0.219	S	C	*	.	H	α-helix	trans	-65.5	-32	176.2	-73	172.2	0	0	0	112.7	L61 V62 G67	L61-L65 HydrophobicContact CD1-CD1 4.48Å; L61-L65 HydrophobicContact CD1-CG 4.49Å; L61-L65 HydrophobicContact CG-CD1 4.11Å; L61-L65 WeakPolarHBondContact O-CB 3.42Å; L61-L65 VanDerWaalsContact O-CG 3.23Å; L61-L65 WeakPolarHBondContact O-CG 3.48Å; L61-L65 PolarHBondContact O-N 3.48Å; V62-L65 PolarHBondContact O-N 3.44Å; L65-G67 PolarHBondContact O-N 2.66Å
66	K	87	Confident	91.7	Very high	99 Å²	99	43.2 Å²	43.2	43%	0.43	21%	0.21	S	C	.	.	H	α-helix	trans	-73.5	-14.6	171.8	-75.2	-172.6	174.4	-171.8	0	113.1	V62 M63 E64	V62-K66 WeakPolarHBondContact O-CG 3.21Å; V62-K66 PolarHBondContact O-N 2.98Å; M63-K66 PolarHBondContact O-N 3.37Å; E64-K66 VanDerWaalsContact C-N 3.29Å; E64-K66 PolarHBondContact O-N 2.77Å
67	G	85.8	Confident	91.7	Very high	22 Å²	22	46.1 Å²	46.1	23%	0.227	23%	0.231	C	C	.	.			trans	98.5	139.7	-176.8	0	0	0	0	0	112.9	M63 E64 L65 I69	M63-G67 PolarHBondContact O-N 2.91Å; E64-G67 PolarHBondContact O-N 2.91Å; L65-G67 PolarHBondContact O-N 2.66Å; G67-I69 VanDerWaalsContact C-N 3.3Å; G67-I69 PolarHBondContact O-N 2.81Å
68	N	86.2	Confident	91.6	Very high	12 Å²	12	38.5 Å²	38.5	6%	0.064	20%	0.204	C	C	.	.	S	Bend	trans	-76.2	-17.8	-179.5	-65.9	-37.9	0	0	0	113.4	T400 V431 G432 V434	N68-T400 PolarHBondContact O-N 2.98Å; N68-V431 PolarHBondContact ND2-O 3.46Å; N68-G432 PolarHBondContact ND2-O 3.45Å; N68-V434 HydrophobicContact CB-CG2 4.18Å
69	I	89.6	Confident	91.3	Very high	12 Å²	12	38.5 Å²	38.5	6%	0.062	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	124.1	167.6	-63.9	178.8	0	0	0	107	G67 F369 T400 V426 C429 V431	G67-I69 VanDerWaalsContact C-N 3.3Å; G67-I69 PolarHBondContact O-N 2.81Å; I69-F369 HydrophobicContact CD1-CD1 4.31Å; I69-F369 HydrophobicContact CD1-CE1 3.98Å; I69-T400 CarbonylContact C-O 3.51Å; I69-T400 VanDerWaalsContact CA-O 3.3Å; I69-T400 WeakPolarHBondContact CA-O 3.42Å; I69-V426 HydrophobicContact CG2-CG1 3.77Å; I69-C429 HydrophobicContact CD1-CB 3.66Å; I69-V431 HydrophobicContact CD1-CG2 3.42Å; I69-V431 VanDerWaalsContact CD1-CG2 3.42Å; I69-V431 HydrophobicContact CG1-CG2 3.95Å
70	R	93	Very high	90.8	Very high	9 Å²	9	42.1 Å²	42.1	3%	0.034	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	147.8	173.8	-66.6	179.8	68	-159.5	1.7	110.3	D137 E152 T400 L401 M402	R70-D137 WeakPolarHBondContact CA-OD2 3.19Å; R70-D137 HydrophobicContact CB-CB 4.5Å; R70-D137 WeakPolarHBondContact CB-OD2 3.39Å; R70-D137 IonicContact NE-OD1 3.84Å; R70-E152 IonicContact NH2-OE2 3.53Å; R70-T400 PolarHBondContact N-O 2.87Å; R70-L401 CarbonylContact O-C 3.54Å; R70-L401 WeakPolarHBondContact O-CA 3.26Å; R70-M402 PolarHBondContact O-N 2.8Å
71	V	95.3	Very high	90.4	Very high	0 Å²	0	46.5 Å²	46.5	0%	0	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	123.6	178.7	-179.4	0	0	0	0	109.7	F136 D137 M402 V404 A423 V426 N427	V71-F136 HydrophobicContact CB-CD1 3.91Å; V71-F136 HydrophobicContact CG1-CD1 3.42Å; V71-F136 VanDerWaalsContact CG1-CD1 3.42Å; V71-F136 HydrophobicContact CG1-CE1 3.76Å; V71-F136 HydrophobicContact CG1-CG 4.17Å; V71-F136 WeakPolarHBondContact O-CB 3.33Å; V71-D137 PolarHBondContact N-OD2 3.31Å; V71-D137 PolarHBondContact O-N 3.38Å; V71-D137 VanDerWaalsContact O-N 3.1Å; V71-M402 CarbonylContact C-O 3.43Å; V71-M402 WeakPolarHBondContact CA-O 3.35Å; V71-M402 HydrophobicContact CG2-CB 4.25Å; V71-V404 HydrophobicContact CG1-CG1 4.21Å; V71-A423 HydrophobicContact CG1-CB 3.86Å; V71-V426 HydrophobicContact CG2-CB 4.22Å; V71-V426 HydrophobicContact CG2-CG1 3.97Å; V71-N427 HydrophobicContact CB-CB 4.03Å; V71-N427 HydrophobicContact CG2-CB 3.65Å
72	F	97.9	Very high	90	Very high	0 Å²	0	43.9 Å²	43.9	0%	0	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	122.3	176.5	-74.6	3.5	0	0	0	109.7	D137 C138 F140 E152 I153 L401 M402 F403 V404	F72-D137 HydrophobicContact CD1-CB 3.94Å; F72-D137 HydrophobicContact CE1-CB 3.72Å; F72-C138 CarbonylContact C-O 3.55Å; F72-C138 VanDerWaalsContact CA-O 3.31Å; F72-C138 WeakPolarHBondContact CA-O 3.44Å; F72-C138 HydrophobicContact CD1-CB 3.58Å; F72-C138 HydrophobicContact CE1-CB 3.67Å; F72-C138 HydrophobicContact CG-CB 4.05Å; F72-C138 HydrophobicContact CZ-CB 4.17Å; F72-F140 HydrophobicContact CB-CE2 3.97Å; F72-F140 AromaticContact CD2-CE2 3.68Å; F72-F140 HydrophobicContact CD2-CE2 3.68Å; F72-F140 HydrophobicContact CD2-CZ 4.08Å; F72-F140 HydrophobicContact CE2-CE2 4.38Å; F72-F140 HydrophobicContact CE2-CZ 4.34Å; F72-F140 AromaticContact CG-CE2 3.98Å; F72-F140 HydrophobicContact CG-CE2 3.98Å; F72-E152 HydrophobicContact CE2-CB 3.52Å; F72-E152 HydrophobicContact CZ-CB 3.83Å; F72-I153 HydrophobicContact CD2-CG2 4.08Å; F72-I153 HydrophobicContact CE2-CG2 3.66Å; F72-L401 HydrophobicContact CD2-CD1 3.93Å; F72-L401 HydrophobicContact CD2-CD2 3.96Å; F72-L401 HydrophobicContact CD2-CG 4.33Å; F72-L401 HydrophobicContact CE1-CD1 4.29Å; F72-L401 HydrophobicContact CE2-CD1 3.62Å; F72-L401 HydrophobicContact CE2-CD2 4.47Å; F72-L401 HydrophobicContact CE2-CG 4.49Å; F72-L401 HydrophobicContact CG-CD1 4.42Å; F72-L401 HydrophobicContact CG-CD2 4.26Å; F72-L401 HydrophobicContact CZ-CD1 3.8Å; F72-M402 PolarHBondContact N-O 3.48Å; F72-F403 HydrophobicContact CB-CD1 3.71Å; F72-F403 HydrophobicContact CB-CE1 3.82Å; F72-F403 HydrophobicContact CD2-CD1 4.4Å; F72-F403 AromaticContact CD2-CE1 3.69Å; F72-F403 HydrophobicContact CD2-CE1 3.69Å; F72-F403 AromaticContact CD2-CZ 3.99Å; F72-F403 HydrophobicContact CD2-CZ 3.99Å; F72-F403 HydrophobicContact CG-CE1 4.27Å; F72-F403 CarbonylContact O-C 3.59Å; F72-F403 VanDerWaalsContact O-CA 3.28Å; F72-F403 WeakPolarHBondContact O-CA 3.41Å; F72-V404 PolarHBondContact O-N 2.76Å
73	C	98.2	Very high	89.1	Confident	0 Å²	0	46.1 Å²	46.1	0%	0	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.1	133.2	172.6	179.9	0	0	0	0	110	F136 C138 V139 F140 V404	C73-F136 HydrophobicContact CB-CD2 3.63Å; C73-F136 HydrophobicContact CB-CE2 4.02Å; C73-F136 HydrophobicContact CB-CG 4.37Å; C73-C138 PolarHBondContact N-O 2.69Å; C73-V139 HydrophobicContact CB-CB 4.42Å; C73-V139 HydrophobicContact CB-CG1 4.18Å; C73-V139 HydrophobicContact CB-CG2 4.07Å; C73-V139 CarbonylContact O-C 3.58Å; C73-V139 VanDerWaalsContact O-CA 3.31Å; C73-V139 WeakPolarHBondContact O-CA 3.42Å; C73-F140 WeakPolarHBondContact O-CD2 3.48Å; C73-F140 PolarHBondContact O-N 3.45Å; C73-V404 WeakPolarHBondContact CA-O 2.91Å; C73-V404 HydrophobicContact CB-CG1 3.7Å
74	R	97.7	Very high	88	Confident	11 Å²	11	49.9 Å²	49.9	4%	0.042	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.8	118.4	176.5	-175	174.9	-172.5	-178.7	10.8	110.7	F140 Q146 T181 V404 N405 I406	R74-F140 HydrophobicContact CB-CB 4.27Å; R74-F140 HydrophobicContact CB-CD2 4.28Å; R74-F140 HydrophobicContact CG-CB 4.03Å; R74-Q146 VanDerWaalsContact CZ-OE1 3.25Å; R74-T181 PolarHBondContact NH1-OG1 3.39Å; R74-T181 VanDerWaalsContact NH1-OG1 3.07Å; R74-V404 PolarHBondContact N-O 3.11Å; R74-N405 WeakPolarHBondContact O-CA 3.21Å; R74-I406 PolarHBondContact O-N 3.43Å
75	M	96.6	Very high	87	Confident	3 Å²	3	48.5 Å²	48.5	2%	0.015	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.4	131.8	169.5	-169.1	160.2	84.8	0	0	109.4	I92 P93 V96 F98 F140 P142 I406 P408	M75-I92 HydrophobicContact CE-CG2 4.22Å; M75-P93 HydrophobicContact CE-CG 4.49Å; M75-V96 HydrophobicContact CE-CB 4.26Å; M75-V96 HydrophobicContact CE-CG1 3.97Å; M75-V96 HydrophobicContact SD-CB 4.37Å; M75-V96 HydrophobicContact SD-CG1 3.91Å; M75-V96 HydrophobicContact SD-CG2 4.13Å; M75-F98 HydrophobicContact CB-CZ 4.03Å; M75-F98 HydrophobicContact CE-CE2 3.58Å; M75-F98 HydrophobicContact CE-CZ 3.55Å; M75-F98 HydrophobicContact SD-CZ 4.01Å; M75-F140 PolarHBondContact N-O 3.26Å; M75-P142 HydrophobicContact CB-CG 4.36Å; M75-P142 HydrophobicContact CE-CG 3.26Å; M75-P142 HydrophobicContact CG-CG 4.16Å; M75-P142 WeakPolarHBondContact O-CA 3.46Å; M75-I406 HydrophobicContact CB-CD1 4.08Å; M75-I406 HydrophobicContact CB-CG1 3.76Å; M75-I406 HydrophobicContact CG-CD1 4.33Å; M75-I406 HydrophobicContact CG-CG1 4Å; M75-I406 HydrophobicContact SD-CD1 4.25Å; M75-I406 HydrophobicContact SD-CG1 4.49Å; M75-P408 HydrophobicContact CE-CB 4.36Å; M75-P408 HydrophobicContact CG-CB 4.24Å; M75-P408 HydrophobicContact SD-CB 4.1Å
76	R	94.3	Very high	86.2	Confident	26 Å²	26	46.3 Å²	46.3	10%	0.098	29%	0.288	C	S	.	.	P	Polyproline II helix	trans	-81.3	159.5	173	65.4	160.7	178.7	81.9	-6.9	111.8	E82 G175 I406 S407 P408	R76-E82 IonicContact CZ-OE1 3.36Å; R76-E82 IonicContact CZ-OE2 2.87Å; R76-E82 IonicContact NH1-OE1 3.41Å; R76-E82 IonicContact NH1-OE2 2.75Å; R76-E82 PolarHBondContact NH1-OE2 2.94Å; R76-E82 IonicContact NH2-OE1 2.69Å; R76-E82 PolarHBondContact NH2-OE1 3.41Å; R76-E82 IonicContact NH2-OE2 2.7Å; R76-E82 PolarHBondContact NH2-OE2 3.16Å; R76-G175 PolarHBondContact NE-O 3.08Å; R76-G175 PolarHBondContact NH2-O 3.01Å; R76-I406 PolarHBondContact N-O 2.87Å; R76-S407 PolarHBondContact NH2-OG 2.82Å; R76-P408 HydrophobicContact CG-CG 4.5Å; R76-P408 WeakPolarHBondContact O-CG 3.29Å
77	P	91.3	Very high	85.6	Confident	75 Å²	75	44.3 Å²	44.3	49%	0.487	28%	0.284	S	S	.	.	P	Polyproline II helix	trans	-58.3	157.9	164.4	-21.9	32.3	0	0	0	113.3	P142	P77-P142 HydrophobicContact CG-CB 4.38Å; P77-P142 WeakPolarHBondContact CG-O 3.28Å
78	L	88.8	Confident	85.1	Confident	34 Å²	34	46.6 Å²	46.6	18%	0.178	29%	0.291	C	S	.	.	P	Polyproline II helix	trans	-64.4	138	165	-74.2	164.3	0	0	0	109.9	E82 T87 P408 T409	L78-E82 HydrophobicContact CB-CB 4.41Å; L78-E82 HydrophobicContact CD2-CB 3.69Å; L78-T87 HydrophobicContact CD1-CG2 3.28Å; L78-P408 HydrophobicContact CD2-CB 4.04Å; L78-P408 HydrophobicContact CD2-CG 3.71Å; L78-P408 HydrophobicContact CG-CB 4.2Å; L78-P408 HydrophobicContact CG-CG 3.97Å; L78-T409 HydrophobicContact CD2-CG2 4.05Å
79	L	86.6	Confident	84.2	Confident	90 Å²	90	51.7 Å²	51.7	47%	0.471	34%	0.335	S	S	.	.	P	Polyproline II helix	trans	-78.4	160.2	171.9	-58.6	174.1	0	0	0	109.9	S81 E82 I83	L79-S81 PolarHBondContact O-N 3.18Å; L79-S81 VanDerWaalsContact O-N 3.08Å; L79-E82 HydrophobicContact CB-CG 4.11Å; L79-E82 PolarHBondContact N-OE2 2.92Å; L79-E82 WeakPolarHBondContact O-CA 3.09Å; L79-E82 WeakPolarHBondContact O-CB 3.27Å; L79-E82 PolarHBondContact O-N 3.44Å; L79-I83 PolarHBondContact O-N 3.24Å
80	S	83.5	Confident	83.3	Confident	110 Å²	110	55 Å²	55	77%	0.769	36%	0.358	S	S	*	.	G	3₁₀ helix	trans	-55.3	-31.3	178.2	-49.6	0	0	0	0	113.3	E82	S80-E82 VanDerWaalsContact C-N 3.28Å; S80-E82 PolarHBondContact O-N 2.9Å
81	S	81	Confident	82.4	Confident	110 Å²	110	56 Å²	56	77%	0.769	37%	0.372	S	S	*	.	G	3₁₀ helix	trans	-75.1	-11.6	175.7	54.1	0	0	0	0	114.4	L79	L79-S81 PolarHBondContact O-N 3.18Å; L79-S81 VanDerWaalsContact O-N 3.08Å
82	E	81.8	Confident	81.9	Confident	30 Å²	30	57.3 Å²	57.3	14%	0.14	38%	0.379	C	S	.	.	G	3₁₀ helix	trans	-109.6	-1.7	-172.6	-59.7	172.6	153.2	0	0	113.3	R76 L78 L79 S80 G84 T85 T409	R76-E82 IonicContact CZ-OE1 3.36Å; R76-E82 IonicContact CZ-OE2 2.87Å; R76-E82 IonicContact NH1-OE1 3.41Å; R76-E82 IonicContact NH1-OE2 2.75Å; R76-E82 PolarHBondContact NH1-OE2 2.94Å; R76-E82 IonicContact NH2-OE1 2.69Å; R76-E82 PolarHBondContact NH2-OE1 3.41Å; R76-E82 IonicContact NH2-OE2 2.7Å; R76-E82 PolarHBondContact NH2-OE2 3.16Å; L78-E82 HydrophobicContact CB-CB 4.41Å; L78-E82 HydrophobicContact CD2-CB 3.69Å; L79-E82 HydrophobicContact CB-CG 4.11Å; L79-E82 PolarHBondContact N-OE2 2.92Å; L79-E82 WeakPolarHBondContact O-CA 3.09Å; L79-E82 WeakPolarHBondContact O-CB 3.27Å; L79-E82 PolarHBondContact O-N 3.44Å; S80-E82 VanDerWaalsContact C-N 3.28Å; S80-E82 PolarHBondContact O-N 2.9Å; E82-G84 PolarHBondContact O-N 3.36Å; E82-T85 WeakPolarHBondContact O-CB 3.41Å; E82-T85 PolarHBondContact O-N 3.29Å; E82-T85 PolarHBondContact O-OG1 3.49Å; E82-T409 HydrophobicContact CB-CG2 4.05Å; E82-T409 VanDerWaalsContact CD-CG2 3.41Å; E82-T409 HydrophobicContact CG-CG2 3.85Å; E82-T409 WeakPolarHBondContact OE1-CG2 3.46Å
83	I	72.2	Confident	81.2	Confident	121 Å²	121	57.3 Å²	57.3	62%	0.621	38%	0.379	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60	-13.1	-176.3	-64.2	174.8	0	0	0	112.8	L79 T85	L79-I83 PolarHBondContact O-N 3.24Å; I83-T85 PolarHBondContact O-N 3.07Å; I83-T85 VanDerWaalsContact O-N 3.16Å
84	G	68.7	Low	80.6	Confident	84 Å²	84	61.8 Å²	61.8	87%	0.866	40%	0.403	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.2	-8.8	170.2	0	0	0	0	0	115.3	E82	E82-G84 PolarHBondContact O-N 3.36Å
85	T	65.3	Low	80.1	Confident	30 Å²	30	62.1 Å²	62.1	18%	0.184	41%	0.405	C	S	.	.	S	Bend	trans	-75.9	134.6	177.3	-45.2	0	0	0	0	110.5	E82 I83 T87	E82-T85 WeakPolarHBondContact O-CB 3.41Å; E82-T85 PolarHBondContact O-N 3.29Å; E82-T85 PolarHBondContact O-OG1 3.49Å; I83-T85 PolarHBondContact O-N 3.07Å; I83-T85 VanDerWaalsContact O-N 3.16Å; T85-T87 PolarHBondContact O-N 3.45Å
86	T	68.9	Low	79.9	Confident	95 Å²	95	62.4 Å²	62.4	58%	0.583	41%	0.407	S	S	*	.			trans	-65	121.8	176	54.8	0	0	0	0	110.4	D94	T86-D94 WeakPolarHBondContact CB-OD2 3.44Å; T86-D94 PolarHBondContact O-N 3.26Å; T86-D94 PolarHBondContact OG1-OD2 3.44Å
87	T	75.2	Confident	79.8	Confident	57 Å²	57	63.3 Å²	63.3	35%	0.35	42%	0.417	S	S	.	.	B	Isolated β-bridge	trans	-126.6	154.5	-179.2	45.9	0	0	0	0	111.1	L78 T85 I92	L78-T87 HydrophobicContact CD1-CG2 3.28Å; T85-T87 PolarHBondContact O-N 3.45Å; T87-I92 CarbonylContact C-O 3.55Å; T87-I92 VanDerWaalsContact CA-O 3.28Å; T87-I92 WeakPolarHBondContact CA-O 3.44Å
88	D	74.4	Confident	79.9	Confident	70 Å²	70	61.8 Å²	61.8	37%	0.374	40%	0.402	S	S	.	.			trans	-73.3	177.8	167.4	73.2	13.3	0	0	0	112	S90 G91 I92	D88-S90 VanDerWaalsContact CG-OG 3.27Å; D88-S90 PolarHBondContact O-N 2.82Å; D88-S90 VanDerWaalsContact OD1-CA 3.29Å; D88-S90 WeakPolarHBondContact OD1-CA 3.38Å; D88-S90 WeakPolarHBondContact OD1-CB 3.37Å; D88-S90 PolarHBondContact OD1-N 3.27Å; D88-S90 PolarHBondContact OD1-OG 2.86Å; D88-S90 PolarHBondContact OD2-OG 3.31Å; D88-G91 PolarHBondContact O-N 3.49Å; D88-G91 PolarHBondContact OD1-N 3.07Å; D88-G91 VanDerWaalsContact OD1-N 3.14Å; D88-I92 PolarHBondContact N-O 3.01Å; D88-I92 PolarHBondContact OD1-N 3.31Å
89	A	68.6	Low	79.9	Confident	119 Å²	119	62 Å²	62	98%	0.983	41%	0.406	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.2	-14.1	179.3	0	0	0	0	0	114.3
90	S	70.3	Confident	79.7	Confident	80 Å²	80	60.7 Å²	60.7	56%	0.559	42%	0.415	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.4	3.1	177.1	71.6	0	0	0	0	113.5	D88 I92	D88-S90 VanDerWaalsContact CG-OG 3.27Å; D88-S90 PolarHBondContact O-N 2.82Å; D88-S90 VanDerWaalsContact OD1-CA 3.29Å; D88-S90 WeakPolarHBondContact OD1-CA 3.38Å; D88-S90 WeakPolarHBondContact OD1-CB 3.37Å; D88-S90 PolarHBondContact OD1-N 3.27Å; D88-S90 PolarHBondContact OD1-OG 2.86Å; D88-S90 PolarHBondContact OD2-OG 3.31Å; S90-I92 VanDerWaalsContact C-N 3.29Å; S90-I92 VanDerWaalsContact OG-CD1 3.28Å; S90-I92 WeakPolarHBondContact OG-CD1 3.39Å; S90-I92 WeakPolarHBondContact OG-CG1 3.27Å
91	G	74.9	Confident	79.6	Confident	32 Å²	32	63.8 Å²	63.8	33%	0.33	42%	0.42	S	S	.	.	S	Bend	trans	77.1	14.8	-177.8	0	0	0	0	0	113.5	D88	D88-G91 PolarHBondContact O-N 3.49Å; D88-G91 PolarHBondContact OD1-N 3.07Å; D88-G91 VanDerWaalsContact OD1-N 3.14Å
92	I	83	Confident	79.8	Confident	26 Å²	26	65.2 Å²	65.2	13%	0.133	42%	0.415	C	S	.	.			trans	-88.8	132.3	176.7	-61.6	173.2	0	0	0	108.4	M75 T87 D88 S90 V96 F98 P142	M75-I92 HydrophobicContact CE-CG2 4.22Å; T87-I92 CarbonylContact C-O 3.55Å; T87-I92 VanDerWaalsContact CA-O 3.28Å; T87-I92 WeakPolarHBondContact CA-O 3.44Å; D88-I92 PolarHBondContact N-O 3.01Å; D88-I92 PolarHBondContact OD1-N 3.31Å; S90-I92 VanDerWaalsContact C-N 3.29Å; S90-I92 VanDerWaalsContact OG-CD1 3.28Å; S90-I92 WeakPolarHBondContact OG-CD1 3.39Å; S90-I92 WeakPolarHBondContact OG-CG1 3.27Å; I92-V96 HydrophobicContact CG2-CB 4.29Å; I92-V96 WeakPolarHBondContact CG2-O 3.17Å; I92-F98 HydrophobicContact CD1-CD2 4.01Å; I92-F98 HydrophobicContact CD1-CE2 4.23Å; I92-F98 HydrophobicContact CG2-CD2 4.41Å; I92-F98 HydrophobicContact CG2-CE2 4.05Å; I92-P142 HydrophobicContact CG1-CG 4.43Å
93	P	84.4	Confident	80.2	Confident	1 Å²	1	69.2 Å²	69.2	1%	0.006	43%	0.429	C	S	.	.	B	Isolated β-bridge	trans	-61.7	142.4	177.5	-18.3	28.6	0	0	0	112.2	M75 F95 V96 P408	M75-P93 HydrophobicContact CE-CG 4.49Å; P93-F95 HydrophobicContact CB-CD1 3.69Å; P93-F95 HydrophobicContact CB-CE1 3.41Å; P93-F95 VanDerWaalsContact CB-CE1 3.41Å; P93-F95 HydrophobicContact CB-CG 4.5Å; P93-F95 HydrophobicContact CB-CZ 4.03Å; P93-F95 HydrophobicContact CG-CE1 4.2Å; P93-F95 HydrophobicContact CG-CZ 4.42Å; P93-F95 PolarHBondContact O-N 3.34Å; P93-V96 HydrophobicContact CB-CG2 4.35Å; P93-V96 HydrophobicContact CG-CG2 4.43Å; P93-V96 PolarHBondContact O-N 3.02Å; P93-V96 VanDerWaalsContact O-O 3.14Å; P93-P408 HydrophobicContact CG-CB 3.61Å; P93-P408 WeakPolarHBondContact CG-O 3.3Å
94	D	84.6	Confident	81.2	Confident	93 Å²	93	67.8 Å²	67.8	50%	0.497	42%	0.418	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.1	-24.2	-177.2	-67	-28.9	0	0	0	114.6	T86	T86-D94 WeakPolarHBondContact CB-OD2 3.44Å; T86-D94 PolarHBondContact O-N 3.26Å; T86-D94 PolarHBondContact OG1-OD2 3.44Å
95	F	87.7	Confident	82.5	Confident	19 Å²	19	67.1 Å²	67.1	8%	0.083	39%	0.393	C	S	.	.	T	Hydrogen-bonded Turn	trans	-88.1	-3.5	-179.3	70.5	-93	0	0	0	113.6	P93 L108 L109 P408 E410 F413	P93-F95 HydrophobicContact CB-CD1 3.69Å; P93-F95 HydrophobicContact CB-CE1 3.41Å; P93-F95 VanDerWaalsContact CB-CE1 3.41Å; P93-F95 HydrophobicContact CB-CG 4.5Å; P93-F95 HydrophobicContact CB-CZ 4.03Å; P93-F95 HydrophobicContact CG-CE1 4.2Å; P93-F95 HydrophobicContact CG-CZ 4.42Å; P93-F95 PolarHBondContact O-N 3.34Å; F95-L108 CarbonylContact O-C 3.56Å; F95-L108 WeakPolarHBondContact O-CA 3.27Å; F95-L109 HydrophobicContact CB-CB 4.45Å; F95-L109 PolarHBondContact O-N 3.32Å; F95-P408 WeakPolarHBondContact CE1-O 3.46Å; F95-P408 VanDerWaalsContact CZ-O 3.25Å; F95-P408 WeakPolarHBondContact CZ-O 3.35Å; F95-E410 HydrophobicContact CD1-CB 4.49Å; F95-E410 HydrophobicContact CE1-CB 4.06Å; F95-F413 AromaticContact CD2-CD2 3.64Å; F95-F413 HydrophobicContact CD2-CD2 3.64Å; F95-F413 AromaticContact CD2-CE2 3.9Å; F95-F413 HydrophobicContact CD2-CE2 3.9Å; F95-F413 AromaticContact CE2-CD2 3.79Å; F95-F413 HydrophobicContact CE2-CD2 3.79Å; F95-F413 HydrophobicContact CE2-CE2 4.42Å; F95-F413 HydrophobicContact CG-CD2 4.49Å
96	V	91.8	Very high	83.9	Confident	9 Å²	9	65.7 Å²	65.7	6%	0.055	38%	0.384	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	138.3	179.8	-170.7	0	0	0	0	109.8	M75 I92 P93 F98 V106 E107 L108	M75-V96 HydrophobicContact CE-CB 4.26Å; M75-V96 HydrophobicContact CE-CG1 3.97Å; M75-V96 HydrophobicContact SD-CB 4.37Å; M75-V96 HydrophobicContact SD-CG1 3.91Å; M75-V96 HydrophobicContact SD-CG2 4.13Å; I92-V96 HydrophobicContact CG2-CB 4.29Å; I92-V96 WeakPolarHBondContact CG2-O 3.17Å; P93-V96 HydrophobicContact CB-CG2 4.35Å; P93-V96 HydrophobicContact CG-CG2 4.43Å; P93-V96 PolarHBondContact O-N 3.02Å; P93-V96 VanDerWaalsContact O-O 3.14Å; V96-F98 HydrophobicContact CG1-CE1 4.49Å; V96-F98 HydrophobicContact CG1-CE2 3.78Å; V96-F98 HydrophobicContact CG1-CZ 3.75Å; V96-V106 HydrophobicContact CG1-CG2 3.9Å; V96-E107 CarbonylContact C-O 3.37Å; V96-E107 WeakPolarHBondContact CA-O 3.37Å; V96-L108 HydrophobicContact CB-CD2 4.31Å; V96-L108 HydrophobicContact CG1-CD2 4.05Å; V96-L108 HydrophobicContact CG2-CD2 3.77Å
97	S	92.6	Very high	85.1	Confident	44 Å²	44	62.2 Å²	62.2	31%	0.308	36%	0.361	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.7	156	168.4	62	0	0	0	0	111.7	P99 E107	S97-P99 WeakPolarHBondContact O-CD 3.48Å; S97-E107 PolarHBondContact N-O 2.73Å; S97-E107 PolarHBondContact O-N 3.31Å; S97-E107 WeakPolarHBondContact OG-CB 3.32Å; S97-E107 PolarHBondContact OG-OE2 3.16Å
98	F	93.3	Very high	85.9	Confident	43 Å²	43	59.5 Å²	59.5	19%	0.189	34%	0.344	C	S	.	.			trans	-121.5	80.2	-177.4	-60.5	-84.7	0	0	0	108.8	M75 I92 V96 V106 V139 P141	M75-F98 HydrophobicContact CB-CZ 4.03Å; M75-F98 HydrophobicContact CE-CE2 3.58Å; M75-F98 HydrophobicContact CE-CZ 3.55Å; M75-F98 HydrophobicContact SD-CZ 4.01Å; I92-F98 HydrophobicContact CD1-CD2 4.01Å; I92-F98 HydrophobicContact CD1-CE2 4.23Å; I92-F98 HydrophobicContact CG2-CD2 4.41Å; I92-F98 HydrophobicContact CG2-CE2 4.05Å; V96-F98 HydrophobicContact CG1-CE1 4.49Å; V96-F98 HydrophobicContact CG1-CE2 3.78Å; V96-F98 HydrophobicContact CG1-CZ 3.75Å; F98-V106 HydrophobicContact CD1-CB 4.25Å; F98-V106 HydrophobicContact CD1-CG2 4.2Å; F98-V106 HydrophobicContact CE1-CB 4.14Å; F98-V106 HydrophobicContact CE1-CG2 3.77Å; F98-V106 HydrophobicContact CZ-CG2 4.33Å; F98-V139 HydrophobicContact CD1-CG1 3.53Å; F98-V139 HydrophobicContact CE1-CG1 3.63Å; F98-P141 HydrophobicContact CB-CG 4.14Å; F98-P141 HydrophobicContact CD1-CB 4.27Å; F98-P141 HydrophobicContact CD1-CG 3.94Å; F98-P141 HydrophobicContact CD2-CB 3.83Å; F98-P141 HydrophobicContact CD2-CG 4.08Å; F98-P141 HydrophobicContact CE1-CB 4.3Å; F98-P141 HydrophobicContact CE1-CG 4.36Å; F98-P141 HydrophobicContact CE2-CB 3.87Å; F98-P141 HydrophobicContact CE2-CG 4.5Å; F98-P141 HydrophobicContact CG-CB 4.04Å; F98-P141 HydrophobicContact CG-CG 3.78Å; F98-P141 HydrophobicContact CZ-CB 4.1Å
99	P	89.4	Confident	86.6	Confident	38 Å²	38	58.3 Å²	58.3	25%	0.247	34%	0.338	C	S	.	.			trans	-71.7	148.5	-176.7	32.5	-38.5	0	0	0	111.5	S97 Q105 E107	S97-P99 WeakPolarHBondContact O-CD 3.48Å; P99-Q105 HydrophobicContact CG-CB 3.76Å; P99-E107 HydrophobicContact CG-CG 3.69Å
100	G	82.4	Confident	87	Confident	64 Å²	64	54.2 Å²	54.2	66%	0.66	30%	0.298	S	S	*	.	S	Bend	trans	83.1	150.6	173.9	0	0	0	0	0	114	E102	G100-E102 VanDerWaalsContact C-N 3.32Å
101	I	82.1	Confident	86.9	Confident	174 Å²	174	52.5 Å²	52.5	89%	0.892	29%	0.285	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.4	-23.7	-177	-55.4	167.4	0	0	0	110.8	R103	I101-R103 PolarHBondContact O-N 3.09Å
102	E	83.6	Confident	86.1	Confident	141 Å²	141	54.2 Å²	54.2	66%	0.659	30%	0.296	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.7	-3.8	-176.3	-62.3	-171	-173.5	0	0	114.8	G100 K104	G100-E102 VanDerWaalsContact C-N 3.32Å; E102-K104 VanDerWaalsContact C-N 3.31Å; E102-K104 HydrophobicContact CB-CD 4.3Å; E102-K104 HydrophobicContact CB-CG 4.17Å; E102-K104 PolarHBondContact O-N 3.04Å; E102-K104 WeakPolarHBondContact OE2-CD 3.48Å; E102-K104 WeakPolarHBondContact OE2-CE 3.24Å; E102-K104 IonicContact OE2-NZ 2.87Å; E102-K104 PolarHBondContact OE2-NZ 3.25Å
103	R	91	Very high	84.5	Confident	114 Å²	114	57.5 Å²	57.5	43%	0.43	32%	0.32	S	S	.	.	S	Bend	trans	52.3	45.5	-178.2	-65.2	-176.6	-177.2	174.6	-0.8	113	I101 C138 V139	I101-R103 PolarHBondContact O-N 3.09Å; R103-C138 CarbonylContact O-C 3.6Å; R103-C138 WeakPolarHBondContact O-CA 3.2Å; R103-V139 WeakPolarHBondContact CB-O 3.45Å; R103-V139 PolarHBondContact O-N 3.46Å
104	K	93.6	Very high	82.8	Confident	90 Å²	90	61.7 Å²	61.7	39%	0.391	36%	0.363	S	S	.	.			trans	-108	-12.6	179.4	-72.6	-175.8	-178.5	157.8	0	114.5	E102 T135 F136 V139	E102-K104 VanDerWaalsContact C-N 3.31Å; E102-K104 HydrophobicContact CB-CD 4.3Å; E102-K104 HydrophobicContact CB-CG 4.17Å; E102-K104 PolarHBondContact O-N 3.04Å; E102-K104 WeakPolarHBondContact OE2-CD 3.48Å; E102-K104 WeakPolarHBondContact OE2-CE 3.24Å; E102-K104 IonicContact OE2-NZ 2.87Å; E102-K104 PolarHBondContact OE2-NZ 3.25Å; K104-T135 HydrophobicContact CB-CG2 4.41Å; K104-T135 CarbonylContact O-C 3.58Å; K104-T135 VanDerWaalsContact O-CA 3.28Å; K104-T135 WeakPolarHBondContact O-CA 2.99Å; K104-F136 PolarHBondContact O-N 3.33Å; K104-V139 WeakPolarHBondContact O-CG2 3.44Å
105	Q	94.6	Very high	81	Confident	71 Å²	71	65 Å²	65	33%	0.332	37%	0.374	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	142.1	-170.5	-70	-177.9	-2.7	0	0	112.2	P99 T133 F134 T135	P99-Q105 HydrophobicContact CG-CB 3.76Å; Q105-T133 HydrophobicContact CG-CG2 4.47Å; Q105-F134 VanDerWaalsContact CA-O 3.28Å; Q105-F134 WeakPolarHBondContact CA-O 3.47Å; Q105-T135 HydrophobicContact CG-CG2 4.21Å
106	V	95.1	Very high	79.2	Confident	0 Å²	0	69.1 Å²	69.1	0%	0	40%	0.402	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	133.5	164.9	59	0	0	0	0	108.1	V96 F98 L108 F134 F136 V139 I406 L420	V96-V106 HydrophobicContact CG1-CG2 3.9Å; F98-V106 HydrophobicContact CD1-CB 4.25Å; F98-V106 HydrophobicContact CD1-CG2 4.2Å; F98-V106 HydrophobicContact CE1-CB 4.14Å; F98-V106 HydrophobicContact CE1-CG2 3.77Å; F98-V106 HydrophobicContact CZ-CG2 4.33Å; V106-L108 HydrophobicContact CG2-CD2 4.4Å; V106-F134 HydrophobicContact CG1-CB 3.92Å; V106-F134 PolarHBondContact N-O 3.43Å; V106-F134 PolarHBondContact O-N 2.92Å; V106-F136 HydrophobicContact CG1-CE2 4.24Å; V106-V139 HydrophobicContact CB-CG1 3.92Å; V106-I406 HydrophobicContact CG2-CD1 4.42Å; V106-L420 HydrophobicContact CG1-CD1 4.42Å; V106-L420 HydrophobicContact CG1-CD2 4.05Å
107	E	94	Very high	77.1	Confident	21 Å²	21	72.9 Å²	72.9	10%	0.098	43%	0.429	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	133.4	179	-58.2	-173.7	136	0	0	110.3	V96 S97 P99 K131 M132 T133	V96-E107 CarbonylContact C-O 3.37Å; V96-E107 WeakPolarHBondContact CA-O 3.37Å; S97-E107 PolarHBondContact N-O 2.73Å; S97-E107 PolarHBondContact O-N 3.31Å; S97-E107 WeakPolarHBondContact OG-CB 3.32Å; S97-E107 PolarHBondContact OG-OE2 3.16Å; P99-E107 HydrophobicContact CG-CG 3.69Å; E107-K131 WeakPolarHBondContact OE1-CE 3.28Å; E107-K131 IonicContact OE1-NZ 3.92Å; E107-K131 PolarHBondContact OE1-NZ 3.1Å; E107-K131 WeakPolarHBondContact OE2-CE 3.43Å; E107-K131 IonicContact OE2-NZ 4Å; E107-K131 PolarHBondContact OE2-NZ 3.34Å; E107-M132 CarbonylContact C-O 3.53Å; E107-M132 VanDerWaalsContact CA-O 3.26Å; E107-M132 WeakPolarHBondContact CA-O 3.31Å; E107-T133 HydrophobicContact CG-CG2 3.98Å; E107-T133 PolarHBondContact OE1-OG1 3.28Å
108	L	92.6	Very high	75	Confident	0 Å²	0	78.2 Å²	78.2	0%	0	45%	0.454	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	133.6	176.9	-58.4	-176.7	0	0	0	110.3	F95 V96 V106 M132 F134 F413 T416 V417 L420	F95-L108 CarbonylContact O-C 3.56Å; F95-L108 WeakPolarHBondContact O-CA 3.27Å; V96-L108 HydrophobicContact CB-CD2 4.31Å; V96-L108 HydrophobicContact CG1-CD2 4.05Å; V96-L108 HydrophobicContact CG2-CD2 3.77Å; V106-L108 HydrophobicContact CG2-CD2 4.4Å; L108-M132 PolarHBondContact N-O 2.75Å; L108-M132 PolarHBondContact O-N 3.29Å; L108-F134 HydrophobicContact CD1-CE2 4.14Å; L108-F134 HydrophobicContact CG-CE2 4.48Å; L108-F413 HydrophobicContact CB-CE2 3.99Å; L108-F413 HydrophobicContact CB-CZ 4.24Å; L108-F413 HydrophobicContact CD1-CE2 4.46Å; L108-T416 HydrophobicContact CD1-CG2 3.79Å; L108-V417 HydrophobicContact CD1-CG2 3.78Å; L108-L420 HydrophobicContact CD1-CD1 3.45Å; L108-L420 VanDerWaalsContact CD1-CD1 3.45Å; L108-L420 HydrophobicContact CG-CD1 4.18Å
109	L	88.2	Confident	73	Confident	46 Å²	46	77.6 Å²	77.6	24%	0.241	45%	0.454	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	108.3	173.8	-67.5	169.7	0	0	0	109	F95 P111 L125 K131	F95-L109 HydrophobicContact CB-CB 4.45Å; F95-L109 PolarHBondContact O-N 3.32Å; L109-P111 WeakPolarHBondContact O-CD 3.48Å; L109-L125 HydrophobicContact CD2-CD1 3.45Å; L109-L125 VanDerWaalsContact CD2-CD1 3.45Å; L109-K131 HydrophobicContact CD2-CB 3.94Å; L109-K131 HydrophobicContact CD2-CG 4.01Å
110	K	78.9	Confident	71.3	Confident	32 Å²	32	83.8 Å²	83.8	14%	0.139	48%	0.481	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.7	128.8	176.1	-167.3	178.7	169	-176.8	0	110.3	F115 Q130 F413	K110-F115 PolarHBondContact NZ-O 3.46Å; K110-Q130 HydrophobicContact CB-CB 3.76Å; K110-Q130 WeakPolarHBondContact CB-O 3.2Å; K110-Q130 HydrophobicContact CD-CB 4.03Å; K110-Q130 PolarHBondContact N-O 3.19Å; K110-F413 HydrophobicContact CB-CE1 4.19Å; K110-F413 HydrophobicContact CB-CZ 3.92Å; K110-F413 HydrophobicContact CG-CE1 3.94Å; K110-F413 HydrophobicContact CG-CZ 4.19Å
111	P	66.3	Low	70.2	Confident	44 Å²	44	85.1 Å²	85.1	29%	0.286	47%	0.473	S	S	.	.			trans	-60.1	149.9	167.6	-17.2	29	0	0	0	110.5	L109 C113 E410	L109-P111 WeakPolarHBondContact O-CD 3.48Å; P111-C113 VanDerWaalsContact C-N 3.26Å; P111-C113 PolarHBondContact O-N 2.76Å; P111-E410 HydrophobicContact CG-CG 4.43Å; P111-E410 WeakPolarHBondContact CG-OE1 3.35Å
112	A	60.1	Low	69.3	Low	69 Å²	69	78.3 Å²	78.3	57%	0.57	44%	0.441	S	S	*	.	S	Bend	trans	-72.5	70.6	-174.1	0	0	0	0	0	112.7
113	C	49.1	Very low	68.7	Low	94 Å²	94	75.7 Å²	75.7	64%	0.635	44%	0.435	S	S	*	.			trans	-141.7	110.1	174	-68.8	0	0	0	0	112.3	P111 F115	P111-C113 VanDerWaalsContact C-N 3.26Å; P111-C113 PolarHBondContact O-N 2.76Å; C113-F115 PolarHBondContact O-N 2.83Å
114	G	48.3	Very low	67.6	Low	89 Å²	89	76.4 Å²	76.4	92%	0.918	45%	0.446	S	S	*	.			trans	71	-9.7	130.7	0	0	0	0	0	123.8
115	F	47.4	Very low	66.2	Low	164 Å²	164	75 Å²	75	72%	0.719	44%	0.442	S	S	*	.			trans	-104.7	143.1	-176.4	-71.5	-79.6	0	0	0	114.2	K110 C113	K110-F115 PolarHBondContact NZ-O 3.46Å; C113-F115 PolarHBondContact O-N 2.83Å
116	P	48.3	Very low	64.4	Low	104 Å²	104	77 Å²	77	68%	0.675	46%	0.462	S	S	*	.			trans	-57.5	144	-165.5	19.4	-30.6	0	0	0	114.1	D118	P116-D118 PolarHBondContact O-N 3.41Å
117	S	49.3	Very low	62.8	Low	88 Å²	88	86.3 Å²	86.3	62%	0.615	50%	0.502	S	S	*	.			trans	-81.7	-1.1	-167.2	45.3	0	0	0	0	115.8	V119	S117-V119 VanDerWaalsContact C-N 3.34Å; S117-V119 PolarHBondContact O-N 3.45Å
118	D	46.9	Very low	61.3	Low	156 Å²	156	87.9 Å²	87.9	83%	0.834	52%	0.524	S	S	*	.			trans	-82.6	78.2	-173.7	-65.6	-16.3	0	0	0	110.8	P116	P116-D118 PolarHBondContact O-N 3.41Å
119	V	51.7	Low	60.2	Low	31 Å²	31	92.8 Å²	92.8	19%	0.188	55%	0.546	C	S	.	.			trans	-138.7	117.8	-175.4	-165.2	0	0	0	0	111.3	S117 S122 M132 R421	S117-V119 VanDerWaalsContact C-N 3.34Å; S117-V119 PolarHBondContact O-N 3.45Å; V119-S122 WeakPolarHBondContact O-CB 3.34Å; V119-S122 PolarHBondContact O-N 3.29Å; V119-M132 HydrophobicContact CG1-CE 4.01Å; V119-R421 VanDerWaalsContact CG2-NH2 3.29Å
120	M	53.8	Low	59.8	Low	167 Å²	167	91.4 Å²	91.4	82%	0.823	54%	0.538	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.1	135.7	168.4	-168.3	173.9	-80.3	0	0	109.8
