A0A060X916_ONCMY Loading...

SREBP regulating gene protein

AlphaFold DB , UniProt , Accession A0A060X916, Species ONCMY (Oncorhynchus mykiss, Rainbow trout), Gene LOC110526013, Length 199 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	55.7	Low	63	Low	225 Å²	225	163.8 Å²	163.8	100%	1.108	72%	0.716	S	S	*	*				0	-15.6	0	-108	177.6	-159.5	0	0	115.4
2	V	56.8	Low	64.9	Low	111 Å²	111	157.5 Å²	157.5	67%	0.673	70%	0.7	S	S	*	*	H	α-helix	trans	-78.4	-33	-172.6	-177.5	0	0	0	0	114	R4 R5 L6	V2-R4 PolarHBondContact O-N 3.46Å; V2-R5 PolarHBondContact O-N 3.13Å; V2-L6 HydrophobicContact CG1-CD1 4.26Å; V2-L6 PolarHBondContact O-N 3.23Å
3	L	56.1	Low	66.2	Low	128 Å²	128	154.8 Å²	154.8	67%	0.67	70%	0.696	S	S	*	*	H	α-helix	trans	-67	-36.3	-176.1	-162.7	67.6	0	0	0	113.9	R5 L6 L7	L3-R5 VanDerWaalsContact C-N 3.32Å; L3-R5 PolarHBondContact O-N 3.06Å; L3-L6 PolarHBondContact O-N 3.34Å; L3-L7 HydrophobicContact CG-CD1 4.04Å; L3-L7 WeakPolarHBondContact O-CD1 3.35Å; L3-L7 PolarHBondContact O-N 3.4Å
4	R	58.4	Low	67.9	Low	212 Å²	212	147.1 Å²	147.1	80%	0.8	68%	0.681	S	S	*	*	H	α-helix	trans	-66.5	-29.1	176.6	-80.3	-172.4	175.5	-170.9	-1.1	113.2	V2 R8	V2-R4 PolarHBondContact O-N 3.46Å; R4-R8 WeakPolarHBondContact O-CB 3.32Å; R4-R8 PolarHBondContact O-N 3.43Å
5	R	59.1	Low	69.5	Low	205 Å²	205	142.8 Å²	142.8	77%	0.774	67%	0.669	S	S	*	*	H	α-helix	trans	-74.9	-38.8	175.5	-80.2	-177.3	176.1	176.9	-0.9	111.7	V2 L3 R8 K9	V2-R5 PolarHBondContact O-N 3.13Å; L3-R5 VanDerWaalsContact C-N 3.32Å; L3-R5 PolarHBondContact O-N 3.06Å; R5-R8 PolarHBondContact O-N 3.18Å; R5-K9 PolarHBondContact O-N 3.25Å
6	L	58.2	Low	70.9	Confident	98 Å²	98	139.6 Å²	139.6	51%	0.513	66%	0.662	S	S	.	*	H	α-helix	trans	-66.9	-41.2	176.4	-78.4	162.7	0	0	0	112.4	V2 L3 K9 R10	V2-L6 HydrophobicContact CG1-CD1 4.26Å; V2-L6 PolarHBondContact O-N 3.23Å; L3-L6 PolarHBondContact O-N 3.34Å; L6-K9 PolarHBondContact O-N 3.06Å; L6-R10 PolarHBondContact O-N 3.29Å; L6-R10 VanDerWaalsContact O-N 3.13Å
7	L	59.8	Low	72.1	Confident	93 Å²	93	139.7 Å²	139.7	49%	0.487	66%	0.659	S	S	.	*	H	α-helix	trans	-62.2	-47.8	172.4	-93.8	107	0	0	0	111.3	L3 K9 R10 W11	L3-L7 HydrophobicContact CG-CD1 4.04Å; L3-L7 WeakPolarHBondContact O-CD1 3.35Å; L3-L7 PolarHBondContact O-N 3.4Å; L7-K9 VanDerWaalsContact C-N 3.26Å; L7-K9 PolarHBondContact O-N 3.36Å; L7-R10 PolarHBondContact O-N 2.94Å; L7-W11 PolarHBondContact O-N 3.48Å