121	N	60.3	Low	60.3	Low	93 Å²	93	92.6 Å²	92.6	50%	0.497	54%	0.543	S	S	.	.	T	Hydrogen-bonded Turn	trans	73.8	23	-177.4	-50.7	-12.8	0	0	0	116.8	T133	N121-T133 PolarHBondContact O-N 3.19Å
122	S	62.4	Low	61.5	Low	31 Å²	31	90.8 Å²	90.8	22%	0.217	53%	0.531	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	127.7	173	153.3	0	0	0	0	111.9	V119 Q130 K131	V119-S122 WeakPolarHBondContact O-CB 3.34Å; V119-S122 PolarHBondContact O-N 3.29Å; S122-Q130 VanDerWaalsContact CB-NE2 3.32Å; S122-Q130 VanDerWaalsContact OG-CD 3.31Å; S122-Q130 WeakPolarHBondContact OG-CG 3.4Å; S122-Q130 PolarHBondContact OG-NE2 3.13Å; S122-K131 CarbonylContact C-O 3.58Å; S122-K131 VanDerWaalsContact CA-O 3.29Å; S122-K131 WeakPolarHBondContact CA-O 3.24Å
123	T	70.6	Confident	63.1	Low	86 Å²	86	89 Å²	89	53%	0.528	51%	0.513	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	128.1	165.1	-54	0	0	0	0	109.8	L125 K131	T123-L125 PolarHBondContact O-N 3.21Å; T123-K131 PolarHBondContact N-O 3.26Å; T123-K131 PolarHBondContact O-N 3.06Å
124	I	68.5	Low	65.2	Low	129 Å²	129	85 Å²	85	66%	0.662	49%	0.485	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-80.5	119.1	175.4	-58	173.2	0	0	0	108.2
125	L	64.7	Low	67.5	Low	59 Å²	59	84 Å²	84	31%	0.309	46%	0.461	S	S	.	.	P	Polyproline II helix	trans	-89.3	158.2	175.7	-69.8	167.9	0	0	0	111.2	L109 T123 G128 K129 K131	L109-L125 HydrophobicContact CD2-CD1 3.45Å; L109-L125 VanDerWaalsContact CD2-CD1 3.45Å; T123-L125 PolarHBondContact O-N 3.21Å; L125-G128 PolarHBondContact O-N 2.99Å; L125-K129 HydrophobicContact CB-CB 4.21Å; L125-K129 WeakPolarHBondContact CB-O 3.33Å; L125-K129 HydrophobicContact CD1-CB 4.41Å; L125-K129 PolarHBondContact N-O 3.49Å; L125-K131 HydrophobicContact CD1-CB 3.85Å; L125-K131 HydrophobicContact CG-CB 4.14Å
126	P	57.1	Low	69.8	Low	115 Å²	115	76.5 Å²	76.5	75%	0.747	43%	0.428	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.3	141.5	168.3	-23	32.8	0	0	0	111.3
127	K	60.8	Low	72	Confident	194 Å²	194	73.8 Å²	73.8	84%	0.843	41%	0.408	S	S	*	.	T	Hydrogen-bonded Turn	trans	75.6	16.4	-170	-50	-178.7	176.8	-179.1	0	116	K129	K127-K129 VanDerWaalsContact C-N 3.26Å; K127-K129 PolarHBondContact O-N 2.78Å
128	G	62.9	Low	74.2	Confident	55 Å²	55	70 Å²	70	57%	0.567	38%	0.381	S	S	*	.	S	Bend	trans	74.4	12.2	172.9	0	0	0	0	0	114.7	L125	L125-G128 PolarHBondContact O-N 2.99Å
129	K	69.5	Low	76.6	Confident	103 Å²	103	62.6 Å²	62.6	45%	0.448	34%	0.342	S	S	.	.	P	Polyproline II helix	trans	-73.4	137.8	172.3	-67.8	-171.2	176.5	-169.1	0	109.5	L125 K127	L125-K129 HydrophobicContact CB-CB 4.21Å; L125-K129 WeakPolarHBondContact CB-O 3.33Å; L125-K129 HydrophobicContact CD1-CB 4.41Å; L125-K129 PolarHBondContact N-O 3.49Å; K127-K129 VanDerWaalsContact C-N 3.26Å; K127-K129 PolarHBondContact O-N 2.78Å
130	Q	79.6	Confident	78.7	Confident	17 Å²	17	61.1 Å²	61.1	8%	0.079	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	118.8	178.8	-164.6	177.8	26.8	0	0	109.1	K110 S122 M132	K110-Q130 HydrophobicContact CB-CB 3.76Å; K110-Q130 WeakPolarHBondContact CB-O 3.2Å; K110-Q130 HydrophobicContact CD-CB 4.03Å; K110-Q130 PolarHBondContact N-O 3.19Å; S122-Q130 VanDerWaalsContact CB-NE2 3.32Å; S122-Q130 VanDerWaalsContact OG-CD 3.31Å; S122-Q130 WeakPolarHBondContact OG-CG 3.4Å; S122-Q130 PolarHBondContact OG-NE2 3.13Å; Q130-M132 HydrophobicContact CG-CG 4.43Å
131	K	87.7	Confident	80.7	Confident	57 Å²	57	54 Å²	54	25%	0.248	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.2	123.3	173.9	-175.2	178.4	178.4	-178	0	109.3	E107 L109 S122 T123 L125	E107-K131 WeakPolarHBondContact OE1-CE 3.28Å; E107-K131 IonicContact OE1-NZ 3.92Å; E107-K131 PolarHBondContact OE1-NZ 3.1Å; E107-K131 WeakPolarHBondContact OE2-CE 3.43Å; E107-K131 IonicContact OE2-NZ 4Å; E107-K131 PolarHBondContact OE2-NZ 3.34Å; L109-K131 HydrophobicContact CD2-CB 3.94Å; L109-K131 HydrophobicContact CD2-CG 4.01Å; S122-K131 CarbonylContact C-O 3.58Å; S122-K131 VanDerWaalsContact CA-O 3.29Å; S122-K131 WeakPolarHBondContact CA-O 3.24Å; T123-K131 PolarHBondContact N-O 3.26Å; T123-K131 PolarHBondContact O-N 3.06Å; L125-K131 HydrophobicContact CD1-CB 3.85Å; L125-K131 HydrophobicContact CG-CB 4.14Å
132	M	91.8	Very high	82.2	Confident	6 Å²	6	50.4 Å²	50.4	3%	0.03	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	122.7	179.1	-60.1	-179	59.4	0	0	109.5	E107 L108 V119 Q130 F134 V417	E107-M132 CarbonylContact C-O 3.53Å; E107-M132 VanDerWaalsContact CA-O 3.26Å; E107-M132 WeakPolarHBondContact CA-O 3.31Å; L108-M132 PolarHBondContact N-O 2.75Å; L108-M132 PolarHBondContact O-N 3.29Å; V119-M132 HydrophobicContact CG1-CE 4.01Å; Q130-M132 HydrophobicContact CG-CG 4.43Å; M132-F134 HydrophobicContact CB-CE2 3.96Å; M132-F134 HydrophobicContact CE-CE2 4.07Å; M132-F134 HydrophobicContact CE-CZ 3.62Å; M132-V417 HydrophobicContact CE-CG1 3.77Å; M132-V417 HydrophobicContact SD-CG1 4.28Å; M132-V417 HydrophobicContact SD-CG2 4.34Å
133	T	93.4	Very high	83.6	Confident	31 Å²	31	54.7 Å²	54.7	19%	0.19	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	128	179.2	-56.6	0	0	0	0	110	Q105 E107 N121	Q105-T133 HydrophobicContact CG-CG2 4.47Å; E107-T133 HydrophobicContact CG-CG2 3.98Å; E107-T133 PolarHBondContact OE1-OG1 3.28Å; N121-T133 PolarHBondContact O-N 3.19Å
134	F	95	Very high	84.7	Confident	10 Å²	10	51.1 Å²	51.1	4%	0.044	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	138.4	175.5	-61.1	-88.3	0	0	0	109.7	Q105 V106 L108 M132 F136 L420 R421 T424	Q105-F134 VanDerWaalsContact CA-O 3.28Å; Q105-F134 WeakPolarHBondContact CA-O 3.47Å; V106-F134 HydrophobicContact CG1-CB 3.92Å; V106-F134 PolarHBondContact N-O 3.43Å; V106-F134 PolarHBondContact O-N 2.92Å; L108-F134 HydrophobicContact CD1-CE2 4.14Å; L108-F134 HydrophobicContact CG-CE2 4.48Å; M132-F134 HydrophobicContact CB-CE2 3.96Å; M132-F134 HydrophobicContact CE-CE2 4.07Å; M132-F134 HydrophobicContact CE-CZ 3.62Å; F134-F136 HydrophobicContact CB-CD2 4.44Å; F134-F136 HydrophobicContact CB-CE2 3.63Å; F134-F136 HydrophobicContact CB-CZ 4.01Å; F134-L420 HydrophobicContact CD1-CB 3.72Å; F134-L420 HydrophobicContact CD2-CB 4.03Å; F134-L420 HydrophobicContact CD2-CD1 3.73Å; F134-L420 HydrophobicContact CD2-CG 4.42Å; F134-L420 HydrophobicContact CE1-CB 3.59Å; F134-L420 HydrophobicContact CE2-CB 3.92Å; F134-L420 HydrophobicContact CE2-CD1 3.72Å; F134-L420 HydrophobicContact CE2-CG 4.48Å; F134-L420 HydrophobicContact CG-CB 3.9Å; F134-L420 HydrophobicContact CG-CD1 4.31Å; F134-L420 HydrophobicContact CZ-CB 3.66Å; F134-L420 HydrophobicContact CZ-CD1 4.28Å; F134-R421 HydrophobicContact CE1-CG 3.98Å; F134-R421 HydrophobicContact CZ-CG 4.27Å; F134-T424 WeakPolarHBondContact CD1-OG1 2.98Å
135	T	95	Very high	85.9	Confident	69 Å²	69	48.3 Å²	48.3	42%	0.423	27%	0.269	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	131.9	-179.1	-54.6	0	0	0	0	110.4	K104 Q105 N427	K104-T135 HydrophobicContact CB-CG2 4.41Å; K104-T135 CarbonylContact O-C 3.58Å; K104-T135 VanDerWaalsContact O-CA 3.28Å; K104-T135 WeakPolarHBondContact O-CA 2.99Å; Q105-T135 HydrophobicContact CG-CG2 4.21Å; T135-N427 PolarHBondContact O-ND2 3.43Å
136	F	95.6	Very high	87.4	Confident	5 Å²	5	45.8 Å²	45.8	2%	0.022	26%	0.255	C	S	.	.			trans	-138	173.6	-176.3	-62.3	-63.2	0	0	0	111	V71 C73 K104 V106 F134 C138 V139 V404 L420 A423 N427	V71-F136 HydrophobicContact CB-CD1 3.91Å; V71-F136 HydrophobicContact CG1-CD1 3.42Å; V71-F136 VanDerWaalsContact CG1-CD1 3.42Å; V71-F136 HydrophobicContact CG1-CE1 3.76Å; V71-F136 HydrophobicContact CG1-CG 4.17Å; V71-F136 WeakPolarHBondContact O-CB 3.33Å; C73-F136 HydrophobicContact CB-CD2 3.63Å; C73-F136 HydrophobicContact CB-CE2 4.02Å; C73-F136 HydrophobicContact CB-CG 4.37Å; K104-F136 PolarHBondContact O-N 3.33Å; V106-F136 HydrophobicContact CG1-CE2 4.24Å; F134-F136 HydrophobicContact CB-CD2 4.44Å; F134-F136 HydrophobicContact CB-CE2 3.63Å; F134-F136 HydrophobicContact CB-CZ 4.01Å; F136-C138 VanDerWaalsContact C-N 3.28Å; F136-C138 PolarHBondContact O-N 3.42Å; F136-V139 HydrophobicContact CB-CG2 4.16Å; F136-V139 HydrophobicContact CD2-CG2 4.14Å; F136-V404 HydrophobicContact CZ-CG1 4.49Å; F136-L420 HydrophobicContact CE2-CD2 3.66Å; F136-L420 HydrophobicContact CZ-CD2 4.02Å; F136-A423 HydrophobicContact CE1-CB 3.7Å; F136-A423 HydrophobicContact CZ-CB 3.89Å; F136-N427 HydrophobicContact CD1-CB 4.37Å
137	D	94.6	Very high	89.2	Confident	48 Å²	48	44.2 Å²	44.2	26%	0.257	24%	0.244	S	C	.	.	S	Bend	trans	-64.6	-36	176.8	-65.2	-81.4	0	0	0	112.4	R70 V71 F72 N427	R70-D137 WeakPolarHBondContact CA-OD2 3.19Å; R70-D137 HydrophobicContact CB-CB 4.5Å; R70-D137 WeakPolarHBondContact CB-OD2 3.39Å; R70-D137 IonicContact NE-OD1 3.84Å; V71-D137 PolarHBondContact N-OD2 3.31Å; V71-D137 PolarHBondContact O-N 3.38Å; V71-D137 VanDerWaalsContact O-N 3.1Å; F72-D137 HydrophobicContact CD1-CB 3.94Å; F72-D137 HydrophobicContact CE1-CB 3.72Å; D137-N427 PolarHBondContact OD2-OD1 3.32Å
138	C	96	Very high	90.9	Very high	7 Å²	7	37.3 Å²	37.3	5%	0.047	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.2	146.2	174.5	-162.6	0	0	0	0	110.3	F72 C73 R103 F136 F140	F72-C138 CarbonylContact C-O 3.55Å; F72-C138 VanDerWaalsContact CA-O 3.31Å; F72-C138 WeakPolarHBondContact CA-O 3.44Å; F72-C138 HydrophobicContact CD1-CB 3.58Å; F72-C138 HydrophobicContact CE1-CB 3.67Å; F72-C138 HydrophobicContact CG-CB 4.05Å; F72-C138 HydrophobicContact CZ-CB 4.17Å; C73-C138 PolarHBondContact N-O 2.69Å; R103-C138 CarbonylContact O-C 3.6Å; R103-C138 WeakPolarHBondContact O-CA 3.2Å; F136-C138 VanDerWaalsContact C-N 3.28Å; F136-C138 PolarHBondContact O-N 3.42Å; C138-F140 HydrophobicContact CB-CE2 4.16Å; C138-F140 HydrophobicContact CB-CZ 4.14Å; C138-F140 WeakPolarHBondContact SG-CZ 3.48Å
139	V	97.5	Very high	92.5	Very high	1 Å²	1	34.7 Å²	34.7	1%	0.006	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.8	116	179.7	-178.3	0	0	0	0	107.9	C73 F98 R103 K104 V106 F136 P141	C73-V139 HydrophobicContact CB-CB 4.42Å; C73-V139 HydrophobicContact CB-CG1 4.18Å; C73-V139 HydrophobicContact CB-CG2 4.07Å; C73-V139 CarbonylContact O-C 3.58Å; C73-V139 VanDerWaalsContact O-CA 3.31Å; C73-V139 WeakPolarHBondContact O-CA 3.42Å; F98-V139 HydrophobicContact CD1-CG1 3.53Å; F98-V139 HydrophobicContact CE1-CG1 3.63Å; R103-V139 WeakPolarHBondContact CB-O 3.45Å; R103-V139 PolarHBondContact O-N 3.46Å; K104-V139 WeakPolarHBondContact O-CG2 3.44Å; V106-V139 HydrophobicContact CB-CG1 3.92Å; F136-V139 HydrophobicContact CB-CG2 4.16Å; F136-V139 HydrophobicContact CD2-CG2 4.14Å; V139-P141 WeakPolarHBondContact O-CD 3.48Å
140	F	96.8	Very high	93.8	Very high	1 Å²	1	31 Å²	31	0%	0.004	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.2	110.5	-179.4	-58.1	-77.6	0	0	0	110	F72 C73 R74 M75 C138 C144 V149 E152 F403	F72-F140 HydrophobicContact CB-CE2 3.97Å; F72-F140 AromaticContact CD2-CE2 3.68Å; F72-F140 HydrophobicContact CD2-CE2 3.68Å; F72-F140 HydrophobicContact CD2-CZ 4.08Å; F72-F140 HydrophobicContact CE2-CE2 4.38Å; F72-F140 HydrophobicContact CE2-CZ 4.34Å; F72-F140 AromaticContact CG-CE2 3.98Å; F72-F140 HydrophobicContact CG-CE2 3.98Å; C73-F140 WeakPolarHBondContact O-CD2 3.48Å; C73-F140 PolarHBondContact O-N 3.45Å; R74-F140 HydrophobicContact CB-CB 4.27Å; R74-F140 HydrophobicContact CB-CD2 4.28Å; R74-F140 HydrophobicContact CG-CB 4.03Å; M75-F140 PolarHBondContact N-O 3.26Å; C138-F140 HydrophobicContact CB-CE2 4.16Å; C138-F140 HydrophobicContact CB-CZ 4.14Å; C138-F140 WeakPolarHBondContact SG-CZ 3.48Å; F140-C144 HydrophobicContact CB-CB 3.99Å; F140-C144 HydrophobicContact CD1-CB 4.13Å; F140-V149 HydrophobicContact CB-CG2 4.36Å; F140-V149 HydrophobicContact CD1-CG2 3.67Å; F140-V149 HydrophobicContact CD2-CG2 4.1Å; F140-V149 HydrophobicContact CE1-CB 4.29Å; F140-V149 HydrophobicContact CE1-CG2 3.89Å; F140-V149 HydrophobicContact CE2-CG1 4.13Å; F140-V149 HydrophobicContact CE2-CG2 4.29Å; F140-V149 HydrophobicContact CG-CG2 3.78Å; F140-V149 HydrophobicContact CZ-CB 4.32Å; F140-V149 HydrophobicContact CZ-CG1 4.17Å; F140-V149 HydrophobicContact CZ-CG2 4.19Å; F140-E152 HydrophobicContact CE1-CG 4.04Å; F140-E152 HydrophobicContact CZ-CB 3.91Å; F140-E152 HydrophobicContact CZ-CG 3.82Å; F140-F403 HydrophobicContact CE2-CE1 4.14Å
141	P	94.5	Very high	94.6	Very high	16 Å²	16	35.6 Å²	35.6	10%	0.104	20%	0.195	C	C	.	.			trans	-67.6	170.5	169.8	-15.2	30.5	0	0	0	111.4	F98 V139 N143 C144	F98-P141 HydrophobicContact CB-CG 4.14Å; F98-P141 HydrophobicContact CD1-CB 4.27Å; F98-P141 HydrophobicContact CD1-CG 3.94Å; F98-P141 HydrophobicContact CD2-CB 3.83Å; F98-P141 HydrophobicContact CD2-CG 4.08Å; F98-P141 HydrophobicContact CE1-CB 4.3Å; F98-P141 HydrophobicContact CE1-CG 4.36Å; F98-P141 HydrophobicContact CE2-CB 3.87Å; F98-P141 HydrophobicContact CE2-CG 4.5Å; F98-P141 HydrophobicContact CG-CB 4.04Å; F98-P141 HydrophobicContact CG-CG 3.78Å; F98-P141 HydrophobicContact CZ-CB 4.1Å; V139-P141 WeakPolarHBondContact O-CD 3.48Å; P141-N143 PolarHBondContact O-N 2.83Å; P141-N143 VanDerWaalsContact O-N 3.08Å; P141-C144 WeakPolarHBondContact O-CB 3.47Å; P141-C144 PolarHBondContact O-N 3.44Å; P141-C144 VanDerWaalsContact O-N 3.07Å
142	P	92.4	Very high	95	Very high	18 Å²	18	36.4 Å²	36.4	12%	0.117	20%	0.199	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.8	-25.8	-173.6	-27.6	37.4	0	0	0	115.4	M75 P77 I92 C144	M75-P142 HydrophobicContact CB-CG 4.36Å; M75-P142 HydrophobicContact CE-CG 3.26Å; M75-P142 HydrophobicContact CG-CG 4.16Å; M75-P142 WeakPolarHBondContact O-CA 3.46Å; P77-P142 HydrophobicContact CG-CB 4.38Å; P77-P142 WeakPolarHBondContact CG-O 3.28Å; I92-P142 HydrophobicContact CG1-CG 4.43Å; P142-C144 VanDerWaalsContact C-N 3.28Å; P142-C144 PolarHBondContact O-N 3.47Å
143	N	91.3	Very high	95.2	Very high	121 Å²	121	36.1 Å²	36.1	65%	0.647	20%	0.198	S	C	*	.	T	Hydrogen-bonded Turn	trans	-79.1	-5.3	-179.4	66	-23.5	0	0	0	114.1	P141	P141-N143 PolarHBondContact O-N 2.83Å; P141-N143 VanDerWaalsContact O-N 3.08Å
144	C	93.3	Very high	95.3	Very high	12 Å²	12	39.1 Å²	39.1	8%	0.081	21%	0.209	C	C	.	.			trans	-76.8	126.5	177.7	-70.3	0	0	0	0	111.7	F140 P141 P142 D148	F140-C144 HydrophobicContact CB-CB 3.99Å; F140-C144 HydrophobicContact CD1-CB 4.13Å; P141-C144 WeakPolarHBondContact O-CB 3.47Å; P141-C144 PolarHBondContact O-N 3.44Å; P141-C144 VanDerWaalsContact O-N 3.07Å; P142-C144 VanDerWaalsContact C-N 3.28Å; P142-C144 PolarHBondContact O-N 3.47Å; C144-D148 HydrophobicContact CB-CB 4.36Å
145	T	94.5	Very high	95.3	Very high	70 Å²	70	40.4 Å²	40.4	43%	0.429	22%	0.219	S	C	.	.			trans	-77.8	169.6	178.4	67.9	0	0	0	0	112	T147 D148 V149	T145-T147 PolarHBondContact O-N 2.98Å; T145-T147 PolarHBondContact OG1-N 3.48Å; T145-D148 WeakPolarHBondContact CB-OD2 3.48Å; T145-D148 PolarHBondContact N-OD2 3.06Å; T145-D148 PolarHBondContact O-N 3.31Å; T145-D148 PolarHBondContact OG1-N 3.26Å; T145-D148 PolarHBondContact OG1-OD2 3.21Å; T145-V149 WeakPolarHBondContact O-CG2 3.25Å; T145-V149 PolarHBondContact O-N 3.31Å
146	Q	95.6	Very high	95.3	Very high	5 Å²	5	37.2 Å²	37.2	2%	0.023	20%	0.199	C	C	.	.	H	α-helix	trans	-58.2	-38.9	170.7	-64.6	-77.3	52.1	0	0	111.6	R74 V149 F150 Y180 C191 P192 M194 L197	R74-Q146 VanDerWaalsContact CZ-OE1 3.25Å; Q146-V149 PolarHBondContact O-N 3.27Å; Q146-F150 WeakPolarHBondContact O-CB 3.48Å; Q146-F150 PolarHBondContact O-N 2.83Å; Q146-Y180 HydrophobicContact CG-CE1 4.23Å; Q146-Y180 PolarHBondContact NE2-O 2.98Å; Q146-C191 VanDerWaalsContact CG-SG 3.54Å; Q146-P192 WeakPolarHBondContact CB-O 3.28Å; Q146-P192 WeakPolarHBondContact CG-O 3.2Å; Q146-P192 PolarHBondContact NE2-O 3.41Å; Q146-M194 HydrophobicContact CB-CE 4.05Å; Q146-M194 WeakPolarHBondContact O-CE 3.29Å; Q146-L197 HydrophobicContact CB-CD1 4.05Å
147	T	95.5	Very high	95.2	Very high	82 Å²	82	37 Å²	37	50%	0.503	20%	0.198	S	C	.	.	H	α-helix	trans	-63.1	-43.8	178.4	-53	0	0	0	0	111.7	T145 V149 F150 Q151	T145-T147 PolarHBondContact O-N 2.98Å; T145-T147 PolarHBondContact OG1-N 3.48Å; T147-V149 VanDerWaalsContact C-N 3.29Å; T147-V149 PolarHBondContact O-N 3.05Å; T147-F150 PolarHBondContact O-N 3.02Å; T147-F150 VanDerWaalsContact O-N 3.17Å; T147-Q151 WeakPolarHBondContact O-CG 3.4Å; T147-Q151 PolarHBondContact O-N 3.32Å; T147-Q151 VanDerWaalsContact O-N 3.09Å
148	D	95.4	Very high	95.2	Very high	50 Å²	50	36 Å²	36	27%	0.267	19%	0.192	S	C	.	.	H	α-helix	trans	-61.4	-40.3	177.2	-58.5	-46.1	0	0	0	111.5	C144 T145	C144-D148 HydrophobicContact CB-CB 4.36Å; T145-D148 WeakPolarHBondContact CB-OD2 3.48Å; T145-D148 PolarHBondContact N-OD2 3.06Å; T145-D148 PolarHBondContact O-N 3.31Å; T145-D148 PolarHBondContact OG1-N 3.26Å; T145-D148 PolarHBondContact OG1-OD2 3.21Å
149	V	97.1	Very high	95.1	Very high	0 Å²	0	35.7 Å²	35.7	0%	0	19%	0.19	C	C	.	.	H	α-helix	trans	-69.1	-38.2	176.7	176.9	0	0	0	0	111.2	F140 T145 Q146 T147 Q151 E152 M194 F403	F140-V149 HydrophobicContact CB-CG2 4.36Å; F140-V149 HydrophobicContact CD1-CG2 3.67Å; F140-V149 HydrophobicContact CD2-CG2 4.1Å; F140-V149 HydrophobicContact CE1-CB 4.29Å; F140-V149 HydrophobicContact CE1-CG2 3.89Å; F140-V149 HydrophobicContact CE2-CG1 4.13Å; F140-V149 HydrophobicContact CE2-CG2 4.29Å; F140-V149 HydrophobicContact CG-CG2 3.78Å; F140-V149 HydrophobicContact CZ-CB 4.32Å; F140-V149 HydrophobicContact CZ-CG1 4.17Å; F140-V149 HydrophobicContact CZ-CG2 4.19Å; T145-V149 WeakPolarHBondContact O-CG2 3.25Å; T145-V149 PolarHBondContact O-N 3.31Å; Q146-V149 PolarHBondContact O-N 3.27Å; T147-V149 VanDerWaalsContact C-N 3.29Å; T147-V149 PolarHBondContact O-N 3.05Å; V149-Q151 PolarHBondContact O-N 2.75Å; V149-E152 PolarHBondContact O-N 3.43Å; V149-M194 HydrophobicContact CB-CE 4.3Å; V149-M194 HydrophobicContact CB-SD 4.43Å; V149-M194 HydrophobicContact CG1-CE 4.24Å; V149-M194 HydrophobicContact CG1-SD 3.88Å; V149-F403 HydrophobicContact CG1-CE1 3.48Å; V149-F403 VanDerWaalsContact CG1-CE1 3.48Å; V149-F403 HydrophobicContact CG1-CZ 3.57Å
150	F	97.9	Very high	94.8	Very high	24 Å²	24	35.6 Å²	35.6	11%	0.105	19%	0.19	C	C	.	.	H	α-helix	trans	-64.5	-39.4	-179.1	-176.4	-106.6	0	0	0	112.6	Q146 T147 E152 I153 E154 V157 M194 L197 A198 Q201	Q146-F150 WeakPolarHBondContact O-CB 3.48Å; Q146-F150 PolarHBondContact O-N 2.83Å; T147-F150 PolarHBondContact O-N 3.02Å; T147-F150 VanDerWaalsContact O-N 3.17Å; F150-E152 PolarHBondContact O-N 2.61Å; F150-E152 VanDerWaalsContact O-N 3.13Å; F150-I153 HydrophobicContact CD2-CD1 3.83Å; F150-I153 HydrophobicContact CD2-CG1 3.71Å; F150-I153 HydrophobicContact CE2-CD1 4.18Å; F150-I153 HydrophobicContact CE2-CG1 4.13Å; F150-I153 HydrophobicContact CG-CG1 4.46Å; F150-I153 CarbonylContact O-C 3.55Å; F150-I153 VanDerWaalsContact O-CG1 3.32Å; F150-I153 WeakPolarHBondContact O-CG1 3.33Å; F150-I153 PolarHBondContact O-N 2.69Å; F150-E154 HydrophobicContact CE1-CB 4.3Å; F150-E154 HydrophobicContact CE1-CG 4.4Å; F150-E154 PolarHBondContact O-N 2.71Å; F150-V157 HydrophobicContact CE2-CG2 4.36Å; F150-M194 HydrophobicContact CB-CE 4.3Å; F150-M194 HydrophobicContact CB-SD 4.15Å; F150-M194 HydrophobicContact CD2-SD 4.2Å; F150-L197 HydrophobicContact CB-CB 4.36Å; F150-L197 HydrophobicContact CB-CD1 3.74Å; F150-L197 HydrophobicContact CD1-CB 4.19Å; F150-L197 HydrophobicContact CD2-CB 3.43Å; F150-L197 VanDerWaalsContact CD2-CB 3.43Å; F150-L197 HydrophobicContact CD2-CD1 4.31Å; F150-L197 HydrophobicContact CD2-CG 4.47Å; F150-L197 HydrophobicContact CE1-CB 4.39Å; F150-L197 VanDerWaalsContact CE2-C 3.42Å; F150-L197 HydrophobicContact CE2-CB 3.69Å; F150-L197 HydrophobicContact CG-CB 3.71Å; F150-L197 HydrophobicContact CG-CD1 4.03Å; F150-L197 HydrophobicContact CG-CG 4.39Å; F150-L197 HydrophobicContact CZ-CB 4.15Å; F150-L197 VanDerWaalsContact CZ-O 3.28Å; F150-L197 WeakPolarHBondContact CZ-O 3.38Å; F150-A198 HydrophobicContact CE2-CB 4.03Å; F150-A198 VanDerWaalsContact CE2-N 3.29Å; F150-Q201 HydrophobicContact CE1-CB 4.47Å; F150-Q201 HydrophobicContact CZ-CB 3.96Å; F150-Q201 VanDerWaalsContact CZ-OE1 3.28Å
151	Q	96.8	Very high	94.5	Very high	115 Å²	115	35.6 Å²	35.6	54%	0.537	19%	0.19	S	C	.	.	H	α-helix	trans	-54	-33.6	176.9	-73.2	173.4	-4.5	0	0	112.8	T147 V149	T147-Q151 WeakPolarHBondContact O-CG 3.4Å; T147-Q151 PolarHBondContact O-N 3.32Å; T147-Q151 VanDerWaalsContact O-N 3.09Å; V149-Q151 PolarHBondContact O-N 2.75Å
152	E	95.4	Very high	94.3	Very high	74 Å²	74	34.9 Å²	34.9	35%	0.346	19%	0.185	S	C	.	.	H	α-helix	trans	-79.1	-22.7	178.7	-72.9	-64.3	154.2	0	0	114	R70 F72 F140 V149 F150	R70-E152 IonicContact NH2-OE2 3.53Å; F72-E152 HydrophobicContact CE2-CB 3.52Å; F72-E152 HydrophobicContact CZ-CB 3.83Å; F140-E152 HydrophobicContact CE1-CG 4.04Å; F140-E152 HydrophobicContact CZ-CB 3.91Å; F140-E152 HydrophobicContact CZ-CG 3.82Å; V149-E152 PolarHBondContact O-N 3.43Å; F150-E152 PolarHBondContact O-N 2.61Å; F150-E152 VanDerWaalsContact O-N 3.13Å
153	I	95.2	Very high	94.2	Very high	0 Å²	0	34 Å²	34	0%	0	18%	0.179	C	C	.	.	H	α-helix	trans	-98.7	-16.2	176.2	71.6	160.3	0	0	0	113.2	F72 F150 P155 I156 V157 M194 F333 L401 F403	F72-I153 HydrophobicContact CD2-CG2 4.08Å; F72-I153 HydrophobicContact CE2-CG2 3.66Å; F150-I153 HydrophobicContact CD2-CD1 3.83Å; F150-I153 HydrophobicContact CD2-CG1 3.71Å; F150-I153 HydrophobicContact CE2-CD1 4.18Å; F150-I153 HydrophobicContact CE2-CG1 4.13Å; F150-I153 HydrophobicContact CG-CG1 4.46Å; F150-I153 CarbonylContact O-C 3.55Å; F150-I153 VanDerWaalsContact O-CG1 3.32Å; F150-I153 WeakPolarHBondContact O-CG1 3.33Å; F150-I153 PolarHBondContact O-N 2.69Å; I153-P155 VanDerWaalsContact O-N 3.11Å; I153-I156 HydrophobicContact CB-CG2 4.14Å; I153-I156 WeakPolarHBondContact O-CA 3.28Å; I153-I156 VanDerWaalsContact O-CG2 3.25Å; I153-I156 WeakPolarHBondContact O-CG2 3.47Å; I153-I156 PolarHBondContact O-N 2.81Å; I153-V157 HydrophobicContact CD1-CG2 4.42Å; I153-V157 PolarHBondContact O-N 3.26Å; I153-M194 HydrophobicContact CD1-CB 3.91Å; I153-M194 HydrophobicContact CD1-CG 3.86Å; I153-M194 HydrophobicContact CD1-SD 3.51Å; I153-M194 VanDerWaalsContact CD1-SD 3.51Å; I153-M194 HydrophobicContact CG1-SD 4.12Å; I153-F333 HydrophobicContact CD1-CE1 4.47Å; I153-L401 HydrophobicContact CG2-CD1 3.74Å; I153-L401 HydrophobicContact CG2-CD2 4.23Å; I153-F403 HydrophobicContact CG2-CE2 4.19Å; I153-F403 HydrophobicContact CG2-CZ 3.72Å
154	E	96.1	Very high	94.2	Very high	93 Å²	93	29.1 Å²	29.1	44%	0.435	15%	0.152	S	C	.	.	H	α-helix	trans	-46.7	-42.5	177	-175	-170.3	-172.6	0	0	112.6	F150 I156 V157 Q158 Q201	F150-E154 HydrophobicContact CE1-CB 4.3Å; F150-E154 HydrophobicContact CE1-CG 4.4Å; F150-E154 PolarHBondContact O-N 2.71Å; E154-I156 PolarHBondContact O-N 2.88Å; E154-V157 PolarHBondContact O-N 3.17Å; E154-Q158 PolarHBondContact O-N 3.49Å; E154-Q201 VanDerWaalsContact CG-CD 3.46Å; E154-Q201 HydrophobicContact CG-CG 4.48Å; E154-Q201 PolarHBondContact O-NE2 3.39Å; E154-Q201 PolarHBondContact O-OE1 3.48Å
155	P	95.1	Very high	94.1	Very high	37 Å²	37	29.8 Å²	29.8	24%	0.24	16%	0.155	C	C	.	.	H	α-helix	trans	-65.5	-34.6	176.1	-23.4	36.6	0	0	0	114	H59 M63 I153 S159	H59-P155 PolarHBondContact CE1-O 3.38Å; H59-P155 PolarHBondContact NE2-O 2.9Å; M63-P155 HydrophobicContact SD-CB 3.74Å; I153-P155 VanDerWaalsContact O-N 3.11Å; P155-S159 PolarHBondContact O-N 3.37Å; P155-S159 PolarHBondContact O-OG 2.88Å
156	I	94	Very high	94.1	Very high	3 Å²	3	26.5 Å²	26.5	2%	0.015	13%	0.134	C	C	.	.	H	α-helix	trans	-72.5	-37.4	177.6	-145.9	174.8	0	0	0	110.5	M63 I153 E154 Q158 S159 V166 V168 K399 L401	M63-I156 HydrophobicContact CE-CB 3.95Å; M63-I156 HydrophobicContact CE-CD1 4.44Å; M63-I156 HydrophobicContact CE-CG1 3.78Å; I153-I156 HydrophobicContact CB-CG2 4.14Å; I153-I156 WeakPolarHBondContact O-CA 3.28Å; I153-I156 VanDerWaalsContact O-CG2 3.25Å; I153-I156 WeakPolarHBondContact O-CG2 3.47Å; I153-I156 PolarHBondContact O-N 2.81Å; E154-I156 PolarHBondContact O-N 2.88Å; I156-Q158 PolarHBondContact O-N 2.75Å; I156-S159 VanDerWaalsContact O-CB 3.28Å; I156-S159 WeakPolarHBondContact O-CB 3.28Å; I156-S159 PolarHBondContact O-N 2.85Å; I156-S159 VanDerWaalsContact O-N 3.13Å; I156-V166 HydrophobicContact CB-CG1 4.43Å; I156-V166 HydrophobicContact CD1-CG1 4.09Å; I156-V166 HydrophobicContact CG1-CG1 3.76Å; I156-V166 HydrophobicContact CG2-CG1 4.04Å; I156-V166 WeakPolarHBondContact O-CG2 3.28Å; I156-V168 HydrophobicContact CG2-CG2 4.17Å; I156-K399 HydrophobicContact CD1-CB 4.03Å; I156-K399 HydrophobicContact CG1-CB 4.03Å; I156-L401 HydrophobicContact CD1-CB 3.83Å; I156-L401 HydrophobicContact CD1-CD1 4.35Å; I156-L401 HydrophobicContact CG2-CD1 4.46Å
157	V	95.4	Very high	94	Very high	0 Å²	0	26.2 Å²	26.2	0%	0	13%	0.133	C	C	.	.	H	α-helix	trans	-62.1	-43.8	174.1	175.2	0	0	0	0	110.6	F150 I153 E154 S159 S160 A198 Q201 V202 L331	F150-V157 HydrophobicContact CE2-CG2 4.36Å; I153-V157 HydrophobicContact CD1-CG2 4.42Å; I153-V157 PolarHBondContact O-N 3.26Å; E154-V157 PolarHBondContact O-N 3.17Å; V157-S159 PolarHBondContact O-N 2.89Å; V157-S160 WeakPolarHBondContact O-CB 3.32Å; V157-S160 PolarHBondContact O-N 2.95Å; V157-S160 PolarHBondContact O-OG 2.93Å; V157-A198 HydrophobicContact CG1-CB 3.95Å; V157-A198 HydrophobicContact CG2-CB 3.74Å; V157-Q201 VanDerWaalsContact CB-OE1 3.31Å; V157-Q201 HydrophobicContact CG1-CB 4.43Å; V157-Q201 HydrophobicContact CG1-CG 4.42Å; V157-Q201 VanDerWaalsContact CG1-OE1 3.31Å; V157-V202 HydrophobicContact CG1-CG2 3.79Å; V157-L331 HydrophobicContact CG1-CD2 4.06Å; V157-L331 HydrophobicContact CG2-CD2 4.42Å
158	Q	94.4	Very high	94.1	Very high	27 Å²	27	22.3 Å²	22.3	13%	0.126	11%	0.109	C	C	.	.	H	α-helix	trans	-58	-32.3	175.6	-176	58.7	48.1	0	0	112.6	E154 I156 S160 L161 D162 C205	E154-Q158 PolarHBondContact O-N 3.49Å; I156-Q158 PolarHBondContact O-N 2.75Å; Q158-S160 PolarHBondContact O-N 2.88Å; Q158-L161 PolarHBondContact O-N 3.33Å; Q158-D162 PolarHBondContact NE2-OD1 2.88Å; Q158-D162 PolarHBondContact O-N 2.63Å; Q158-D162 VanDerWaalsContact O-N 3.16Å; Q158-C205 PolarHBondContact OE1-SG 2.83Å
159	S	93.2	Very high	94.1	Very high	0 Å²	0	20.1 Å²	20.1	0%	0	10%	0.097	C	C	.	.	H	α-helix	trans	-62	-29.6	176.2	-66.4	0	0	0	0	112.5	H59 P155 I156 V157 D162 G163 Y164 K399	H59-S159 PolarHBondContact NE2-OG 2.77Å; P155-S159 PolarHBondContact O-N 3.37Å; P155-S159 PolarHBondContact O-OG 2.88Å; I156-S159 VanDerWaalsContact O-CB 3.28Å; I156-S159 WeakPolarHBondContact O-CB 3.28Å; I156-S159 PolarHBondContact O-N 2.85Å; I156-S159 VanDerWaalsContact O-N 3.13Å; V157-S159 PolarHBondContact O-N 2.89Å; S159-D162 PolarHBondContact O-N 2.83Å; S159-G163 PolarHBondContact O-N 3.32Å; S159-Y164 VanDerWaalsContact O-CB 3.32Å; S159-Y164 WeakPolarHBondContact O-CB 3.43Å; S159-Y164 VanDerWaalsContact O-CD2 3.31Å; S159-Y164 WeakPolarHBondContact O-CD2 3.35Å; S159-Y164 PolarHBondContact O-N 3.25Å; S159-Y164 VanDerWaalsContact O-N 3.09Å; S159-K399 WeakPolarHBondContact OG-CD 3.41Å; S159-K399 PolarHBondContact OG-NZ 3.34Å
160	S	91.6	Very high	94.1	Very high	0 Å²	0	20.1 Å²	20.1	0%	0	10%	0.097	C	C	.	.	H	α-helix	trans	-66.3	-43	176.5	70.7	0	0	0	0	111.7	V157 Q158 D162 G163 Y164 G329	V157-S160 WeakPolarHBondContact O-CB 3.32Å; V157-S160 PolarHBondContact O-N 2.95Å; V157-S160 PolarHBondContact O-OG 2.93Å; Q158-S160 PolarHBondContact O-N 2.88Å; S160-D162 PolarHBondContact O-N 3.47Å; S160-G163 PolarHBondContact O-N 2.85Å; S160-G163 VanDerWaalsContact O-N 3.1Å; S160-Y164 WeakPolarHBondContact CA-O 3.26Å; S160-G329 VanDerWaalsContact O-CA 3.28Å; S160-G329 WeakPolarHBondContact O-CA 3.34Å
161	L	89.7	Confident	94	Very high	1 Å²	1	20 Å²	20	1%	0.005	10%	0.096	C	C	.	.	H	α-helix	trans	-62.6	-29.8	173.5	-65.8	168.2	0	0	0	112.8	Q158 G163 V202 C205 V316	Q158-L161 PolarHBondContact O-N 3.33Å; L161-G163 PolarHBondContact O-N 2.8Å; L161-V202 HydrophobicContact CD2-CB 4.45Å; L161-V202 HydrophobicContact CD2-CG1 4.03Å; L161-V202 HydrophobicContact CD2-CG2 4.43Å; L161-V202 HydrophobicContact CG-CG2 4.45Å; L161-C205 HydrophobicContact CD1-CB 3.28Å; L161-V316 HydrophobicContact CD2-CG1 4.13Å
162	D	90.7	Very high	93.9	Very high	0 Å²	0	14.5 Å²	14.5	0%	0	7%	0.07	C	C	.	.	T	Hydrogen-bonded Turn	trans	-79.1	2.9	179	-64.3	-6.4	0	0	0	112.9	R55 R56 H59 Q158 S159 S160 Y164 R436	R55-D162 IonicContact CZ-OD1 3.72Å; R55-D162 IonicContact CZ-OD2 3.6Å; R55-D162 IonicContact NH1-OD1 2.66Å; R55-D162 PolarHBondContact NH1-OD1 3.36Å; R55-D162 IonicContact NH1-OD2 2.91Å; R55-D162 PolarHBondContact NH1-OD2 3.34Å; R55-D162 IonicContact NH2-OD1 3.63Å; R55-D162 PolarHBondContact NH2-OD1 2.83Å; R55-D162 IonicContact NH2-OD2 2.76Å; R55-D162 PolarHBondContact NH2-OD2 2.94Å; R56-D162 HydrophobicContact CG-CB 4.4Å; H59-D162 IonicContact CD2-OD2 3.57Å; H59-D162 PolarHBondContact CD2-OD2 3.1Å; Q158-D162 PolarHBondContact NE2-OD1 2.88Å; Q158-D162 PolarHBondContact O-N 2.63Å; Q158-D162 VanDerWaalsContact O-N 3.16Å; S159-D162 PolarHBondContact O-N 2.83Å; S160-D162 PolarHBondContact O-N 3.47Å; D162-Y164 HydrophobicContact CB-CD2 3.94Å; D162-Y164 HydrophobicContact CB-CE2 4.03Å; D162-R436 WeakPolarHBondContact O-CD 3.33Å
163	G	90.5	Very high	93.8	Very high	0 Å²	0	11.4 Å²	11.4	0%	0	6%	0.056	C	C	.	.	T	Hydrogen-bonded Turn	trans	92.6	22.6	175.4	0	0	0	0	0	115	S159 S160 L161 R436 N437	S159-G163 PolarHBondContact O-N 3.32Å; S160-G163 PolarHBondContact O-N 2.85Å; S160-G163 VanDerWaalsContact O-N 3.1Å; L161-G163 PolarHBondContact O-N 2.8Å; G163-R436 WeakPolarHBondContact O-CG 3.4Å; G163-N437 PolarHBondContact O-N 3.2Å
164	Y	90.6	Very high	93.6	Very high	19 Å²	19	13.3 Å²	13.3	8%	0.075	7%	0.068	C	C	.	.			trans	-104.7	151.8	177.6	-62.1	-86.3	0	0	0	111.5	N60 S159 S160 D162 G329 C330 V434 R436	N60-Y164 HydrophobicContact CB-CE2 4.2Å; N60-Y164 WeakPolarHBondContact CB-OH 3.42Å; N60-Y164 PolarHBondContact ND2-OH 3.35Å; N60-Y164 WeakPolarHBondContact OD1-CE1 3.47Å; N60-Y164 PolarHBondContact OD1-OH 2.96Å; S159-Y164 VanDerWaalsContact O-CB 3.32Å; S159-Y164 WeakPolarHBondContact O-CB 3.43Å; S159-Y164 VanDerWaalsContact O-CD2 3.31Å; S159-Y164 WeakPolarHBondContact O-CD2 3.35Å; S159-Y164 PolarHBondContact O-N 3.25Å; S159-Y164 VanDerWaalsContact O-N 3.09Å; S160-Y164 WeakPolarHBondContact CA-O 3.26Å; D162-Y164 HydrophobicContact CB-CD2 3.94Å; D162-Y164 HydrophobicContact CB-CE2 4.03Å; Y164-G329 WeakPolarHBondContact O-CA 2.98Å; Y164-C330 PolarHBondContact O-N 3.01Å; Y164-V434 HydrophobicContact CD1-CG1 3.67Å; Y164-V434 HydrophobicContact CE1-CG1 4.32Å; Y164-R436 HydrophobicContact CD1-CB 4.37Å; Y164-R436 HydrophobicContact CE1-CB 3.79Å; Y164-R436 HydrophobicContact CE1-CG 4.42Å; Y164-R436 HydrophobicContact CE2-CB 4.42Å; Y164-R436 HydrophobicContact CE2-CG 4.29Å
165	N	91.5	Very high	93.4	Very high	26 Å²	26	11.1 Å²	11.1	14%	0.139	7%	0.07	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.5	137.5	165.1	-55.5	-51.2	0	0	0	109.3	C330 N397 S398 K399 N437	N165-C330 CarbonylContact C-O 3.55Å; N165-C330 WeakPolarHBondContact CA-O 3.4Å; N165-C330 WeakPolarHBondContact OD1-CB 3.37Å; N165-N397 WeakPolarHBondContact CB-O 3.1Å; N165-N397 PolarHBondContact ND2-O 2.86Å; N165-S398 CarbonylContact O-C 3.59Å; N165-S398 VanDerWaalsContact O-CA 3.3Å; N165-S398 WeakPolarHBondContact O-CA 3.14Å; N165-S398 PolarHBondContact O-OG 2.86Å; N165-K399 PolarHBondContact O-N 3.28Å; N165-N437 PolarHBondContact ND2-ND2 3Å; N165-N437 PolarHBondContact OD1-ND2 3.31Å
166	V	94.2	Very high	93.3	Very high	0 Å²	0	9.4 Å²	9.4	0%	0	6%	0.059	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.3	137.4	179.7	179.2	0	0	0	0	108.3	I156 V168 C330 L331 N332 K399	I156-V166 HydrophobicContact CB-CG1 4.43Å; I156-V166 HydrophobicContact CD1-CG1 4.09Å; I156-V166 HydrophobicContact CG1-CG1 3.76Å; I156-V166 HydrophobicContact CG2-CG1 4.04Å; I156-V166 WeakPolarHBondContact O-CG2 3.28Å; V166-V168 HydrophobicContact CG1-CG2 4.27Å; V166-C330 PolarHBondContact N-O 2.94Å; V166-L331 HydrophobicContact CB-CD1 3.67Å; V166-L331 HydrophobicContact CG1-CD1 3.43Å; V166-L331 VanDerWaalsContact CG1-CD1 3.43Å; V166-N332 PolarHBondContact O-N 3.22Å; V166-N332 PolarHBondContact O-ND2 3.3Å; V166-K399 CarbonylContact C-O 3.53Å; V166-K399 VanDerWaalsContact CA-O 3.23Å; V166-K399 WeakPolarHBondContact CA-O 3.44Å; V166-K399 HydrophobicContact CG2-CB 4.47Å
167	C	94.9	Very high	93.4	Very high	0 Å²	0	10 Å²	10	0%	0	7%	0.066	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.7	124.1	175.2	-171.3	0	0	0	0	109.8	N332 C393 K399 T400 L401	C167-N332 CarbonylContact C-O 3.49Å; C167-N332 WeakPolarHBondContact CA-O 3.45Å; C167-N332 HydrophobicContact CB-CB 4.46Å; C167-C393 HydrophobicContact CB-CB 3.52Å; C167-K399 PolarHBondContact N-O 3.05Å; C167-T400 CarbonylContact O-C 3.53Å; C167-T400 VanDerWaalsContact O-CA 3.31Å; C167-T400 WeakPolarHBondContact O-CA 3.48Å; C167-L401 PolarHBondContact O-N 2.99Å
168	V	97	Very high	93.4	Very high	0 Å²	0	10.7 Å²	10.7	0%	0	7%	0.069	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	120.8	175.5	-175.5	0	0	0	0	106.8	I156 V166 M182 N332 F333 V334 L401 F403	I156-V168 HydrophobicContact CG2-CG2 4.17Å; V166-V168 HydrophobicContact CG1-CG2 4.27Å; V168-M182 HydrophobicContact CG1-CE 3.99Å; V168-M182 WeakPolarHBondContact O-CE 3.44Å; V168-N332 PolarHBondContact N-O 2.9Å; V168-F333 HydrophobicContact CB-CD1 3.74Å; V168-F333 HydrophobicContact CB-CE1 3.83Å; V168-F333 HydrophobicContact CG1-CD1 4.1Å; V168-F333 HydrophobicContact CG1-CE1 4.11Å; V168-F333 HydrophobicContact CG2-CD1 4.33Å; V168-F333 HydrophobicContact CG2-CE1 3.94Å; V168-F333 CarbonylContact O-C 3.52Å; V168-F333 VanDerWaalsContact O-CA 3.29Å; V168-F333 WeakPolarHBondContact O-CA 3.34Å; V168-V334 PolarHBondContact O-N 2.96Å; V168-L401 CarbonylContact C-O 3.57Å; V168-L401 VanDerWaalsContact CA-O 3.29Å; V168-L401 WeakPolarHBondContact CA-O 3.5Å; V168-L401 HydrophobicContact CG1-CD2 3.9Å; V168-L401 HydrophobicContact CG2-CB 4.38Å; V168-F403 HydrophobicContact CG1-CD2 3.83Å; V168-F403 HydrophobicContact CG1-CE2 3.61Å
169	F	94.7	Very high	93.4	Very high	3 Å²	3	12.4 Å²	12.4	1%	0.013	8%	0.081	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	144.3	-179.7	57	-100	0	0	0	112.8	V334 L336 F369 L394 T400 L401 M402 F403	F169-V334 CarbonylContact C-O 3.56Å; F169-V334 WeakPolarHBondContact CA-O 3.43Å; F169-V334 HydrophobicContact CB-CB 3.72Å; F169-V334 HydrophobicContact CB-CG1 4.42Å; F169-V334 HydrophobicContact CB-CG2 4.4Å; F169-L336 HydrophobicContact CD2-CD1 4.28Å; F169-F369 HydrophobicContact CE1-CZ 4.14Å; F169-F369 HydrophobicContact CE2-CE2 4.5Å; F169-F369 HydrophobicContact CE2-CZ 4.46Å; F169-F369 HydrophobicContact CZ-CE2 4.01Å; F169-F369 AromaticContact CZ-CZ 3.56Å; F169-F369 HydrophobicContact CZ-CZ 3.56Å; F169-L394 HydrophobicContact CE1-CD2 4.27Å; F169-T400 HydrophobicContact CD1-CG2 4.15Å; F169-T400 HydrophobicContact CE1-CG2 3.32Å; F169-T400 HydrophobicContact CZ-CG2 4.12Å; F169-L401 PolarHBondContact N-O 2.95Å; F169-M402 HydrophobicContact CD2-CB 3.93Å; F169-M402 HydrophobicContact CD2-CG 3.77Å; F169-M402 HydrophobicContact CE1-CB 4.48Å; F169-M402 HydrophobicContact CE2-CB 3.29Å; F169-M402 HydrophobicContact CE2-CG 3.23Å; F169-M402 HydrophobicContact CE2-SD 3.67Å; F169-M402 HydrophobicContact CZ-CB 3.58Å; F169-M402 HydrophobicContact CZ-CG 4.03Å; F169-M402 HydrophobicContact CZ-SD 4.35Å; F169-M402 CarbonylContact O-C 3.52Å; F169-M402 WeakPolarHBondContact O-CA 3.25Å; F169-F403 PolarHBondContact O-N 2.93Å
170	A	97.3	Very high	93.5	Very high	0 Å²	0	16.7 Å²	16.7	0%	0	10%	0.098	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107	128	179.4	0	0	0	0	0	109.3	K178 M182 V334 L336 F403	A170-K178 HydrophobicContact CB-CB 3.83Å; A170-K178 HydrophobicContact CB-CG 4.2Å; A170-M182 HydrophobicContact CB-CE 3.48Å; A170-M182 VanDerWaalsContact CB-CE 3.48Å; A170-M182 HydrophobicContact CB-CG 3.85Å; A170-V334 PolarHBondContact N-O 2.99Å; A170-L336 VanDerWaalsContact O-CB 3.24Å; A170-L336 WeakPolarHBondContact O-CB 3.35Å; A170-L336 WeakPolarHBondContact O-CG 3.34Å; A170-L336 PolarHBondContact O-N 2.87Å; A170-L336 VanDerWaalsContact O-N 3.16Å; A170-F403 HydrophobicContact CB-CB 4.38Å
171	Y	96.1	Very high	93.7	Very high	22 Å²	22	16.8 Å²	16.8	9%	0.086	10%	0.098	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	146	-176.1	177.6	-87	0	0	0	110.1	L336 S339 L362 M402 F403 V404 N405 F422	Y171-L336 HydrophobicContact CD2-CD1 3.92Å; Y171-S339 WeakPolarHBondContact OH-CB 3.37Å; Y171-L362 HydrophobicContact CD2-CD2 4.27Å; Y171-L362 HydrophobicContact CE2-CD1 4.39Å; Y171-L362 HydrophobicContact CE2-CD2 4.12Å; Y171-M402 VanDerWaalsContact CB-CE 3.48Å; Y171-M402 HydrophobicContact CD1-CE 3.53Å; Y171-M402 HydrophobicContact CD2-CE 4.42Å; Y171-M402 HydrophobicContact CE1-CE 4.4Å; Y171-M402 HydrophobicContact CG-CE 3.55Å; Y171-F403 PolarHBondContact N-O 3.39Å; Y171-V404 HydrophobicContact CD1-CG2 4.5Å; Y171-V404 CarbonylContact O-C 3.53Å; Y171-V404 WeakPolarHBondContact O-CA 3.4Å; Y171-N405 PolarHBondContact O-N 2.69Å; Y171-F422 AromaticContact CD1-CD1 3.88Å; Y171-F422 HydrophobicContact CD1-CD1 3.88Å; Y171-F422 HydrophobicContact CD1-CE1 4.39Å; Y171-F422 HydrophobicContact CD2-CD1 4.2Å; Y171-F422 AromaticContact CD2-CE1 4Å; Y171-F422 HydrophobicContact CD2-CE1 4Å; Y171-F422 HydrophobicContact CE1-CB 4.34Å; Y171-F422 AromaticContact CE1-CD1 3.5Å; Y171-F422 HydrophobicContact CE1-CD1 3.5Å; Y171-F422 VanDerWaalsContact CE1-CD1 3.5Å; Y171-F422 HydrophobicContact CE1-CE1 4.26Å; Y171-F422 HydrophobicContact CE1-CG 4.24Å; Y171-F422 AromaticContact CE2-CD1 3.82Å; Y171-F422 HydrophobicContact CE2-CD1 3.82Å; Y171-F422 AromaticContact CE2-CE1 3.82Å; Y171-F422 HydrophobicContact CE2-CE1 3.82Å; Y171-F422 HydrophobicContact CG-CD1 4.22Å; Y171-F422 HydrophobicContact CG-CE1 4.27Å; Y171-F422 AromaticContact CZ-CD1 3.44Å; Y171-F422 VanDerWaalsContact CZ-CD1 3.44Å; Y171-F422 AromaticContact CZ-CE1 3.95Å
172	G	95.2	Very high	94.1	Very high	0 Å²	0	16.8 Å²	16.8	0%	0	10%	0.098	C	C	.	.	S	Bend	trans	145	172.3	-179.9	0	0	0	0	0	111	K178 S339	G172-K178 WeakPolarHBondContact O-CD 3.34Å; G172-K178 WeakPolarHBondContact O-CE 3.29Å; G172-K178 PolarHBondContact O-NZ 3.13Å; G172-S339 WeakPolarHBondContact CA-OG 3.36Å; G172-S339 PolarHBondContact O-N 2.92Å; G172-S339 VanDerWaalsContact O-N 3.14Å; G172-S339 PolarHBondContact O-OG 2.87Å
173	Q	92.7	Very high	94.3	Very high	8 Å²	8	17.3 Å²	17.3	4%	0.037	10%	0.101	C	C	.	.	S	Bend	trans	-64.7	163.9	-178.5	63.7	174.5	94.8	0	0	112.8	S176 K178 S339 E340 H412 E415	Q173-S176 VanDerWaalsContact O-CB 3.28Å; Q173-S176 WeakPolarHBondContact O-CB 3.3Å; Q173-S176 PolarHBondContact O-N 3.29Å; Q173-S176 PolarHBondContact O-OG 3.25Å; Q173-K178 VanDerWaalsContact C-NZ 3.32Å; Q173-K178 PolarHBondContact O-NZ 3.48Å; Q173-S339 PolarHBondContact N-OG 3.2Å; Q173-S339 VanDerWaalsContact N-OG 3.09Å; Q173-E340 WeakPolarHBondContact CA-OE2 3.39Å; Q173-E340 HydrophobicContact CB-CB 4.13Å; Q173-E340 WeakPolarHBondContact CB-OE2 3.24Å; Q173-H412 PolarHBondContact NE2-CD2 3.09Å; Q173-H412 PolarHBondContact NE2-CE1 3.17Å; Q173-H412 PolarHBondContact NE2-ND1 2.84Å; Q173-H412 VanDerWaalsContact NE2-ND1 3.2Å; Q173-H412 PolarHBondContact NE2-NE2 3.23Å; Q173-H412 PolarHBondContact OE1-O 2.64Å; Q173-E415 HydrophobicContact CB-CB 4.25Å
174	T	91.4	Very high	94.4	Very high	41 Å²	41	17.5 Å²	17.5	25%	0.252	10%	0.103	S	C	.	.	T	Hydrogen-bonded Turn	trans	-56.1	139.1	169.1	-61.4	0	0	0	0	110.6	S176 S306 E340	T174-S176 VanDerWaalsContact C-N 3.26Å; T174-S176 PolarHBondContact O-N 3.38Å; T174-S306 WeakPolarHBondContact OG1-CB 3.29Å; T174-E340 WeakPolarHBondContact CB-OE1 3.41Å; T174-E340 PolarHBondContact N-OE2 3.41Å; T174-E340 PolarHBondContact OG1-OE1 3.48Å; T174-E340 PolarHBondContact OG1-OE2 2.69Å
175	G	90.5	Very high	94.3	Very high	47 Å²	47	18.5 Å²	18.5	49%	0.485	11%	0.112	S	C	.	.	T	Hydrogen-bonded Turn	trans	73.5	5.6	-176.4	0	0	0	0	0	115.4	R76 G177	R76-G175 PolarHBondContact NE-O 3.08Å; R76-G175 PolarHBondContact NH2-O 3.01Å; G175-G177 VanDerWaalsContact C-N 3.34Å
176	S	94.2	Very high	93.8	Very high	0 Å²	0	22 Å²	22	0%	0	13%	0.134	C	C	.	.	S	Bend	trans	-79.4	-9.4	176.1	60.5	0	0	0	0	115	Q173 T174 N405	Q173-S176 VanDerWaalsContact O-CB 3.28Å; Q173-S176 WeakPolarHBondContact O-CB 3.3Å; Q173-S176 PolarHBondContact O-N 3.29Å; Q173-S176 PolarHBondContact O-OG 3.25Å; T174-S176 VanDerWaalsContact C-N 3.26Å; T174-S176 PolarHBondContact O-N 3.38Å; S176-N405 WeakPolarHBondContact CB-O 3.42Å; S176-N405 WeakPolarHBondContact OG-CB 3.22Å; S176-N405 PolarHBondContact OG-O 3.37Å
177	G	94.8	Very high	93	Very high	16 Å²	16	31.3 Å²	31.3	17%	0.165	18%	0.178	C	C	.	.	S	Bend	trans	102.2	19.4	178.5	0	0	0	0	0	116.1	G175 T181 N405	G175-G177 VanDerWaalsContact C-N 3.34Å; G177-T181 WeakPolarHBondContact O-CB 3.18Å; G177-T181 PolarHBondContact O-N 3.29Å; G177-T181 PolarHBondContact O-OG1 3.44Å; G177-N405 PolarHBondContact O-ND2 3.49Å
178	K	95.8	Very high	92.4	Very high	14 Å²	14	34.7 Å²	34.7	6%	0.061	20%	0.196	C	C	.	.	H	α-helix	trans	-58.8	-58.5	176.2	-57.1	-173.5	-65.2	-68.9	0	112.9	A170 G172 Q173 Y180 T181 M182 D335 L336 N405	A170-K178 HydrophobicContact CB-CB 3.83Å; A170-K178 HydrophobicContact CB-CG 4.2Å; G172-K178 WeakPolarHBondContact O-CD 3.34Å; G172-K178 WeakPolarHBondContact O-CE 3.29Å; G172-K178 PolarHBondContact O-NZ 3.13Å; Q173-K178 VanDerWaalsContact C-NZ 3.32Å; Q173-K178 PolarHBondContact O-NZ 3.48Å; K178-Y180 VanDerWaalsContact C-N 3.3Å; K178-Y180 PolarHBondContact O-N 2.99Å; K178-T181 WeakPolarHBondContact O-CA 2.95Å; K178-T181 WeakPolarHBondContact O-CB 3.33Å; K178-T181 PolarHBondContact O-N 3.18Å; K178-M182 PolarHBondContact O-N 2.82Å; K178-D335 WeakPolarHBondContact CB-OD1 3.24Å; K178-L336 WeakPolarHBondContact CE-O 3.43Å; K178-N405 HydrophobicContact CG-CB 4Å
179	T	94.5	Very high	91.5	Very high	63 Å²	63	41.8 Å²	41.8	39%	0.387	23%	0.234	S	C	.	.	H	α-helix	trans	-61.5	-38.2	178.1	-45.7	0	0	0	0	112.1	T181 M182 E183 G184 D335	T179-T181 VanDerWaalsContact C-N 3.32Å; T179-T181 PolarHBondContact O-N 3.33Å; T179-M182 PolarHBondContact O-N 2.73Å; T179-E183 HydrophobicContact CG2-CB 4.49Å; T179-E183 HydrophobicContact CG2-CG 4.45Å; T179-E183 PolarHBondContact O-N 3.11Å; T179-G184 PolarHBondContact O-N 3.43Å; T179-D335 WeakPolarHBondContact CA-OD2 3.45Å; T179-D335 VanDerWaalsContact CB-OD2 3.25Å; T179-D335 WeakPolarHBondContact CB-OD2 3.41Å; T179-D335 PolarHBondContact N-OD2 3.5Å; T179-D335 PolarHBondContact OG1-OD2 3.39Å
180	Y	94.8	Very high	91.1	Very high	91 Å²	91	48.9 Å²	48.9	36%	0.357	27%	0.272	S	S	.	.	H	α-helix	trans	-59.7	-43.9	172.1	178	-88.2	0	0	0	111.2	Q146 K178 G184 P185 C191	Q146-Y180 HydrophobicContact CG-CE1 4.23Å; Q146-Y180 PolarHBondContact NE2-O 2.98Å; K178-Y180 VanDerWaalsContact C-N 3.3Å; K178-Y180 PolarHBondContact O-N 2.99Å; Y180-G184 WeakPolarHBondContact O-CA 3.43Å; Y180-G184 PolarHBondContact O-N 3.4Å; Y180-P185 HydrophobicContact CD2-CB 4.41Å; Y180-P185 HydrophobicContact CD2-CG 4.49Å; Y180-P185 HydrophobicContact CE2-CB 4.34Å; Y180-P185 HydrophobicContact CE2-CG 4.07Å; Y180-C191 PolarHBondContact OH-SG 3.3Å
181	T	97.3	Very high	90.7	Very high	1 Å²	1	49.9 Å²	49.9	1%	0.006	28%	0.279	C	S	.	.	H	α-helix	trans	-63.3	-47	176.9	-60.2	0	0	0	0	111.2	R74 G177 K178 T179 M194 F403 N405	R74-T181 PolarHBondContact NH1-OG1 3.39Å; R74-T181 VanDerWaalsContact NH1-OG1 3.07Å; G177-T181 WeakPolarHBondContact O-CB 3.18Å; G177-T181 PolarHBondContact O-N 3.29Å; G177-T181 PolarHBondContact O-OG1 3.44Å; K178-T181 WeakPolarHBondContact O-CA 2.95Å; K178-T181 WeakPolarHBondContact O-CB 3.33Å; K178-T181 PolarHBondContact O-N 3.18Å; T179-T181 VanDerWaalsContact C-N 3.32Å; T179-T181 PolarHBondContact O-N 3.33Å; T181-M194 HydrophobicContact CG2-CG 4.04Å; T181-M194 VanDerWaalsContact O-CG 3.27Å; T181-M194 WeakPolarHBondContact O-CG 3.4Å; T181-M194 PolarHBondContact O-N 3.2Å; T181-F403 HydrophobicContact CG2-CD1 4.25Å; T181-F403 HydrophobicContact CG2-CD2 4.01Å; T181-F403 HydrophobicContact CG2-CE1 4.39Å; T181-F403 HydrophobicContact CG2-CE2 4.15Å; T181-F403 HydrophobicContact CG2-CG 4.05Å; T181-F403 HydrophobicContact CG2-CZ 4.34Å; T181-N405 PolarHBondContact OG1-ND2 3.07Å
182	M	97.1	Very high	90.6	Very high	1 Å²	1	50.3 Å²	50.3	1%	0.005	28%	0.284	C	S	.	.	H	α-helix	trans	-76.3	-52.5	-174.1	-71	-61.9	-178.4	0	0	113.9	V168 A170 K178 T179 G193 M194 I195 F333 V334 D335 F403	V168-M182 HydrophobicContact CG1-CE 3.99Å; V168-M182 WeakPolarHBondContact O-CE 3.44Å; A170-M182 HydrophobicContact CB-CE 3.48Å; A170-M182 VanDerWaalsContact CB-CE 3.48Å; A170-M182 HydrophobicContact CB-CG 3.85Å; K178-M182 PolarHBondContact O-N 2.82Å; T179-M182 PolarHBondContact O-N 2.73Å; M182-G193 CarbonylContact O-C 3.47Å; M182-G193 WeakPolarHBondContact O-CA 3.18Å; M182-M194 PolarHBondContact O-N 2.97Å; M182-M194 VanDerWaalsContact O-N 3.12Å; M182-I195 HydrophobicContact CB-CD1 4.43Å; M182-I195 WeakPolarHBondContact O-CG1 3.38Å; M182-I195 PolarHBondContact O-N 2.75Å; M182-F333 HydrophobicContact SD-CB 4.2Å; M182-F333 HydrophobicContact SD-CD1 3.87Å; M182-V334 WeakPolarHBondContact CE-O 3.31Å; M182-D335 HydrophobicContact CB-CB 4.31Å; M182-D335 HydrophobicContact CG-CB 4.1Å; M182-F403 HydrophobicContact CE-CD2 4.31Å
183	E	94.9	Very high	90.7	Very high	11 Å²	11	50.3 Å²	50.3	5%	0.051	28%	0.284	C	S	.	.	H	α-helix	trans	-104.6	-20.1	-172.5	-57.5	-172.5	-169	0	0	113.5	T179 G193 I195 R291 R294	T179-E183 HydrophobicContact CG2-CB 4.49Å; T179-E183 HydrophobicContact CG2-CG 4.45Å; T179-E183 PolarHBondContact O-N 3.11Å; E183-G193 PolarHBondContact O-N 3.24Å; E183-I195 HydrophobicContact CG-CD1 4.18Å; E183-R291 PolarHBondContact O-NH2 3.38Å; E183-R291 IonicContact OE2-CZ 2.94Å; E183-R291 IonicContact OE2-NE 2.87Å; E183-R291 PolarHBondContact OE2-NE 2.84Å; E183-R291 IonicContact OE2-NH2 3.72Å; E183-R294 IonicContact OE1-CZ 3.91Å; E183-R294 IonicContact OE1-NH1 2.67Å; E183-R294 PolarHBondContact OE1-NH1 3.2Å; E183-R294 IonicContact OE1-NH2 3.09Å
184	G	93.1	Very high	91	Very high	5 Å²	5	49.9 Å²	49.9	5%	0.052	28%	0.282	C	S	.	.			trans	80.4	172.6	-172.1	0	0	0	0	0	113	T179 Y180 R291	T179-G184 PolarHBondContact O-N 3.43Å; Y180-G184 WeakPolarHBondContact O-CA 3.43Å; Y180-G184 PolarHBondContact O-N 3.4Å; G184-R291 PolarHBondContact O-NH2 3.45Å
185	P	88.7	Confident	91.3	Very high	40 Å²	40	48.1 Å²	48.1	26%	0.26	27%	0.271	S	S	.	.			trans	-65.4	148.1	173.1	31.6	-31.3	0	0	0	110.4	Y180 D188 C191	Y180-P185 HydrophobicContact CD2-CB 4.41Å; Y180-P185 HydrophobicContact CD2-CG 4.49Å; Y180-P185 HydrophobicContact CE2-CB 4.34Å; Y180-P185 HydrophobicContact CE2-CG 4.07Å; P185-D188 HydrophobicContact CB-CB 4.49Å; P185-D188 HydrophobicContact CG-CB 3.84Å; P185-C191 WeakPolarHBondContact CD-O 3.47Å; P185-C191 HydrophobicContact CG-CB 3.81Å
186	V	80.2	Confident	91.6	Very high	100 Å²	100	46.6 Å²	46.6	61%	0.606	25%	0.252	S	S	*	.	S	Bend	trans	-73.3	-32.9	179.8	-178.9	0	0	0	0	111.5
187	E	77.5	Confident	91.7	Very high	195 Å²	195	47.8 Å²	47.8	91%	0.911	26%	0.258	S	S	*	.	S	Bend	trans	-90.9	-15.9	-169.9	-60.5	180	176.1	0	0	113.7
188	D	82.6	Confident	91.9	Very high	71 Å²	71	47 Å²	47	38%	0.38	25%	0.25	S	S	.	.			trans	-120.9	96.4	-175.3	-178.6	13.2	0	0	0	111.8	P185 N190 C191	P185-D188 HydrophobicContact CB-CB 4.49Å; P185-D188 HydrophobicContact CG-CB 3.84Å; D188-N190 PolarHBondContact O-N 3.31Å; D188-N190 WeakPolarHBondContact OD1-CA 3.3Å; D188-N190 VanDerWaalsContact OD1-CB 3.29Å; D188-N190 WeakPolarHBondContact OD1-CB 3.23Å; D188-N190 PolarHBondContact OD1-N 3.3Å; D188-C191 HydrophobicContact CB-CB 4.37Å; D188-C191 PolarHBondContact O-N 3.07Å; D188-C191 VanDerWaalsContact O-N 3.15Å; D188-C191 WeakPolarHBondContact OD2-CB 3.39Å
189	N	79.3	Confident	92	Very high	148 Å²	148	46.3 Å²	46.3	79%	0.791	25%	0.248	S	C	*	.	T	Hydrogen-bonded Turn	trans	-65.9	-16.8	176.1	-69.8	-24.8	0	0	0	113.3	C191	N189-C191 PolarHBondContact O-N 3.03Å
190	N	85.1	Confident	92.1	Very high	152 Å²	152	48 Å²	48	81%	0.813	25%	0.251	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.5	-4.9	176.8	-61.1	-34.2	0	0	0	112.4	D188 P192	D188-N190 PolarHBondContact O-N 3.31Å; D188-N190 WeakPolarHBondContact OD1-CA 3.3Å; D188-N190 VanDerWaalsContact OD1-CB 3.29Å; D188-N190 WeakPolarHBondContact OD1-CB 3.23Å; D188-N190 PolarHBondContact OD1-N 3.3Å; N190-P192 VanDerWaalsContact O-CD 3.32Å; N190-P192 WeakPolarHBondContact O-CD 3.37Å
191	C	89.8	Confident	92.2	Very high	22 Å²	22	44.5 Å²	44.5	15%	0.149	24%	0.238	C	C	.	.	S	Bend	trans	-119.1	51.7	179.3	-157.9	0	0	0	0	112.9	Q146 Y180 P185 D188 N189	Q146-C191 VanDerWaalsContact CG-SG 3.54Å; Y180-C191 PolarHBondContact OH-SG 3.3Å; P185-C191 WeakPolarHBondContact CD-O 3.47Å; P185-C191 HydrophobicContact CG-CB 3.81Å; D188-C191 HydrophobicContact CB-CB 4.37Å; D188-C191 PolarHBondContact O-N 3.07Å; D188-C191 VanDerWaalsContact O-N 3.15Å; D188-C191 WeakPolarHBondContact OD2-CB 3.39Å; N189-C191 PolarHBondContact O-N 3.03Å
192	P	94.3	Very high	92.2	Very high	30 Å²	30	44.5 Å²	44.5	20%	0.195	24%	0.237	C	C	.	.			trans	-58.4	145.2	-174.9	26.1	-35.2	0	0	0	112.7	Q146 N190 V196 L197	Q146-P192 WeakPolarHBondContact CB-O 3.28Å; Q146-P192 WeakPolarHBondContact CG-O 3.2Å; Q146-P192 PolarHBondContact NE2-O 3.41Å; N190-P192 VanDerWaalsContact O-CD 3.32Å; N190-P192 WeakPolarHBondContact O-CD 3.37Å; P192-V196 HydrophobicContact CB-CB 3.85Å; P192-V196 HydrophobicContact CB-CG1 3.77Å; P192-L197 HydrophobicContact CB-CD2 4.45Å; P192-L197 HydrophobicContact CB-CG 4.2Å; P192-L197 HydrophobicContact CG-CD1 4.42Å; P192-L197 HydrophobicContact CG-CD2 3.64Å; P192-L197 HydrophobicContact CG-CG 3.84Å; P192-L197 WeakPolarHBondContact O-CD1 3.45Å
193	G	96.7	Very high	92.2	Very high	0 Å²	0	45.3 Å²	45.3	0%	0	24%	0.241	C	C	.	.			trans	-71.4	174.1	172.5	0	0	0	0	0	113.7	M182 E183 I195 V196 L197	M182-G193 CarbonylContact O-C 3.47Å; M182-G193 WeakPolarHBondContact O-CA 3.18Å; E183-G193 PolarHBondContact O-N 3.24Å; G193-I195 PolarHBondContact O-N 3.44Å; G193-V196 PolarHBondContact O-N 2.83Å; G193-L197 PolarHBondContact O-N 2.89Å; G193-L197 VanDerWaalsContact O-N 3.07Å
194	M	98	Very high	92.3	Very high	0 Å²	0	49.5 Å²	49.5	0%	0	26%	0.261	C	S	.	.	H	α-helix	trans	-57.7	-33.2	-178.9	-67.5	-50.5	97.8	0	0	112.9	Q146 V149 F150 I153 T181 M182 L197 A198 F333 F403	Q146-M194 HydrophobicContact CB-CE 4.05Å; Q146-M194 WeakPolarHBondContact O-CE 3.29Å; V149-M194 HydrophobicContact CB-CE 4.3Å; V149-M194 HydrophobicContact CB-SD 4.43Å; V149-M194 HydrophobicContact CG1-CE 4.24Å; V149-M194 HydrophobicContact CG1-SD 3.88Å; F150-M194 HydrophobicContact CB-CE 4.3Å; F150-M194 HydrophobicContact CB-SD 4.15Å; F150-M194 HydrophobicContact CD2-SD 4.2Å; I153-M194 HydrophobicContact CD1-CB 3.91Å; I153-M194 HydrophobicContact CD1-CG 3.86Å; I153-M194 HydrophobicContact CD1-SD 3.51Å; I153-M194 VanDerWaalsContact CD1-SD 3.51Å; I153-M194 HydrophobicContact CG1-SD 4.12Å; T181-M194 HydrophobicContact CG2-CG 4.04Å; T181-M194 VanDerWaalsContact O-CG 3.27Å; T181-M194 WeakPolarHBondContact O-CG 3.4Å; T181-M194 PolarHBondContact O-N 3.2Å; M182-M194 PolarHBondContact O-N 2.97Å; M182-M194 VanDerWaalsContact O-N 3.12Å; M194-L197 HydrophobicContact CE-CD1 3.79Å; M194-A198 WeakPolarHBondContact O-CB 3.46Å; M194-A198 PolarHBondContact O-N 3.37Å; M194-F333 HydrophobicContact CB-CD1 4.42Å; M194-F333 HydrophobicContact CB-CE1 4.01Å; M194-F403 HydrophobicContact CG-CE2 4.22Å; M194-F403 HydrophobicContact CG-CZ 4.38Å
195	I	97.7	Very high	92.3	Very high	3 Å²	3	50.5 Å²	50.5	2%	0.015	27%	0.266	C	S	.	.	H	α-helix	trans	-60.5	-54.6	177.3	-65.4	166.6	0	0	0	110.2	M182 E183 G193 A198 M199 I287 F312 F333	M182-I195 HydrophobicContact CB-CD1 4.43Å; M182-I195 WeakPolarHBondContact O-CG1 3.38Å; M182-I195 PolarHBondContact O-N 2.75Å; E183-I195 HydrophobicContact CG-CD1 4.18Å; G193-I195 PolarHBondContact O-N 3.44Å; I195-A198 PolarHBondContact O-N 3.28Å; I195-M199 VanDerWaalsContact O-CG 3.29Å; I195-M199 WeakPolarHBondContact O-CG 3.39Å; I195-M199 PolarHBondContact O-N 2.65Å; I195-I287 HydrophobicContact CB-CD1 4.45Å; I195-I287 HydrophobicContact CG2-CD1 3.83Å; I195-F312 HydrophobicContact CD1-CB 4Å; I195-F312 HydrophobicContact CD1-CG 4.36Å; I195-F312 HydrophobicContact CG1-CD1 4.42Å; I195-F312 HydrophobicContact CG2-CD1 3.66Å; I195-F312 HydrophobicContact CG2-CD2 4.49Å; I195-F312 HydrophobicContact CG2-CE1 3.7Å; I195-F312 HydrophobicContact CG2-CG 4.08Å; I195-F312 HydrophobicContact CG2-CZ 4.15Å; I195-F333 HydrophobicContact CB-CD2 4.46Å; I195-F333 HydrophobicContact CD1-CB 3.95Å; I195-F333 HydrophobicContact CD1-CG 4.49Å; I195-F333 HydrophobicContact CG1-CB 3.52Å; I195-F333 HydrophobicContact CG1-CD1 4.06Å; I195-F333 HydrophobicContact CG1-CD2 3.83Å; I195-F333 HydrophobicContact CG1-CG 3.54Å
196	V	97.1	Very high	92.5	Very high	15 Å²	15	48.9 Å²	48.9	9%	0.091	26%	0.256	C	S	.	.	H	α-helix	trans	-67	-43.2	-175.5	175.4	0	0	0	0	110.9	P192 G193 A198 M199 H200 V280 I287	P192-V196 HydrophobicContact CB-CB 3.85Å; P192-V196 HydrophobicContact CB-CG1 3.77Å; G193-V196 PolarHBondContact O-N 2.83Å; V196-A198 VanDerWaalsContact C-N 3.34Å; V196-A198 PolarHBondContact O-N 3.18Å; V196-M199 WeakPolarHBondContact O-CB 3.39Å; V196-M199 PolarHBondContact O-N 2.92Å; V196-M199 VanDerWaalsContact O-N 3.13Å; V196-H200 PolarHBondContact O-CD2 3.41Å; V196-H200 VanDerWaalsContact O-CD2 3.24Å; V196-H200 PolarHBondContact O-N 2.73Å; V196-V280 HydrophobicContact CG1-CG1 3.99Å; V196-I287 HydrophobicContact CG2-CD1 3.6Å
197	L	97.4	Very high	93.1	Very high	25 Å²	25	49.9 Å²	49.9	13%	0.131	25%	0.252	C	S	.	.	H	α-helix	trans	-60.5	-42.5	175.6	-71	172.2	0	0	0	112	Q146 F150 P192 G193 M194 M199 H200 Q201	Q146-L197 HydrophobicContact CB-CD1 4.05Å; F150-L197 HydrophobicContact CB-CB 4.36Å; F150-L197 HydrophobicContact CB-CD1 3.74Å; F150-L197 HydrophobicContact CD1-CB 4.19Å; F150-L197 HydrophobicContact CD2-CB 3.43Å; F150-L197 VanDerWaalsContact CD2-CB 3.43Å; F150-L197 HydrophobicContact CD2-CD1 4.31Å; F150-L197 HydrophobicContact CD2-CG 4.47Å; F150-L197 HydrophobicContact CE1-CB 4.39Å; F150-L197 VanDerWaalsContact CE2-C 3.42Å; F150-L197 HydrophobicContact CE2-CB 3.69Å; F150-L197 HydrophobicContact CG-CB 3.71Å; F150-L197 HydrophobicContact CG-CD1 4.03Å; F150-L197 HydrophobicContact CG-CG 4.39Å; F150-L197 HydrophobicContact CZ-CB 4.15Å; F150-L197 VanDerWaalsContact CZ-O 3.28Å; F150-L197 WeakPolarHBondContact CZ-O 3.38Å; P192-L197 HydrophobicContact CB-CD2 4.45Å; P192-L197 HydrophobicContact CB-CG 4.2Å; P192-L197 HydrophobicContact CG-CD1 4.42Å; P192-L197 HydrophobicContact CG-CD2 3.64Å; P192-L197 HydrophobicContact CG-CG 3.84Å; P192-L197 WeakPolarHBondContact O-CD1 3.45Å; G193-L197 PolarHBondContact O-N 2.89Å; G193-L197 VanDerWaalsContact O-N 3.07Å; M194-L197 HydrophobicContact CE-CD1 3.79Å; L197-M199 VanDerWaalsContact C-N 3.31Å; L197-M199 PolarHBondContact O-N 2.97Å; L197-H200 WeakPolarHBondContact O-CB 3.42Å; L197-H200 PolarHBondContact O-N 3.3Å; L197-Q201 PolarHBondContact O-N 2.86Å
198	A	98.2	Very high	93.8	Very high	0 Å²	0	44.3 Å²	44.3	0%	0	23%	0.229	C	C	.	.	H	α-helix	trans	-63.6	-37.7	174.7	0	0	0	0	0	112.1	F150 V157 M194 I195 V196 Q201 V202 L331 F333	F150-A198 HydrophobicContact CE2-CB 4.03Å; F150-A198 VanDerWaalsContact CE2-N 3.29Å; V157-A198 HydrophobicContact CG1-CB 3.95Å; V157-A198 HydrophobicContact CG2-CB 3.74Å; M194-A198 WeakPolarHBondContact O-CB 3.46Å; M194-A198 PolarHBondContact O-N 3.37Å; I195-A198 PolarHBondContact O-N 3.28Å; V196-A198 VanDerWaalsContact C-N 3.34Å; V196-A198 PolarHBondContact O-N 3.18Å; A198-Q201 PolarHBondContact O-N 3.27Å; A198-V202 WeakPolarHBondContact O-CB 3.28Å; A198-V202 VanDerWaalsContact O-CG2 3.28Å; A198-V202 WeakPolarHBondContact O-CG2 3.31Å; A198-V202 PolarHBondContact O-N 2.84Å; A198-L331 HydrophobicContact CB-CD2 4.2Å; A198-F333 HydrophobicContact CB-CE2 3.82Å; A198-F333 HydrophobicContact CB-CZ 3.42Å; A198-F333 VanDerWaalsContact CB-CZ 3.42Å
199	M	97.9	Very high	94.1	Very high	0 Å²	0	41.4 Å²	41.4	0%	0	21%	0.213	C	C	.	.	H	α-helix	trans	-64.8	-40	175.7	-66.2	-49.3	94.4	0	0	111.9	I195 V196 L197 Q201 V202 F203 V280 V283 F312 M314 L331 F333	I195-M199 VanDerWaalsContact O-CG 3.29Å; I195-M199 WeakPolarHBondContact O-CG 3.39Å; I195-M199 PolarHBondContact O-N 2.65Å; V196-M199 WeakPolarHBondContact O-CB 3.39Å; V196-M199 PolarHBondContact O-N 2.92Å; V196-M199 VanDerWaalsContact O-N 3.13Å; L197-M199 VanDerWaalsContact C-N 3.31Å; L197-M199 PolarHBondContact O-N 2.97Å; M199-Q201 VanDerWaalsContact C-N 3.31Å; M199-Q201 PolarHBondContact O-N 3.41Å; M199-V202 HydrophobicContact CE-CG2 4.35Å; M199-V202 PolarHBondContact O-N 2.85Å; M199-F203 HydrophobicContact CB-CD2 4.2Å; M199-F203 HydrophobicContact CB-CE2 4.2Å; M199-F203 WeakPolarHBondContact O-CD2 3.26Å; M199-F203 PolarHBondContact O-N 2.87Å; M199-V280 HydrophobicContact CB-CG1 4.38Å; M199-V280 HydrophobicContact CB-CG2 4.18Å; M199-V283 HydrophobicContact CG-CB 4.15Å; M199-V283 HydrophobicContact CG-CG1 3.8Å; M199-V283 HydrophobicContact CG-CG2 4.05Å; M199-V283 HydrophobicContact SD-CG2 4.33Å; M199-F312 HydrophobicContact CE-CE1 4.25Å; M199-F312 HydrophobicContact SD-CE1 4.21Å; M199-F312 HydrophobicContact SD-CZ 4.33Å; M199-M314 HydrophobicContact CE-CB 4.11Å; M199-M314 HydrophobicContact CE-CG 4.2Å; M199-M314 HydrophobicContact SD-CB 4.25Å; M199-M314 HydrophobicContact SD-CE 3.26Å; M199-M314 WeakPolarHBondContact SD-CE 3.28Å; M199-M314 HydrophobicContact SD-CG 4.01Å; M199-M314 HydrophobicContact SD-SD 4.48Å; M199-L331 HydrophobicContact CE-CD2 3.96Å; M199-F333 HydrophobicContact CE-CE2 4.29Å
200	H	96.9	Very high	94.7	Very high	99 Å²	99	39.4 Å²	39.4	46%	0.458	20%	0.199	S	C	.	.	H	α-helix	trans	-54.6	-47.9	173.1	-79.5	-72.5	0	0	0	111.6	V196 L197 Q204 V280	V196-H200 PolarHBondContact O-CD2 3.41Å; V196-H200 VanDerWaalsContact O-CD2 3.24Å; V196-H200 PolarHBondContact O-N 2.73Å; L197-H200 WeakPolarHBondContact O-CB 3.42Å; L197-H200 PolarHBondContact O-N 3.3Å; H200-Q204 WeakPolarHBondContact O-CB 3.33Å; H200-Q204 PolarHBondContact O-N 2.78Å; H200-V280 HydrophobicContact CB-CG2 4.47Å
201	Q	97.3	Very high	94.7	Very high	17 Å²	17	39.9 Å²	39.9	8%	0.079	20%	0.197	C	C	.	.	H	α-helix	trans	-63.2	-47.4	175.9	-177.2	-170.3	-7.4	0	0	111.9	F150 E154 V157 L197 A198 M199 F203 Q204 C205	F150-Q201 HydrophobicContact CE1-CB 4.47Å; F150-Q201 HydrophobicContact CZ-CB 3.96Å; F150-Q201 VanDerWaalsContact CZ-OE1 3.28Å; E154-Q201 VanDerWaalsContact CG-CD 3.46Å; E154-Q201 HydrophobicContact CG-CG 4.48Å; E154-Q201 PolarHBondContact O-NE2 3.39Å; E154-Q201 PolarHBondContact O-OE1 3.48Å; V157-Q201 VanDerWaalsContact CB-OE1 3.31Å; V157-Q201 HydrophobicContact CG1-CB 4.43Å; V157-Q201 HydrophobicContact CG1-CG 4.42Å; V157-Q201 VanDerWaalsContact CG1-OE1 3.31Å; L197-Q201 PolarHBondContact O-N 2.86Å; A198-Q201 PolarHBondContact O-N 3.27Å; M199-Q201 VanDerWaalsContact C-N 3.31Å; M199-Q201 PolarHBondContact O-N 3.41Å; Q201-F203 PolarHBondContact O-N 2.84Å; Q201-Q204 PolarHBondContact O-N 2.67Å; Q201-C205 WeakPolarHBondContact O-CB 3.16Å; Q201-C205 PolarHBondContact O-N 2.72Å; Q201-C205 PolarHBondContact O-SG 3.02Å; Q201-C205 VanDerWaalsContact O-SG 3.38Å
202	V	97	Very high	94.5	Very high	0 Å²	0	40 Å²	40	0%	0	20%	0.196	C	C	.	.	H	α-helix	trans	-57.8	-49.4	-178.5	163.7	0	0	0	0	111.4	V157 L161 A198 M199 S206 M218 V316 L331	V157-V202 HydrophobicContact CG1-CG2 3.79Å; L161-V202 HydrophobicContact CD2-CB 4.45Å; L161-V202 HydrophobicContact CD2-CG1 4.03Å; L161-V202 HydrophobicContact CD2-CG2 4.43Å; L161-V202 HydrophobicContact CG-CG2 4.45Å; A198-V202 WeakPolarHBondContact O-CB 3.28Å; A198-V202 VanDerWaalsContact O-CG2 3.28Å; A198-V202 WeakPolarHBondContact O-CG2 3.31Å; A198-V202 PolarHBondContact O-N 2.84Å; M199-V202 HydrophobicContact CE-CG2 4.35Å; M199-V202 PolarHBondContact O-N 2.85Å; V202-S206 VanDerWaalsContact O-CB 3.24Å; V202-S206 WeakPolarHBondContact O-CB 3.47Å; V202-S206 PolarHBondContact O-N 2.86Å; V202-M218 HydrophobicContact CG1-CE 3.47Å; V202-M218 VanDerWaalsContact CG1-CE 3.47Å; V202-M218 HydrophobicContact CG1-SD 3.64Å; V202-V316 HydrophobicContact CG1-CG2 4.21Å; V202-L331 HydrophobicContact CG2-CD2 4.41Å
203	F	97.1	Very high	94.3	Very high	18 Å²	18	39 Å²	39	8%	0.079	19%	0.19	C	C	.	.	H	α-helix	trans	-69.2	-37.2	178.2	-74.3	-69.9	0	0	0	112.5	M199 Q201 S206 K207 M218 V277 D278 N279 V280 V283	M199-F203 HydrophobicContact CB-CD2 4.2Å; M199-F203 HydrophobicContact CB-CE2 4.2Å; M199-F203 WeakPolarHBondContact O-CD2 3.26Å; M199-F203 PolarHBondContact O-N 2.87Å; Q201-F203 PolarHBondContact O-N 2.84Å; F203-S206 PolarHBondContact O-N 2.7Å; F203-K207 WeakPolarHBondContact O-CG 3.13Å; F203-K207 PolarHBondContact O-N 2.8Å; F203-M218 HydrophobicContact CD1-CE 4.23Å; F203-M218 HydrophobicContact CD1-SD 3.52Å; F203-M218 VanDerWaalsContact CD1-SD 3.52Å; F203-M218 HydrophobicContact CE1-SD 3.26Å; F203-M218 WeakPolarHBondContact CE1-SD 3.44Å; F203-M218 HydrophobicContact CG-SD 4.26Å; F203-M218 HydrophobicContact CZ-SD 3.83Å; F203-V277 HydrophobicContact CZ-CB 4.29Å; F203-V277 HydrophobicContact CZ-CG2 3.83Å; F203-D278 WeakPolarHBondContact CE1-O 3.5Å; F203-N279 WeakPolarHBondContact CE2-O 3.29Å; F203-N279 VanDerWaalsContact CZ-C 3.49Å; F203-N279 WeakPolarHBondContact CZ-O 3.37Å; F203-V280 HydrophobicContact CB-CG2 4.47Å; F203-V280 HydrophobicContact CD2-CB 4.46Å; F203-V280 HydrophobicContact CD2-CG2 3.55Å; F203-V280 HydrophobicContact CE2-CG2 4.22Å; F203-V280 HydrophobicContact CG-CG2 4.37Å; F203-V283 HydrophobicContact CE2-CG2 4.02Å; F203-V283 HydrophobicContact CZ-CG2 4.35Å
204	Q	95.9	Very high	94.1	Very high	100 Å²	100	39.8 Å²	39.8	47%	0.467	19%	0.193	S	C	.	.	H	α-helix	trans	-66.2	-48	177.6	-175.3	59.3	40.7	0	0	111.8	H200 Q201 S206 K207 N208	H200-Q204 WeakPolarHBondContact O-CB 3.33Å; H200-Q204 PolarHBondContact O-N 2.78Å; Q201-Q204 PolarHBondContact O-N 2.67Å; Q204-S206 VanDerWaalsContact C-N 3.31Å; Q204-S206 PolarHBondContact O-N 2.84Å; Q204-K207 PolarHBondContact O-N 2.82Å; Q204-N208 PolarHBondContact NE2-OD1 2.85Å; Q204-N208 VanDerWaalsContact NE2-OD1 3.07Å; Q204-N208 PolarHBondContact O-N 3.35Å; Q204-N208 PolarHBondContact O-OD1 2.8Å
205	C	93.4	Very high	93.8	Very high	25 Å²	25	45.7 Å²	45.7	17%	0.169	22%	0.219	C	C	.	.	H	α-helix	trans	-63.3	-38.5	176.6	-70.8	0	0	0	0	111.7	Q158 L161 Q201 K207 N208 L209	Q158-C205 PolarHBondContact OE1-SG 2.83Å; L161-C205 HydrophobicContact CD1-CB 3.28Å; Q201-C205 WeakPolarHBondContact O-CB 3.16Å; Q201-C205 PolarHBondContact O-N 2.72Å; Q201-C205 PolarHBondContact O-SG 3.02Å; Q201-C205 VanDerWaalsContact O-SG 3.38Å; C205-K207 PolarHBondContact O-N 2.89Å; C205-N208 PolarHBondContact O-N 3.05Å; C205-L209 WeakPolarHBondContact O-CB 3.26Å; C205-L209 VanDerWaalsContact O-CG 3.27Å; C205-L209 WeakPolarHBondContact O-CG 3.42Å; C205-L209 PolarHBondContact O-N 2.79Å
206	S	93	Very high	93.6	Very high	6 Å²	6	47.1 Å²	47.1	4%	0.042	23%	0.225	C	C	.	.	H	α-helix	trans	-57.9	-46.3	173.7	170.7	0	0	0	0	112.1	V202 F203 Q204 N208 L209 Q210 H216	V202-S206 VanDerWaalsContact O-CB 3.24Å; V202-S206 WeakPolarHBondContact O-CB 3.47Å; V202-S206 PolarHBondContact O-N 2.86Å; F203-S206 PolarHBondContact O-N 2.7Å; Q204-S206 VanDerWaalsContact C-N 3.31Å; Q204-S206 PolarHBondContact O-N 2.84Å; S206-N208 PolarHBondContact O-N 2.92Å; S206-L209 PolarHBondContact O-N 2.77Å; S206-Q210 WeakPolarHBondContact O-CG 3.38Å; S206-Q210 PolarHBondContact O-N 2.76Å; S206-H216 WeakPolarHBondContact OG-CB 3.4Å; S206-H216 VanDerWaalsContact OG-CG 3.25Å; S206-H216 PolarHBondContact OG-ND1 3.24Å
207	K	93.4	Very high	93.6	Very high	122 Å²	122	49.2 Å²	49.2	53%	0.53	23%	0.234	S	C	.	.	H	α-helix	trans	-59.5	-46.6	175	-72.6	175.3	-178.2	179.2	0	112.1	F203 Q204 C205 L209 Q210	F203-K207 WeakPolarHBondContact O-CG 3.13Å; F203-K207 PolarHBondContact O-N 2.8Å; Q204-K207 PolarHBondContact O-N 2.82Å; C205-K207 PolarHBondContact O-N 2.89Å; K207-L209 VanDerWaalsContact C-N 3.28Å; K207-L209 PolarHBondContact O-N 2.82Å; K207-Q210 WeakPolarHBondContact O-CB 3.49Å; K207-Q210 PolarHBondContact O-N 2.91Å
208	N	91.6	Very high	93.5	Very high	77 Å²	77	48.3 Å²	48.3	41%	0.412	23%	0.229	S	C	.	.	H	α-helix	trans	-62	-38.2	178.1	-62.7	-5.4	0	0	0	111.7	Q204 C205 S206 E211	Q204-N208 PolarHBondContact NE2-OD1 2.85Å; Q204-N208 VanDerWaalsContact NE2-OD1 3.07Å; Q204-N208 PolarHBondContact O-N 3.35Å; Q204-N208 PolarHBondContact O-OD1 2.8Å; C205-N208 PolarHBondContact O-N 3.05Å; S206-N208 PolarHBondContact O-N 2.92Å; N208-E211 PolarHBondContact O-N 3.44Å
209	L	89.7	Confident	93.5	Very high	11 Å²	11	53.7 Å²	53.7	6%	0.058	25%	0.249	C	C	.	.	H	α-helix	trans	-73.9	-25.8	178.2	-72.3	174.2	0	0	0	112.8	E52 C205 S206 K207 E211 L212 G213 W214 H216	E52-L209 HydrophobicContact CG-CD2 4.29Å; C205-L209 WeakPolarHBondContact O-CB 3.26Å; C205-L209 VanDerWaalsContact O-CG 3.27Å; C205-L209 WeakPolarHBondContact O-CG 3.42Å; C205-L209 PolarHBondContact O-N 2.79Å; S206-L209 PolarHBondContact O-N 2.77Å; K207-L209 VanDerWaalsContact C-N 3.28Å; K207-L209 PolarHBondContact O-N 2.82Å; L209-E211 VanDerWaalsContact C-N 3.28Å; L209-E211 PolarHBondContact O-N 2.83Å; L209-L212 HydrophobicContact CD2-CD1 4.08Å; L209-L212 CarbonylContact O-C 3.53Å; L209-L212 WeakPolarHBondContact O-CA 3.27Å; L209-L212 WeakPolarHBondContact O-CB 3.49Å; L209-L212 PolarHBondContact O-N 3.33Å; L209-G213 PolarHBondContact O-N 3.07Å; L209-W214 HydrophobicContact CB-CB 4Å; L209-W214 HydrophobicContact CB-CG 4.29Å; L209-W214 WeakPolarHBondContact O-CB 3.41Å; L209-W214 PolarHBondContact O-N 2.97Å; L209-W214 VanDerWaalsContact O-N 3.08Å; L209-H216 VanDerWaalsContact CB-CE1 3.41Å; L209-H216 WeakPolarHBondContact CB-CE1 3.31Å
210	Q	90.4	Very high	93.5	Very high	106 Å²	106	53.7 Å²	53.7	50%	0.495	25%	0.249	S	C	.	.	H	α-helix	trans	-60.9	-37.4	172.3	-74.8	169.5	3.8	0	0	111.9	S206 K207 L212 G213 W214	S206-Q210 WeakPolarHBondContact O-CG 3.38Å; S206-Q210 PolarHBondContact O-N 2.76Å; K207-Q210 WeakPolarHBondContact O-CB 3.49Å; K207-Q210 PolarHBondContact O-N 2.91Å; Q210-L212 PolarHBondContact O-N 3.2Å; Q210-L212 VanDerWaalsContact O-N 3.16Å; Q210-G213 PolarHBondContact O-N 3.19Å; Q210-W214 VanDerWaalsContact CA-O 3.27Å; Q210-W214 WeakPolarHBondContact CA-O 3.45Å; Q210-W214 VanDerWaalsContact CG-O 3.27Å; Q210-W214 WeakPolarHBondContact CG-O 3.45Å
211	E	86.6	Confident	93.5	Very high	162 Å²	162	49.6 Å²	49.6	76%	0.757	23%	0.232	S	C	*	.	T	Hydrogen-bonded Turn	trans	-61.3	-23.2	173.6	-59.5	-179.1	175.6	0	0	112.5	N208 L209	N208-E211 PolarHBondContact O-N 3.44Å; L209-E211 VanDerWaalsContact C-N 3.28Å; L209-E211 PolarHBondContact O-N 2.83Å
212	L	85.9	Confident	93.5	Very high	25 Å²	25	48.9 Å²	48.9	13%	0.131	23%	0.229	C	C	.	.	T	Hydrogen-bonded Turn	trans	-90.7	1.4	175.9	-52.4	-173.3	0	0	0	113.4	Y45 L48 E52 L209 Q210 H320	Y45-L212 PolarHBondContact OH-O 3.36Å; L48-L212 HydrophobicContact CD1-CD2 4.28Å; L48-L212 HydrophobicContact CD2-CD2 3.15Å; L48-L212 HydrophobicContact CG-CD1 4.46Å; L48-L212 HydrophobicContact CG-CD2 3.49Å; L48-L212 VanDerWaalsContact CG-CD2 3.49Å; E52-L212 HydrophobicContact CB-CD1 4.47Å; E52-L212 HydrophobicContact CG-CD1 4.47Å; L209-L212 HydrophobicContact CD2-CD1 4.08Å; L209-L212 CarbonylContact O-C 3.53Å; L209-L212 WeakPolarHBondContact O-CA 3.27Å; L209-L212 WeakPolarHBondContact O-CB 3.49Å; L209-L212 PolarHBondContact O-N 3.33Å; Q210-L212 PolarHBondContact O-N 3.2Å; Q210-L212 VanDerWaalsContact O-N 3.16Å; L212-H320 PolarHBondContact O-NE2 3.05Å
213	G	89.4	Confident	93.4	Very high	7 Å²	7	49 Å²	49	7%	0.072	23%	0.23	C	C	.	.	T	Hydrogen-bonded Turn	trans	88	19	-178.4	0	0	0	0	0	114.6	L209 Q210 H320 E321	L209-G213 PolarHBondContact O-N 3.07Å; Q210-G213 PolarHBondContact O-N 3.19Å; G213-H320 WeakPolarHBondContact O-CA 3.5Å; G213-E321 WeakPolarHBondContact O-CG 3.48Å; G213-E321 PolarHBondContact O-N 3.13Å
214	W	91.5	Very high	93.3	Very high	17 Å²	17	48.3 Å²	48.3	6%	0.064	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.9	122.6	171.1	-67.1	89.8	0	0	0	111.5	R56 L209 Q210 H216 C318 H320 L325 Y327	R56-W214 VanDerWaalsContact NH1-CH2 3.31Å; L209-W214 HydrophobicContact CB-CB 4Å; L209-W214 HydrophobicContact CB-CG 4.29Å; L209-W214 WeakPolarHBondContact O-CB 3.41Å; L209-W214 PolarHBondContact O-N 2.97Å; L209-W214 VanDerWaalsContact O-N 3.08Å; Q210-W214 VanDerWaalsContact CA-O 3.27Å; Q210-W214 WeakPolarHBondContact CA-O 3.45Å; Q210-W214 VanDerWaalsContact CG-O 3.27Å; Q210-W214 WeakPolarHBondContact CG-O 3.45Å; W214-H216 VanDerWaalsContact CB-CE1 3.44Å; W214-H216 WeakPolarHBondContact CB-CE1 2.86Å; W214-H216 PolarHBondContact O-ND1 3.12Å; W214-C318 HydrophobicContact CE3-CB 4.09Å; W214-C318 HydrophobicContact CZ3-CB 4.48Å; W214-H320 AromaticContact CD1-CD2 3.94Å; W214-H320 HydrophobicContact CD2-CB 3.85Å; W214-H320 AromaticContact CD2-CD2 3.99Å; W214-H320 AromaticContact CE2-CD2 3.57Å; W214-H320 HydrophobicContact CE3-CB 3.7Å; W214-H320 HydrophobicContact CH2-CB 3.57Å; W214-H320 HydrophobicContact CZ2-CB 3.83Å; W214-H320 AromaticContact CZ2-CD2 3.87Å; W214-H320 HydrophobicContact CZ3-CB 3.57Å; W214-H320 AromaticContact NE1-CD2 3.61Å; W214-L325 HydrophobicContact CH2-CB 3.99Å; W214-L325 WeakPolarHBondContact CZ3-O 3.37Å; W214-Y327 AromaticContact CH2-CD2 3.86Å; W214-Y327 HydrophobicContact CH2-CD2 3.86Å; W214-Y327 AromaticContact CH2-CE2 3.31Å; W214-Y327 HydrophobicContact CH2-CE2 3.31Å; W214-Y327 HydrophobicContact CZ2-CE2 4.27Å; W214-Y327 AromaticContact CZ3-CD2 3.66Å; W214-Y327 HydrophobicContact CZ3-CD2 3.66Å; W214-Y327 AromaticContact CZ3-CE2 3.63Å; W214-Y327 HydrophobicContact CZ3-CE2 3.63Å
215	K	92.9	Very high	93.1	Very high	125 Å²	125	43.6 Å²	43.6	54%	0.543	21%	0.205	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.4	140	166	-75.8	176.9	160.3	129.7	0	109.9	C318 E319 E321	K215-C318 CarbonylContact O-C 3.55Å; K215-C318 WeakPolarHBondContact O-CA 3.45Å; K215-E319 PolarHBondContact N-O 2.9Å; K215-E319 PolarHBondContact O-N 2.99Å; K215-E321 HydrophobicContact CD-CG 3.94Å; K215-E321 WeakPolarHBondContact CD-OE1 3.4Å; K215-E321 WeakPolarHBondContact CE-OE1 3.47Å; K215-E321 HydrophobicContact CG-CG 4.01Å; K215-E321 IonicContact NZ-OE1 2.68Å; K215-E321 PolarHBondContact NZ-OE1 3.47Å
216	H	93.7	Very high	92.9	Very high	32 Å²	32	44.2 Å²	44.2	15%	0.148	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	136.1	178.5	-59.1	78.9	0	0	0	109.7	S206 L209 W214 M218 K317 C318	S206-H216 WeakPolarHBondContact OG-CB 3.4Å; S206-H216 VanDerWaalsContact OG-CG 3.25Å; S206-H216 PolarHBondContact OG-ND1 3.24Å; L209-H216 VanDerWaalsContact CB-CE1 3.41Å; L209-H216 WeakPolarHBondContact CB-CE1 3.31Å; W214-H216 VanDerWaalsContact CB-CE1 3.44Å; W214-H216 WeakPolarHBondContact CB-CE1 2.86Å; W214-H216 PolarHBondContact O-ND1 3.12Å; H216-M218 HydrophobicContact CB-CE 4.24Å; H216-K317 CarbonylContact C-O 3.49Å; H216-K317 VanDerWaalsContact CA-O 3.28Å; H216-K317 WeakPolarHBondContact CA-O 3.42Å; H216-C318 PolarHBondContact CD2-SG 3.34Å
217	E	95.8	Very high	92.5	Very high	59 Å²	59	47.3 Å²	47.3	28%	0.276	22%	0.22	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	121.4	168.3	-172.3	-175.9	165.4	0	0	108.5	R219 K317	E217-R219 IonicContact OE1-CZ 2.69Å; E217-R219 IonicContact OE1-NE 3.1Å; E217-R219 PolarHBondContact OE1-NE 2.91Å; E217-R219 IonicContact OE1-NH2 3.29Å; E217-R219 PolarHBondContact OE1-NH2 2.89Å; E217-R219 IonicContact OE2-NH2 3.36Å; E217-K317 HydrophobicContact CB-CB 4.39Å; E217-K317 PolarHBondContact N-O 3.47Å; E217-K317 PolarHBondContact O-N 2.94Å
218	M	97	Very high	92.1	Very high	6 Å²	6	43.3 Å²	43.3	3%	0.03	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	128.6	-176.5	-65.1	179.2	-173.6	0	0	110.2	V202 F203 H216 K276 V277 M314 R315 V316	V202-M218 HydrophobicContact CG1-CE 3.47Å; V202-M218 VanDerWaalsContact CG1-CE 3.47Å; V202-M218 HydrophobicContact CG1-SD 3.64Å; F203-M218 HydrophobicContact CD1-CE 4.23Å; F203-M218 HydrophobicContact CD1-SD 3.52Å; F203-M218 VanDerWaalsContact CD1-SD 3.52Å; F203-M218 HydrophobicContact CE1-SD 3.26Å; F203-M218 WeakPolarHBondContact CE1-SD 3.44Å; F203-M218 HydrophobicContact CG-SD 4.26Å; F203-M218 HydrophobicContact CZ-SD 3.83Å; H216-M218 HydrophobicContact CB-CE 4.24Å; M218-K276 WeakPolarHBondContact O-CA 3.42Å; M218-V277 HydrophobicContact CB-CG2 4.12Å; M218-V277 PolarHBondContact O-N 2.69Å; M218-M314 HydrophobicContact CB-SD 3.91Å; M218-R315 WeakPolarHBondContact CA-O 3.35Å; M218-V316 HydrophobicContact CE-CG1 4.22Å; M218-V316 HydrophobicContact CG-CG1 4.15Å; M218-V316 HydrophobicContact CG-CG2 4.31Å
219	R	97.6	Very high	92	Very high	113 Å²	113	41.7 Å²	41.7	43%	0.426	20%	0.196	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.5	121.6	-178	-69.2	-175.3	-177.6	-175.8	2.1	110.1	E217 I274 V275 R315	E217-R219 IonicContact OE1-CZ 2.69Å; E217-R219 IonicContact OE1-NE 3.1Å; E217-R219 PolarHBondContact OE1-NE 2.91Å; E217-R219 IonicContact OE1-NH2 3.29Å; E217-R219 PolarHBondContact OE1-NH2 2.89Å; E217-R219 IonicContact OE2-NH2 3.36Å; R219-I274 HydrophobicContact CB-CG2 3.66Å; R219-I274 HydrophobicContact CG-CG2 4.21Å; R219-V275 CarbonylContact C-O 3.51Å; R219-V275 WeakPolarHBondContact CA-O 3.48Å; R219-R315 HydrophobicContact CB-CB 4.44Å; R219-R315 PolarHBondContact N-O 3.02Å; R219-R315 PolarHBondContact O-N 3.17Å
220	A	97.9	Very high	92.1	Very high	0 Å²	0	41.3 Å²	41.3	0%	0	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	146.6	179.9	0	0	0	0	0	111.8	V275 V277 L286 F312 S313 M314	A220-V275 PolarHBondContact N-O 3.4Å; A220-V275 PolarHBondContact O-N 2.91Å; A220-V277 HydrophobicContact CB-CG1 4.24Å; A220-V277 HydrophobicContact CB-CG2 4.33Å; A220-L286 HydrophobicContact CB-CD1 3.77Å; A220-F312 HydrophobicContact CB-CE2 4.11Å; A220-F312 HydrophobicContact CB-CZ 4.16Å; A220-S313 CarbonylContact C-O 3.56Å; A220-S313 VanDerWaalsContact CA-O 3.27Å; A220-S313 WeakPolarHBondContact CA-O 3.36Å; A220-M314 HydrophobicContact CB-CE 4Å; A220-M314 HydrophobicContact CB-SD 4.5Å
221	S	97	Very high	92.1	Very high	14 Å²	14	37.8 Å²	37.8	10%	0.098	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.2	151	165.4	62.2	0	0	0	0	109.9	S313	S221-S313 PolarHBondContact N-O 3.28Å; S221-S313 PolarHBondContact O-N 2.89Å
222	F	96.9	Very high	92.5	Very high	2 Å²	2	30.8 Å²	30.8	1%	0.009	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.3	120.5	176.1	-154.3	166.7	0	0	0	109.4	L233 L234 I287 A290 V311 F312	F222-L233 HydrophobicContact CB-CB 4.33Å; F222-L233 HydrophobicContact CD2-CD1 3.74Å; F222-L233 HydrophobicContact CE2-CD1 4.03Å; F222-L233 HydrophobicContact CG-CB 4.46Å; F222-L233 HydrophobicContact CG-CD1 4.11Å; F222-L233 WeakPolarHBondContact O-CB 3.32Å; F222-L233 PolarHBondContact O-N 3Å; F222-L234 HydrophobicContact CB-CD1 4.03Å; F222-L234 HydrophobicContact CB-CD2 3.82Å; F222-L234 HydrophobicContact CB-CG 3.78Å; F222-I287 HydrophobicContact CE1-CG1 4.42Å; F222-A290 HydrophobicContact CD1-CB 3.28Å; F222-A290 HydrophobicContact CE1-CB 3.52Å; F222-A290 HydrophobicContact CG-CB 3.99Å; F222-A290 HydrophobicContact CZ-CB 4.4Å; F222-V311 WeakPolarHBondContact CA-O 3.42Å; F222-V311 VanDerWaalsContact CD2-O 3.28Å; F222-V311 WeakPolarHBondContact CD2-O 3.35Å; F222-F312 HydrophobicContact CB-CD2 4.4Å; F222-F312 HydrophobicContact CD1-CD2 4.11Å; F222-F312 HydrophobicContact CD2-CB 4.05Å; F222-F312 HydrophobicContact CE2-CB 3.98Å; F222-F312 HydrophobicContact CG-CB 4.35Å; F222-F312 HydrophobicContact CG-CD2 4.2Å; F222-F312 HydrophobicContact CZ-CB 4.26Å
223	L	95.3	Very high	92.9	Very high	3 Å²	3	29.9 Å²	29.9	2%	0.016	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	162	178.1	66.3	81.6	0	0	0	112	I225 I230 N231 L272 V311 L389	L223-I225 HydrophobicContact CD1-CD1 4.44Å; L223-I225 HydrophobicContact CD1-CG1 3.81Å; L223-I230 HydrophobicContact CB-CG2 4.26Å; L223-I230 HydrophobicContact CD1-CG2 4.36Å; L223-I230 HydrophobicContact CD2-CG2 4.14Å; L223-I230 HydrophobicContact CG-CG2 4.5Å; L223-N231 CarbonylContact C-O 3.53Å; L223-N231 VanDerWaalsContact CA-O 3.29Å; L223-N231 WeakPolarHBondContact CA-O 3.38Å; L223-N231 WeakPolarHBondContact CB-O 3.47Å; L223-L272 HydrophobicContact CB-CD1 3.97Å; L223-L272 HydrophobicContact CD2-CD1 4.35Å; L223-L272 HydrophobicContact CD2-CD2 3.84Å; L223-V311 HydrophobicContact CD1-CB 3.74Å; L223-V311 HydrophobicContact CD1-CG2 3.9Å; L223-V311 HydrophobicContact CG-CB 4Å; L223-V311 PolarHBondContact N-O 3.02Å; L223-V311 PolarHBondContact O-N 3.39Å; L223-L389 HydrophobicContact CD1-CD2 3.87Å; L223-L389 HydrophobicContact CD2-CD2 4.01Å; L223-L389 HydrophobicContact CG-CD2 4.5Å
224	E	94	Very high	93.1	Very high	2 Å²	2	29.7 Å²	29.7	1%	0.009	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	133.7	170.9	-178.8	-173.4	-130.5	0	0	109.4	N231 L233 R304 S308 H309	E224-N231 HydrophobicContact CB-CB 4.42Å; E224-N231 PolarHBondContact N-O 2.95Å; E224-N231 PolarHBondContact O-N 3.02Å; E224-L233 HydrophobicContact CB-CD1 3.95Å; E224-L233 HydrophobicContact CB-CD2 3.85Å; E224-L233 HydrophobicContact CB-CG 3.95Å; E224-R304 IonicContact OE1-NE 3.04Å; E224-R304 PolarHBondContact OE1-NE 3.08Å; E224-R304 IonicContact OE2-CZ 3.72Å; E224-R304 VanDerWaalsContact OE2-CZ 3.29Å; E224-R304 IonicContact OE2-NE 3.4Å; E224-R304 PolarHBondContact OE2-NE 3.07Å; E224-R304 VanDerWaalsContact OE2-NE 3.1Å; E224-R304 IonicContact OE2-NH2 2.64Å; E224-R304 PolarHBondContact OE2-NH2 3.5Å; E224-S308 WeakPolarHBondContact OE1-CB 3.27Å; E224-S308 PolarHBondContact OE1-OG 3.24Å; E224-H309 CarbonylContact C-O 3.59Å; E224-H309 VanDerWaalsContact CA-O 3.25Å; E224-H309 WeakPolarHBondContact CA-O 3.35Å
225	I	92.3	Very high	93	Very high	2 Å²	2	29.7 Å²	29.7	1%	0.01	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	110.9	166.6	-52.7	179.9	0	0	0	107.5	L223 T229 I230 S308 H309 R385 L386 L389	L223-I225 HydrophobicContact CD1-CD1 4.44Å; L223-I225 HydrophobicContact CD1-CG1 3.81Å; I225-T229 WeakPolarHBondContact CA-O 3.35Å; I225-I230 HydrophobicContact CG1-CG1 4.37Å; I225-S308 WeakPolarHBondContact O-CA 3.41Å; I225-H309 HydrophobicContact CB-CB 4.27Å; I225-H309 PolarHBondContact N-O 3.45Å; I225-H309 PolarHBondContact O-N 2.89Å; I225-R385 HydrophobicContact CG2-CB 4.23Å; I225-L386 HydrophobicContact CD1-CB 4.18Å; I225-L386 HydrophobicContact CD1-CD1 4.17Å; I225-L389 HydrophobicContact CD1-CD2 3.92Å
226	Y	88.5	Confident	92.4	Very high	38 Å²	38	30.1 Å²	30.1	15%	0.149	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	129	175.1	176.6	-106	0	0	0	108.6	E228 T229 R304 R307 E354	Y226-E228 VanDerWaalsContact C-N 3.34Å; Y226-E228 PolarHBondContact O-N 3.43Å; Y226-T229 PolarHBondContact N-O 2.82Å; Y226-T229 WeakPolarHBondContact O-CB 3.28Å; Y226-T229 PolarHBondContact O-N 3.2Å; Y226-R304 HydrophobicContact CD2-CG 4.15Å; Y226-R304 HydrophobicContact CE2-CG 4.2Å; Y226-R307 HydrophobicContact CE2-CB 4.25Å; Y226-E354 HydrophobicContact CE2-CG 4.27Å; Y226-E354 PolarHBondContact OH-OE1 3.01Å; Y226-E354 VanDerWaalsContact OH-OE1 3.06Å
227	N	84.6	Confident	91	Very high	71 Å²	71	35.1 Å²	35.1	38%	0.38	17%	0.171	S	C	.	.	T	Hydrogen-bonded Turn	trans	51.8	48.7	179.8	-164.2	37.9	0	0	0	113.4	T229 F357	N227-T229 PolarHBondContact O-N 2.64Å; N227-T229 PolarHBondContact O-OG1 3.43Å; N227-F357 WeakPolarHBondContact OD1-CD2 3.38Å; N227-F357 WeakPolarHBondContact OD1-CG 3.09Å
228	E	86.4	Confident	89	Confident	37 Å²	37	35.6 Å²	35.6	17%	0.173	18%	0.181	C	C	.	.	T	Hydrogen-bonded Turn	trans	54.6	18	-176.4	-65.7	-67.7	128.8	0	0	115	Y226 F357 S384 R385	Y226-E228 VanDerWaalsContact C-N 3.34Å; Y226-E228 PolarHBondContact O-N 3.43Å; E228-F357 HydrophobicContact CG-CD1 3.71Å; E228-F357 HydrophobicContact CG-CE1 4.29Å; E228-F357 HydrophobicContact CG-CG 4.4Å; E228-S384 WeakPolarHBondContact OE2-CA 3.42Å; E228-R385 HydrophobicContact CB-CG 4.4Å; E228-R385 VanDerWaalsContact O-CG 3.25Å; E228-R385 WeakPolarHBondContact O-CG 3.4Å; E228-R385 WeakPolarHBondContact OE2-CG 3.25Å; E228-R385 PolarHBondContact OE2-N 3.43Å
229	T	88.6	Confident	86.9	Confident	43 Å²	43	39.5 Å²	39.5	26%	0.264	21%	0.208	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	136	176	-55.4	0	0	0	0	109.6	I225 Y226 N227	I225-T229 WeakPolarHBondContact CA-O 3.35Å; Y226-T229 PolarHBondContact N-O 2.82Å; Y226-T229 WeakPolarHBondContact O-CB 3.28Å; Y226-T229 PolarHBondContact O-N 3.2Å; N227-T229 PolarHBondContact O-N 2.64Å; N227-T229 PolarHBondContact O-OG1 3.43Å
230	I	91.5	Very high	84.4	Confident	4 Å²	4	43 Å²	43	2%	0.021	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.6	122.8	176.9	-60.6	174	0	0	0	108.7	L223 I225 L246 I248 V269	L223-I230 HydrophobicContact CB-CG2 4.26Å; L223-I230 HydrophobicContact CD1-CG2 4.36Å; L223-I230 HydrophobicContact CD2-CG2 4.14Å; L223-I230 HydrophobicContact CG-CG2 4.5Å; I225-I230 HydrophobicContact CG1-CG1 4.37Å; I230-L246 HydrophobicContact CB-CB 3.95Å; I230-L246 HydrophobicContact CG2-CB 3.94Å; I230-L246 HydrophobicContact CG2-CD1 4.03Å; I230-I248 HydrophobicContact CD1-CD1 3.86Å; I230-I248 HydrophobicContact CD1-CG1 3.4Å; I230-I248 VanDerWaalsContact CD1-CG1 3.4Å; I230-V269 HydrophobicContact CD1-CG1 4.44Å; I230-V269 HydrophobicContact CD1-CG2 4.38Å; I230-V269 HydrophobicContact CG2-CG1 4.28Å
231	N	91.8	Very high	82.1	Confident	32 Å²	32	49.6 Å²	49.6	17%	0.171	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113	130.7	175.8	-57.5	-66.5	0	0	0	109.3	L223 E224 R304	L223-N231 CarbonylContact C-O 3.53Å; L223-N231 VanDerWaalsContact CA-O 3.29Å; L223-N231 WeakPolarHBondContact CA-O 3.38Å; L223-N231 WeakPolarHBondContact CB-O 3.47Å; E224-N231 HydrophobicContact CB-CB 4.42Å; E224-N231 PolarHBondContact N-O 2.95Å; E224-N231 PolarHBondContact O-N 3.02Å; N231-R304 PolarHBondContact ND2-NH2 3.14Å
232	D	93.4	Very high	79.8	Confident	15 Å²	15	51.2 Å²	51.2	8%	0.08	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.9	123.5	171.5	-171.3	-19.8	0	0	0	109.9	L234 S235 L246 L272 T273	D232-L234 WeakPolarHBondContact OD1-CA 3.41Å; D232-L234 PolarHBondContact OD1-N 2.84Å; D232-S235 PolarHBondContact O-OG 2.98Å; D232-S235 PolarHBondContact OD1-N 2.93Å; D232-S235 VanDerWaalsContact OD1-N 3.15Å; D232-L246 HydrophobicContact CB-CD1 3.98Å; D232-L272 HydrophobicContact CB-CD1 4.05Å; D232-T273 WeakPolarHBondContact OD2-CA 3.3Å; D232-T273 WeakPolarHBondContact OD2-CB 3.29Å; D232-T273 PolarHBondContact OD2-N 3.46Å; D232-T273 PolarHBondContact OD2-OG1 3.4Å
233	L	93.8	Very high	77.8	Confident	6 Å²	6	54 Å²	54	3%	0.031	30%	0.296	C	S	.	.	S	Bend	trans	-90.8	-6.2	179.1	-63.2	175.1	0	0	0	112.9	F222 E224 A290 H293 R294	F222-L233 HydrophobicContact CB-CB 4.33Å; F222-L233 HydrophobicContact CD2-CD1 3.74Å; F222-L233 HydrophobicContact CE2-CD1 4.03Å; F222-L233 HydrophobicContact CG-CB 4.46Å; F222-L233 HydrophobicContact CG-CD1 4.11Å; F222-L233 WeakPolarHBondContact O-CB 3.32Å; F222-L233 PolarHBondContact O-N 3Å; E224-L233 HydrophobicContact CB-CD1 3.95Å; E224-L233 HydrophobicContact CB-CD2 3.85Å; E224-L233 HydrophobicContact CB-CG 3.95Å; L233-A290 HydrophobicContact CB-CB 3.74Å; L233-A290 HydrophobicContact CD1-CB 4.06Å; L233-A290 HydrophobicContact CG-CB 4.5Å; L233-H293 HydrophobicContact CD2-CB 4.48Å; L233-H293 PolarHBondContact O-ND1 3.19Å; L233-R294 HydrophobicContact CD2-CG 3.98Å
234	L	94.2	Very high	75.9	Confident	2 Å²	2	57.8 Å²	57.8	1%	0.01	32%	0.321	C	S	.	.	S	Bend	trans	-107.7	-11.1	-179.5	-55.2	-175.4	0	0	0	113.1	F222 D232 T273 V275 L286 K289	F222-L234 HydrophobicContact CB-CD1 4.03Å; F222-L234 HydrophobicContact CB-CD2 3.82Å; F222-L234 HydrophobicContact CB-CG 3.78Å; D232-L234 WeakPolarHBondContact OD1-CA 3.41Å; D232-L234 PolarHBondContact OD1-N 2.84Å; L234-T273 HydrophobicContact CB-CG2 4.18Å; L234-V275 HydrophobicContact CD1-CG2 4.09Å; L234-L286 HydrophobicContact CD1-CD1 4.3Å; L234-L286 HydrophobicContact CD1-CD2 4.23Å; L234-L286 HydrophobicContact CD2-CB 3.97Å; L234-L286 HydrophobicContact CD2-CD2 4.03Å; L234-K289 VanDerWaalsContact O-CE 3.27Å; L234-K289 WeakPolarHBondContact O-CE 3.45Å; L234-K289 PolarHBondContact O-NZ 2.98Å
235	S	88.9	Confident	74.7	Confident	17 Å²	17	64.8 Å²	64.8	12%	0.119	35%	0.353	C	S	.	.			trans	-67	132.4	179.1	66.7	0	0	0	0	112.4	D232 K237 H293	D232-S235 PolarHBondContact O-OG 2.98Å; D232-S235 PolarHBondContact OD1-N 2.93Å; D232-S235 VanDerWaalsContact OD1-N 3.15Å; S235-K237 VanDerWaalsContact C-N 3.26Å; S235-H293 PolarHBondContact O-CE1 3.3Å
236	D	80.7	Confident	74.3	Confident	135 Å²	135	65.5 Å²	65.5	72%	0.722	36%	0.357	S	S	*	.			trans	-81	-6.6	171.2	-66.7	-52.5	0	0	0	113.4	S238 K289	D236-S238 PolarHBondContact O-N 3.48Å; D236-K289 WeakPolarHBondContact OD1-CE 3.2Å; D236-K289 IonicContact OD1-NZ 2.86Å; D236-K289 PolarHBondContact OD1-NZ 2.98Å; D236-K289 IonicContact OD2-NZ 2.72Å; D236-K289 PolarHBondContact OD2-NZ 3.35Å
237	K	65.3	Low	74.1	Confident	136 Å²	136	68.7 Å²	68.7	59%	0.591	37%	0.373	S	S	*	.			trans	-63.3	106.2	179.7	-66.6	-175	-179.1	-179.9	0	108.5	S235 S239	S235-K237 VanDerWaalsContact C-N 3.26Å; K237-S239 PolarHBondContact O-N 3.46Å
238	S	53.5	Low	74.1	Confident	70 Å²	70	65.8 Å²	65.8	49%	0.49	36%	0.357	S	S	.	.			trans	-55.4	138.3	170.2	74.3	0	0	0	0	107.9	D236 K240 D241	D236-S238 PolarHBondContact O-N 3.48Å; S238-K240 PolarHBondContact O-N 3.29Å; S238-D241 PolarHBondContact O-N 2.89Å
239	S	52.2	Low	74	Confident	87 Å²	87	69.4 Å²	69.4	61%	0.608	37%	0.373	S	S	*	.	G	3₁₀ helix	trans	-53	-0.2	-179.2	50.3	0	0	0	0	115.7	K237	K237-S239 PolarHBondContact O-N 3.46Å
240	K	45	Very low	73.3	Confident	187 Å²	187	69.7 Å²	69.7	81%	0.813	37%	0.372	S	S	*	.	G	3₁₀ helix	trans	-71.5	-30.4	176.5	-69.6	-170.5	175.2	-176.4	0	114	S238 G242	S238-K240 PolarHBondContact O-N 3.29Å; K240-G242 PolarHBondContact O-N 3.26Å
241	D	50.2	Low	72	Confident	138 Å²	138	71 Å²	71	74%	0.738	38%	0.384	S	S	*	.	G	3₁₀ helix	trans	-82.6	6.8	179.7	-77.1	-20	0	0	0	113.5	S238	S238-D241 PolarHBondContact O-N 2.89Å
242	G	49.1	Very low	70	Confident	48 Å²	48	73 Å²	73	50%	0.495	41%	0.405	S	S	.	.			trans	67.2	103.4	-168.2	0	0	0	0	0	108.7	K240 P244	K240-G242 PolarHBondContact O-N 3.26Å; G242-P244 WeakPolarHBondContact O-CD 3.29Å
243	N	54	Low	67.6	Low	62 Å²	62	76.6 Å²	76.6	33%	0.332	42%	0.424	S	S	.	.			trans	-55.4	116.9	170.5	-93.6	-1.7	0	0	0	107	H245	N243-H245 PolarHBondContact O-N 3.16Å; N243-H245 VanDerWaalsContact O-N 3.1Å
244	P	57.1	Low	65	Low	81 Å²	81	85.6 Å²	85.6	53%	0.526	47%	0.466	S	S	.	.			trans	-57.4	126	178.2	22.5	-30.7	0	0	0	106.5	G242 L246	G242-P244 WeakPolarHBondContact O-CD 3.29Å; P244-L246 PolarHBondContact O-N 3.37Å
245	H	68	Low	62.2	Low	150 Å²	150	89.6 Å²	89.6	69%	0.694	49%	0.494	S	S	*	.			trans	-55.8	107.9	176.5	-79.5	-80.4	0	0	0	107.9	N243 E247	N243-H245 PolarHBondContact O-N 3.16Å; N243-H245 VanDerWaalsContact O-N 3.1Å; H245-E247 PolarHBondContact O-N 2.87Å
246	L	83.3	Confident	59.5	Low	16 Å²	16	94.8 Å²	94.8	8%	0.084	53%	0.53	C	S	.	.	B	Isolated β-bridge	trans	-72.4	124.9	-179.8	-68.8	177.3	0	0	0	108.3	I230 D232 P244 V269 P270 L272	I230-L246 HydrophobicContact CB-CB 3.95Å; I230-L246 HydrophobicContact CG2-CB 3.94Å; I230-L246 HydrophobicContact CG2-CD1 4.03Å; D232-L246 HydrophobicContact CB-CD1 3.98Å; P244-L246 PolarHBondContact O-N 3.37Å; L246-V269 HydrophobicContact CB-CG1 3.83Å; L246-V269 HydrophobicContact CD1-CG1 4.33Å; L246-V269 HydrophobicContact CG-CG1 4.46Å; L246-P270 WeakPolarHBondContact CD2-O 3.25Å; L246-L272 HydrophobicContact CD1-CD1 4.16Å
247	E	85	Confident	57.1	Low	105 Å²	105	92.6 Å²	92.6	49%	0.491	53%	0.526	S	S	.	.			trans	-111.3	143	179.4	-65.7	-167.3	149.7	0	0	110.9	H245 P270	H245-E247 PolarHBondContact O-N 2.87Å; E247-P270 WeakPolarHBondContact O-CD 3.44Å
248	I	85.1	Confident	55.5	Low	10 Å²	10	91.5 Å²	91.5	5%	0.051	54%	0.535	C	S	.	.			trans	-77.7	124.4	173.8	-55.2	173.2	0	0	0	108.5	I230 V267 V269 R385 Y388 L389	I230-I248 HydrophobicContact CD1-CD1 3.86Å; I230-I248 HydrophobicContact CD1-CG1 3.4Å; I230-I248 VanDerWaalsContact CD1-CG1 3.4Å; I248-V267 HydrophobicContact CG2-CG1 3.35Å; I248-V269 HydrophobicContact CG1-CG2 4.41Å; I248-R385 HydrophobicContact CD1-CB 4.2Å; I248-R385 VanDerWaalsContact CD1-O 3.28Å; I248-R385 WeakPolarHBondContact CD1-O 3.47Å; I248-Y388 HydrophobicContact CB-CD1 3.74Å; I248-Y388 HydrophobicContact CB-CE1 3.73Å; I248-Y388 HydrophobicContact CB-CG 4.48Å; I248-Y388 HydrophobicContact CD1-CD1 3.77Å; I248-Y388 HydrophobicContact CD1-CG 4.06Å; I248-Y388 HydrophobicContact CG1-CD1 4.34Å; I248-Y388 HydrophobicContact CG2-CD1 3.73Å; I248-Y388 HydrophobicContact CG2-CD2 4.33Å; I248-Y388 HydrophobicContact CG2-CE1 3.65Å; I248-Y388 HydrophobicContact CG2-CE2 4.28Å; I248-Y388 HydrophobicContact CG2-CG 4.07Å; I248-L389 HydrophobicContact CD1-CB 3.96Å
249	K	83.4	Confident	54.6	Low	114 Å²	114	95.8 Å²	95.8	50%	0.496	55%	0.551	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-118.7	145.7	172.5	-61.8	-162.5	-172.5	177.1	0	110.6	T268 P270	K249-T268 PolarHBondContact N-O 3.45Å; K249-T268 PolarHBondContact O-N 2.85Å; K249-T268 VanDerWaalsContact O-O 3.08Å; K249-T268 PolarHBondContact O-OG1 3.27Å; K249-P270 HydrophobicContact CB-CG 4.09Å; K249-P270 HydrophobicContact CD-CG 3.95Å; K249-P270 HydrophobicContact CG-CG 3.99Å
250	L	74.5	Confident	53.7	Low	48 Å²	48	102.5 Å²	102.5	25%	0.251	56%	0.563	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-84	123.2	166.3	-69	175.1	0	0	0	107.5	A252 H265 V267 R382 Y388	L250-A252 PolarHBondContact O-N 3.47Å; L250-H265 HydrophobicContact CB-CB 4.01Å; L250-H265 HydrophobicContact CD1-CB 4.48Å; L250-H265 HydrophobicContact CD2-CB 3.96Å; L250-H265 HydrophobicContact CG-CB 4.36Å; L250-V267 HydrophobicContact CD2-CG2 3.79Å; L250-R382 VanDerWaalsContact CD1-NH2 3.26Å; L250-Y388 HydrophobicContact CD2-CE2 4.15Å; L250-Y388 HydrophobicContact CG-CE2 4.27Å
251	A	62.8	Low	53.3	Low	32 Å²	32	100.8 Å²	100.8	26%	0.264	56%	0.562	S	S	.	*	P	Polyproline II helix	trans	-62.2	119.7	169.4	0	0	0	0	0	108.3	H265 E266 T268	A251-H265 PolarHBondContact O-ND1 3.35Å; A251-E266 HydrophobicContact CB-CB 4.22Å; A251-E266 WeakPolarHBondContact CB-O 3.33Å; A251-E266 PolarHBondContact N-O 2.89Å; A251-T268 HydrophobicContact CB-CG2 4.4Å
252	A	51.3	Low	52.7	Low	74 Å²	74	97.9 Å²	97.9	61%	0.612	55%	0.553	S	S	*	*	P	Polyproline II helix	trans	-76.7	119.7	162.5	0	0	0	0	0	106.2	L250 Q254	L250-A252 PolarHBondContact O-N 3.47Å; A252-Q254 PolarHBondContact O-N 3.3Å
253	D	42.9	Very low	52.3	Low	91 Å²	91	104.3 Å²	104.3	49%	0.487	57%	0.567	S	S	.	*			trans	-51	104.4	170.8	-77	-28.1	0	0	0	108.2	S255	D253-S255 PolarHBondContact O-N 3.39Å
254	Q	37.5	Very low	52.2	Low	194 Å²	194	105.6 Å²	105.6	91%	0.907	57%	0.571	S	S	*	*			trans	-74.4	-4.8	168.1	-69.2	-164.5	37.5	0	0	111	A252 S256	A252-Q254 PolarHBondContact O-N 3.3Å; Q254-S256 PolarHBondContact O-N 2.9Å; Q254-S256 VanDerWaalsContact O-N 3.11Å
255	S	36.1	Very low	52.4	Low	87 Å²	87	105.7 Å²	105.7	61%	0.608	57%	0.565	S	S	*	*			trans	-82.9	81.9	168.4	50.9	0	0	0	0	110.4	D253 S257	D253-S255 PolarHBondContact O-N 3.39Å; S255-S257 PolarHBondContact O-N 3.44Å
256	S	31.8	Very low	52.8	Low	125 Å²	125	102.2 Å²	102.2	87%	0.874	55%	0.549	S	S	*	.			trans	-65.3	76.5	157	-55.5	0	0	0	0	109	Q254	Q254-S256 PolarHBondContact O-N 2.9Å; Q254-S256 VanDerWaalsContact O-N 3.11Å
257	S	30.1	Very low	52.7	Low	90 Å²	90	102.4 Å²	102.4	63%	0.629	55%	0.551	S	S	*	*			trans	-149.2	90.6	172.6	-169.1	0	0	0	0	110.9	S255 I259	S255-S257 PolarHBondContact O-N 3.44Å; S257-I259 PolarHBondContact O-N 3.31Å
258	S	32.6	Very low	52.8	Low	112 Å²	112	99.5 Å²	99.5	78%	0.783	54%	0.54	S	S	*	.			trans	21.4	70.7	146	45.4	0	0	0	0	119.3
259	I	33.9	Very low	53	Low	160 Å²	160	99.9 Å²	99.9	82%	0.821	54%	0.543	S	S	*	.			trans	-138.2	101.7	141.9	-59.6	-177.4	0	0	0	107	S257 D261	S257-I259 PolarHBondContact O-N 3.31Å; I259-D261 PolarHBondContact O-N 3.47Å
260	R	34.2	Very low	53.2	Low	229 Å²	229	97.4 Å²	97.4	86%	0.864	54%	0.538	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.3	117	166.1	-62.6	174.8	-138	-160.9	3.2	105.2
261	D	37.3	Very low	53.7	Low	150 Å²	150	98.4 Å²	98.4	80%	0.802	56%	0.56	S	S	*	*	T	Hydrogen-bonded Turn	trans	170.2	3.5	136.3	-78.6	-16.1	0	0	0	114.7	I259	I259-D261 PolarHBondContact O-N 3.47Å
262	S	36.9	Very low	55.1	Low	78 Å²	78	97.9 Å²	97.9	55%	0.545	55%	0.552	S	S	.	*			trans	-152	76.4	167.9	-61.6	0	0	0	0	112.4	Q264	S262-Q264 PolarHBondContact O-N 3.48Å
263	K	40.5	Very low	57.2	Low	183 Å²	183	96.6 Å²	96.6	80%	0.796	54%	0.537	S	S	*	.			trans	-71.3	53.2	169.7	-68.5	-174.5	176.7	-176.1	0	111.8	H265	K263-H265 PolarHBondContact O-N 3.1Å
264	Q	50.8	Low	59.7	Low	89 Å²	89	96.9 Å²	96.9	42%	0.416	54%	0.538	S	S	.	.			trans	-82.1	105.6	173.4	-94.4	-174.8	9.7	0	0	109	S262 E266	S262-Q264 PolarHBondContact O-N 3.48Å; Q264-E266 PolarHBondContact O-N 2.94Å
265	H	63.3	Low	62.5	Low	83 Å²	83	89.8 Å²	89.8	38%	0.384	51%	0.507	S	S	.	.	P	Polyproline II helix	trans	-60	119.8	172	-66.5	-66.2	0	0	0	110.3	L250 A251 K263 V267 N392	L250-H265 HydrophobicContact CB-CB 4.01Å; L250-H265 HydrophobicContact CD1-CB 4.48Å; L250-H265 HydrophobicContact CD2-CB 3.96Å; L250-H265 HydrophobicContact CG-CB 4.36Å; A251-H265 PolarHBondContact O-ND1 3.35Å; K263-H265 PolarHBondContact O-N 3.1Å; H265-V267 PolarHBondContact O-N 2.93Å; H265-N392 PolarHBondContact O-ND2 3.49Å; H265-N392 VanDerWaalsContact O-ND2 3.16Å
266	E	74.9	Confident	65.5	Low	77 Å²	77	90.6 Å²	90.6	36%	0.36	50%	0.5	S	S	.	.	P	Polyproline II helix	trans	-66.8	126.2	175.3	-164.9	-175.7	164.5	0	0	109.9	A251 Q264 T268 R315	A251-E266 HydrophobicContact CB-CB 4.22Å; A251-E266 WeakPolarHBondContact CB-O 3.33Å; A251-E266 PolarHBondContact N-O 2.89Å; Q264-E266 PolarHBondContact O-N 2.94Å; E266-T268 HydrophobicContact CG-CG2 4.32Å; E266-T268 PolarHBondContact O-N 3.22Å; E266-R315 IonicContact OE1-CZ 3.46Å; E266-R315 IonicContact OE1-NH1 2.68Å; E266-R315 PolarHBondContact OE1-NH1 2.64Å; E266-R315 IonicContact OE1-NH2 3.94Å; E266-R315 PolarHBondContact OE1-NH2 3.25Å
267	V	81.9	Confident	68.6	Low	20 Å²	20	84.8 Å²	84.8	12%	0.121	46%	0.459	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.1	120.2	174.3	179.9	0	0	0	0	108.2	I248 L250 H265 L389 Q391 N392	I248-V267 HydrophobicContact CG2-CG1 3.35Å; L250-V267 HydrophobicContact CD2-CG2 3.79Å; H265-V267 PolarHBondContact O-N 2.93Å; V267-L389 HydrophobicContact CG1-CD1 4.46Å; V267-Q391 HydrophobicContact CG2-CB 4.24Å; V267-N392 PolarHBondContact N-ND2 3.46Å
268	T	85.9	Confident	71.8	Confident	43 Å²	43	85 Å²	85	26%	0.264	45%	0.454	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	154.7	179.4	61	0	0	0	0	110.5	K249 A251 E266 P270	K249-T268 PolarHBondContact N-O 3.45Å; K249-T268 PolarHBondContact O-N 2.85Å; K249-T268 VanDerWaalsContact O-O 3.08Å; K249-T268 PolarHBondContact O-OG1 3.27Å; A251-T268 HydrophobicContact CB-CG2 4.4Å; E266-T268 HydrophobicContact CG-CG2 4.32Å; E266-T268 PolarHBondContact O-N 3.22Å; T268-P270 WeakPolarHBondContact O-CD 3.34Å
269	V	90	Very high	74.8	Confident	18 Å²	18	82.3 Å²	82.3	11%	0.109	43%	0.43	C	S	.	.			trans	-117.2	89	173.2	-175.5	0	0	0	0	107.6	I230 L246 I248 G271 L272 L389	I230-V269 HydrophobicContact CD1-CG1 4.44Å; I230-V269 HydrophobicContact CD1-CG2 4.38Å; I230-V269 HydrophobicContact CG2-CG1 4.28Å; L246-V269 HydrophobicContact CB-CG1 3.83Å; L246-V269 HydrophobicContact CD1-CG1 4.33Å; L246-V269 HydrophobicContact CG-CG1 4.46Å; I248-V269 HydrophobicContact CG1-CG2 4.41Å; V269-G271 PolarHBondContact O-N 3.17Å; V269-L272 HydrophobicContact CB-CB 4.12Å; V269-L272 HydrophobicContact CB-CD2 4.34Å; V269-L272 HydrophobicContact CG1-CB 4.11Å; V269-L272 VanDerWaalsContact O-CB 3.24Å; V269-L272 WeakPolarHBondContact O-CB 3.39Å; V269-L272 PolarHBondContact O-N 3.07Å; V269-L272 VanDerWaalsContact O-N 3.16Å; V269-L389 HydrophobicContact CG2-CD1 3.69Å
270	P	87	Confident	77.8	Confident	63 Å²	63	75.4 Å²	75.4	41%	0.409	40%	0.395	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.6	135.1	180	-23.8	34.6	0	0	0	111.2	L246 E247 K249 T268 L272	L246-P270 WeakPolarHBondContact CD2-O 3.25Å; E247-P270 WeakPolarHBondContact O-CD 3.44Å; K249-P270 HydrophobicContact CB-CG 4.09Å; K249-P270 HydrophobicContact CD-CG 3.95Å; K249-P270 HydrophobicContact CG-CG 3.99Å; T268-P270 WeakPolarHBondContact O-CD 3.34Å; P270-L272 VanDerWaalsContact C-N 3.33Å
271	G	86.6	Confident	80.7	Confident	68 Å²	68	70.6 Å²	70.6	70%	0.701	39%	0.387	S	S	*	.	T	Hydrogen-bonded Turn	trans	87.4	-5.3	-178	0	0	0	0	0	114.9	V269	V269-G271 PolarHBondContact O-N 3.17Å
272	L	92.2	Very high	83.6	Confident	21 Å²	21	66.8 Å²	66.8	11%	0.11	36%	0.364	C	S	.	.			trans	-65.7	134.2	169.5	-176.5	66.3	0	0	0	110.2	L223 D232 L246 V269 P270 I274	L223-L272 HydrophobicContact CB-CD1 3.97Å; L223-L272 HydrophobicContact CD2-CD1 4.35Å; L223-L272 HydrophobicContact CD2-CD2 3.84Å; D232-L272 HydrophobicContact CB-CD1 4.05Å; L246-L272 HydrophobicContact CD1-CD1 4.16Å; V269-L272 HydrophobicContact CB-CB 4.12Å; V269-L272 HydrophobicContact CB-CD2 4.34Å; V269-L272 HydrophobicContact CG1-CB 4.11Å; V269-L272 VanDerWaalsContact O-CB 3.24Å; V269-L272 WeakPolarHBondContact O-CB 3.39Å; V269-L272 PolarHBondContact O-N 3.07Å; V269-L272 VanDerWaalsContact O-N 3.16Å; P270-L272 VanDerWaalsContact C-N 3.33Å; L272-I274 PolarHBondContact O-N 2.68Å
273	T	94.5	Very high	86.4	Confident	48 Å²	48	63 Å²	63	29%	0.294	34%	0.338	S	S	.	.			trans	-66.9	118.6	174.9	-56.4	0	0	0	0	109.6	D232 L234 V275	D232-T273 WeakPolarHBondContact OD2-CA 3.3Å; D232-T273 WeakPolarHBondContact OD2-CB 3.29Å; D232-T273 PolarHBondContact OD2-N 3.46Å; D232-T273 PolarHBondContact OD2-OG1 3.4Å; L234-T273 HydrophobicContact CB-CG2 4.18Å; T273-V275 HydrophobicContact CG2-CG2 3.9Å
274	I	95.3	Very high	89	Confident	96 Å²	96	56 Å²	56	49%	0.492	31%	0.312	S	S	.	.			trans	-112.4	120.2	175.2	-60.4	172.4	0	0	0	107.5	R219 L272	R219-I274 HydrophobicContact CB-CG2 3.66Å; R219-I274 HydrophobicContact CG-CG2 4.21Å; L272-I274 PolarHBondContact O-N 2.68Å
275	V	97.5	Very high	91.1	Very high	45 Å²	45	54.6 Å²	54.6	27%	0.273	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	125.3	-175	-175.3	0	0	0	0	109	R219 A220 L234 T273 V277 L286	R219-V275 CarbonylContact C-O 3.51Å; R219-V275 WeakPolarHBondContact CA-O 3.48Å; A220-V275 PolarHBondContact N-O 3.4Å; A220-V275 PolarHBondContact O-N 2.91Å; L234-V275 HydrophobicContact CD1-CG2 4.09Å; T273-V275 HydrophobicContact CG2-CG2 3.9Å; V275-V277 HydrophobicContact CG1-CG1 4.42Å; V275-L286 HydrophobicContact CB-CD1 4.19Å; V275-L286 HydrophobicContact CB-CD2 4.42Å; V275-L286 HydrophobicContact CG1-CD1 4.37Å; V275-L286 HydrophobicContact CG1-CD2 4.28Å; V275-L286 HydrophobicContact CG2-CD2 4.22Å
276	K	97.7	Very high	92.7	Very high	105 Å²	105	51.5 Å²	51.5	46%	0.457	30%	0.301	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.4	133.3	168.1	-176.2	179.8	176.5	-93.2	0	108.6	M218 D278	M218-K276 WeakPolarHBondContact O-CA 3.42Å; K276-D278 IonicContact NZ-OD1 2.75Å; K276-D278 PolarHBondContact NZ-OD1 2.75Å; K276-D278 IonicContact NZ-OD2 3.46Å; K276-D278 PolarHBondContact NZ-OD2 3.46Å
277	V	97.8	Very high	93.7	Very high	2 Å²	2	48 Å²	48	1%	0.012	29%	0.285	C	S	.	.			trans	-126.1	142.2	176.8	-66.3	0	0	0	0	111.1	F203 M218 A220 V275 E282 V283 L286 M314	F203-V277 HydrophobicContact CZ-CB 4.29Å; F203-V277 HydrophobicContact CZ-CG2 3.83Å; M218-V277 HydrophobicContact CB-CG2 4.12Å; M218-V277 PolarHBondContact O-N 2.69Å; A220-V277 HydrophobicContact CB-CG1 4.24Å; A220-V277 HydrophobicContact CB-CG2 4.33Å; V275-V277 HydrophobicContact CG1-CG1 4.42Å; V277-E282 VanDerWaalsContact CA-OE2 3.25Å; V277-E282 WeakPolarHBondContact CA-OE2 3.27Å; V277-E282 HydrophobicContact CB-CB 4.33Å; V277-E282 HydrophobicContact CG1-CB 4.15Å; V277-V283 HydrophobicContact CB-CG2 4.21Å; V277-V283 HydrophobicContact CG1-CG2 4.23Å; V277-V283 HydrophobicContact CG2-CG2 3.97Å; V277-L286 HydrophobicContact CG1-CD1 3.72Å; V277-M314 HydrophobicContact CG2-CE 3.52Å; V277-M314 HydrophobicContact CG2-SD 4.18Å
278	D	96.1	Very high	94.2	Very high	96 Å²	96	50.4 Å²	50.4	51%	0.513	30%	0.297	S	S	.	.			trans	-117.1	-10	-175.4	-69.5	-55	0	0	0	113	F203 K276 E282	F203-D278 WeakPolarHBondContact CE1-O 3.5Å; K276-D278 IonicContact NZ-OD1 2.75Å; K276-D278 PolarHBondContact NZ-OD1 2.75Å; K276-D278 IonicContact NZ-OD2 3.46Å; K276-D278 PolarHBondContact NZ-OD2 3.46Å; D278-E282 PolarHBondContact N-OE2 2.99Å
279	N	96.3	Very high	94.6	Very high	55 Å²	55	50.7 Å²	50.7	29%	0.294	30%	0.295	S	S	.	.	S	Bend	trans	-155.2	172.2	177	57.4	69.5	0	0	0	112.6	F203 D281 E282	F203-N279 WeakPolarHBondContact CE2-O 3.29Å; F203-N279 VanDerWaalsContact CZ-C 3.49Å; F203-N279 WeakPolarHBondContact CZ-O 3.37Å; N279-D281 VanDerWaalsContact C-N 3.35Å; N279-D281 WeakPolarHBondContact OD1-CB 3.25Å; N279-D281 PolarHBondContact OD1-N 2.89Å; N279-D281 VanDerWaalsContact OD1-N 3.12Å; N279-E282 PolarHBondContact ND2-OE1 3.18Å; N279-E282 WeakPolarHBondContact OD1-CG 3.43Å; N279-E282 PolarHBondContact OD1-N 3.26Å
280	V	96.3	Very high	94.7	Very high	14 Å²	14	49.8 Å²	49.8	9%	0.085	29%	0.289	C	S	.	.	H	α-helix	trans	-67	-35.3	-179.9	-178.9	0	0	0	0	111.9	V196 M199 H200 F203 E282 V283 C284	V196-V280 HydrophobicContact CG1-CG1 3.99Å; M199-V280 HydrophobicContact CB-CG1 4.38Å; M199-V280 HydrophobicContact CB-CG2 4.18Å; H200-V280 HydrophobicContact CB-CG2 4.47Å; F203-V280 HydrophobicContact CB-CG2 4.47Å; F203-V280 HydrophobicContact CD2-CB 4.46Å; F203-V280 HydrophobicContact CD2-CG2 3.55Å; F203-V280 HydrophobicContact CE2-CG2 4.22Å; F203-V280 HydrophobicContact CG-CG2 4.37Å; V280-E282 VanDerWaalsContact C-N 3.3Å; V280-E282 PolarHBondContact O-N 3.31Å; V280-V283 WeakPolarHBondContact O-CA 3.31Å; V280-V283 WeakPolarHBondContact O-CB 3.31Å; V280-V283 PolarHBondContact O-N 2.79Å; V280-C284 PolarHBondContact O-N 2.8Å; V280-C284 PolarHBondContact O-SG 2.88Å
281	D	95.9	Very high	94.9	Very high	129 Å²	129	49.1 Å²	49.1	69%	0.69	28%	0.279	S	S	*	.	H	α-helix	trans	-62.8	-38	-177.6	-60.5	-43.4	0	0	0	111.7	N279 C284 A285	N279-D281 VanDerWaalsContact C-N 3.35Å; N279-D281 WeakPolarHBondContact OD1-CB 3.25Å; N279-D281 PolarHBondContact OD1-N 2.89Å; N279-D281 VanDerWaalsContact OD1-N 3.12Å; D281-C284 WeakPolarHBondContact O-CB 3.38Å; D281-C284 PolarHBondContact O-N 3.37Å; D281-A285 PolarHBondContact O-N 3.47Å
282	E	97.4	Very high	95	Very high	69 Å²	69	52.9 Å²	52.9	32%	0.322	28%	0.276	S	S	.	.	H	α-helix	trans	-62.2	-41.3	172	-75	169.2	-154.9	0	0	111.7	V277 D278 N279 V280 A285 L286	V277-E282 VanDerWaalsContact CA-OE2 3.25Å; V277-E282 WeakPolarHBondContact CA-OE2 3.27Å; V277-E282 HydrophobicContact CB-CB 4.33Å; V277-E282 HydrophobicContact CG1-CB 4.15Å; D278-E282 PolarHBondContact N-OE2 2.99Å; N279-E282 PolarHBondContact ND2-OE1 3.18Å; N279-E282 WeakPolarHBondContact OD1-CG 3.43Å; N279-E282 PolarHBondContact OD1-N 3.26Å; V280-E282 VanDerWaalsContact C-N 3.3Å; V280-E282 PolarHBondContact O-N 3.31Å; E282-A285 WeakPolarHBondContact O-CB 3.49Å; E282-A285 PolarHBondContact O-N 2.84Å; E282-L286 WeakPolarHBondContact O-CG 3.46Å; E282-L286 PolarHBondContact O-N 2.9Å
283	V	96.6	Very high	94.7	Very high	0 Å²	0	55 Å²	55	0%	0	29%	0.285	C	S	.	.	H	α-helix	trans	-65.4	-42.1	175.1	-178.5	0	0	0	0	111.1	M199 F203 V277 V280 A285 L286 I287 F312 M314	M199-V283 HydrophobicContact CG-CB 4.15Å; M199-V283 HydrophobicContact CG-CG1 3.8Å; M199-V283 HydrophobicContact CG-CG2 4.05Å; M199-V283 HydrophobicContact SD-CG2 4.33Å; F203-V283 HydrophobicContact CE2-CG2 4.02Å; F203-V283 HydrophobicContact CZ-CG2 4.35Å; V277-V283 HydrophobicContact CB-CG2 4.21Å; V277-V283 HydrophobicContact CG1-CG2 4.23Å; V277-V283 HydrophobicContact CG2-CG2 3.97Å; V280-V283 WeakPolarHBondContact O-CA 3.31Å; V280-V283 WeakPolarHBondContact O-CB 3.31Å; V280-V283 PolarHBondContact O-N 2.79Å; V283-A285 VanDerWaalsContact C-N 3.26Å; V283-A285 PolarHBondContact O-N 2.91Å; V283-L286 WeakPolarHBondContact O-CB 3.49Å; V283-L286 PolarHBondContact O-N 2.89Å; V283-L286 VanDerWaalsContact O-N 3.09Å; V283-I287 HydrophobicContact CG1-CD1 4.15Å; V283-I287 HydrophobicContact CG1-CG1 4.45Å; V283-I287 WeakPolarHBondContact O-CG1 3.49Å; V283-I287 PolarHBondContact O-N 2.78Å; V283-F312 HydrophobicContact CG1-CE2 3.82Å; V283-F312 HydrophobicContact CG1-CZ 3.57Å; V283-M314 HydrophobicContact CG2-CE 3.96Å
284	C	95.5	Very high	94.3	Very high	36 Å²	36	54.2 Å²	54.2	24%	0.243	28%	0.277	C	S	.	.	H	α-helix	trans	-58.5	-39	173.1	-71	0	0	0	0	111.7	V280 D281 I287 N288	V280-C284 PolarHBondContact O-N 2.8Å; V280-C284 PolarHBondContact O-SG 2.88Å; D281-C284 WeakPolarHBondContact O-CB 3.38Å; D281-C284 PolarHBondContact O-N 3.37Å; C284-I287 PolarHBondContact O-N 2.82Å; C284-N288 WeakPolarHBondContact O-CB 3.31Å; C284-N288 PolarHBondContact O-N 2.81Å; C284-N288 PolarHBondContact O-ND2 3.05Å
285	A	95.5	Very high	93.6	Very high	58 Å²	58	52.3 Å²	52.3	48%	0.479	28%	0.276	S	S	.	.	H	α-helix	trans	-63.8	-40.1	174	0	0	0	0	0	112.3	D281 E282 V283 N288 K289	D281-A285 PolarHBondContact O-N 3.47Å; E282-A285 WeakPolarHBondContact O-CB 3.49Å; E282-A285 PolarHBondContact O-N 2.84Å; V283-A285 VanDerWaalsContact C-N 3.26Å; V283-A285 PolarHBondContact O-N 2.91Å; A285-N288 PolarHBondContact O-N 2.86Å; A285-K289 WeakPolarHBondContact O-CB 3.34Å; A285-K289 PolarHBondContact O-N 2.82Å
286	L	96.4	Very high	92.5	Very high	19 Å²	19	54.3 Å²	54.3	10%	0.099	29%	0.288	C	S	.	.	H	α-helix	trans	-64.7	-42.6	174.6	-63.5	-179.5	0	0	0	112.2	A220 L234 V275 V277 E282 V283 N288 K289 A290	A220-L286 HydrophobicContact CB-CD1 3.77Å; L234-L286 HydrophobicContact CD1-CD1 4.3Å; L234-L286 HydrophobicContact CD1-CD2 4.23Å; L234-L286 HydrophobicContact CD2-CB 3.97Å; L234-L286 HydrophobicContact CD2-CD2 4.03Å; V275-L286 HydrophobicContact CB-CD1 4.19Å; V275-L286 HydrophobicContact CB-CD2 4.42Å; V275-L286 HydrophobicContact CG1-CD1 4.37Å; V275-L286 HydrophobicContact CG1-CD2 4.28Å; V275-L286 HydrophobicContact CG2-CD2 4.22Å; V277-L286 HydrophobicContact CG1-CD1 3.72Å; E282-L286 WeakPolarHBondContact O-CG 3.46Å; E282-L286 PolarHBondContact O-N 2.9Å; V283-L286 WeakPolarHBondContact O-CB 3.49Å; V283-L286 PolarHBondContact O-N 2.89Å; V283-L286 VanDerWaalsContact O-N 3.09Å; L286-N288 VanDerWaalsContact C-N 3.34Å; L286-N288 PolarHBondContact O-N 2.83Å; L286-K289 WeakPolarHBondContact O-CB 3.47Å; L286-K289 PolarHBondContact O-N 2.75Å; L286-A290 WeakPolarHBondContact O-CB 3.47Å; L286-A290 PolarHBondContact O-N 2.83Å
287	I	95	Very high	91.1	Very high	4 Å²	4	50.1 Å²	50.1	2%	0.021	27%	0.273	C	S	.	.	H	α-helix	trans	-60.4	-46.6	174.9	-66.4	167.3	0	0	0	110	I195 V196 F222 V283 C284 K289 A290 R291	I195-I287 HydrophobicContact CB-CD1 4.45Å; I195-I287 HydrophobicContact CG2-CD1 3.83Å; V196-I287 HydrophobicContact CG2-CD1 3.6Å; F222-I287 HydrophobicContact CE1-CG1 4.42Å; V283-I287 HydrophobicContact CG1-CD1 4.15Å; V283-I287 HydrophobicContact CG1-CG1 4.45Å; V283-I287 WeakPolarHBondContact O-CG1 3.49Å; V283-I287 PolarHBondContact O-N 2.78Å; C284-I287 PolarHBondContact O-N 2.82Å; I287-K289 VanDerWaalsContact C-N 3.34Å; I287-K289 PolarHBondContact O-N 3.48Å; I287-A290 PolarHBondContact O-N 2.86Å; I287-R291 HydrophobicContact CG2-CG 4.49Å; I287-R291 WeakPolarHBondContact O-CG 3.49Å; I287-R291 PolarHBondContact O-N 3.34Å
288	N	93.4	Very high	89.4	Confident	70 Å²	70	51.8 Å²	51.8	37%	0.374	29%	0.286	S	S	.	.	H	α-helix	trans	-65.3	-35.3	178.1	-74.1	-32.1	0	0	0	112.8	C284 A285 L286 R291 K292	C284-N288 WeakPolarHBondContact O-CB 3.31Å; C284-N288 PolarHBondContact O-N 2.81Å; C284-N288 PolarHBondContact O-ND2 3.05Å; A285-N288 PolarHBondContact O-N 2.86Å; L286-N288 VanDerWaalsContact C-N 3.34Å; L286-N288 PolarHBondContact O-N 2.83Å; N288-R291 PolarHBondContact OD1-NH1 2.9Å; N288-K292 WeakPolarHBondContact O-CG 3.46Å; N288-K292 PolarHBondContact O-N 2.99Å; N288-K292 VanDerWaalsContact O-N 3.09Å
289	K	93.8	Very high	87.6	Confident	48 Å²	48	53 Å²	53	21%	0.209	30%	0.298	C	S	.	.	H	α-helix	trans	-62.4	-48.5	172.1	-171.2	178.9	-171.6	179.8	0	111	L234 D236 A285 L286 I287 R291 K292 H293	L234-K289 VanDerWaalsContact O-CE 3.27Å; L234-K289 WeakPolarHBondContact O-CE 3.45Å; L234-K289 PolarHBondContact O-NZ 2.98Å; D236-K289 WeakPolarHBondContact OD1-CE 3.2Å; D236-K289 IonicContact OD1-NZ 2.86Å; D236-K289 PolarHBondContact OD1-NZ 2.98Å; D236-K289 IonicContact OD2-NZ 2.72Å; D236-K289 PolarHBondContact OD2-NZ 3.35Å; A285-K289 WeakPolarHBondContact O-CB 3.34Å; A285-K289 PolarHBondContact O-N 2.82Å; L286-K289 WeakPolarHBondContact O-CB 3.47Å; L286-K289 PolarHBondContact O-N 2.75Å; I287-K289 VanDerWaalsContact C-N 3.34Å; I287-K289 PolarHBondContact O-N 3.48Å; K289-R291 PolarHBondContact O-N 2.93Å; K289-K292 PolarHBondContact O-N 2.88Å; K289-H293 PolarHBondContact O-N 2.88Å
290	A	93	Very high	85.4	Confident	0 Å²	0	58 Å²	58	0%	0	32%	0.317	C	S	.	.	H	α-helix	trans	-60.1	-43.1	177.3	0	0	0	0	0	112.4	F222 L233 L286 I287 K292 H293 R294	F222-A290 HydrophobicContact CD1-CB 3.28Å; F222-A290 HydrophobicContact CE1-CB 3.52Å; F222-A290 HydrophobicContact CG-CB 3.99Å; F222-A290 HydrophobicContact CZ-CB 4.4Å; L233-A290 HydrophobicContact CB-CB 3.74Å; L233-A290 HydrophobicContact CD1-CB 4.06Å; L233-A290 HydrophobicContact CG-CB 4.5Å; L286-A290 WeakPolarHBondContact O-CB 3.47Å; L286-A290 PolarHBondContact O-N 2.83Å; I287-A290 PolarHBondContact O-N 2.86Å; A290-K292 PolarHBondContact O-N 3.01Å; A290-H293 PolarHBondContact O-N 2.84Å; A290-R294 PolarHBondContact O-N 3.07Å
291	R	89.8	Confident	82.9	Confident	48 Å²	48	60.6 Å²	60.6	18%	0.181	34%	0.335	C	S	.	.	H	α-helix	trans	-57.6	-46.1	174.3	-74.3	171.8	175.5	179.1	-8.2	112.1	E183 G184 I287 N288 K289 H293 R294 A295	E183-R291 PolarHBondContact O-NH2 3.38Å; E183-R291 IonicContact OE2-CZ 2.94Å; E183-R291 IonicContact OE2-NE 2.87Å; E183-R291 PolarHBondContact OE2-NE 2.84Å; E183-R291 IonicContact OE2-NH2 3.72Å; G184-R291 PolarHBondContact O-NH2 3.45Å; I287-R291 HydrophobicContact CG2-CG 4.49Å; I287-R291 WeakPolarHBondContact O-CG 3.49Å; I287-R291 PolarHBondContact O-N 3.34Å; N288-R291 PolarHBondContact OD1-NH1 2.9Å; K289-R291 PolarHBondContact O-N 2.93Å; R291-H293 PolarHBondContact O-N 2.81Å; R291-R294 PolarHBondContact O-N 2.91Å; R291-A295 WeakPolarHBondContact O-CB 3.29Å; R291-A295 PolarHBondContact O-N 3.47Å
292	K	88.6	Confident	80.8	Confident	148 Å²	148	58.1 Å²	58.1	64%	0.643	32%	0.321	S	S	*	.	H	α-helix	trans	-60.9	-44.2	176.7	-72.5	173.1	-177	178.6	0	111.7	N288 K289 A290 R294 A295 V296	N288-K292 WeakPolarHBondContact O-CG 3.46Å; N288-K292 PolarHBondContact O-N 2.99Å; N288-K292 VanDerWaalsContact O-N 3.09Å; K289-K292 PolarHBondContact O-N 2.88Å; A290-K292 PolarHBondContact O-N 3.01Å; K292-R294 VanDerWaalsContact C-N 3.34Å; K292-R294 PolarHBondContact O-N 3.09Å; K292-A295 PolarHBondContact O-N 3.37Å; K292-V296 WeakPolarHBondContact O-CG2 3.44Å; K292-V296 PolarHBondContact O-N 3.12Å
293	H	87.1	Confident	79.2	Confident	66 Å²	66	59.1 Å²	59.1	31%	0.306	33%	0.329	S	S	.	.	H	α-helix	trans	-62.5	-40.2	177.5	-70.6	175.5	0	0	0	112.3	L233 S235 K289 A290 R291 A297	L233-H293 HydrophobicContact CD2-CB 4.48Å; L233-H293 PolarHBondContact O-ND1 3.19Å; S235-H293 PolarHBondContact O-CE1 3.3Å; K289-H293 PolarHBondContact O-N 2.88Å; A290-H293 PolarHBondContact O-N 2.84Å; R291-H293 PolarHBondContact O-N 2.81Å; H293-A297 PolarHBondContact O-N 2.88Å
294	R	85.6	Confident	78	Confident	30 Å²	30	61.3 Å²	61.3	11%	0.113	34%	0.337	C	S	.	.	H	α-helix	trans	-66.2	-41.2	173.5	-70	-167.2	-164.4	129	16.7	112.8	E183 L233 A290 R291 K292 V296 A297 A298 S310	E183-R294 IonicContact OE1-CZ 3.91Å; E183-R294 IonicContact OE1-NH1 2.67Å; E183-R294 PolarHBondContact OE1-NH1 3.2Å; E183-R294 IonicContact OE1-NH2 3.09Å; L233-R294 HydrophobicContact CD2-CG 3.98Å; A290-R294 PolarHBondContact O-N 3.07Å; R291-R294 PolarHBondContact O-N 2.91Å; K292-R294 VanDerWaalsContact C-N 3.34Å; K292-R294 PolarHBondContact O-N 3.09Å; R294-V296 PolarHBondContact O-N 3.36Å; R294-A297 WeakPolarHBondContact O-CB 3.27Å; R294-A297 PolarHBondContact O-N 3.03Å; R294-A297 VanDerWaalsContact O-N 3.12Å; R294-A298 PolarHBondContact O-N 2.99Å; R294-S310 PolarHBondContact NE-OG 2.97Å; R294-S310 PolarHBondContact NH1-OG 2.86Å; R294-S310 PolarHBondContact NH2-OG 3.31Å
295	A	80.7	Confident	77	Confident	57 Å²	57	63 Å²	63	47%	0.471	35%	0.349	S	S	.	.	H	α-helix	trans	-63.5	-40.4	179.2	0	0	0	0	0	112.7	R291 K292 A297 A298 T299	R291-A295 WeakPolarHBondContact O-CB 3.29Å; R291-A295 PolarHBondContact O-N 3.47Å; K292-A295 PolarHBondContact O-N 3.37Å; A295-A297 PolarHBondContact O-N 2.88Å; A295-A298 PolarHBondContact O-N 2.91Å; A295-T299 PolarHBondContact O-N 2.99Å; A295-T299 VanDerWaalsContact O-N 3.07Å; A295-T299 PolarHBondContact O-OG1 3.44Å
296	V	73.6	Confident	76.4	Confident	87 Å²	87	61 Å²	61	53%	0.527	33%	0.332	S	S	.	.	H	α-helix	trans	-65.1	-31.1	174.5	173.6	0	0	0	0	111.6	K292 R294 T299	K292-V296 WeakPolarHBondContact O-CG2 3.44Å; K292-V296 PolarHBondContact O-N 3.12Å; R294-V296 PolarHBondContact O-N 3.36Å; V296-T299 PolarHBondContact O-OG1 3.23Å; V296-T299 VanDerWaalsContact O-OG1 3.1Å
297	A	68.6	Low	75.8	Confident	17 Å²	17	62.8 Å²	62.8	14%	0.14	34%	0.337	C	S	.	.	H	α-helix	trans	-76.1	-38.4	175.4	0	0	0	0	0	113.1	H293 R294 A295 K300 C301	H293-A297 PolarHBondContact O-N 2.88Å; R294-A297 WeakPolarHBondContact O-CB 3.27Å; R294-A297 PolarHBondContact O-N 3.03Å; R294-A297 VanDerWaalsContact O-N 3.12Å; A295-A297 PolarHBondContact O-N 2.88Å; A297-K300 PolarHBondContact O-N 3.18Å; A297-C301 PolarHBondContact O-N 2.79Å
298	A	62.6	Low	75.5	Confident	36 Å²	36	62.7 Å²	62.7	30%	0.298	34%	0.337	S	S	.	.	H	α-helix	trans	-71	-33.2	179.2	0	0	0	0	0	113.3	R294 A295 K300 C301 R304	R294-A298 PolarHBondContact O-N 2.99Å; A295-A298 PolarHBondContact O-N 2.91Å; A298-K300 PolarHBondContact O-N 3.48Å; A298-C301 CarbonylContact C-O 3.58Å; A298-C301 WeakPolarHBondContact CA-O 3.38Å; A298-C301 CarbonylContact O-C 3.49Å; A298-C301 VanDerWaalsContact O-C 3.29Å; A298-C301 PolarHBondContact O-N 2.76Å; A298-R304 HydrophobicContact CB-CB 4.42Å
299	T	57.5	Low	75.5	Confident	123 Å²	123	59.6 Å²	59.6	76%	0.755	32%	0.32	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.7	-22.6	173.6	38.2	0	0	0	0	113	A295 V296	A295-T299 PolarHBondContact O-N 2.99Å; A295-T299 VanDerWaalsContact O-N 3.07Å; A295-T299 PolarHBondContact O-OG1 3.44Å; V296-T299 PolarHBondContact O-OG1 3.23Å; V296-T299 VanDerWaalsContact O-OG1 3.1Å
300	K	50.7	Low	75.6	Confident	160 Å²	160	57.6 Å²	57.6	70%	0.696	31%	0.313	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.1	-17.4	175.6	-68.4	-178.7	179.6	179	0	113.5	A297 A298	A297-K300 PolarHBondContact O-N 3.18Å; A298-K300 PolarHBondContact O-N 3.48Å
301	C	44.4	Very low	75.7	Confident	68 Å²	68	57.7 Å²	57.7	46%	0.459	31%	0.313	S	S	.	.	S	Bend	trans	-164.1	134.7	-175.7	-147.4	0	0	0	0	110.3	A297 A298	A297-C301 PolarHBondContact O-N 2.79Å; A298-C301 CarbonylContact C-O 3.58Å; A298-C301 WeakPolarHBondContact CA-O 3.38Å; A298-C301 CarbonylContact O-C 3.49Å; A298-C301 VanDerWaalsContact O-C 3.29Å; A298-C301 PolarHBondContact O-N 2.76Å
302	N	51.7	Low	76.1	Confident	77 Å²	77	55.4 Å²	55.4	41%	0.412	30%	0.304	S	S	.	.	T	Hydrogen-bonded Turn	trans	-19.8	148.7	175.6	-72	2.5	0	0	0	116.7	R304 R351	N302-R304 WeakPolarHBondContact O-CA 2.98Å; N302-R304 PolarHBondContact O-N 3.28Å; N302-R351 PolarHBondContact ND2-NE 3.32Å; N302-R351 PolarHBondContact ND2-NH2 2.96Å
303	D	63.5	Low	76.5	Confident	89 Å²	89	49.1 Å²	49.1	48%	0.476	28%	0.279	S	S	.	.	T	Hydrogen-bonded Turn	trans	-10.6	64.2	174	-160.5	-9.2	0	0	0	117.3	S305 S306	D303-S305 PolarHBondContact O-N 3.25Å; D303-S305 PolarHBondContact OD1-OG 2.9Å; D303-S306 VanDerWaalsContact CG-OG 3.31Å; D303-S306 PolarHBondContact O-N 2.87Å; D303-S306 VanDerWaalsContact O-N 3.12Å; D303-S306 PolarHBondContact O-OG 2.85Å; D303-S306 PolarHBondContact OD1-N 2.98Å
304	R	70.3	Confident	77	Confident	47 Å²	47	46 Å²	46	18%	0.177	27%	0.265	C	S	.	.	H	α-helix	trans	-64.1	-32	-173.1	178.9	174.6	169.7	152.4	-2.7	110.8	E224 Y226 N231 A298 N302 S306 R307 S308	E224-R304 IonicContact OE1-NE 3.04Å; E224-R304 PolarHBondContact OE1-NE 3.08Å; E224-R304 IonicContact OE2-CZ 3.72Å; E224-R304 VanDerWaalsContact OE2-CZ 3.29Å; E224-R304 IonicContact OE2-NE 3.4Å; E224-R304 PolarHBondContact OE2-NE 3.07Å; E224-R304 VanDerWaalsContact OE2-NE 3.1Å; E224-R304 IonicContact OE2-NH2 2.64Å; E224-R304 PolarHBondContact OE2-NH2 3.5Å; Y226-R304 HydrophobicContact CD2-CG 4.15Å; Y226-R304 HydrophobicContact CE2-CG 4.2Å; N231-R304 PolarHBondContact ND2-NH2 3.14Å; A298-R304 HydrophobicContact CB-CB 4.42Å; N302-R304 WeakPolarHBondContact O-CA 2.98Å; N302-R304 PolarHBondContact O-N 3.28Å; R304-S306 VanDerWaalsContact C-N 3.32Å; R304-S306 PolarHBondContact O-N 3.08Å; R304-R307 CarbonylContact O-C 3.29Å; R304-R307 PolarHBondContact O-N 3.29Å; R304-S308 WeakPolarHBondContact O-CB 3.44Å; R304-S308 PolarHBondContact O-N 3.26Å; R304-S308 PolarHBondContact O-OG 3.15Å
305	S	76.2	Confident	77.4	Confident	71 Å²	71	48 Å²	48	50%	0.497	27%	0.272	S	S	.	.	H	α-helix	trans	-57.9	-39.6	175.1	30.1	0	0	0	0	113.3	D303 R307	D303-S305 PolarHBondContact O-N 3.25Å; D303-S305 PolarHBondContact OD1-OG 2.9Å; S305-R307 PolarHBondContact O-N 2.89Å
306	S	81.3	Confident	78.1	Confident	17 Å²	17	45.3 Å²	45.3	12%	0.119	25%	0.25	C	C	.	.	H	α-helix	trans	-70.4	-16.4	177.7	67.1	0	0	0	0	113.3	T174 D303 R304 G338	T174-S306 WeakPolarHBondContact OG1-CB 3.29Å; D303-S306 VanDerWaalsContact CG-OG 3.31Å; D303-S306 PolarHBondContact O-N 2.87Å; D303-S306 VanDerWaalsContact O-N 3.12Å; D303-S306 PolarHBondContact O-OG 2.85Å; D303-S306 PolarHBondContact OD1-N 2.98Å; R304-S306 VanDerWaalsContact C-N 3.32Å; R304-S306 PolarHBondContact O-N 3.08Å; S306-G338 PolarHBondContact O-N 3.39Å
307	R	84.7	Confident	79.1	Confident	55 Å²	55	44.9 Å²	44.9	21%	0.208	24%	0.241	C	C	.	.	H	α-helix	trans	-120.2	-0.9	-166.4	-65	-170	177.5	-170.5	-7.8	114.3	Y226 R304 S305 E354 I358	Y226-R307 HydrophobicContact CE2-CB 4.25Å; R304-R307 CarbonylContact O-C 3.29Å; R304-R307 PolarHBondContact O-N 3.29Å; S305-R307 PolarHBondContact O-N 2.89Å; R307-E354 WeakPolarHBondContact CD-OE1 3.31Å; R307-E354 IonicContact CZ-OE1 3.17Å; R307-E354 IonicContact NE-OE1 3.71Å; R307-E354 IonicContact NH1-OE1 3.57Å; R307-E354 PolarHBondContact NH1-OE1 2.78Å; R307-E354 IonicContact NH1-OE2 2.93Å; R307-E354 PolarHBondContact NH1-OE2 2.92Å; R307-I358 HydrophobicContact CB-CD1 3.45Å; R307-I358 VanDerWaalsContact CB-CD1 3.45Å; R307-I358 HydrophobicContact CB-CG1 4.19Å; R307-I358 HydrophobicContact CG-CD1 3.52Å; R307-I358 WeakPolarHBondContact O-CG1 3.34Å
308	S	89.3	Confident	80.2	Confident	3 Å²	3	44.1 Å²	44.1	2%	0.021	24%	0.235	C	C	.	.			trans	-115.6	153.5	176.4	68.4	0	0	0	0	111	E224 I225 R304 A337	E224-S308 WeakPolarHBondContact OE1-CB 3.27Å; E224-S308 PolarHBondContact OE1-OG 3.24Å; I225-S308 WeakPolarHBondContact O-CA 3.41Å; R304-S308 WeakPolarHBondContact O-CB 3.44Å; R304-S308 PolarHBondContact O-N 3.26Å; R304-S308 PolarHBondContact O-OG 3.15Å; S308-A337 PolarHBondContact O-N 2.95Å
309	H	93.2	Very high	81.7	Confident	5 Å²	5	46.8 Å²	46.8	2%	0.023	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.8	142.1	170.1	-49.9	-79.6	0	0	0	108.8	E224 I225 D335 L336 A337 S361 L386	E224-H309 CarbonylContact C-O 3.59Å; E224-H309 VanDerWaalsContact CA-O 3.25Å; E224-H309 WeakPolarHBondContact CA-O 3.35Å; I225-H309 HydrophobicContact CB-CB 4.27Å; I225-H309 PolarHBondContact N-O 3.45Å; I225-H309 PolarHBondContact O-N 2.89Å; H309-D335 CarbonylContact C-O 3.35Å; H309-D335 WeakPolarHBondContact CA-O 3.42Å; H309-L336 WeakPolarHBondContact ND1-CA 3.25Å; H309-L336 WeakPolarHBondContact ND1-CD2 3.37Å; H309-A337 VanDerWaalsContact CE1-CB 3.47Å; H309-A337 WeakPolarHBondContact CE1-CB 3.49Å; H309-A337 PolarHBondContact CE1-N 3.1Å; H309-A337 PolarHBondContact ND1-N 3.28Å; H309-S361 PolarHBondContact CE1-OG 2.78Å; H309-S361 PolarHBondContact NE2-OG 3.4Å; H309-L386 HydrophobicContact CB-CD1 4.21Å
310	S	94.8	Very high	83.2	Confident	6 Å²	6	41 Å²	41	4%	0.042	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	129.5	-177.6	-65.3	0	0	0	0	109.4	R294 V334 D335	R294-S310 PolarHBondContact NE-OG 2.97Å; R294-S310 PolarHBondContact NH1-OG 2.86Å; R294-S310 PolarHBondContact NH2-OG 3.31Å; S310-V334 CarbonylContact O-C 3.52Å; S310-V334 VanDerWaalsContact O-CA 3.26Å; S310-V334 WeakPolarHBondContact O-CA 3.29Å; S310-D335 PolarHBondContact N-O 3.46Å; S310-D335 PolarHBondContact O-N 3.45Å
311	V	96.5	Very high	85	Confident	1 Å²	1	38.6 Å²	38.6	1%	0.006	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	107	-176.6	-176.2	0	0	0	0	109	F222 L223 F333 V334 L389	F222-V311 WeakPolarHBondContact CA-O 3.42Å; F222-V311 VanDerWaalsContact CD2-O 3.28Å; F222-V311 WeakPolarHBondContact CD2-O 3.35Å; L223-V311 HydrophobicContact CD1-CB 3.74Å; L223-V311 HydrophobicContact CD1-CG2 3.9Å; L223-V311 HydrophobicContact CG-CB 4Å; L223-V311 PolarHBondContact N-O 3.02Å; L223-V311 PolarHBondContact O-N 3.39Å; V311-F333 WeakPolarHBondContact CA-O 3.49Å; V311-V334 HydrophobicContact CG1-CG2 4.22Å; V311-V334 HydrophobicContact CG2-CG1 4.04Å; V311-V334 HydrophobicContact CG2-CG2 4.2Å; V311-L389 HydrophobicContact CB-CD2 4.41Å; V311-L389 HydrophobicContact CG1-CD2 4.35Å; V311-L389 HydrophobicContact CG2-CD2 4.01Å
312	F	97.6	Very high	86.9	Confident	0 Å²	0	42.5 Å²	42.5	0%	0	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.1	130.1	166	175.9	-91.6	0	0	0	108.6	I195 M199 A220 F222 V283 M314 N332 F333	I195-F312 HydrophobicContact CD1-CB 4Å; I195-F312 HydrophobicContact CD1-CG 4.36Å; I195-F312 HydrophobicContact CG1-CD1 4.42Å; I195-F312 HydrophobicContact CG2-CD1 3.66Å; I195-F312 HydrophobicContact CG2-CD2 4.49Å; I195-F312 HydrophobicContact CG2-CE1 3.7Å; I195-F312 HydrophobicContact CG2-CG 4.08Å; I195-F312 HydrophobicContact CG2-CZ 4.15Å; M199-F312 HydrophobicContact CE-CE1 4.25Å; M199-F312 HydrophobicContact SD-CE1 4.21Å; M199-F312 HydrophobicContact SD-CZ 4.33Å; A220-F312 HydrophobicContact CB-CE2 4.11Å; A220-F312 HydrophobicContact CB-CZ 4.16Å; F222-F312 HydrophobicContact CB-CD2 4.4Å; F222-F312 HydrophobicContact CD1-CD2 4.11Å; F222-F312 HydrophobicContact CD2-CB 4.05Å; F222-F312 HydrophobicContact CE2-CB 3.98Å; F222-F312 HydrophobicContact CG-CB 4.35Å; F222-F312 HydrophobicContact CG-CD2 4.2Å; F222-F312 HydrophobicContact CZ-CB 4.26Å; V283-F312 HydrophobicContact CG1-CE2 3.82Å; V283-F312 HydrophobicContact CG1-CZ 3.57Å; F312-M314 HydrophobicContact CE1-CB 4.04Å; F312-M314 HydrophobicContact CZ-CE 4.15Å; F312-N332 CarbonylContact O-C 3.09Å; F312-N332 WeakPolarHBondContact O-CA 3.49Å; F312-F333 HydrophobicContact CB-CB 4.45Å; F312-F333 HydrophobicContact CD1-CD2 4.08Å; F312-F333 PolarHBondContact N-O 3.35Å; F312-F333 PolarHBondContact O-N 3.32Å
313	S	96.9	Very high	88.3	Confident	17 Å²	17	42.5 Å²	42.5	12%	0.119	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	130.8	179.1	-58.9	0	0	0	0	109.8	A220 S221 L331 N332	A220-S313 CarbonylContact C-O 3.56Å; A220-S313 VanDerWaalsContact CA-O 3.27Å; A220-S313 WeakPolarHBondContact CA-O 3.36Å; S221-S313 PolarHBondContact N-O 3.28Å; S221-S313 PolarHBondContact O-N 2.89Å; S313-L331 WeakPolarHBondContact CA-O 3.46Å; S313-N332 WeakPolarHBondContact CB-OD1 3.26Å; S313-N332 PolarHBondContact OG-OD1 2.65Å
314	M	96.6	Very high	89.2	Confident	0 Å²	0	40.8 Å²	40.8	0%	0	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	113.8	172.1	178.3	58.4	75.8	0	0	109.2	M199 M218 A220 V277 V283 F312 V316 L331	M199-M314 HydrophobicContact CE-CB 4.11Å; M199-M314 HydrophobicContact CE-CG 4.2Å; M199-M314 HydrophobicContact SD-CB 4.25Å; M199-M314 HydrophobicContact SD-CE 3.26Å; M199-M314 WeakPolarHBondContact SD-CE 3.28Å; M199-M314 HydrophobicContact SD-CG 4.01Å; M199-M314 HydrophobicContact SD-SD 4.48Å; M218-M314 HydrophobicContact CB-SD 3.91Å; A220-M314 HydrophobicContact CB-CE 4Å; A220-M314 HydrophobicContact CB-SD 4.5Å; V277-M314 HydrophobicContact CG2-CE 3.52Å; V277-M314 HydrophobicContact CG2-SD 4.18Å; V283-M314 HydrophobicContact CG2-CE 3.96Å; F312-M314 HydrophobicContact CE1-CB 4.04Å; F312-M314 HydrophobicContact CZ-CE 4.15Å; M314-V316 HydrophobicContact CG-CG2 3.92Å; M314-L331 HydrophobicContact CB-CB 4.39Å; M314-L331 PolarHBondContact N-O 3.47Å; M314-L331 PolarHBondContact O-N 2.61Å
315	R	95.2	Very high	89.9	Confident	72 Å²	72	42 Å²	42	27%	0.272	22%	0.218	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.4	127.3	173.4	-179.5	-177.5	-71.5	-123.4	3.5	108.8	M218 R219 E266 E328 G329	M218-R315 WeakPolarHBondContact CA-O 3.35Å; R219-R315 HydrophobicContact CB-CB 4.44Å; R219-R315 PolarHBondContact N-O 3.02Å; R219-R315 PolarHBondContact O-N 3.17Å; E266-R315 IonicContact OE1-CZ 3.46Å; E266-R315 IonicContact OE1-NH1 2.68Å; E266-R315 PolarHBondContact OE1-NH1 2.64Å; E266-R315 IonicContact OE1-NH2 3.94Å; E266-R315 PolarHBondContact OE1-NH2 3.25Å; R315-E328 WeakPolarHBondContact CD-OE1 3.42Å; R315-E328 HydrophobicContact CG-CG 4.12Å; R315-E328 WeakPolarHBondContact CG-OE1 3.28Å; R315-E328 IonicContact CZ-OE1 2.84Å; R315-E328 IonicContact NE-OE1 2.7Å; R315-E328 PolarHBondContact NE-OE1 3.42Å; R315-E328 IonicContact NH1-OE1 3.02Å; R315-E328 PolarHBondContact NH1-OE1 3.48Å; R315-G329 WeakPolarHBondContact CA-O 3.47Å
316	V	94.9	Very high	90.6	Very high	0 Å²	0	39.1 Å²	39.1	0%	0	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	108.8	-178.7	-170.7	0	0	0	0	108.6	L161 V202 M218 M314 E328 G329	L161-V316 HydrophobicContact CD2-CG1 4.13Å; V202-V316 HydrophobicContact CG1-CG2 4.21Å; M218-V316 HydrophobicContact CE-CG1 4.22Å; M218-V316 HydrophobicContact CG-CG1 4.15Å; M218-V316 HydrophobicContact CG-CG2 4.31Å; M314-V316 HydrophobicContact CG-CG2 3.92Å; V316-E328 CarbonylContact O-C 3.54Å; V316-E328 WeakPolarHBondContact O-CA 3.34Å; V316-G329 PolarHBondContact N-O 3.45Å; V316-G329 PolarHBondContact O-N 3.39Å
317	K	94.3	Very high	91	Very high	78 Å²	78	38.9 Å²	38.9	34%	0.339	20%	0.196	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.5	124.8	170.4	-178.1	177.7	174.4	-177.2	0	108.7	H216 E217 Y327 L439	H216-K317 CarbonylContact C-O 3.49Å; H216-K317 VanDerWaalsContact CA-O 3.28Å; H216-K317 WeakPolarHBondContact CA-O 3.42Å; E217-K317 HydrophobicContact CB-CB 4.39Å; E217-K317 PolarHBondContact N-O 3.47Å; E217-K317 PolarHBondContact O-N 2.94Å; K317-Y327 WeakPolarHBondContact CA-O 3.43Å; K317-L439 HydrophobicContact CD-CD1 3.94Å; K317-L439 HydrophobicContact CG-CD1 3.88Å
318	C	92.4	Very high	91.4	Very high	2 Å²	2	37.9 Å²	37.9	1%	0.014	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	130.5	179.3	-50.3	0	0	0	0	108.6	W214 K215 H216 A326 Y327	W214-C318 HydrophobicContact CE3-CB 4.09Å; W214-C318 HydrophobicContact CZ3-CB 4.48Å; K215-C318 CarbonylContact O-C 3.55Å; K215-C318 WeakPolarHBondContact O-CA 3.45Å; H216-C318 PolarHBondContact CD2-SG 3.34Å; C318-A326 CarbonylContact O-C 3.56Å; C318-A326 WeakPolarHBondContact O-CA 3.05Å; C318-Y327 PolarHBondContact N-O 3.45Å; C318-Y327 PolarHBondContact O-N 2.93Å
319	E	93.1	Very high	91.5	Very high	91 Å²	91	37.8 Å²	37.8	43%	0.425	19%	0.192	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.3	130.1	178.2	-176	177.7	165	0	0	110	K215 L325 A326	K215-E319 PolarHBondContact N-O 2.9Å; K215-E319 PolarHBondContact O-N 2.99Å; E319-L325 CarbonylContact C-O 3.59Å; E319-L325 WeakPolarHBondContact CA-O 3.5Å; E319-A326 HydrophobicContact CB-CB 4.38Å; E319-A326 HydrophobicContact CG-CB 4.3Å
320	H	90.3	Very high	91.5	Very high	2 Å²	2	38.6 Å²	38.6	1%	0.009	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.2	122.1	-179.6	-178	-77.8	0	0	0	111.7	Q49 L212 G213 W214 K322 N323 G324 L325	Q49-H320 PolarHBondContact NE2-CE1 2.99Å; Q49-H320 VanDerWaalsContact NE2-CE1 3.34Å; Q49-H320 PolarHBondContact NE2-NE2 2.84Å; Q49-H320 VanDerWaalsContact NE2-NE2 3.13Å; L212-H320 PolarHBondContact O-NE2 3.05Å; G213-H320 WeakPolarHBondContact O-CA 3.5Å; W214-H320 AromaticContact CD1-CD2 3.94Å; W214-H320 HydrophobicContact CD2-CB 3.85Å; W214-H320 AromaticContact CD2-CD2 3.99Å; W214-H320 AromaticContact CE2-CD2 3.57Å; W214-H320 HydrophobicContact CE3-CB 3.7Å; W214-H320 HydrophobicContact CH2-CB 3.57Å; W214-H320 HydrophobicContact CZ2-CB 3.83Å; W214-H320 AromaticContact CZ2-CD2 3.87Å; W214-H320 HydrophobicContact CZ3-CB 3.57Å; W214-H320 AromaticContact NE1-CD2 3.61Å; H320-K322 VanDerWaalsContact C-N 3.29Å; H320-K322 PolarHBondContact ND1-N 3.35Å; H320-K322 PolarHBondContact O-N 2.87Å; H320-K322 VanDerWaalsContact O-N 3.12Å; H320-N323 WeakPolarHBondContact CB-OD1 3.39Å; H320-N323 VanDerWaalsContact CG-OD1 3.28Å; H320-N323 PolarHBondContact ND1-N 3.46Å; H320-N323 PolarHBondContact ND1-ND2 2.8Å; H320-N323 PolarHBondContact ND1-OD1 3.46Å; H320-N323 PolarHBondContact O-N 3.45Å; H320-G324 PolarHBondContact O-N 3.27Å; H320-G324 VanDerWaalsContact O-N 3.08Å; H320-L325 HydrophobicContact CB-CB 4.49Å; H320-L325 PolarHBondContact N-O 2.78Å
321	E	87.7	Confident	91.5	Very high	109 Å²	109	38.3 Å²	38.3	51%	0.509	20%	0.196	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58.5	-34.1	-166.5	-67	-178.7	151.6	0	0	114.7	G213 K215	G213-E321 WeakPolarHBondContact O-CG 3.48Å; G213-E321 PolarHBondContact O-N 3.13Å; K215-E321 HydrophobicContact CD-CG 3.94Å; K215-E321 WeakPolarHBondContact CD-OE1 3.4Å; K215-E321 WeakPolarHBondContact CE-OE1 3.47Å; K215-E321 HydrophobicContact CG-CG 4.01Å; K215-E321 IonicContact NZ-OE1 2.68Å; K215-E321 PolarHBondContact NZ-OE1 3.47Å
322	K	84	Confident	91.5	Very high	150 Å²	150	39 Å²	39	65%	0.652	20%	0.2	S	C	*	.	T	Hydrogen-bonded Turn	trans	-95.9	-26.4	-171.5	-60.8	177.8	178.6	168.2	0	115.1	Y45 H320	Y45-K322 HydrophobicContact CE1-CD 4.27Å; H320-K322 VanDerWaalsContact C-N 3.29Å; H320-K322 PolarHBondContact ND1-N 3.35Å; H320-K322 PolarHBondContact O-N 2.87Å; H320-K322 VanDerWaalsContact O-N 3.12Å
323	N	81.2	Confident	91.5	Very high	78 Å²	78	39.1 Å²	39.1	42%	0.417	20%	0.201	S	C	.	.	T	Hydrogen-bonded Turn	trans	-118.3	-2.7	-171.9	66	13.9	0	0	0	112.8	H320 L325	H320-N323 WeakPolarHBondContact CB-OD1 3.39Å; H320-N323 VanDerWaalsContact CG-OD1 3.28Å; H320-N323 PolarHBondContact ND1-N 3.46Å; H320-N323 PolarHBondContact ND1-ND2 2.8Å; H320-N323 PolarHBondContact ND1-OD1 3.46Å; H320-N323 PolarHBondContact O-N 3.45Å; N323-L325 WeakPolarHBondContact ND2-CD1 3.48Å; N323-L325 PolarHBondContact O-N 2.99Å; N323-L325 VanDerWaalsContact O-N 3.17Å; N323-L325 WeakPolarHBondContact OD1-CB 3.44Å; N323-L325 WeakPolarHBondContact OD1-CG 3.16Å; N323-L325 PolarHBondContact OD1-N 2.9Å
324	G	82	Confident	91.5	Very high	52 Å²	52	38.3 Å²	38.3	54%	0.536	20%	0.195	S	C	.	.			trans	68.4	7.7	178	0	0	0	0	0	114.5	H320 A326	H320-G324 PolarHBondContact O-N 3.27Å; H320-G324 VanDerWaalsContact O-N 3.08Å; G324-A326 PolarHBondContact O-N 3.16Å
325	L	86.7	Confident	91.5	Very high	72 Å²	72	38.9 Å²	38.9	38%	0.377	20%	0.198	S	C	.	.			trans	-65.7	123.7	176	-70.3	175.3	0	0	0	109.2	W214 E319 H320 N323 Y327	W214-L325 HydrophobicContact CH2-CB 3.99Å; W214-L325 WeakPolarHBondContact CZ3-O 3.37Å; E319-L325 CarbonylContact C-O 3.59Å; E319-L325 WeakPolarHBondContact CA-O 3.5Å; H320-L325 HydrophobicContact CB-CB 4.49Å; H320-L325 PolarHBondContact N-O 2.78Å; N323-L325 WeakPolarHBondContact ND2-CD1 3.48Å; N323-L325 PolarHBondContact O-N 2.99Å; N323-L325 VanDerWaalsContact O-N 3.17Å; N323-L325 WeakPolarHBondContact OD1-CB 3.44Å; N323-L325 WeakPolarHBondContact OD1-CG 3.16Å; N323-L325 PolarHBondContact OD1-N 2.9Å; L325-Y327 HydrophobicContact CB-CE2 4.46Å
326	A	90.4	Very high	91.4	Very high	11 Å²	11	35.6 Å²	35.6	9%	0.091	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127	138.2	178.3	0	0	0	0	0	111.6	C318 E319 G324 L439	C318-A326 CarbonylContact O-C 3.56Å; C318-A326 WeakPolarHBondContact O-CA 3.05Å; E319-A326 HydrophobicContact CB-CB 4.38Å; E319-A326 HydrophobicContact CG-CB 4.3Å; G324-A326 PolarHBondContact O-N 3.16Å; A326-L439 HydrophobicContact CB-CB 3.87Å; A326-L439 HydrophobicContact CB-CD1 4.26Å; A326-L439 PolarHBondContact O-N 3.18Å
327	Y	90	Very high	91.3	Very high	13 Å²	13	35.6 Å²	35.6	5%	0.051	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.3	153.3	179.5	-52.5	-61.2	0	0	0	109.9	W214 K317 C318 L325 R436 N437 T438	W214-Y327 AromaticContact CH2-CD2 3.86Å; W214-Y327 HydrophobicContact CH2-CD2 3.86Å; W214-Y327 AromaticContact CH2-CE2 3.31Å; W214-Y327 HydrophobicContact CH2-CE2 3.31Å; W214-Y327 HydrophobicContact CZ2-CE2 4.27Å; W214-Y327 AromaticContact CZ3-CD2 3.66Å; W214-Y327 HydrophobicContact CZ3-CD2 3.66Å; W214-Y327 AromaticContact CZ3-CE2 3.63Å; W214-Y327 HydrophobicContact CZ3-CE2 3.63Å; K317-Y327 WeakPolarHBondContact CA-O 3.43Å; C318-Y327 PolarHBondContact N-O 3.45Å; C318-Y327 PolarHBondContact O-N 2.93Å; L325-Y327 HydrophobicContact CB-CE2 4.46Å; Y327-R436 HydrophobicContact CD1-CG 4.42Å; Y327-N437 WeakPolarHBondContact CA-O 2.99Å; Y327-T438 HydrophobicContact CD1-CG2 4.23Å; Y327-T438 HydrophobicContact CE1-CG2 4.04Å
328	E	91.5	Very high	91.2	Very high	34 Å²	34	32 Å²	32	16%	0.159	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.4	113.1	175	-172	174	173	0	0	111	R315 V316 N437 L439	R315-E328 WeakPolarHBondContact CD-OE1 3.42Å; R315-E328 HydrophobicContact CG-CG 4.12Å; R315-E328 WeakPolarHBondContact CG-OE1 3.28Å; R315-E328 IonicContact CZ-OE1 2.84Å; R315-E328 IonicContact NE-OE1 2.7Å; R315-E328 PolarHBondContact NE-OE1 3.42Å; R315-E328 IonicContact NH1-OE1 3.02Å; R315-E328 PolarHBondContact NH1-OE1 3.48Å; V316-E328 CarbonylContact O-C 3.54Å; V316-E328 WeakPolarHBondContact O-CA 3.34Å; E328-N437 PolarHBondContact N-O 2.65Å; E328-N437 WeakPolarHBondContact O-CB 3.39Å; E328-N437 PolarHBondContact O-ND2 2.87Å; E328-L439 HydrophobicContact CB-CD1 4.18Å; E328-L439 HydrophobicContact CB-CD2 4.32Å; E328-L439 HydrophobicContact CB-CG 4.21Å
329	G	91.7	Very high	91	Very high	0 Å²	0	32.3 Å²	32.3	0%	0	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.2	154.5	171.4	0	0	0	0	0	112.1	S160 Y164 R315 V316	S160-G329 VanDerWaalsContact O-CA 3.28Å; S160-G329 WeakPolarHBondContact O-CA 3.34Å; Y164-G329 WeakPolarHBondContact O-CA 2.98Å; R315-G329 WeakPolarHBondContact CA-O 3.47Å; V316-G329 PolarHBondContact N-O 3.45Å; V316-G329 PolarHBondContact O-N 3.39Å
330	C	93.2	Very high	90.7	Very high	22 Å²	22	30.5 Å²	30.5	15%	0.149	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	122.3	172.2	-172.2	0	0	0	0	109.2	Y164 N165 V166 N332	Y164-C330 PolarHBondContact O-N 3.01Å; N165-C330 CarbonylContact C-O 3.55Å; N165-C330 WeakPolarHBondContact CA-O 3.4Å; N165-C330 WeakPolarHBondContact OD1-CB 3.37Å; V166-C330 PolarHBondContact N-O 2.94Å; C330-N332 PolarHBondContact SG-ND2 3.46Å; C330-N332 VanDerWaalsContact SG-ND2 3.41Å
331	L	95.5	Very high	89.8	Confident	0 Å²	0	38.7 Å²	38.7	0%	0	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	114.3	177.8	178.8	59.6	0	0	0	109.2	V157 V166 A198 M199 V202 S313 M314 F333	V157-L331 HydrophobicContact CG1-CD2 4.06Å; V157-L331 HydrophobicContact CG2-CD2 4.42Å; V166-L331 HydrophobicContact CB-CD1 3.67Å; V166-L331 HydrophobicContact CG1-CD1 3.43Å; V166-L331 VanDerWaalsContact CG1-CD1 3.43Å; A198-L331 HydrophobicContact CB-CD2 4.2Å; M199-L331 HydrophobicContact CE-CD2 3.96Å; V202-L331 HydrophobicContact CG2-CD2 4.41Å; S313-L331 WeakPolarHBondContact CA-O 3.46Å; M314-L331 HydrophobicContact CB-CB 4.39Å; M314-L331 PolarHBondContact N-O 3.47Å; M314-L331 PolarHBondContact O-N 2.61Å; L331-F333 HydrophobicContact CD1-CE2 3.98Å; L331-F333 HydrophobicContact CD1-CZ 4.07Å; L331-F333 HydrophobicContact CD2-CE2 3.49Å; L331-F333 VanDerWaalsContact CD2-CE2 3.49Å; L331-F333 HydrophobicContact CD2-CZ 3.91Å; L331-F333 HydrophobicContact CG-CD2 4.14Å; L331-F333 HydrophobicContact CG-CE2 3.48Å; L331-F333 VanDerWaalsContact CG-CE2 3.48Å; L331-F333 HydrophobicContact CG-CZ 4.04Å
332	N	96.3	Very high	88.7	Confident	17 Å²	17	36 Å²	36	9%	0.091	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	130.1	-179.1	-58.8	-80.7	0	0	0	110	V166 C167 V168 F312 S313 C330	V166-N332 PolarHBondContact O-N 3.22Å; V166-N332 PolarHBondContact O-ND2 3.3Å; C167-N332 CarbonylContact C-O 3.49Å; C167-N332 WeakPolarHBondContact CA-O 3.45Å; C167-N332 HydrophobicContact CB-CB 4.46Å; V168-N332 PolarHBondContact N-O 2.9Å; F312-N332 CarbonylContact O-C 3.09Å; F312-N332 WeakPolarHBondContact O-CA 3.49Å; S313-N332 WeakPolarHBondContact CB-OD1 3.26Å; S313-N332 PolarHBondContact OG-OD1 2.65Å; C330-N332 PolarHBondContact SG-ND2 3.46Å; C330-N332 VanDerWaalsContact SG-ND2 3.41Å
333	F	97.8	Very high	87.6	Confident	2 Å²	2	38 Å²	38	1%	0.009	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	119.9	169.9	-70.6	-83.5	0	0	0	109.1	I153 V168 M182 M194 I195 A198 M199 V311 F312 L331	I153-F333 HydrophobicContact CD1-CE1 4.47Å; V168-F333 HydrophobicContact CB-CD1 3.74Å; V168-F333 HydrophobicContact CB-CE1 3.83Å; V168-F333 HydrophobicContact CG1-CD1 4.1Å; V168-F333 HydrophobicContact CG1-CE1 4.11Å; V168-F333 HydrophobicContact CG2-CD1 4.33Å; V168-F333 HydrophobicContact CG2-CE1 3.94Å; V168-F333 CarbonylContact O-C 3.52Å; V168-F333 VanDerWaalsContact O-CA 3.29Å; V168-F333 WeakPolarHBondContact O-CA 3.34Å; M182-F333 HydrophobicContact SD-CB 4.2Å; M182-F333 HydrophobicContact SD-CD1 3.87Å; M194-F333 HydrophobicContact CB-CD1 4.42Å; M194-F333 HydrophobicContact CB-CE1 4.01Å; I195-F333 HydrophobicContact CB-CD2 4.46Å; I195-F333 HydrophobicContact CD1-CB 3.95Å; I195-F333 HydrophobicContact CD1-CG 4.49Å; I195-F333 HydrophobicContact CG1-CB 3.52Å; I195-F333 HydrophobicContact CG1-CD1 4.06Å; I195-F333 HydrophobicContact CG1-CD2 3.83Å; I195-F333 HydrophobicContact CG1-CG 3.54Å; A198-F333 HydrophobicContact CB-CE2 3.82Å; A198-F333 HydrophobicContact CB-CZ 3.42Å; A198-F333 VanDerWaalsContact CB-CZ 3.42Å; M199-F333 HydrophobicContact CE-CE2 4.29Å; V311-F333 WeakPolarHBondContact CA-O 3.49Å; F312-F333 HydrophobicContact CB-CB 4.45Å; F312-F333 HydrophobicContact CD1-CD2 4.08Å; F312-F333 PolarHBondContact N-O 3.35Å; F312-F333 PolarHBondContact O-N 3.32Å; L331-F333 HydrophobicContact CD1-CE2 3.98Å; L331-F333 HydrophobicContact CD1-CZ 4.07Å; L331-F333 HydrophobicContact CD2-CE2 3.49Å; L331-F333 VanDerWaalsContact CD2-CE2 3.49Å; L331-F333 HydrophobicContact CD2-CZ 3.91Å; L331-F333 HydrophobicContact CG-CD2 4.14Å; L331-F333 HydrophobicContact CG-CE2 3.48Å; L331-F333 VanDerWaalsContact CG-CE2 3.48Å; L331-F333 HydrophobicContact CG-CZ 4.04Å
334	V	96.8	Very high	86	Confident	0 Å²	0	43.5 Å²	43.5	0%	0	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119	113.2	-174.4	-173.8	0	0	0	0	110.2	V168 F169 A170 M182 S310 V311 L336 L386 L390	V168-V334 PolarHBondContact O-N 2.96Å; F169-V334 CarbonylContact C-O 3.56Å; F169-V334 WeakPolarHBondContact CA-O 3.43Å; F169-V334 HydrophobicContact CB-CB 3.72Å; F169-V334 HydrophobicContact CB-CG1 4.42Å; F169-V334 HydrophobicContact CB-CG2 4.4Å; A170-V334 PolarHBondContact N-O 2.99Å; M182-V334 WeakPolarHBondContact CE-O 3.31Å; S310-V334 CarbonylContact O-C 3.52Å; S310-V334 VanDerWaalsContact O-CA 3.26Å; S310-V334 WeakPolarHBondContact O-CA 3.29Å; V311-V334 HydrophobicContact CG1-CG2 4.22Å; V311-V334 HydrophobicContact CG2-CG1 4.04Å; V311-V334 HydrophobicContact CG2-CG2 4.2Å; V334-L336 HydrophobicContact CG1-CD2 3.57Å; V334-L336 HydrophobicContact CG1-CG 4.12Å; V334-L386 HydrophobicContact CG1-CD1 4.42Å; V334-L390 HydrophobicContact CG1-CD1 4.4Å; V334-L390 HydrophobicContact CG2-CD1 4.22Å; V334-L390 HydrophobicContact CG2-CD2 3.85Å
335	D	96	Very high	84.3	Confident	11 Å²	11	43.9 Å²	43.9	6%	0.059	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.8	106.9	167.9	-174.3	14	0	0	0	108.2	K178 T179 M182 H309 S310	K178-D335 WeakPolarHBondContact CB-OD1 3.24Å; T179-D335 WeakPolarHBondContact CA-OD2 3.45Å; T179-D335 VanDerWaalsContact CB-OD2 3.25Å; T179-D335 WeakPolarHBondContact CB-OD2 3.41Å; T179-D335 PolarHBondContact N-OD2 3.5Å; T179-D335 PolarHBondContact OG1-OD2 3.39Å; M182-D335 HydrophobicContact CB-CB 4.31Å; M182-D335 HydrophobicContact CG-CB 4.1Å; H309-D335 CarbonylContact C-O 3.35Å; H309-D335 WeakPolarHBondContact CA-O 3.42Å; S310-D335 PolarHBondContact N-O 3.46Å; S310-D335 PolarHBondContact O-N 3.45Å
336	L	94.6	Very high	82.6	Confident	3 Å²	3	44.2 Å²	44.2	2%	0.016	23%	0.231	C	C	.	.	P	Polyproline II helix	trans	-78.1	158.7	-177.2	-62.1	173.2	0	0	0	111.1	F169 A170 Y171 K178 H309 V334 L362 L365 L386	F169-L336 HydrophobicContact CD2-CD1 4.28Å; A170-L336 VanDerWaalsContact O-CB 3.24Å; A170-L336 WeakPolarHBondContact O-CB 3.35Å; A170-L336 WeakPolarHBondContact O-CG 3.34Å; A170-L336 PolarHBondContact O-N 2.87Å; A170-L336 VanDerWaalsContact O-N 3.16Å; Y171-L336 HydrophobicContact CD2-CD1 3.92Å; K178-L336 WeakPolarHBondContact CE-O 3.43Å; H309-L336 WeakPolarHBondContact ND1-CA 3.25Å; H309-L336 WeakPolarHBondContact ND1-CD2 3.37Å; V334-L336 HydrophobicContact CG1-CD2 3.57Å; V334-L336 HydrophobicContact CG1-CG 4.12Å; L336-L362 HydrophobicContact CB-CD2 4.27Å; L336-L362 HydrophobicContact CD1-CD2 4.15Å; L336-L365 HydrophobicContact CD1-CD2 3.83Å; L336-L386 HydrophobicContact CD2-CD1 3.91Å; L336-L386 HydrophobicContact CD2-CD2 3.63Å; L336-L386 HydrophobicContact CD2-CG 4.37Å
337	A	92.2	Very high	80.7	Confident	0 Å²	0	44.9 Å²	44.9	0%	0	24%	0.235	C	C	.	.	P	Polyproline II helix	trans	-59.2	163.5	168.6	0	0	0	0	0	111.7	S308 H309 S339 I358	S308-A337 PolarHBondContact O-N 2.95Å; H309-A337 VanDerWaalsContact CE1-CB 3.47Å; H309-A337 WeakPolarHBondContact CE1-CB 3.49Å; H309-A337 PolarHBondContact CE1-N 3.1Å; H309-A337 PolarHBondContact ND1-N 3.28Å; A337-S339 PolarHBondContact O-N 3.28Å; A337-I358 HydrophobicContact CB-CG2 3.86Å
338	G	91.3	Very high	79.1	Confident	2 Å²	2	52.9 Å²	52.9	2%	0.021	27%	0.273	C	S	.	.	P	Polyproline II helix	trans	-52.1	131.1	172	0	0	0	0	0	112.1	S306 E340 L362	S306-G338 PolarHBondContact O-N 3.39Å; G338-E340 VanDerWaalsContact C-N 3.35Å; G338-E340 VanDerWaalsContact C-OE2 3.22Å; G338-E340 WeakPolarHBondContact CA-OE2 3.26Å; G338-L362 WeakPolarHBondContact O-CD1 3.17Å
339	S	89.1	Confident	78	Confident	10 Å²	10	53.7 Å²	53.7	7%	0.07	29%	0.291	C	S	.	.			trans	-86.7	-5.2	177.8	67.8	0	0	0	0	114.3	Y171 G172 Q173 A337 S419	Y171-S339 WeakPolarHBondContact OH-CB 3.37Å; G172-S339 WeakPolarHBondContact CA-OG 3.36Å; G172-S339 PolarHBondContact O-N 2.92Å; G172-S339 VanDerWaalsContact O-N 3.14Å; G172-S339 PolarHBondContact O-OG 2.87Å; Q173-S339 PolarHBondContact N-OG 3.2Å; Q173-S339 VanDerWaalsContact N-OG 3.09Å; A337-S339 PolarHBondContact O-N 3.28Å; S339-S419 PolarHBondContact OG-OG 3.18Å
340	E	85.5	Confident	76.7	Confident	52 Å²	52	57.9 Å²	57.9	24%	0.243	33%	0.325	C	S	.	.	S	Bend	trans	-60.2	141.3	179.2	63.8	-80	-169.7	0	0	111.1	Q173 T174 G338 I342 E415	Q173-E340 WeakPolarHBondContact CA-OE2 3.39Å; Q173-E340 HydrophobicContact CB-CB 4.13Å; Q173-E340 WeakPolarHBondContact CB-OE2 3.24Å; T174-E340 WeakPolarHBondContact CB-OE1 3.41Å; T174-E340 PolarHBondContact N-OE2 3.41Å; T174-E340 PolarHBondContact OG1-OE1 3.48Å; T174-E340 PolarHBondContact OG1-OE2 2.69Å; G338-E340 VanDerWaalsContact C-N 3.35Å; G338-E340 VanDerWaalsContact C-OE2 3.22Å; G338-E340 WeakPolarHBondContact CA-OE2 3.26Å; E340-I342 PolarHBondContact O-N 3.31Å; E340-E415 HydrophobicContact CB-CG 4.04Å
341	R	71.5	Confident	75.4	Confident	175 Å²	175	63 Å²	63	66%	0.66	34%	0.342	S	S	*	.			trans	-75.7	122.9	175.5	-64.2	-178.8	-174.6	178.1	2	107.6	K343 E415	R341-K343 VanDerWaalsContact C-N 3.29Å; R341-K343 PolarHBondContact O-N 3.33Å; R341-E415 PolarHBondContact N-OE1 2.78Å; R341-E415 VanDerWaalsContact N-OE1 3.07Å
342	I	66.4	Low	74.1	Confident	53 Å²	53	67.3 Å²	67.3	27%	0.272	36%	0.364	S	S	.	.			trans	-63.1	101.3	166.9	-63	168.9	0	0	0	105	E340 E344 A355	E340-I342 PolarHBondContact O-N 3.31Å; I342-E344 PolarHBondContact O-N 3.49Å; I342-A355 HydrophobicContact CB-CB 4.4Å; I342-A355 VanDerWaalsContact CD1-CA 3.43Å; I342-A355 HydrophobicContact CD1-CB 3.26Å; I342-A355 HydrophobicContact CG1-CB 4.38Å; I342-A355 HydrophobicContact CG2-CB 4.13Å
343	K	59.3	Low	72.8	Confident	190 Å²	190	70.2 Å²	70.2	83%	0.826	38%	0.377	S	S	*	.			trans	-47.2	130.4	160.5	-67.5	-179.2	-178.7	174.7	0	104.5	R341 S345	R341-K343 VanDerWaalsContact C-N 3.29Å; R341-K343 PolarHBondContact O-N 3.33Å; K343-S345 PolarHBondContact O-N 2.85Å
344	E	48.8	Very low	71.4	Confident	195 Å²	195	70.9 Å²	70.9	91%	0.911	38%	0.38	S	S	*	.			trans	-50.9	81	178.2	-71.7	177.5	163.7	0	0	108.9	I342 G346	I342-E344 PolarHBondContact O-N 3.49Å; E344-G346 PolarHBondContact O-N 2.68Å
345	S	46.3	Very low	69.9	Low	60 Å²	60	71.2 Å²	71.2	42%	0.42	38%	0.383	S	S	.	.			trans	-65.5	128.9	168.5	47.3	0	0	0	0	101.3	K343 S347	K343-S345 PolarHBondContact O-N 2.85Å; S345-S347 PolarHBondContact O-N 2.78Å; S345-S347 PolarHBondContact O-OG 3.22Å; S345-S347 PolarHBondContact OG-OG 3.17Å
346	G	49.8	Very low	68.8	Low	79 Å²	79	76.6 Å²	76.6	81%	0.814	41%	0.406	S	S	*	.			trans	-62.5	32.1	171.8	0	0	0	0	0	112.9	E344 E348	E344-G346 PolarHBondContact O-N 2.68Å; G346-E348 PolarHBondContact O-N 3.39Å
347	S	51.9	Low	67.9	Low	25 Å²	25	79 Å²	79	18%	0.175	42%	0.417	C	S	.	.			trans	-67.4	103.2	169.6	48.5	0	0	0	0	108.7	S345	S345-S347 PolarHBondContact O-N 2.78Å; S345-S347 PolarHBondContact O-OG 3.22Å; S345-S347 PolarHBondContact OG-OG 3.17Å
348	E	56.5	Low	66.8	Low	180 Å²	180	79.6 Å²	79.6	84%	0.841	42%	0.419	S	S	*	.			trans	-72	153.8	174.2	-63.5	-179	163.9	0	0	111.9	G346	G346-E348 PolarHBondContact O-N 3.39Å
349	G	68	Low	66	Low	52 Å²	52	81.9 Å²	81.9	54%	0.536	43%	0.431	S	S	.	.	T	Hydrogen-bonded Turn	trans	73.7	-132.3	168.6	0	0	0	0	0	115.3	R351 L352 E353	G349-R351 VanDerWaalsContact C-N 3.26Å; G349-R351 PolarHBondContact O-N 3.12Å; G349-L352 WeakPolarHBondContact O-CB 3.46Å; G349-L352 PolarHBondContact O-N 2.88Å; G349-E353 PolarHBondContact O-N 3.31Å
350	A	65	Low	65.7	Low	87 Å²	87	85.8 Å²	85.8	72%	0.719	45%	0.447	S	S	*	.	H	α-helix	trans	-59.7	-31.7	-169.1	0	0	0	0	0	114.2	L352 E353 E354	A350-L352 VanDerWaalsContact C-N 3.33Å; A350-L352 PolarHBondContact O-N 2.75Å; A350-E353 PolarHBondContact O-N 3.1Å; A350-E354 WeakPolarHBondContact O-CB 3.28Å; A350-E354 PolarHBondContact O-N 3.16Å
351	R	65.5	Low	65.8	Low	130 Å²	130	83.4 Å²	83.4	49%	0.491	44%	0.436	S	S	.	.	H	α-helix	trans	-68.1	-32.2	177.8	-76.3	-179.4	174.3	166.8	-0.1	112.6	N302 G349 A355	N302-R351 PolarHBondContact ND2-NE 3.32Å; N302-R351 PolarHBondContact ND2-NH2 2.96Å; G349-R351 VanDerWaalsContact C-N 3.26Å; G349-R351 PolarHBondContact O-N 3.12Å; R351-A355 VanDerWaalsContact O-CB 3.25Å; R351-A355 WeakPolarHBondContact O-CB 3.38Å; R351-A355 PolarHBondContact O-N 3.48Å
352	L	66.7	Low	66.5	Low	91 Å²	91	75.8 Å²	75.8	48%	0.476	41%	0.408	S	S	.	.	H	α-helix	trans	-69.4	-45	176.6	-170.1	75.2	0	0	0	110.9	G349 A350 A355 K356	G349-L352 WeakPolarHBondContact O-CB 3.46Å; G349-L352 PolarHBondContact O-N 2.88Å; A350-L352 VanDerWaalsContact C-N 3.33Å; A350-L352 PolarHBondContact O-N 2.75Å; L352-A355 PolarHBondContact O-N 2.79Å; L352-K356 WeakPolarHBondContact O-CB 3.36Å; L352-K356 PolarHBondContact O-N 3.4Å
353	E	69.9	Low	67.5	Low	77 Å²	77	76.4 Å²	76.4	36%	0.36	42%	0.417	S	S	.	.	H	α-helix	trans	-64.8	-42.9	177.1	-74.3	-60.9	129.8	0	0	111	G349 A350 A355 K356 F357	G349-E353 PolarHBondContact O-N 3.31Å; A350-E353 PolarHBondContact O-N 3.1Å; E353-A355 PolarHBondContact O-N 2.64Å; E353-K356 WeakPolarHBondContact O-CB 3.38Å; E353-K356 PolarHBondContact O-N 3.04Å; E353-K356 IonicContact OE1-NZ 3.46Å; E353-K356 PolarHBondContact OE1-NZ 3.16Å; E353-K356 IonicContact OE2-NZ 2.96Å; E353-K356 PolarHBondContact OE2-NZ 3.43Å; E353-F357 HydrophobicContact CB-CE2 4.23Å; E353-F357 WeakPolarHBondContact O-CD2 3.45Å; E353-F357 PolarHBondContact O-N 3.29Å
354	E	67.8	Low	69	Low	16 Å²	16	67.7 Å²	67.7	8%	0.075	38%	0.38	C	S	.	.	H	α-helix	trans	-57	-49.7	173.8	-171	-165.7	161	0	0	112.1	Y226 R307 A350 K356 F357 I358	Y226-E354 HydrophobicContact CE2-CG 4.27Å; Y226-E354 PolarHBondContact OH-OE1 3.01Å; Y226-E354 VanDerWaalsContact OH-OE1 3.06Å; R307-E354 WeakPolarHBondContact CD-OE1 3.31Å; R307-E354 IonicContact CZ-OE1 3.17Å; R307-E354 IonicContact NE-OE1 3.71Å; R307-E354 IonicContact NH1-OE1 3.57Å; R307-E354 PolarHBondContact NH1-OE1 2.78Å; R307-E354 IonicContact NH1-OE2 2.93Å; R307-E354 PolarHBondContact NH1-OE2 2.92Å; A350-E354 WeakPolarHBondContact O-CB 3.28Å; A350-E354 PolarHBondContact O-N 3.16Å; E354-K356 PolarHBondContact O-N 3.4Å; E354-F357 PolarHBondContact O-N 2.98Å; E354-F357 VanDerWaalsContact O-N 3.16Å; E354-I358 HydrophobicContact CG-CD1 4.25Å; E354-I358 WeakPolarHBondContact O-CD1 3.46Å; E354-I358 WeakPolarHBondContact O-CG1 3.36Å; E354-I358 PolarHBondContact O-N 2.82Å; E354-I358 VanDerWaalsContact O-N 3.11Å
355	A	66.9	Low	71.1	Confident	8 Å²	8	58.5 Å²	58.5	7%	0.066	34%	0.337	C	S	.	.	H	α-helix	trans	-56.4	-38.8	176.5	0	0	0	0	0	112.9	I342 R351 L352 E353 N359	I342-A355 HydrophobicContact CB-CB 4.4Å; I342-A355 VanDerWaalsContact CD1-CA 3.43Å; I342-A355 HydrophobicContact CD1-CB 3.26Å; I342-A355 HydrophobicContact CG1-CB 4.38Å; I342-A355 HydrophobicContact CG2-CB 4.13Å; R351-A355 VanDerWaalsContact O-CB 3.25Å; R351-A355 WeakPolarHBondContact O-CB 3.38Å; R351-A355 PolarHBondContact O-N 3.48Å; L352-A355 PolarHBondContact O-N 2.79Å; E353-A355 PolarHBondContact O-N 2.64Å; A355-N359 PolarHBondContact O-N 3.49Å; A355-N359 PolarHBondContact O-ND2 3.26Å
356	K	72	Confident	73.1	Confident	123 Å²	123	56.1 Å²	56.1	54%	0.535	32%	0.323	S	S	.	.	H	α-helix	trans	-69	-40.7	178.3	-177.9	-176.4	175.5	-168.2	0	111.7	L352 E353 E354 K360	L352-K356 WeakPolarHBondContact O-CB 3.36Å; L352-K356 PolarHBondContact O-N 3.4Å; E353-K356 WeakPolarHBondContact O-CB 3.38Å; E353-K356 PolarHBondContact O-N 3.04Å; E353-K356 IonicContact OE1-NZ 3.46Å; E353-K356 PolarHBondContact OE1-NZ 3.16Å; E353-K356 IonicContact OE2-NZ 2.96Å; E353-K356 PolarHBondContact OE2-NZ 3.43Å; E354-K356 PolarHBondContact O-N 3.4Å; K356-K360 WeakPolarHBondContact O-CB 3.28Å; K356-K360 PolarHBondContact O-N 2.88Å
357	F	75.9	Confident	75	Confident	54 Å²	54	56.5 Å²	56.5	24%	0.237	30%	0.303	C	S	.	.	H	α-helix	trans	-70.9	-37.3	179.3	-73.3	-64.6	0	0	0	113.6	N227 E228 E353 E354 K360 S361	N227-F357 WeakPolarHBondContact OD1-CD2 3.38Å; N227-F357 WeakPolarHBondContact OD1-CG 3.09Å; E228-F357 HydrophobicContact CG-CD1 3.71Å; E228-F357 HydrophobicContact CG-CE1 4.29Å; E228-F357 HydrophobicContact CG-CG 4.4Å; E353-F357 HydrophobicContact CB-CE2 4.23Å; E353-F357 WeakPolarHBondContact O-CD2 3.45Å; E353-F357 PolarHBondContact O-N 3.29Å; E354-F357 PolarHBondContact O-N 2.98Å; E354-F357 VanDerWaalsContact O-N 3.16Å; F357-K360 HydrophobicContact CD1-CD 4.21Å; F357-K360 WeakPolarHBondContact O-CB 3.25Å; F357-K360 PolarHBondContact O-N 3.4Å; F357-S361 PolarHBondContact O-N 3.48Å
358	I	69.2	Low	76.8	Confident	12 Å²	12	55.3 Å²	55.3	6%	0.062	30%	0.295	C	S	.	.	H	α-helix	trans	-60.7	-54.1	176.4	-61.6	157.5	0	0	0	110	R307 A337 E354 K360 S361 L362	R307-I358 HydrophobicContact CB-CD1 3.45Å; R307-I358 VanDerWaalsContact CB-CD1 3.45Å; R307-I358 HydrophobicContact CB-CG1 4.19Å; R307-I358 HydrophobicContact CG-CD1 3.52Å; R307-I358 WeakPolarHBondContact O-CG1 3.34Å; A337-I358 HydrophobicContact CB-CG2 3.86Å; E354-I358 HydrophobicContact CG-CD1 4.25Å; E354-I358 WeakPolarHBondContact O-CD1 3.46Å; E354-I358 WeakPolarHBondContact O-CG1 3.36Å; E354-I358 PolarHBondContact O-N 2.82Å; E354-I358 VanDerWaalsContact O-N 3.11Å; I358-K360 PolarHBondContact O-N 3.36Å; I358-S361 PolarHBondContact O-N 2.78Å; I358-S361 PolarHBondContact O-OG 2.94Å; I358-L362 PolarHBondContact O-N 2.9Å
359	N	73.2	Confident	78.4	Confident	51 Å²	51	46.8 Å²	46.8	27%	0.273	26%	0.255	S	S	.	.	H	α-helix	trans	-63.6	-32.2	178.4	-74.2	-58.2	0	0	0	112.2	A355 S363	A355-N359 PolarHBondContact O-N 3.49Å; A355-N359 PolarHBondContact O-ND2 3.26Å; N359-S363 WeakPolarHBondContact O-CB 3.49Å; N359-S363 PolarHBondContact O-N 2.81Å
360	K	83.5	Confident	79.3	Confident	91 Å²	91	46.6 Å²	46.6	40%	0.396	24%	0.244	S	C	.	.	H	α-helix	trans	-59.3	-52	173.8	-177.3	-172.7	177.3	-166.2	0	111.1	K356 F357 I358 L362 S363 C364 N383	K356-K360 WeakPolarHBondContact O-CB 3.28Å; K356-K360 PolarHBondContact O-N 2.88Å; F357-K360 HydrophobicContact CD1-CD 4.21Å; F357-K360 WeakPolarHBondContact O-CB 3.25Å; F357-K360 PolarHBondContact O-N 3.4Å; I358-K360 PolarHBondContact O-N 3.36Å; K360-L362 PolarHBondContact O-N 2.74Å; K360-S363 PolarHBondContact O-N 2.77Å; K360-C364 WeakPolarHBondContact O-CB 3.42Å; K360-C364 PolarHBondContact O-N 2.95Å; K360-C364 PolarHBondContact O-SG 2.78Å; K360-N383 VanDerWaalsContact CE-O 3.26Å; K360-N383 WeakPolarHBondContact CE-O 3.47Å; K360-N383 PolarHBondContact NZ-O 2.97Å
361	S	87	Confident	80.4	Confident	2 Å²	2	42.6 Å²	42.6	1%	0.014	21%	0.21	C	C	.	.	H	α-helix	trans	-60.3	-42.9	-176.9	64.3	0	0	0	0	113.1	H309 F357 I358 C364 L365	H309-S361 PolarHBondContact CE1-OG 2.78Å; H309-S361 PolarHBondContact NE2-OG 3.4Å; F357-S361 PolarHBondContact O-N 3.48Å; I358-S361 PolarHBondContact O-N 2.78Å; I358-S361 PolarHBondContact O-OG 2.94Å; S361-C364 PolarHBondContact O-N 2.85Å; S361-L365 PolarHBondContact O-N 2.58Å
362	L	88.1	Confident	81.3	Confident	15 Å²	15	37.5 Å²	37.5	8%	0.079	19%	0.193	C	C	.	.	H	α-helix	trans	-72.1	-36.6	176.6	-65.9	-179.8	0	0	0	112.8	Y171 L336 G338 I358 K360 L365 G366	Y171-L362 HydrophobicContact CD2-CD2 4.27Å; Y171-L362 HydrophobicContact CE2-CD1 4.39Å; Y171-L362 HydrophobicContact CE2-CD2 4.12Å; L336-L362 HydrophobicContact CB-CD2 4.27Å; L336-L362 HydrophobicContact CD1-CD2 4.15Å; G338-L362 WeakPolarHBondContact O-CD1 3.17Å; I358-L362 PolarHBondContact O-N 2.9Å; K360-L362 PolarHBondContact O-N 2.74Å; L362-L365 WeakPolarHBondContact O-CB 3.5Å; L362-L365 PolarHBondContact O-N 2.91Å; L362-G366 PolarHBondContact O-N 3.26Å
363	S	87.2	Confident	82.1	Confident	66 Å²	66	38.7 Å²	38.7	46%	0.462	19%	0.192	S	C	.	.	H	α-helix	trans	-63.2	-44.2	172.8	-178.5	0	0	0	0	111.2	N359 K360 L365 G366 Q367	N359-S363 WeakPolarHBondContact O-CB 3.49Å; N359-S363 PolarHBondContact O-N 2.81Å; K360-S363 PolarHBondContact O-N 2.77Å; S363-L365 VanDerWaalsContact C-N 3.31Å; S363-L365 PolarHBondContact O-N 3.33Å; S363-G366 PolarHBondContact O-N 3.46Å; S363-G366 VanDerWaalsContact O-N 3.17Å; S363-Q367 WeakPolarHBondContact O-CG 3.39Å; S363-Q367 PolarHBondContact O-N 2.73Å
364	C	90.7	Very high	82.8	Confident	7 Å²	7	41.2 Å²	41.2	5%	0.047	20%	0.202	C	C	.	.	H	α-helix	trans	-60.9	-40.2	173.7	-68	0	0	0	0	111.7	K360 S361 G366 Q367 V368 N383 T387	K360-C364 WeakPolarHBondContact O-CB 3.42Å; K360-C364 PolarHBondContact O-N 2.95Å; K360-C364 PolarHBondContact O-SG 2.78Å; S361-C364 PolarHBondContact O-N 2.85Å; C364-G366 VanDerWaalsContact C-N 3.32Å; C364-G366 PolarHBondContact O-N 3.15Å; C364-Q367 WeakPolarHBondContact O-CB 3.25Å; C364-Q367 PolarHBondContact O-N 3.46Å; C364-V368 WeakPolarHBondContact O-CG2 3.43Å; C364-V368 PolarHBondContact O-N 3.41Å; C364-N383 HydrophobicContact CB-CB 4.19Å; C364-N383 VanDerWaalsContact SG-CB 3.54Å; C364-T387 HydrophobicContact CB-CG2 4.04Å
365	L	91.1	Very high	83.5	Confident	2 Å²	2	48.8 Å²	48.8	1%	0.01	23%	0.234	C	C	.	.	H	α-helix	trans	-59	-44.6	174.3	-175.3	65.7	0	0	0	111.3	L336 S361 L362 S363 V368 F369 T387 L394	L336-L365 HydrophobicContact CD1-CD2 3.83Å; S361-L365 PolarHBondContact O-N 2.58Å; L362-L365 WeakPolarHBondContact O-CB 3.5Å; L362-L365 PolarHBondContact O-N 2.91Å; S363-L365 VanDerWaalsContact C-N 3.31Å; S363-L365 PolarHBondContact O-N 3.33Å; L365-V368 WeakPolarHBondContact O-CB 3.43Å; L365-V368 PolarHBondContact O-N 3.09Å; L365-F369 HydrophobicContact CD1-CD2 4.31Å; L365-F369 HydrophobicContact CD1-CE2 3.76Å; L365-F369 HydrophobicContact CD2-CE2 4.43Å; L365-F369 HydrophobicContact CG-CD2 4.15Å; L365-F369 HydrophobicContact CG-CE2 3.85Å; L365-F369 VanDerWaalsContact O-CD2 3.31Å; L365-F369 WeakPolarHBondContact O-CD2 3.11Å; L365-F369 PolarHBondContact O-N 3.14Å; L365-F369 VanDerWaalsContact O-N 3.1Å; L365-T387 HydrophobicContact CB-CG2 4.14Å; L365-T387 HydrophobicContact CD1-CG2 4.25Å; L365-L394 HydrophobicContact CD1-CD1 3.58Å; L365-L394 HydrophobicContact CD1-CD2 3.72Å; L365-L394 HydrophobicContact CD1-CG 4.33Å
366	G	88.8	Confident	84.4	Confident	11 Å²	11	52.7 Å²	52.7	11%	0.113	25%	0.251	C	S	.	.	H	α-helix	trans	-67.8	-33.5	175.8	0	0	0	0	0	114.6	L362 S363 C364 V368 F369 T370 F422	L362-G366 PolarHBondContact O-N 3.26Å; S363-G366 PolarHBondContact O-N 3.46Å; S363-G366 VanDerWaalsContact O-N 3.17Å; C364-G366 VanDerWaalsContact C-N 3.32Å; C364-G366 PolarHBondContact O-N 3.15Å; G366-V368 VanDerWaalsContact C-N 3.35Å; G366-F369 PolarHBondContact O-N 3.39Å; G366-T370 WeakPolarHBondContact O-CB 3.49Å; G366-T370 PolarHBondContact O-N 2.84Å; G366-T370 PolarHBondContact O-OG1 3.38Å; G366-F422 VanDerWaalsContact CA-CE2 3.48Å
367	Q	90	Very high	85	Confident	87 Å²	87	57.5 Å²	57.5	41%	0.407	27%	0.272	S	S	.	.	H	α-helix	trans	-63.6	-40.9	171.1	-70.6	171	0.9	0	0	111.5	S363 C364 T370 A371 P380	S363-Q367 WeakPolarHBondContact O-CG 3.39Å; S363-Q367 PolarHBondContact O-N 2.73Å; C364-Q367 WeakPolarHBondContact O-CB 3.25Å; C364-Q367 PolarHBondContact O-N 3.46Å; Q367-T370 PolarHBondContact O-N 3.45Å; Q367-A371 VanDerWaalsContact O-CB 3.25Å; Q367-A371 WeakPolarHBondContact O-CB 3.49Å; Q367-A371 PolarHBondContact O-N 3.25Å; Q367-P380 HydrophobicContact CB-CG 4.18Å
368	V	90.7	Very high	85.6	Confident	0 Å²	0	61.4 Å²	61.4	0%	0	29%	0.291	C	S	.	.	H	α-helix	trans	-60.8	-50.4	175.7	166.9	0	0	0	0	110.6	C364 L365 G366 T370 A371 L372 I379 P380 Y381 T387 L394	C364-V368 WeakPolarHBondContact O-CG2 3.43Å; C364-V368 PolarHBondContact O-N 3.41Å; L365-V368 WeakPolarHBondContact O-CB 3.43Å; L365-V368 PolarHBondContact O-N 3.09Å; G366-V368 VanDerWaalsContact C-N 3.35Å; V368-T370 PolarHBondContact O-N 2.89Å; V368-A371 PolarHBondContact O-N 2.84Å; V368-L372 HydrophobicContact CG1-CD1 3.82Å; V368-L372 HydrophobicContact CG1-CG 4.43Å; V368-L372 WeakPolarHBondContact O-CB 3.35Å; V368-L372 VanDerWaalsContact O-CG 3.25Å; V368-L372 WeakPolarHBondContact O-CG 3.39Å; V368-L372 PolarHBondContact O-N 3.02Å; V368-I379 HydrophobicContact CB-CG2 4.34Å; V368-I379 HydrophobicContact CG1-CG2 3.82Å; V368-I379 HydrophobicContact CG2-CG2 4.26Å; V368-P380 HydrophobicContact CG2-CG 4.1Å; V368-Y381 HydrophobicContact CG1-CD1 3.88Å; V368-Y381 HydrophobicContact CG1-CE1 3.51Å; V368-Y381 HydrophobicContact CG2-CD1 4.12Å; V368-T387 HydrophobicContact CG2-CG2 3.94Å; V368-L394 HydrophobicContact CG1-CB 4.11Å; V368-L394 HydrophobicContact CG1-CD1 4.04Å
369	F	88.4	Confident	86.6	Confident	0 Å²	0	62.3 Å²	62.3	0%	0	30%	0.295	C	S	.	.	H	α-helix	trans	-62.5	-41	177.1	-76.5	-61.7	0	0	0	112.8	I69 F169 L365 G366 A371 L372 Y373 L394 F422 V426 C429	I69-F369 HydrophobicContact CD1-CD1 4.31Å; I69-F369 HydrophobicContact CD1-CE1 3.98Å; F169-F369 HydrophobicContact CE1-CZ 4.14Å; F169-F369 HydrophobicContact CE2-CE2 4.5Å; F169-F369 HydrophobicContact CE2-CZ 4.46Å; F169-F369 HydrophobicContact CZ-CE2 4.01Å; F169-F369 AromaticContact CZ-CZ 3.56Å; F169-F369 HydrophobicContact CZ-CZ 3.56Å; L365-F369 HydrophobicContact CD1-CD2 4.31Å; L365-F369 HydrophobicContact CD1-CE2 3.76Å; L365-F369 HydrophobicContact CD2-CE2 4.43Å; L365-F369 HydrophobicContact CG-CD2 4.15Å; L365-F369 HydrophobicContact CG-CE2 3.85Å; L365-F369 VanDerWaalsContact O-CD2 3.31Å; L365-F369 WeakPolarHBondContact O-CD2 3.11Å; L365-F369 PolarHBondContact O-N 3.14Å; L365-F369 VanDerWaalsContact O-N 3.1Å; G366-F369 PolarHBondContact O-N 3.39Å; F369-A371 PolarHBondContact O-N 2.79Å; F369-L372 HydrophobicContact CD1-CD1 4.49Å; F369-L372 PolarHBondContact O-N 2.77Å; F369-Y373 WeakPolarHBondContact O-CB 3.39Å; F369-Y373 PolarHBondContact O-N 3.03Å; F369-L394 HydrophobicContact CE1-CD2 4.11Å; F369-L394 HydrophobicContact CE2-CD2 3.94Å; F369-L394 HydrophobicContact CZ-CD2 3.4Å; F369-L394 VanDerWaalsContact CZ-CD2 3.4Å; F369-F422 HydrophobicContact CD2-CZ 4.09Å; F369-V426 HydrophobicContact CB-CG2 4.24Å; F369-V426 HydrophobicContact CD1-CG1 4.05Å; F369-V426 HydrophobicContact CD1-CG2 4.34Å; F369-V426 HydrophobicContact CD2-CG1 4.5Å; F369-V426 HydrophobicContact CD2-CG2 3.66Å; F369-V426 HydrophobicContact CE1-CG1 3.89Å; F369-V426 HydrophobicContact CE2-CG1 4.32Å; F369-V426 HydrophobicContact CE2-CG2 4.04Å; F369-V426 HydrophobicContact CG-CG1 4.37Å; F369-V426 HydrophobicContact CG-CG2 3.83Å; F369-V426 HydrophobicContact CZ-CG1 4.03Å; F369-C429 PolarHBondContact O-SG 2.78Å
370	T	87.1	Confident	87.4	Confident	48 Å²	48	60.6 Å²	60.6	29%	0.294	29%	0.287	S	S	.	.	H	α-helix	trans	-62.5	-43.7	176.7	-58	0	0	0	0	111.6	G366 Q367 V368 L372 Y373 K374	G366-T370 WeakPolarHBondContact O-CB 3.49Å; G366-T370 PolarHBondContact O-N 2.84Å; G366-T370 PolarHBondContact O-OG1 3.38Å; Q367-T370 PolarHBondContact O-N 3.45Å; V368-T370 PolarHBondContact O-N 2.89Å; T370-L372 VanDerWaalsContact C-N 3.34Å; T370-Y373 PolarHBondContact O-N 3.16Å; T370-K374 HydrophobicContact CG2-CD 4.11Å; T370-K374 WeakPolarHBondContact O-CB 3.47Å; T370-K374 WeakPolarHBondContact O-CG 3.28Å; T370-K374 PolarHBondContact O-N 3.08Å
371	A	88.2	Confident	87.8	Confident	3 Å²	3	57.6 Å²	57.6	3%	0.025	27%	0.274	C	S	.	.	H	α-helix	trans	-65.7	-38.5	177.5	0	0	0	0	0	111.5	Q367 V368 F369 K374 K375 E376 I379	Q367-A371 VanDerWaalsContact O-CB 3.25Å; Q367-A371 WeakPolarHBondContact O-CB 3.49Å; Q367-A371 PolarHBondContact O-N 3.25Å; V368-A371 PolarHBondContact O-N 2.84Å; F369-A371 PolarHBondContact O-N 2.79Å; A371-K374 PolarHBondContact O-N 3.48Å; A371-K375 PolarHBondContact O-N 3.44Å; A371-E376 HydrophobicContact CB-CB 4.23Å; A371-E376 HydrophobicContact CB-CG 4.43Å; A371-E376 PolarHBondContact O-N 3.21Å; A371-I379 HydrophobicContact CB-CD1 3.69Å
372	L	85.5	Confident	87.9	Confident	24 Å²	24	65.6 Å²	65.6	13%	0.126	30%	0.304	C	S	.	.	H	α-helix	trans	-65.1	-47	174.5	-73.5	169.9	0	0	0	111.9	V368 F369 T370 K374 K375 I379 L394	V368-L372 HydrophobicContact CG1-CD1 3.82Å; V368-L372 HydrophobicContact CG1-CG 4.43Å; V368-L372 WeakPolarHBondContact O-CB 3.35Å; V368-L372 VanDerWaalsContact O-CG 3.25Å; V368-L372 WeakPolarHBondContact O-CG 3.39Å; V368-L372 PolarHBondContact O-N 3.02Å; F369-L372 HydrophobicContact CD1-CD1 4.49Å; F369-L372 PolarHBondContact O-N 2.77Å; T370-L372 VanDerWaalsContact C-N 3.34Å; L372-K374 VanDerWaalsContact C-N 3.31Å; L372-K374 PolarHBondContact O-N 2.7Å; L372-K375 PolarHBondContact O-N 3.43Å; L372-I379 HydrophobicContact CD2-CD1 3.96Å; L372-I379 HydrophobicContact CD2-CG1 3.98Å; L372-I379 HydrophobicContact CD2-CG2 4.33Å; L372-I379 HydrophobicContact CG-CD1 4.24Å; L372-I379 HydrophobicContact CG-CG2 4.18Å; L372-L394 VanDerWaalsContact CD1-O 3.29Å; L372-L394 WeakPolarHBondContact CD1-O 3.36Å
373	Y	82.6	Confident	88	Confident	116 Å²	116	68.3 Å²	68.3	46%	0.455	32%	0.318	S	S	.	.	H	α-helix	trans	-56.5	-45.7	175	173.1	-111.8	0	0	0	111.8	F369 T370 K375 Q428	F369-Y373 WeakPolarHBondContact O-CB 3.39Å; F369-Y373 PolarHBondContact O-N 3.03Å; T370-Y373 PolarHBondContact O-N 3.16Å; Y373-K375 PolarHBondContact O-N 3.2Å; Y373-Q428 HydrophobicContact CD2-CB 4.11Å; Y373-Q428 WeakPolarHBondContact CD2-O 3.3Å; Y373-Q428 HydrophobicContact CE2-CB 3.86Å
374	K	84.3	Confident	88.2	Confident	130 Å²	130	65.3 Å²	65.3	57%	0.565	30%	0.297	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.3	-3.9	177.8	-71	177.9	180	179.8	0	114	T370 A371 L372 E376	T370-K374 HydrophobicContact CG2-CD 4.11Å; T370-K374 WeakPolarHBondContact O-CB 3.47Å; T370-K374 WeakPolarHBondContact O-CG 3.28Å; T370-K374 PolarHBondContact O-N 3.08Å; A371-K374 PolarHBondContact O-N 3.48Å; L372-K374 VanDerWaalsContact C-N 3.31Å; L372-K374 PolarHBondContact O-N 2.7Å; K374-E376 HydrophobicContact CB-CG 3.88Å; K374-E376 WeakPolarHBondContact CD-OE1 3.28Å; K374-E376 PolarHBondContact O-N 3.3Å
375	K	82.4	Confident	88.2	Confident	174 Å²	174	68.4 Å²	68.4	76%	0.757	31%	0.308	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.1	41.8	-175.3	-57.4	-178.8	-179.9	180	0	112.1	A371 L372 Y373	A371-K375 PolarHBondContact O-N 3.44Å; L372-K375 PolarHBondContact O-N 3.43Å; Y373-K375 PolarHBondContact O-N 3.2Å
376	E	86	Confident	88.2	Confident	91 Å²	91	68.3 Å²	68.3	43%	0.425	31%	0.307	S	S	.	.			trans	-64.7	146.5	177.1	-68.1	-178.9	-163.8	0	0	110.7	A371 K374 H378 I379	A371-E376 HydrophobicContact CB-CB 4.23Å; A371-E376 HydrophobicContact CB-CG 4.43Å; A371-E376 PolarHBondContact O-N 3.21Å; K374-E376 HydrophobicContact CB-CG 3.88Å; K374-E376 WeakPolarHBondContact CD-OE1 3.28Å; K374-E376 PolarHBondContact O-N 3.3Å; E376-H378 VanDerWaalsContact C-N 3.29Å; E376-H378 PolarHBondContact O-N 2.89Å; E376-I379 HydrophobicContact CB-CD1 4.43Å; E376-I379 WeakPolarHBondContact O-CD1 3.32Å
377	K	85.2	Confident	88.3	Confident	223 Å²	223	67.8 Å²	67.8	97%	0.97	30%	0.302	S	S	*	.	S	Bend	trans	-65.7	-33.1	-179.7	-69.1	-175.9	178.8	-179.7	0	112.9
378	H	88.8	Confident	88.3	Confident	137 Å²	137	65.1 Å²	65.1	63%	0.634	29%	0.288	S	S	*	.			trans	-115.2	115.2	-178.7	174.2	-90.5	0	0	0	109.5	E376	E376-H378 VanDerWaalsContact C-N 3.29Å; E376-H378 PolarHBondContact O-N 2.89Å
379	I	89.4	Confident	88.3	Confident	30 Å²	30	66.4 Å²	66.4	15%	0.154	30%	0.295	C	S	.	.			trans	-98.5	125.6	176	-49.6	-58.1	0	0	0	108.9	V368 A371 L372 E376 Y381	V368-I379 HydrophobicContact CB-CG2 4.34Å; V368-I379 HydrophobicContact CG1-CG2 3.82Å; V368-I379 HydrophobicContact CG2-CG2 4.26Å; A371-I379 HydrophobicContact CB-CD1 3.69Å; L372-I379 HydrophobicContact CD2-CD1 3.96Å; L372-I379 HydrophobicContact CD2-CG1 3.98Å; L372-I379 HydrophobicContact CD2-CG2 4.33Å; L372-I379 HydrophobicContact CG-CD1 4.24Å; L372-I379 HydrophobicContact CG-CG2 4.18Å; E376-I379 HydrophobicContact CB-CD1 4.43Å; E376-I379 WeakPolarHBondContact O-CD1 3.32Å; I379-Y381 HydrophobicContact CB-CD2 3.89Å; I379-Y381 HydrophobicContact CB-CE2 3.48Å; I379-Y381 VanDerWaalsContact CB-CE2 3.48Å; I379-Y381 HydrophobicContact CG1-CE2 4.21Å; I379-Y381 HydrophobicContact CG2-CD1 4.11Å; I379-Y381 HydrophobicContact CG2-CD2 3.91Å; I379-Y381 HydrophobicContact CG2-CE1 3.68Å; I379-Y381 HydrophobicContact CG2-CE2 3.5Å; I379-Y381 HydrophobicContact CG2-CG 4.21Å; I379-Y381 PolarHBondContact O-N 3.18Å
380	P	91.2	Very high	88.2	Confident	16 Å²	16	66.5 Å²	66.5	10%	0.104	30%	0.296	C	S	.	.			trans	-79.5	48.1	-169.6	32.7	-37.1	0	0	0	114.3	Q367 V368 R382 N383	Q367-P380 HydrophobicContact CB-CG 4.18Å; V368-P380 HydrophobicContact CG2-CG 4.1Å; P380-R382 PolarHBondContact O-N 3.21Å; P380-R382 VanDerWaalsContact O-N 3.12Å; P380-N383 WeakPolarHBondContact CB-ND2 3.4Å; P380-N383 WeakPolarHBondContact O-CB 3.08Å; P380-N383 PolarHBondContact O-N 2.9Å
381	Y	90.3	Very high	88.3	Confident	27 Å²	27	66.4 Å²	66.4	11%	0.106	29%	0.292	C	S	.	.	G	3₁₀ helix	trans	-56.5	-31.9	-178.2	-64.4	-64.9	0	0	0	113.4	V368 I379 N383 T387 Y388 Q391 L394 G395	V368-Y381 HydrophobicContact CG1-CD1 3.88Å; V368-Y381 HydrophobicContact CG1-CE1 3.51Å; V368-Y381 HydrophobicContact CG2-CD1 4.12Å; I379-Y381 HydrophobicContact CB-CD2 3.89Å; I379-Y381 HydrophobicContact CB-CE2 3.48Å; I379-Y381 VanDerWaalsContact CB-CE2 3.48Å; I379-Y381 HydrophobicContact CG1-CE2 4.21Å; I379-Y381 HydrophobicContact CG2-CD1 4.11Å; I379-Y381 HydrophobicContact CG2-CD2 3.91Å; I379-Y381 HydrophobicContact CG2-CE1 3.68Å; I379-Y381 HydrophobicContact CG2-CE2 3.5Å; I379-Y381 HydrophobicContact CG2-CG 4.21Å; I379-Y381 PolarHBondContact O-N 3.18Å; Y381-N383 VanDerWaalsContact C-N 3.31Å; Y381-N383 PolarHBondContact O-N 3.43Å; Y381-T387 CarbonylContact O-C 3.52Å; Y381-T387 VanDerWaalsContact O-CB 3.26Å; Y381-T387 WeakPolarHBondContact O-CB 3.45Å; Y381-T387 PolarHBondContact O-OG1 2.77Å; Y381-Y388 VanDerWaalsContact O-CA 3.24Å; Y381-Y388 WeakPolarHBondContact O-CA 3.04Å; Y381-Y388 WeakPolarHBondContact O-CB 3.45Å; Y381-Y388 PolarHBondContact O-N 2.94Å; Y381-Q391 HydrophobicContact CD1-CB 3.96Å; Y381-Q391 HydrophobicContact CD1-CG 3.97Å; Y381-Q391 HydrophobicContact CD2-CB 4.42Å; Y381-Q391 HydrophobicContact CD2-CG 3.61Å; Y381-Q391 HydrophobicContact CE1-CG 4.32Å; Y381-Q391 HydrophobicContact CE2-CG 3.96Å; Y381-Q391 HydrophobicContact CG-CB 3.89Å; Y381-Q391 HydrophobicContact CG-CG 3.59Å; Y381-L394 HydrophobicContact CE1-CB 4.04Å; Y381-G395 VanDerWaalsContact OH-CA 3.3Å; Y381-G395 WeakPolarHBondContact OH-CA 3.24Å; Y381-G395 PolarHBondContact OH-N 3.46Å
382	R	90	Very high	87.9	Confident	170 Å²	170	67.6 Å²	67.6	64%	0.642	30%	0.298	S	S	*	.	G	3₁₀ helix	trans	-82.3	-1.6	-175.8	-67.6	-177.7	174.6	159.7	-1.7	114.9	L250 P380 S384 Y388	L250-R382 VanDerWaalsContact CD1-NH2 3.26Å; P380-R382 PolarHBondContact O-N 3.21Å; P380-R382 VanDerWaalsContact O-N 3.12Å; R382-S384 PolarHBondContact O-N 3.09Å; R382-Y388 HydrophobicContact CG-CD2 4Å; R382-Y388 HydrophobicContact CG-CE2 4.08Å; R382-Y388 HydrophobicContact CG-CG 4.24Å
383	N	89.6	Confident	87.6	Confident	73 Å²	73	67 Å²	67	39%	0.39	30%	0.295	S	S	.	.	G	3₁₀ helix	trans	-70.4	-20	-176.5	-74.3	9.1	0	0	0	113.6	K360 C364 P380 Y381	K360-N383 VanDerWaalsContact CE-O 3.26Å; K360-N383 WeakPolarHBondContact CE-O 3.47Å; K360-N383 PolarHBondContact NZ-O 2.97Å; C364-N383 HydrophobicContact CB-CB 4.19Å; C364-N383 VanDerWaalsContact SG-CB 3.54Å; P380-N383 WeakPolarHBondContact CB-ND2 3.4Å; P380-N383 WeakPolarHBondContact O-CB 3.08Å; P380-N383 PolarHBondContact O-N 2.9Å; Y381-N383 VanDerWaalsContact C-N 3.31Å; Y381-N383 PolarHBondContact O-N 3.43Å
384	S	91.5	Very high	87.5	Confident	2 Å²	2	61.5 Å²	61.5	1%	0.014	27%	0.274	C	S	.	.	S	Bend	trans	-142	156.2	171.2	74.6	0	0	0	0	111	E228 R382 L386 T387 Y388	E228-S384 WeakPolarHBondContact OE2-CA 3.42Å; R382-S384 PolarHBondContact O-N 3.09Å; S384-L386 PolarHBondContact O-N 3.25Å; S384-T387 PolarHBondContact N-OG1 3.01Å; S384-T387 PolarHBondContact O-N 3.04Å; S384-T387 PolarHBondContact O-OG1 3.43Å; S384-T387 VanDerWaalsContact O-OG1 3.1Å; S384-T387 WeakPolarHBondContact OG-CB 3.29Å; S384-T387 WeakPolarHBondContact OG-CG2 3.37Å; S384-T387 PolarHBondContact OG-N 3.25Å; S384-T387 PolarHBondContact OG-OG1 3.15Å; S384-Y388 VanDerWaalsContact O-CB 3.3Å; S384-Y388 WeakPolarHBondContact O-CB 3.41Å; S384-Y388 PolarHBondContact O-N 2.89Å
385	R	91.1	Very high	86.7	Confident	73 Å²	73	56.2 Å²	56.2	28%	0.275	26%	0.257	S	S	.	.	H	α-helix	trans	-60.9	-35.8	172.4	-67.7	-56.5	-175.2	169.3	1.4	112.1	I225 E228 I248 Y388 L389	I225-R385 HydrophobicContact CG2-CB 4.23Å; E228-R385 HydrophobicContact CB-CG 4.4Å; E228-R385 VanDerWaalsContact O-CG 3.25Å; E228-R385 WeakPolarHBondContact O-CG 3.4Å; E228-R385 WeakPolarHBondContact OE2-CG 3.25Å; E228-R385 PolarHBondContact OE2-N 3.43Å; I248-R385 HydrophobicContact CD1-CB 4.2Å; I248-R385 VanDerWaalsContact CD1-O 3.28Å; I248-R385 WeakPolarHBondContact CD1-O 3.47Å; R385-Y388 PolarHBondContact O-N 3.18Å; R385-L389 VanDerWaalsContact O-CB 3.28Å; R385-L389 WeakPolarHBondContact O-CB 3.38Å; R385-L389 PolarHBondContact O-N 3.42Å
386	L	90.8	Very high	86	Confident	0 Å²	0	48.6 Å²	48.6	0%	0	23%	0.227	C	C	.	.	H	α-helix	trans	-61.1	-55.9	177.2	176.7	68.2	0	0	0	111.4	I225 H309 V334 L336 S384 Y388 L389 L390	I225-L386 HydrophobicContact CD1-CB 4.18Å; I225-L386 HydrophobicContact CD1-CD1 4.17Å; H309-L386 HydrophobicContact CB-CD1 4.21Å; V334-L386 HydrophobicContact CG1-CD1 4.42Å; L336-L386 HydrophobicContact CD2-CD1 3.91Å; L336-L386 HydrophobicContact CD2-CD2 3.63Å; L336-L386 HydrophobicContact CD2-CG 4.37Å; S384-L386 PolarHBondContact O-N 3.25Å; L386-Y388 PolarHBondContact O-N 3.19Å; L386-L389 PolarHBondContact O-N 3.36Å; L386-L390 HydrophobicContact CD1-CD1 3.65Å; L386-L390 HydrophobicContact CD1-CG 4.27Å; L386-L390 HydrophobicContact CG-CD1 4.14Å; L386-L390 WeakPolarHBondContact O-CB 3.08Å; L386-L390 WeakPolarHBondContact O-CG 2.85Å; L386-L390 PolarHBondContact O-N 2.69Å
387	T	90.9	Very high	85.5	Confident	0 Å²	0	44.8 Å²	44.8	0%	0	21%	0.21	C	C	.	.	H	α-helix	trans	-64.6	-27.7	179.7	51.5	0	0	0	0	112.5	C364 L365 V368 Y381 S384 Q391	C364-T387 HydrophobicContact CB-CG2 4.04Å; L365-T387 HydrophobicContact CB-CG2 4.14Å; L365-T387 HydrophobicContact CD1-CG2 4.25Å; V368-T387 HydrophobicContact CG2-CG2 3.94Å; Y381-T387 CarbonylContact O-C 3.52Å; Y381-T387 VanDerWaalsContact O-CB 3.26Å; Y381-T387 WeakPolarHBondContact O-CB 3.45Å; Y381-T387 PolarHBondContact O-OG1 2.77Å; S384-T387 PolarHBondContact N-OG1 3.01Å; S384-T387 PolarHBondContact O-N 3.04Å; S384-T387 PolarHBondContact O-OG1 3.43Å; S384-T387 VanDerWaalsContact O-OG1 3.1Å; S384-T387 WeakPolarHBondContact OG-CB 3.29Å; S384-T387 WeakPolarHBondContact OG-CG2 3.37Å; S384-T387 PolarHBondContact OG-N 3.25Å; S384-T387 PolarHBondContact OG-OG1 3.15Å; T387-Q391 WeakPolarHBondContact O-CA 3.46Å; T387-Q391 PolarHBondContact O-N 2.81Å; T387-Q391 VanDerWaalsContact O-N 3.1Å
388	Y	91.2	Very high	85.6	Confident	30 Å²	30	34.3 Å²	34.3	12%	0.118	17%	0.165	C	C	.	.	H	α-helix	trans	-76.6	-42.7	178.3	-171.3	-160.2	0	0	0	111.2	I248 L250 Y381 R382 S384 R385 L386 L390 Q391	I248-Y388 HydrophobicContact CB-CD1 3.74Å; I248-Y388 HydrophobicContact CB-CE1 3.73Å; I248-Y388 HydrophobicContact CB-CG 4.48Å; I248-Y388 HydrophobicContact CD1-CD1 3.77Å; I248-Y388 HydrophobicContact CD1-CG 4.06Å; I248-Y388 HydrophobicContact CG1-CD1 4.34Å; I248-Y388 HydrophobicContact CG2-CD1 3.73Å; I248-Y388 HydrophobicContact CG2-CD2 4.33Å; I248-Y388 HydrophobicContact CG2-CE1 3.65Å; I248-Y388 HydrophobicContact CG2-CE2 4.28Å; I248-Y388 HydrophobicContact CG2-CG 4.07Å; L250-Y388 HydrophobicContact CD2-CE2 4.15Å; L250-Y388 HydrophobicContact CG-CE2 4.27Å; Y381-Y388 VanDerWaalsContact O-CA 3.24Å; Y381-Y388 WeakPolarHBondContact O-CA 3.04Å; Y381-Y388 WeakPolarHBondContact O-CB 3.45Å; Y381-Y388 PolarHBondContact O-N 2.94Å; R382-Y388 HydrophobicContact CG-CD2 4Å; R382-Y388 HydrophobicContact CG-CE2 4.08Å; R382-Y388 HydrophobicContact CG-CG 4.24Å; S384-Y388 VanDerWaalsContact O-CB 3.3Å; S384-Y388 WeakPolarHBondContact O-CB 3.41Å; S384-Y388 PolarHBondContact O-N 2.89Å; R385-Y388 PolarHBondContact O-N 3.18Å; L386-Y388 PolarHBondContact O-N 3.19Å; Y388-L390 VanDerWaalsContact C-N 3.29Å; Y388-L390 PolarHBondContact O-N 3.36Å; Y388-Q391 VanDerWaalsContact O-CB 3.29Å; Y388-Q391 WeakPolarHBondContact O-CB 3.27Å; Y388-Q391 PolarHBondContact O-N 3.02Å
389	L	90.2	Very high	85.7	Confident	27 Å²	27	28 Å²	28	14%	0.141	14%	0.135	C	C	.	.	H	α-helix	trans	-60.9	-42.5	174.5	-177.8	66.5	0	0	0	110.9	L223 I225 I248 V267 V269 V311 R385 L386 Q391	L223-L389 HydrophobicContact CD1-CD2 3.87Å; L223-L389 HydrophobicContact CD2-CD2 4.01Å; L223-L389 HydrophobicContact CG-CD2 4.5Å; I225-L389 HydrophobicContact CD1-CD2 3.92Å; I248-L389 HydrophobicContact CD1-CB 3.96Å; V267-L389 HydrophobicContact CG1-CD1 4.46Å; V269-L389 HydrophobicContact CG2-CD1 3.69Å; V311-L389 HydrophobicContact CB-CD2 4.41Å; V311-L389 HydrophobicContact CG1-CD2 4.35Å; V311-L389 HydrophobicContact CG2-CD2 4.01Å; R385-L389 VanDerWaalsContact O-CB 3.28Å; R385-L389 WeakPolarHBondContact O-CB 3.38Å; R385-L389 PolarHBondContact O-N 3.42Å; L386-L389 PolarHBondContact O-N 3.36Å; L389-Q391 VanDerWaalsContact C-N 3.31Å; L389-Q391 PolarHBondContact O-N 3.16Å
390	L	86.8	Confident	85.9	Confident	3 Å²	3	26.6 Å²	26.6	2%	0.016	13%	0.128	C	C	.	.	T	Hydrogen-bonded Turn	trans	-88.5	10.1	-178.2	-58.6	-179.6	0	0	0	113.6	V334 L386 Y388 N392 C393 L394	V334-L390 HydrophobicContact CG1-CD1 4.4Å; V334-L390 HydrophobicContact CG2-CD1 4.22Å; V334-L390 HydrophobicContact CG2-CD2 3.85Å; L386-L390 HydrophobicContact CD1-CD1 3.65Å; L386-L390 HydrophobicContact CD1-CG 4.27Å; L386-L390 HydrophobicContact CG-CD1 4.14Å; L386-L390 WeakPolarHBondContact O-CB 3.08Å; L386-L390 WeakPolarHBondContact O-CG 2.85Å; L386-L390 PolarHBondContact O-N 2.69Å; Y388-L390 VanDerWaalsContact C-N 3.29Å; Y388-L390 PolarHBondContact O-N 3.36Å; L390-N392 VanDerWaalsContact C-N 3.28Å; L390-N392 PolarHBondContact O-N 2.95Å; L390-C393 HydrophobicContact CB-CB 4.27Å; L390-C393 CarbonylContact O-C 3.56Å; L390-C393 WeakPolarHBondContact O-CA 3.33Å; L390-C393 VanDerWaalsContact O-CB 3.27Å; L390-C393 WeakPolarHBondContact O-CB 3.14Å; L390-C393 PolarHBondContact O-N 2.82Å; L390-L394 HydrophobicContact CB-CD1 3.83Å; L390-L394 HydrophobicContact CB-CG 3.92Å; L390-L394 VanDerWaalsContact O-CG 3.31Å; L390-L394 WeakPolarHBondContact O-CG 3.38Å; L390-L394 PolarHBondContact O-N 3.49Å
391	Q	87.5	Confident	86.1	Confident	46 Å²	46	25.9 Å²	25.9	22%	0.215	12%	0.123	C	C	.	.	H	α-helix	trans	-52.8	-46.1	-176.5	169.5	172.9	-8.4	0	0	112.3	V267 Y381 T387 Y388 L389 C393 L394	V267-Q391 HydrophobicContact CG2-CB 4.24Å; Y381-Q391 HydrophobicContact CD1-CB 3.96Å; Y381-Q391 HydrophobicContact CD1-CG 3.97Å; Y381-Q391 HydrophobicContact CD2-CB 4.42Å; Y381-Q391 HydrophobicContact CD2-CG 3.61Å; Y381-Q391 HydrophobicContact CE1-CG 4.32Å; Y381-Q391 HydrophobicContact CE2-CG 3.96Å; Y381-Q391 HydrophobicContact CG-CB 3.89Å; Y381-Q391 HydrophobicContact CG-CG 3.59Å; T387-Q391 WeakPolarHBondContact O-CA 3.46Å; T387-Q391 PolarHBondContact O-N 2.81Å; T387-Q391 VanDerWaalsContact O-N 3.1Å; Y388-Q391 VanDerWaalsContact O-CB 3.29Å; Y388-Q391 WeakPolarHBondContact O-CB 3.27Å; Y388-Q391 PolarHBondContact O-N 3.02Å; L389-Q391 VanDerWaalsContact C-N 3.31Å; L389-Q391 PolarHBondContact O-N 3.16Å; Q391-C393 PolarHBondContact O-N 3.08Å; Q391-L394 PolarHBondContact O-N 3.39Å
392	N	81.3	Confident	86.3	Confident	28 Å²	28	24.6 Å²	24.6	15%	0.15	12%	0.118	C	C	.	.	H	α-helix	trans	-71.9	-19.7	-179.6	-67.5	-6.5	0	0	0	112.3	H265 V267 L390 S398	H265-N392 PolarHBondContact O-ND2 3.49Å; H265-N392 VanDerWaalsContact O-ND2 3.16Å; V267-N392 PolarHBondContact N-ND2 3.46Å; L390-N392 VanDerWaalsContact C-N 3.28Å; L390-N392 PolarHBondContact O-N 2.95Å; N392-S398 VanDerWaalsContact O-CB 3.22Å; N392-S398 WeakPolarHBondContact O-CB 3.07Å
393	C	79.5	Confident	86.8	Confident	10 Å²	10	16.5 Å²	16.5	7%	0.068	9%	0.088	C	C	.	.	H	α-helix	trans	-82.8	-39.7	176.5	-58.2	0	0	0	0	112.8	C167 L390 Q391 T400	C167-C393 HydrophobicContact CB-CB 3.52Å; L390-C393 HydrophobicContact CB-CB 4.27Å; L390-C393 CarbonylContact O-C 3.56Å; L390-C393 WeakPolarHBondContact O-CA 3.33Å; L390-C393 VanDerWaalsContact O-CB 3.27Å; L390-C393 WeakPolarHBondContact O-CB 3.14Å; L390-C393 PolarHBondContact O-N 2.82Å; Q391-C393 PolarHBondContact O-N 3.08Å; C393-T400 PolarHBondContact O-OG1 3.02Å
394	L	79.5	Confident	87.2	Confident	1 Å²	1	13 Å²	13	1%	0.005	7%	0.069	C	C	.	.	H	α-helix	trans	-83.5	-37.4	-162.7	-68.7	170.5	0	0	0	115	F169 L365 V368 F369 L372 Y381 L390 Q391	F169-L394 HydrophobicContact CE1-CD2 4.27Å; L365-L394 HydrophobicContact CD1-CD1 3.58Å; L365-L394 HydrophobicContact CD1-CD2 3.72Å; L365-L394 HydrophobicContact CD1-CG 4.33Å; V368-L394 HydrophobicContact CG1-CB 4.11Å; V368-L394 HydrophobicContact CG1-CD1 4.04Å; F369-L394 HydrophobicContact CE1-CD2 4.11Å; F369-L394 HydrophobicContact CE2-CD2 3.94Å; F369-L394 HydrophobicContact CZ-CD2 3.4Å; F369-L394 VanDerWaalsContact CZ-CD2 3.4Å; L372-L394 VanDerWaalsContact CD1-O 3.29Å; L372-L394 WeakPolarHBondContact CD1-O 3.36Å; Y381-L394 HydrophobicContact CE1-CB 4.04Å; L390-L394 HydrophobicContact CB-CD1 3.83Å; L390-L394 HydrophobicContact CB-CG 3.92Å; L390-L394 VanDerWaalsContact O-CG 3.31Å; L390-L394 WeakPolarHBondContact O-CG 3.38Å; L390-L394 PolarHBondContact O-N 3.49Å; Q391-L394 PolarHBondContact O-N 3.39Å
395	G	68.6	Low	87.5	Confident	20 Å²	20	13 Å²	13	21%	0.206	7%	0.069	C	C	.	.	S	Bend	trans	-142.4	14.8	-179.4	0	0	0	0	0	114	Y381	Y381-G395 VanDerWaalsContact OH-CA 3.3Å; Y381-G395 WeakPolarHBondContact OH-CA 3.24Å; Y381-G395 PolarHBondContact OH-N 3.46Å
396	G	67.1	Low	87.8	Confident	13 Å²	13	9.6 Å²	9.6	13%	0.134	6%	0.056	C	C	.	.	S	Bend	trans	-108.4	-150.7	-176.3	0	0	0	0	0	112.7	S398	G396-S398 PolarHBondContact O-N 3.31Å
397	N	76.1	Confident	87.9	Confident	12 Å²	12	9.6 Å²	9.6	6%	0.064	6%	0.056	C	C	.	.	S	Bend	trans	-76.6	63.3	179.7	-173.7	26.5	0	0	0	112	N165 V434 T435 N437	N165-N397 WeakPolarHBondContact CB-O 3.1Å; N165-N397 PolarHBondContact ND2-O 2.86Å; N397-V434 VanDerWaalsContact OD1-C 3.23Å; N397-V434 WeakPolarHBondContact OD1-CA 3.46Å; N397-V434 WeakPolarHBondContact OD1-CG1 3.37Å; N397-T435 PolarHBondContact ND2-O 3.06Å; N397-T435 VanDerWaalsContact OD1-CA 3.3Å; N397-T435 WeakPolarHBondContact OD1-CA 3.4Å; N397-T435 PolarHBondContact OD1-N 3.49Å; N397-T435 PolarHBondContact OD1-O 2.93Å; N397-N437 PolarHBondContact ND2-OD1 3.43Å
398	S	85.9	Confident	87.9	Confident	3 Å²	3	9.6 Å²	9.6	2%	0.021	6%	0.056	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.6	146.2	-176.9	-179.3	0	0	0	0	112.7	N165 N392 G396 V434	N165-S398 CarbonylContact O-C 3.59Å; N165-S398 VanDerWaalsContact O-CA 3.3Å; N165-S398 WeakPolarHBondContact O-CA 3.14Å; N165-S398 PolarHBondContact O-OG 2.86Å; N392-S398 VanDerWaalsContact O-CB 3.22Å; N392-S398 WeakPolarHBondContact O-CB 3.07Å; G396-S398 PolarHBondContact O-N 3.31Å; S398-V434 WeakPolarHBondContact O-CG2 2.84Å
399	K	91.3	Very high	87.8	Confident	3 Å²	3	8.7 Å²	8.7	1%	0.013	5%	0.054	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.7	126.2	167.2	-66.5	167.1	-179.2	150.9	0	108.9	N60 M63 I156 S159 N165 V166 C167 V434	N60-K399 VanDerWaalsContact OD1-CE 3.24Å; N60-K399 WeakPolarHBondContact OD1-CE 3.47Å; N60-K399 PolarHBondContact OD1-NZ 3.21Å; M63-K399 HydrophobicContact CB-CD 4.25Å; I156-K399 HydrophobicContact CD1-CB 4.03Å; I156-K399 HydrophobicContact CG1-CB 4.03Å; S159-K399 WeakPolarHBondContact OG-CD 3.41Å; S159-K399 PolarHBondContact OG-NZ 3.34Å; N165-K399 PolarHBondContact O-N 3.28Å; V166-K399 CarbonylContact C-O 3.53Å; V166-K399 VanDerWaalsContact CA-O 3.23Å; V166-K399 WeakPolarHBondContact CA-O 3.44Å; V166-K399 HydrophobicContact CG2-CB 4.47Å; C167-K399 PolarHBondContact N-O 3.05Å; K399-V434 HydrophobicContact CG-CG2 4.36Å
400	T	92.9	Very high	87.6	Confident	2 Å²	2	12.4 Å²	12.4	1%	0.012	7%	0.07	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	129.9	-163.7	-69.1	0	0	0	0	110.9	N68 I69 R70 C167 F169 C393	N68-T400 PolarHBondContact O-N 2.98Å; I69-T400 CarbonylContact C-O 3.51Å; I69-T400 VanDerWaalsContact CA-O 3.3Å; I69-T400 WeakPolarHBondContact CA-O 3.42Å; R70-T400 PolarHBondContact N-O 2.87Å; C167-T400 CarbonylContact O-C 3.53Å; C167-T400 VanDerWaalsContact O-CA 3.31Å; C167-T400 WeakPolarHBondContact O-CA 3.48Å; F169-T400 HydrophobicContact CD1-CG2 4.15Å; F169-T400 HydrophobicContact CE1-CG2 3.32Å; F169-T400 HydrophobicContact CZ-CG2 4.12Å; C393-T400 PolarHBondContact O-OG1 3.02Å
401	L	95.4	Very high	87.5	Confident	0 Å²	0	20.6 Å²	20.6	0%	0	11%	0.109	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	126.2	-179.1	-170.5	148	0	0	0	110	R70 F72 I153 I156 C167 V168 F169 F403	R70-L401 CarbonylContact O-C 3.54Å; R70-L401 WeakPolarHBondContact O-CA 3.26Å; F72-L401 HydrophobicContact CD2-CD1 3.93Å; F72-L401 HydrophobicContact CD2-CD2 3.96Å; F72-L401 HydrophobicContact CD2-CG 4.33Å; F72-L401 HydrophobicContact CE1-CD1 4.29Å; F72-L401 HydrophobicContact CE2-CD1 3.62Å; F72-L401 HydrophobicContact CE2-CD2 4.47Å; F72-L401 HydrophobicContact CE2-CG 4.49Å; F72-L401 HydrophobicContact CG-CD1 4.42Å; F72-L401 HydrophobicContact CG-CD2 4.26Å; F72-L401 HydrophobicContact CZ-CD1 3.8Å; I153-L401 HydrophobicContact CG2-CD1 3.74Å; I153-L401 HydrophobicContact CG2-CD2 4.23Å; I156-L401 HydrophobicContact CD1-CB 3.83Å; I156-L401 HydrophobicContact CD1-CD1 4.35Å; I156-L401 HydrophobicContact CG2-CD1 4.46Å; C167-L401 PolarHBondContact O-N 2.99Å; V168-L401 CarbonylContact C-O 3.57Å; V168-L401 VanDerWaalsContact CA-O 3.29Å; V168-L401 WeakPolarHBondContact CA-O 3.5Å; V168-L401 HydrophobicContact CG1-CD2 3.9Å; V168-L401 HydrophobicContact CG2-CB 4.38Å; F169-L401 PolarHBondContact N-O 2.95Å; L401-F403 HydrophobicContact CD2-CD2 3.71Å; L401-F403 HydrophobicContact CD2-CE1 4.44Å; L401-F403 HydrophobicContact CD2-CE2 3.55Å; L401-F403 HydrophobicContact CD2-CG 4.25Å; L401-F403 HydrophobicContact CD2-CZ 3.95Å
402	M	96.3	Very high	87.6	Confident	0 Å²	0	20.5 Å²	20.5	0%	0	11%	0.108	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	120.7	175	177.9	175.3	177.5	0	0	110	R70 V71 F72 F169 Y171 V404 F422 A423 V426	R70-M402 PolarHBondContact O-N 2.8Å; V71-M402 CarbonylContact C-O 3.43Å; V71-M402 WeakPolarHBondContact CA-O 3.35Å; V71-M402 HydrophobicContact CG2-CB 4.25Å; F72-M402 PolarHBondContact N-O 3.48Å; F169-M402 HydrophobicContact CD2-CB 3.93Å; F169-M402 HydrophobicContact CD2-CG 3.77Å; F169-M402 HydrophobicContact CE1-CB 4.48Å; F169-M402 HydrophobicContact CE2-CB 3.29Å; F169-M402 HydrophobicContact CE2-CG 3.23Å; F169-M402 HydrophobicContact CE2-SD 3.67Å; F169-M402 HydrophobicContact CZ-CB 3.58Å; F169-M402 HydrophobicContact CZ-CG 4.03Å; F169-M402 HydrophobicContact CZ-SD 4.35Å; F169-M402 CarbonylContact O-C 3.52Å; F169-M402 WeakPolarHBondContact O-CA 3.25Å; Y171-M402 VanDerWaalsContact CB-CE 3.48Å; Y171-M402 HydrophobicContact CD1-CE 3.53Å; Y171-M402 HydrophobicContact CD2-CE 4.42Å; Y171-M402 HydrophobicContact CE1-CE 4.4Å; Y171-M402 HydrophobicContact CG-CE 3.55Å; M402-V404 HydrophobicContact CE-CB 4.31Å; M402-F422 HydrophobicContact CE-CD1 3.58Å; M402-F422 HydrophobicContact CE-CE1 3.62Å; M402-F422 HydrophobicContact SD-CE1 4.3Å; M402-A423 HydrophobicContact CE-CB 4.07Å; M402-A423 HydrophobicContact SD-CB 4.48Å; M402-V426 HydrophobicContact SD-CB 3.92Å; M402-V426 HydrophobicContact SD-CG1 3.87Å; M402-V426 HydrophobicContact SD-CG2 3.86Å
403	F	98.4	Very high	88	Confident	0 Å²	0	20.3 Å²	20.3	0%	0	11%	0.106	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.4	124	156.8	-73.3	-76.2	0	0	0	109.5	F72 F140 V149 I153 V168 F169 A170 Y171 T181 M182 M194 L401	F72-F403 HydrophobicContact CB-CD1 3.71Å; F72-F403 HydrophobicContact CB-CE1 3.82Å; F72-F403 HydrophobicContact CD2-CD1 4.4Å; F72-F403 AromaticContact CD2-CE1 3.69Å; F72-F403 HydrophobicContact CD2-CE1 3.69Å; F72-F403 AromaticContact CD2-CZ 3.99Å; F72-F403 HydrophobicContact CD2-CZ 3.99Å; F72-F403 HydrophobicContact CG-CE1 4.27Å; F72-F403 CarbonylContact O-C 3.59Å; F72-F403 VanDerWaalsContact O-CA 3.28Å; F72-F403 WeakPolarHBondContact O-CA 3.41Å; F140-F403 HydrophobicContact CE2-CE1 4.14Å; V149-F403 HydrophobicContact CG1-CE1 3.48Å; V149-F403 VanDerWaalsContact CG1-CE1 3.48Å; V149-F403 HydrophobicContact CG1-CZ 3.57Å; I153-F403 HydrophobicContact CG2-CE2 4.19Å; I153-F403 HydrophobicContact CG2-CZ 3.72Å; V168-F403 HydrophobicContact CG1-CD2 3.83Å; V168-F403 HydrophobicContact CG1-CE2 3.61Å; F169-F403 PolarHBondContact O-N 2.93Å; A170-F403 HydrophobicContact CB-CB 4.38Å; Y171-F403 PolarHBondContact N-O 3.39Å; T181-F403 HydrophobicContact CG2-CD1 4.25Å; T181-F403 HydrophobicContact CG2-CD2 4.01Å; T181-F403 HydrophobicContact CG2-CE1 4.39Å; T181-F403 HydrophobicContact CG2-CE2 4.15Å; T181-F403 HydrophobicContact CG2-CG 4.05Å; T181-F403 HydrophobicContact CG2-CZ 4.34Å; M182-F403 HydrophobicContact CE-CD2 4.31Å; M194-F403 HydrophobicContact CG-CE2 4.22Å; M194-F403 HydrophobicContact CG-CZ 4.38Å; L401-F403 HydrophobicContact CD2-CD2 3.71Å; L401-F403 HydrophobicContact CD2-CE1 4.44Å; L401-F403 HydrophobicContact CD2-CE2 3.55Å; L401-F403 HydrophobicContact CD2-CG 4.25Å; L401-F403 HydrophobicContact CD2-CZ 3.95Å
404	V	98.1	Very high	88.5	Confident	0 Å²	0	21.9 Å²	21.9	0%	0	12%	0.124	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99	103.7	161.9	60.2	0	0	0	0	108.6	V71 F72 C73 R74 F136 Y171 M402 I406 L420 A423	V71-V404 HydrophobicContact CG1-CG1 4.21Å; F72-V404 PolarHBondContact O-N 2.76Å; C73-V404 WeakPolarHBondContact CA-O 2.91Å; C73-V404 HydrophobicContact CB-CG1 3.7Å; R74-V404 PolarHBondContact N-O 3.11Å; F136-V404 HydrophobicContact CZ-CG1 4.49Å; Y171-V404 HydrophobicContact CD1-CG2 4.5Å; Y171-V404 CarbonylContact O-C 3.53Å; Y171-V404 WeakPolarHBondContact O-CA 3.4Å; M402-V404 HydrophobicContact CE-CB 4.31Å; V404-I406 HydrophobicContact CG2-CG2 4.22Å; V404-L420 HydrophobicContact CG1-CD2 4.33Å; V404-L420 HydrophobicContact CG2-CD2 4.48Å; V404-A423 HydrophobicContact CB-CB 3.76Å; V404-A423 HydrophobicContact CG1-CB 3.72Å; V404-A423 HydrophobicContact CG2-CB 3.93Å
405	N	98.4	Very high	89.1	Confident	2 Å²	2	23.7 Å²	23.7	1%	0.011	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.8	127.2	178.1	-68.9	95.4	0	0	0	109.7	R74 Y171 S176 G177 K178 T181	R74-N405 WeakPolarHBondContact O-CA 3.21Å; Y171-N405 PolarHBondContact O-N 2.69Å; S176-N405 WeakPolarHBondContact CB-O 3.42Å; S176-N405 WeakPolarHBondContact OG-CB 3.22Å; S176-N405 PolarHBondContact OG-O 3.37Å; G177-N405 PolarHBondContact O-ND2 3.49Å; K178-N405 HydrophobicContact CG-CB 4Å; T181-N405 PolarHBondContact OG1-ND2 3.07Å
406	I	96.9	Very high	90.3	Very high	1 Å²	1	22.8 Å²	22.8	1%	0.005	12%	0.123	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124	148.8	-178.5	62.4	171.4	0	0	0	111.8	R74 M75 R76 V106 V404 T416 L420	R74-I406 PolarHBondContact O-N 3.43Å; M75-I406 HydrophobicContact CB-CD1 4.08Å; M75-I406 HydrophobicContact CB-CG1 3.76Å; M75-I406 HydrophobicContact CG-CD1 4.33Å; M75-I406 HydrophobicContact CG-CG1 4Å; M75-I406 HydrophobicContact SD-CD1 4.25Å; M75-I406 HydrophobicContact SD-CG1 4.49Å; R76-I406 PolarHBondContact N-O 2.87Å; V106-I406 HydrophobicContact CG2-CD1 4.42Å; V404-I406 HydrophobicContact CG2-CG2 4.22Å; I406-T416 HydrophobicContact CB-CG2 3.86Å; I406-T416 HydrophobicContact CD1-CG2 4.23Å; I406-T416 HydrophobicContact CG2-CG2 3.94Å; I406-L420 HydrophobicContact CG2-CD2 3.99Å; I406-L420 HydrophobicContact CG2-CG 4.08Å
407	S	93.1	Very high	91.5	Very high	0 Å²	0	22.6 Å²	22.6	0%	0	12%	0.119	C	C	.	.			trans	-89.8	141.5	177.8	-178.1	0	0	0	0	110.9	R76 T409 H412 T416	R76-S407 PolarHBondContact NH2-OG 2.82Å; S407-T409 VanDerWaalsContact C-N 3.28Å; S407-T409 PolarHBondContact O-N 3.3Å; S407-T409 PolarHBondContact OG-N 3Å; S407-T409 PolarHBondContact OG-OG1 3.3Å; S407-H412 WeakPolarHBondContact CB-ND1 3.34Å; S407-H412 PolarHBondContact OG-ND1 3.1Å; S407-T416 PolarHBondContact N-OG1 3.27Å; S407-T416 PolarHBondContact O-OG1 2.91Å
408	P	91.3	Very high	92.3	Very high	1 Å²	1	24.3 Å²	24.3	1%	0.006	13%	0.128	C	C	.	.			trans	-79.8	-0.1	175	34.2	-38.3	0	0	0	113.9	M75 R76 L78 P93 F95	M75-P408 HydrophobicContact CE-CB 4.36Å; M75-P408 HydrophobicContact CG-CB 4.24Å; M75-P408 HydrophobicContact SD-CB 4.1Å; R76-P408 HydrophobicContact CG-CG 4.5Å; R76-P408 WeakPolarHBondContact O-CG 3.29Å; L78-P408 HydrophobicContact CD2-CB 4.04Å; L78-P408 HydrophobicContact CD2-CG 3.71Å; L78-P408 HydrophobicContact CG-CB 4.2Å; L78-P408 HydrophobicContact CG-CG 3.97Å; P93-P408 HydrophobicContact CG-CB 3.61Å; P93-P408 WeakPolarHBondContact CG-O 3.3Å; F95-P408 WeakPolarHBondContact CE1-O 3.46Å; F95-P408 VanDerWaalsContact CZ-O 3.25Å; F95-P408 WeakPolarHBondContact CZ-O 3.35Å
409	T	88.8	Confident	92.7	Very high	10 Å²	10	24.2 Å²	24.2	6%	0.061	13%	0.127	C	C	.	.	S	Bend	trans	-91.1	144.4	-176	63.7	0	0	0	0	112.5	L78 E82 S407 E411 H412	L78-T409 HydrophobicContact CD2-CG2 4.05Å; E82-T409 HydrophobicContact CB-CG2 4.05Å; E82-T409 VanDerWaalsContact CD-CG2 3.41Å; E82-T409 HydrophobicContact CG-CG2 3.85Å; E82-T409 WeakPolarHBondContact OE1-CG2 3.46Å; S407-T409 VanDerWaalsContact C-N 3.28Å; S407-T409 PolarHBondContact O-N 3.3Å; S407-T409 PolarHBondContact OG-N 3Å; S407-T409 PolarHBondContact OG-OG1 3.3Å; T409-E411 VanDerWaalsContact C-N 3.3Å; T409-E411 PolarHBondContact O-N 3.42Å; T409-H412 PolarHBondContact O-N 3.16Å; T409-H412 WeakPolarHBondContact OG1-CB 3.43Å; T409-H412 PolarHBondContact OG1-ND1 3.46Å
410	E	85.5	Confident	92.9	Very high	105 Å²	105	24 Å²	24	49%	0.491	13%	0.127	S	C	.	.	G	3₁₀ helix	trans	-66.5	-32.3	179.2	-170.5	176.1	-177.8	0	0	112.1	F95 P111 H412 F413	F95-E410 HydrophobicContact CD1-CB 4.49Å; F95-E410 HydrophobicContact CE1-CB 4.06Å; P111-E410 HydrophobicContact CG-CG 4.43Å; P111-E410 WeakPolarHBondContact CG-OE1 3.35Å; E410-H412 PolarHBondContact O-N 3.06Å; E410-H412 VanDerWaalsContact O-N 3.15Å; E410-F413 WeakPolarHBondContact O-CB 3.48Å; E410-F413 PolarHBondContact O-N 3.23Å
411	E	86.2	Confident	92.8	Very high	176 Å²	176	28.6 Å²	28.6	82%	0.822	14%	0.144	S	C	*	.	G	3₁₀ helix	trans	-53.7	-35.4	173.4	-178.2	179	179	0	0	112.1	T409	T409-E411 VanDerWaalsContact C-N 3.3Å; T409-E411 PolarHBondContact O-N 3.42Å
412	H	89	Confident	92.6	Very high	43 Å²	43	30.1 Å²	30.1	20%	0.199	15%	0.15	C	C	.	.	G	3₁₀ helix	trans	-92.5	2.6	-177.2	-67.9	163.8	0	0	0	113.7	Q173 S407 T409 E410 G414 E415 T416	Q173-H412 PolarHBondContact NE2-CD2 3.09Å; Q173-H412 PolarHBondContact NE2-CE1 3.17Å; Q173-H412 PolarHBondContact NE2-ND1 2.84Å; Q173-H412 VanDerWaalsContact NE2-ND1 3.2Å; Q173-H412 PolarHBondContact NE2-NE2 3.23Å; Q173-H412 PolarHBondContact OE1-O 2.64Å; S407-H412 WeakPolarHBondContact CB-ND1 3.34Å; S407-H412 PolarHBondContact OG-ND1 3.1Å; T409-H412 PolarHBondContact O-N 3.16Å; T409-H412 WeakPolarHBondContact OG1-CB 3.43Å; T409-H412 PolarHBondContact OG1-ND1 3.46Å; E410-H412 PolarHBondContact O-N 3.06Å; E410-H412 VanDerWaalsContact O-N 3.15Å; H412-G414 VanDerWaalsContact C-N 3.27Å; H412-G414 PolarHBondContact O-N 2.69Å; H412-G414 VanDerWaalsContact O-N 3.16Å; H412-E415 PolarHBondContact O-N 3.12Å; H412-E415 VanDerWaalsContact O-N 3.08Å; H412-T416 PolarHBondContact O-N 3.26Å; H412-T416 PolarHBondContact O-OG1 3.12Å
413	F	89.9	Confident	92.5	Very high	24 Å²	24	30.1 Å²	30.1	11%	0.105	15%	0.15	C	C	.	.	H	α-helix	trans	-52.1	-44.3	-175.1	-177.3	-87.9	0	0	0	112.8	F95 L108 K110 E410 E415 T416 V417	F95-F413 AromaticContact CD2-CD2 3.64Å; F95-F413 HydrophobicContact CD2-CD2 3.64Å; F95-F413 AromaticContact CD2-CE2 3.9Å; F95-F413 HydrophobicContact CD2-CE2 3.9Å; F95-F413 AromaticContact CE2-CD2 3.79Å; F95-F413 HydrophobicContact CE2-CD2 3.79Å; F95-F413 HydrophobicContact CE2-CE2 4.42Å; F95-F413 HydrophobicContact CG-CD2 4.49Å; L108-F413 HydrophobicContact CB-CE2 3.99Å; L108-F413 HydrophobicContact CB-CZ 4.24Å; L108-F413 HydrophobicContact CD1-CE2 4.46Å; K110-F413 HydrophobicContact CB-CE1 4.19Å; K110-F413 HydrophobicContact CB-CZ 3.92Å; K110-F413 HydrophobicContact CG-CE1 3.94Å; K110-F413 HydrophobicContact CG-CZ 4.19Å; E410-F413 WeakPolarHBondContact O-CB 3.48Å; E410-F413 PolarHBondContact O-N 3.23Å; F413-E415 PolarHBondContact O-N 3.2Å; F413-T416 PolarHBondContact O-N 2.6Å; F413-V417 HydrophobicContact CD1-CG2 4.01Å; F413-V417 HydrophobicContact CE1-CG2 3.57Å; F413-V417 HydrophobicContact CZ-CG2 3.86Å; F413-V417 WeakPolarHBondContact O-CG2 3.18Å; F413-V417 PolarHBondContact O-N 3.47Å
414	G	90.2	Very high	92.2	Very high	43 Å²	43	31.3 Å²	31.3	44%	0.443	16%	0.158	S	C	.	.	H	α-helix	trans	-61.3	-42.4	-179.6	0	0	0	0	0	113.3	H412 V417 N418	H412-G414 VanDerWaalsContact C-N 3.27Å; H412-G414 PolarHBondContact O-N 2.69Å; H412-G414 VanDerWaalsContact O-N 3.16Å; G414-V417 PolarHBondContact O-N 3.3Å; G414-N418 VanDerWaalsContact O-CG 3.27Å; G414-N418 PolarHBondContact O-N 3.29Å; G414-N418 PolarHBondContact O-ND2 3.1Å
415	E	91.2	Very high	91.7	Very high	39 Å²	39	33.7 Å²	33.7	18%	0.182	17%	0.172	C	C	.	.	H	α-helix	trans	-77.2	-33.9	-180	-66.6	-59.3	173.7	0	0	112.4	Q173 E340 R341 H412 F413 N418 S419	Q173-E415 HydrophobicContact CB-CB 4.25Å; E340-E415 HydrophobicContact CB-CG 4.04Å; R341-E415 PolarHBondContact N-OE1 2.78Å; R341-E415 VanDerWaalsContact N-OE1 3.07Å; H412-E415 PolarHBondContact O-N 3.12Å; H412-E415 VanDerWaalsContact O-N 3.08Å; F413-E415 PolarHBondContact O-N 3.2Å; E415-N418 PolarHBondContact O-N 3.48Å; E415-N418 PolarHBondContact OE2-ND2 2.98Å; E415-S419 WeakPolarHBondContact O-CB 3.19Å; E415-S419 PolarHBondContact O-N 3.16Å; E415-S419 PolarHBondContact O-OG 3.3Å
416	T	93.6	Very high	91.3	Very high	2 Å²	2	33.6 Å²	33.6	1%	0.012	17%	0.172	C	C	.	.	H	α-helix	trans	-57.5	-48.1	167.7	-74.6	0	0	0	0	110.8	L108 I406 S407 H412 F413 N418 S419 L420	L108-T416 HydrophobicContact CD1-CG2 3.79Å; I406-T416 HydrophobicContact CB-CG2 3.86Å; I406-T416 HydrophobicContact CD1-CG2 4.23Å; I406-T416 HydrophobicContact CG2-CG2 3.94Å; S407-T416 PolarHBondContact N-OG1 3.27Å; S407-T416 PolarHBondContact O-OG1 2.91Å; H412-T416 PolarHBondContact O-N 3.26Å; H412-T416 PolarHBondContact O-OG1 3.12Å; F413-T416 PolarHBondContact O-N 2.6Å; T416-N418 PolarHBondContact O-N 3.05Å; T416-S419 PolarHBondContact O-N 3.46Å; T416-L420 HydrophobicContact CG2-CD1 3.88Å; T416-L420 VanDerWaalsContact O-CG 3.27Å; T416-L420 WeakPolarHBondContact O-CG 3.37Å; T416-L420 PolarHBondContact O-N 3Å
417	V	93.4	Very high	90.9	Very high	9 Å²	9	35.5 Å²	35.5	6%	0.055	18%	0.182	C	C	.	.	H	α-helix	trans	-61.9	-43.9	177.2	169.2	0	0	0	0	111.9	L108 M132 F413 G414 S419 L420 R421	L108-V417 HydrophobicContact CD1-CG2 3.78Å; M132-V417 HydrophobicContact CE-CG1 3.77Å; M132-V417 HydrophobicContact SD-CG1 4.28Å; M132-V417 HydrophobicContact SD-CG2 4.34Å; F413-V417 HydrophobicContact CD1-CG2 4.01Å; F413-V417 HydrophobicContact CE1-CG2 3.57Å; F413-V417 HydrophobicContact CZ-CG2 3.86Å; F413-V417 WeakPolarHBondContact O-CG2 3.18Å; F413-V417 PolarHBondContact O-N 3.47Å; G414-V417 PolarHBondContact O-N 3.3Å; V417-S419 VanDerWaalsContact C-N 3.32Å; V417-S419 PolarHBondContact O-N 2.88Å; V417-L420 PolarHBondContact O-N 3.46Å; V417-R421 WeakPolarHBondContact O-CG 3.36Å; V417-R421 PolarHBondContact O-N 3.28Å
418	N	91.9	Very high	90.5	Very high	47 Å²	47	39.5 Å²	39.5	25%	0.251	20%	0.201	S	C	.	.	H	α-helix	trans	-59.8	-44.4	176.6	-71.9	-25.9	0	0	0	111.5	G414 E415 T416 R421 F422	G414-N418 VanDerWaalsContact O-CG 3.27Å; G414-N418 PolarHBondContact O-N 3.29Å; G414-N418 PolarHBondContact O-ND2 3.1Å; E415-N418 PolarHBondContact O-N 3.48Å; E415-N418 PolarHBondContact OE2-ND2 2.98Å; T416-N418 PolarHBondContact O-N 3.05Å; N418-R421 PolarHBondContact O-N 3Å; N418-F422 PolarHBondContact O-N 3.4Å
419	S	94.4	Very high	90	Very high	1 Å²	1	39.7 Å²	39.7	1%	0.007	20%	0.202	C	C	.	.	H	α-helix	trans	-64.6	-42.9	-178.9	-57.9	0	0	0	0	112	S339 E415 T416 V417 F422 A423	S339-S419 PolarHBondContact OG-OG 3.18Å; E415-S419 WeakPolarHBondContact O-CB 3.19Å; E415-S419 PolarHBondContact O-N 3.16Å; E415-S419 PolarHBondContact O-OG 3.3Å; T416-S419 PolarHBondContact O-N 3.46Å; V417-S419 VanDerWaalsContact C-N 3.32Å; V417-S419 PolarHBondContact O-N 2.88Å; S419-F422 PolarHBondContact O-N 3.06Å; S419-A423 VanDerWaalsContact O-CB 3.31Å; S419-A423 WeakPolarHBondContact O-CB 3.48Å; S419-A423 PolarHBondContact O-N 2.68Å
420	L	95.2	Very high	89.1	Confident	0 Å²	0	46.3 Å²	46.3	0%	0	23%	0.232	C	C	.	.	H	α-helix	trans	-67.1	-36.8	177.7	-66.2	168.2	0	0	0	112.6	V106 L108 F134 F136 V404 I406 T416 V417 A423 T424	V106-L420 HydrophobicContact CG1-CD1 4.42Å; V106-L420 HydrophobicContact CG1-CD2 4.05Å; L108-L420 HydrophobicContact CD1-CD1 3.45Å; L108-L420 VanDerWaalsContact CD1-CD1 3.45Å; L108-L420 HydrophobicContact CG-CD1 4.18Å; F134-L420 HydrophobicContact CD1-CB 3.72Å; F134-L420 HydrophobicContact CD2-CB 4.03Å; F134-L420 HydrophobicContact CD2-CD1 3.73Å; F134-L420 HydrophobicContact CD2-CG 4.42Å; F134-L420 HydrophobicContact CE1-CB 3.59Å; F134-L420 HydrophobicContact CE2-CB 3.92Å; F134-L420 HydrophobicContact CE2-CD1 3.72Å; F134-L420 HydrophobicContact CE2-CG 4.48Å; F134-L420 HydrophobicContact CG-CB 3.9Å; F134-L420 HydrophobicContact CG-CD1 4.31Å; F134-L420 HydrophobicContact CZ-CB 3.66Å; F134-L420 HydrophobicContact CZ-CD1 4.28Å; F136-L420 HydrophobicContact CE2-CD2 3.66Å; F136-L420 HydrophobicContact CZ-CD2 4.02Å; V404-L420 HydrophobicContact CG1-CD2 4.33Å; V404-L420 HydrophobicContact CG2-CD2 4.48Å; I406-L420 HydrophobicContact CG2-CD2 3.99Å; I406-L420 HydrophobicContact CG2-CG 4.08Å; T416-L420 HydrophobicContact CG2-CD1 3.88Å; T416-L420 VanDerWaalsContact O-CG 3.27Å; T416-L420 WeakPolarHBondContact O-CG 3.37Å; T416-L420 PolarHBondContact O-N 3Å; V417-L420 PolarHBondContact O-N 3.46Å; L420-A423 PolarHBondContact O-N 3.41Å; L420-T424 WeakPolarHBondContact O-CB 3.33Å; L420-T424 PolarHBondContact O-N 3.31Å; L420-T424 PolarHBondContact O-OG1 2.53Å
421	R	92	Very high	88	Confident	98 Å²	98	42.8 Å²	42.8	37%	0.37	22%	0.217	S	C	.	.	H	α-helix	trans	-65	-43.2	173.4	-74.4	175.5	177.7	171.5	0.7	111.9	V119 F134 V417 N418 T424 T425	V119-R421 VanDerWaalsContact CG2-NH2 3.29Å; F134-R421 HydrophobicContact CE1-CG 3.98Å; F134-R421 HydrophobicContact CZ-CG 4.27Å; V417-R421 WeakPolarHBondContact O-CG 3.36Å; V417-R421 PolarHBondContact O-N 3.28Å; N418-R421 PolarHBondContact O-N 3Å; R421-T424 WeakPolarHBondContact O-CB 3.36Å; R421-T424 PolarHBondContact O-N 2.67Å; R421-T425 PolarHBondContact O-N 3.23Å; R421-T425 PolarHBondContact O-OG1 2.63Å
422	F	91.3	Very high	86.8	Confident	31 Å²	31	37 Å²	37	14%	0.136	21%	0.205	C	C	.	.	H	α-helix	trans	-60.1	-50.4	174.6	177.2	-111.8	0	0	0	110.9	Y171 G366 F369 M402 N418 S419 T424 T425 V426	Y171-F422 AromaticContact CD1-CD1 3.88Å; Y171-F422 HydrophobicContact CD1-CD1 3.88Å; Y171-F422 HydrophobicContact CD1-CE1 4.39Å; Y171-F422 HydrophobicContact CD2-CD1 4.2Å; Y171-F422 AromaticContact CD2-CE1 4Å; Y171-F422 HydrophobicContact CD2-CE1 4Å; Y171-F422 HydrophobicContact CE1-CB 4.34Å; Y171-F422 AromaticContact CE1-CD1 3.5Å; Y171-F422 HydrophobicContact CE1-CD1 3.5Å; Y171-F422 VanDerWaalsContact CE1-CD1 3.5Å; Y171-F422 HydrophobicContact CE1-CE1 4.26Å; Y171-F422 HydrophobicContact CE1-CG 4.24Å; Y171-F422 AromaticContact CE2-CD1 3.82Å; Y171-F422 HydrophobicContact CE2-CD1 3.82Å; Y171-F422 AromaticContact CE2-CE1 3.82Å; Y171-F422 HydrophobicContact CE2-CE1 3.82Å; Y171-F422 HydrophobicContact CG-CD1 4.22Å; Y171-F422 HydrophobicContact CG-CE1 4.27Å; Y171-F422 AromaticContact CZ-CD1 3.44Å; Y171-F422 VanDerWaalsContact CZ-CD1 3.44Å; Y171-F422 AromaticContact CZ-CE1 3.95Å; G366-F422 VanDerWaalsContact CA-CE2 3.48Å; F369-F422 HydrophobicContact CD2-CZ 4.09Å; M402-F422 HydrophobicContact CE-CD1 3.58Å; M402-F422 HydrophobicContact CE-CE1 3.62Å; M402-F422 HydrophobicContact SD-CE1 4.3Å; N418-F422 PolarHBondContact O-N 3.4Å; S419-F422 PolarHBondContact O-N 3.06Å; F422-T424 VanDerWaalsContact C-N 3.25Å; F422-T424 PolarHBondContact O-N 2.92Å; F422-T425 WeakPolarHBondContact O-CA 2.86Å; F422-T425 VanDerWaalsContact O-CB 3.31Å; F422-T425 WeakPolarHBondContact O-CB 3.47Å; F422-T425 PolarHBondContact O-N 2.94Å; F422-V426 HydrophobicContact CD1-CG2 4.43Å; F422-V426 HydrophobicContact CE1-CG2 3.93Å; F422-V426 HydrophobicContact CE2-CG2 4.13Å; F422-V426 HydrophobicContact CZ-CG2 3.76Å; F422-V426 PolarHBondContact O-N 3.07Å; F422-V426 VanDerWaalsContact O-N 3.07Å
423	A	93.5	Very high	85.4	Confident	0 Å²	0	38.8 Å²	38.8	0%	0	23%	0.227	C	C	.	.	H	α-helix	trans	-58	-36.3	177	0	0	0	0	0	112.6	V71 F136 M402 V404 S419 L420 T425 V426 N427	V71-A423 HydrophobicContact CG1-CB 3.86Å; F136-A423 HydrophobicContact CE1-CB 3.7Å; F136-A423 HydrophobicContact CZ-CB 3.89Å; M402-A423 HydrophobicContact CE-CB 4.07Å; M402-A423 HydrophobicContact SD-CB 4.48Å; V404-A423 HydrophobicContact CB-CB 3.76Å; V404-A423 HydrophobicContact CG1-CB 3.72Å; V404-A423 HydrophobicContact CG2-CB 3.93Å; S419-A423 VanDerWaalsContact O-CB 3.31Å; S419-A423 WeakPolarHBondContact O-CB 3.48Å; S419-A423 PolarHBondContact O-N 2.68Å; L420-A423 PolarHBondContact O-N 3.41Å; A423-T425 VanDerWaalsContact C-N 3.32Å; A423-T425 PolarHBondContact O-N 2.87Å; A423-V426 PolarHBondContact O-N 3.17Å; A423-N427 WeakPolarHBondContact O-CB 3.41Å; A423-N427 PolarHBondContact O-N 3.24Å
424	T	91.8	Very high	84.2	Confident	26 Å²	26	37.9 Å²	37.9	16%	0.16	22%	0.224	C	C	.	.	H	α-helix	trans	-62.8	-39.3	174.8	-57.9	0	0	0	0	111.7	F134 L420 R421 F422 N427 Q428	F134-T424 WeakPolarHBondContact CD1-OG1 2.98Å; L420-T424 WeakPolarHBondContact O-CB 3.33Å; L420-T424 PolarHBondContact O-N 3.31Å; L420-T424 PolarHBondContact O-OG1 2.53Å; R421-T424 WeakPolarHBondContact O-CB 3.36Å; R421-T424 PolarHBondContact O-N 2.67Å; F422-T424 VanDerWaalsContact C-N 3.25Å; F422-T424 PolarHBondContact O-N 2.92Å; T424-N427 PolarHBondContact O-N 3.34Å; T424-Q428 WeakPolarHBondContact O-CG 3.2Å; T424-Q428 PolarHBondContact O-N 3.1Å
425	T	87.9	Confident	83.1	Confident	49 Å²	49	39.4 Å²	39.4	30%	0.301	23%	0.225	S	C	.	.	H	α-helix	trans	-65.7	-42.1	176.2	-52.4	0	0	0	0	110.8	R421 F422 A423 Q428 C429	R421-T425 PolarHBondContact O-N 3.23Å; R421-T425 PolarHBondContact O-OG1 2.63Å; F422-T425 WeakPolarHBondContact O-CA 2.86Å; F422-T425 VanDerWaalsContact O-CB 3.31Å; F422-T425 WeakPolarHBondContact O-CB 3.47Å; F422-T425 PolarHBondContact O-N 2.94Å; A423-T425 VanDerWaalsContact C-N 3.32Å; A423-T425 PolarHBondContact O-N 2.87Å; T425-Q428 PolarHBondContact O-N 3.01Å; T425-C429 PolarHBondContact O-SG 3.04Å
426	V	89.3	Confident	82.3	Confident	0 Å²	0	41.5 Å²	41.5	0%	0	23%	0.231	C	C	.	.	H	α-helix	trans	-64	-42.5	175.7	179	0	0	0	0	111.1	I69 V71 F369 M402 F422 A423 Q428 C429	I69-V426 HydrophobicContact CG2-CG1 3.77Å; V71-V426 HydrophobicContact CG2-CB 4.22Å; V71-V426 HydrophobicContact CG2-CG1 3.97Å; F369-V426 HydrophobicContact CB-CG2 4.24Å; F369-V426 HydrophobicContact CD1-CG1 4.05Å; F369-V426 HydrophobicContact CD1-CG2 4.34Å; F369-V426 HydrophobicContact CD2-CG1 4.5Å; F369-V426 HydrophobicContact CD2-CG2 3.66Å; F369-V426 HydrophobicContact CE1-CG1 3.89Å; F369-V426 HydrophobicContact CE2-CG1 4.32Å; F369-V426 HydrophobicContact CE2-CG2 4.04Å; F369-V426 HydrophobicContact CG-CG1 4.37Å; F369-V426 HydrophobicContact CG-CG2 3.83Å; F369-V426 HydrophobicContact CZ-CG1 4.03Å; M402-V426 HydrophobicContact SD-CB 3.92Å; M402-V426 HydrophobicContact SD-CG1 3.87Å; M402-V426 HydrophobicContact SD-CG2 3.86Å; F422-V426 HydrophobicContact CD1-CG2 4.43Å; F422-V426 HydrophobicContact CE1-CG2 3.93Å; F422-V426 HydrophobicContact CE2-CG2 4.13Å; F422-V426 HydrophobicContact CZ-CG2 3.76Å; F422-V426 PolarHBondContact O-N 3.07Å; F422-V426 VanDerWaalsContact O-N 3.07Å; A423-V426 PolarHBondContact O-N 3.17Å; V426-Q428 PolarHBondContact O-N 3.4Å; V426-C429 WeakPolarHBondContact O-CB 3.25Å; V426-C429 PolarHBondContact O-N 3.4Å
427	N	89	Confident	81.3	Confident	41 Å²	41	43.6 Å²	43.6	22%	0.219	24%	0.242	C	C	.	.	H	α-helix	trans	-64	-22.9	-179.4	-160	29.4	0	0	0	113.3	V71 T135 F136 D137 A423 T424 C429	V71-N427 HydrophobicContact CB-CB 4.03Å; V71-N427 HydrophobicContact CG2-CB 3.65Å; T135-N427 PolarHBondContact O-ND2 3.43Å; F136-N427 HydrophobicContact CD1-CB 4.37Å; D137-N427 PolarHBondContact OD2-OD1 3.32Å; A423-N427 WeakPolarHBondContact O-CB 3.41Å; A423-N427 PolarHBondContact O-N 3.24Å; T424-N427 PolarHBondContact O-N 3.34Å; N427-C429 VanDerWaalsContact C-N 3.34Å
428	Q	85.1	Confident	80.2	Confident	85 Å²	85	47 Å²	47	40%	0.397	26%	0.263	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.3	-11	176.1	-68.9	170.8	-2.4	0	0	112.8	Y373 T424 T425 V426 H430	Y373-Q428 HydrophobicContact CD2-CB 4.11Å; Y373-Q428 WeakPolarHBondContact CD2-O 3.3Å; Y373-Q428 HydrophobicContact CE2-CB 3.86Å; T424-Q428 WeakPolarHBondContact O-CG 3.2Å; T424-Q428 PolarHBondContact O-N 3.1Å; T425-Q428 PolarHBondContact O-N 3.01Å; V426-Q428 PolarHBondContact O-N 3.4Å; Q428-H430 PolarHBondContact O-N 3.28Å; Q428-H430 PolarHBondContact O-ND1 3Å
429	C	80.1	Confident	79	Confident	4 Å²	4	51 Å²	51	3%	0.027	28%	0.284	C	S	.	.			trans	-72.5	116.5	178.8	-61.9	0	0	0	0	110.5	I69 F369 T425 V426 N427	I69-C429 HydrophobicContact CD1-CB 3.66Å; F369-C429 PolarHBondContact O-SG 2.78Å; T425-C429 PolarHBondContact O-SG 3.04Å; V426-C429 WeakPolarHBondContact O-CB 3.25Å; V426-C429 PolarHBondContact O-N 3.4Å; N427-C429 VanDerWaalsContact C-N 3.34Å
430	H	69.8	Low	78.2	Confident	150 Å²	150	53.6 Å²	53.6	69%	0.694	30%	0.298	S	S	*	.			trans	-106.8	108.1	173.3	-67.9	72	0	0	0	109.4	Q428	Q428-H430 PolarHBondContact O-N 3.28Å; Q428-H430 PolarHBondContact O-ND1 3Å
431	V	64.1	Low	77.3	Confident	30 Å²	30	56.4 Å²	56.4	18%	0.182	31%	0.313	C	S	.	.			trans	-88.7	145	172.6	-174.2	0	0	0	0	108.7	N68 I69	N68-V431 PolarHBondContact ND2-O 3.46Å; I69-V431 HydrophobicContact CD1-CG2 3.42Å; I69-V431 VanDerWaalsContact CD1-CG2 3.42Å; I69-V431 HydrophobicContact CG1-CG2 3.95Å
432	G	60.3	Low	76.5	Confident	55 Å²	55	54.1 Å²	54.1	57%	0.567	31%	0.31	S	S	*	.			trans	-62.1	-177.1	178.3	0	0	0	0	0	113.6	N68	N68-G432 PolarHBondContact ND2-O 3.45Å
433	A	60.7	Low	75.6	Confident	80 Å²	80	55.4 Å²	55.4	66%	0.661	32%	0.32	S	S	*	.	P	Polyproline II helix	trans	-59.5	149.1	-176.1	0	0	0	0	0	113.4
434	V	62.7	Low	74.5	Confident	6 Å²	6	58.9 Å²	58.9	4%	0.036	34%	0.34	C	S	.	.	P	Polyproline II helix	trans	-102	118.4	-179	178	0	0	0	0	108.4	N68 Y164 N397 S398 K399	N68-V434 HydrophobicContact CB-CG2 4.18Å; Y164-V434 HydrophobicContact CD1-CG1 3.67Å; Y164-V434 HydrophobicContact CE1-CG1 4.32Å; N397-V434 VanDerWaalsContact OD1-C 3.23Å; N397-V434 WeakPolarHBondContact OD1-CA 3.46Å; N397-V434 WeakPolarHBondContact OD1-CG1 3.37Å; S398-V434 WeakPolarHBondContact O-CG2 2.84Å; K399-V434 HydrophobicContact CG-CG2 4.36Å
435	T	68.4	Low	73.4	Confident	75 Å²	75	61.1 Å²	61.1	46%	0.46	35%	0.352	S	S	.	.	P	Polyproline II helix	trans	-73.2	142.8	171.9	-45.2	0	0	0	0	112.2	N397	N397-T435 PolarHBondContact ND2-O 3.06Å; N397-T435 VanDerWaalsContact OD1-CA 3.3Å; N397-T435 WeakPolarHBondContact OD1-CA 3.4Å; N397-T435 PolarHBondContact OD1-N 3.49Å; N397-T435 PolarHBondContact OD1-O 2.93Å
436	R	74.6	Confident	72.3	Confident	83 Å²	83	61.9 Å²	61.9	31%	0.313	36%	0.356	S	S	.	.	P	Polyproline II helix	trans	-79.4	138.5	172	-172.5	-179.7	60.5	-170.8	1	110.5	D162 G163 Y164 Y327 T438	D162-R436 WeakPolarHBondContact O-CD 3.33Å; G163-R436 WeakPolarHBondContact O-CG 3.4Å; Y164-R436 HydrophobicContact CD1-CB 4.37Å; Y164-R436 HydrophobicContact CE1-CB 3.79Å; Y164-R436 HydrophobicContact CE1-CG 4.42Å; Y164-R436 HydrophobicContact CE2-CB 4.42Å; Y164-R436 HydrophobicContact CE2-CG 4.29Å; Y327-R436 HydrophobicContact CD1-CG 4.42Å; R436-T438 PolarHBondContact O-N 3.06Å
437	N	71.6	Confident	71	Confident	46 Å²	46	66.7 Å²	66.7	25%	0.246	38%	0.383	C	S	.	.			trans	-76.8	113.2	171.7	-55.6	-32.6	0	0	0	109	G163 N165 Y327 E328 N397	G163-N437 PolarHBondContact O-N 3.2Å; N165-N437 PolarHBondContact ND2-ND2 3Å; N165-N437 PolarHBondContact OD1-ND2 3.31Å; Y327-N437 WeakPolarHBondContact CA-O 2.99Å; E328-N437 PolarHBondContact N-O 2.65Å; E328-N437 WeakPolarHBondContact O-CB 3.39Å; E328-N437 PolarHBondContact O-ND2 2.87Å; N397-N437 PolarHBondContact ND2-OD1 3.43Å
438	T	70.5	Confident	69.5	Low	80 Å²	80	68.8 Å²	68.8	49%	0.491	40%	0.397	S	S	.	.	B	Isolated β-bridge	trans	-113.2	129	174.8	-48	0	0	0	0	107.1	Y327 R436	Y327-T438 HydrophobicContact CD1-CG2 4.23Å; Y327-T438 HydrophobicContact CE1-CG2 4.04Å; R436-T438 PolarHBondContact O-N 3.06Å
439	L	66.3	Low	68.1	Low	132 Å²	132	67.4 Å²	67.4	69%	0.691	40%	0.397	S	S	*	.			trans	-84.7	0	-176.5	-70.1	177.6	0	0	0	112.9	K317 A326 E328	K317-L439 HydrophobicContact CD-CD1 3.94Å; K317-L439 HydrophobicContact CG-CD1 3.88Å; A326-L439 HydrophobicContact CB-CB 3.87Å; A326-L439 HydrophobicContact CB-CD1 4.26Å; A326-L439 PolarHBondContact O-N 3.18Å; E328-L439 HydrophobicContact CB-CD1 4.18Å; E328-L439 HydrophobicContact CB-CD2 4.32Å; E328-L439 HydrophobicContact CB-CG 4.21Å

Retrieved 439 of 439 residues in 209.6 ms (Link to these results)

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