8	R	66.4	Low	73.3	Confident	192 Å²	192	133.4 Å²	133.4	73%	0.725	64%	0.638	S	S	*	*	H	α-helix	trans	-58.8	-37.4	179.6	-162.8	-179.4	-66.3	-164.5	-3.3	112.4	R4 R5 V12	R4-R8 WeakPolarHBondContact O-CB 3.32Å; R4-R8 PolarHBondContact O-N 3.43Å; R5-R8 PolarHBondContact O-N 3.18Å; R8-V12 VanDerWaalsContact O-CG2 3.3Å; R8-V12 WeakPolarHBondContact O-CG2 3.37Å; R8-V12 PolarHBondContact O-N 2.97Å
9	K	66.4	Low	74.4	Confident	156 Å²	156	132.3 Å²	132.3	68%	0.678	64%	0.635	S	S	*	*	H	α-helix	trans	-70.7	-37.8	178.6	-137.8	177.4	-174.6	-174.3	0	112.9	R5 L6 L7 L13	R5-K9 PolarHBondContact O-N 3.25Å; L6-K9 PolarHBondContact O-N 3.06Å; L7-K9 VanDerWaalsContact C-N 3.26Å; L7-K9 PolarHBondContact O-N 3.36Å; K9-L13 PolarHBondContact O-N 3.43Å
10	R	75.9	Confident	75.3	Confident	199 Å²	199	128.8 Å²	128.8	75%	0.751	63%	0.625	S	S	*	*	H	α-helix	trans	-70.6	-35.9	176.1	-76.3	-177.5	172.1	-176.3	-2.5	112.8	L6 L7 L13 G14	L6-R10 PolarHBondContact O-N 3.29Å; L6-R10 VanDerWaalsContact O-N 3.13Å; L7-R10 PolarHBondContact O-N 2.94Å; R10-L13 PolarHBondContact O-N 2.89Å; R10-G14 PolarHBondContact O-N 3.33Å
11	W	80.3	Confident	76.1	Confident	183 Å²	183	126.7 Å²	126.7	69%	0.693	62%	0.616	S	S	*	*	H	α-helix	trans	-65.3	-42.6	174.4	-86.9	89.1	0	0	0	112.4	L7 L13 G14 V15	L7-W11 PolarHBondContact O-N 3.48Å; W11-L13 PolarHBondContact O-N 3.03Å; W11-G14 PolarHBondContact O-N 3.26Å; W11-V15 WeakPolarHBondContact O-CG2 3.47Å; W11-V15 PolarHBondContact O-N 3.47Å
12	V	85.3	Confident	77.9	Confident	88 Å²	88	120.8 Å²	120.8	53%	0.533	59%	0.588	S	S	.	*	H	α-helix	trans	-62.3	-42.8	176.2	172.9	0	0	0	0	111.3	R8 V15 V16	R8-V12 VanDerWaalsContact O-CG2 3.3Å; R8-V12 WeakPolarHBondContact O-CG2 3.37Å; R8-V12 PolarHBondContact O-N 2.97Å; V12-V15 PolarHBondContact O-N 3.45Å; V12-V16 WeakPolarHBondContact O-CG2 3.34Å; V12-V16 PolarHBondContact O-N 3.2Å
13	L	82.8	Confident	79.7	Confident	122 Å²	122	122.9 Å²	122.9	64%	0.639	59%	0.585	S	S	*	*	H	α-helix	trans	-62.2	-41.8	174.8	-86.6	156.1	0	0	0	112.4	K9 R10 W11 V16 F17	K9-L13 PolarHBondContact O-N 3.43Å; R10-L13 PolarHBondContact O-N 2.89Å; W11-L13 PolarHBondContact O-N 3.03Å; L13-V16 PolarHBondContact O-N 3.49Å; L13-F17 WeakPolarHBondContact O-CB 3.42Å; L13-F17 PolarHBondContact O-N 2.94Å
14	G	89.4	Confident	81.4	Confident	47 Å²	47	123.3 Å²	123.3	49%	0.485	58%	0.582	S	S	.	*	H	α-helix	trans	-63	-40.3	175.5	0	0	0	0	0	113.1	R10 W11 G18	R10-G14 PolarHBondContact O-N 3.33Å; W11-G14 PolarHBondContact O-N 3.26Å; G14-G18 PolarHBondContact O-N 2.98Å
15	V	91.6	Very high	82.8	Confident	83 Å²	83	117.2 Å²	117.2	50%	0.503	57%	0.565	S	S	.	*	H	α-helix	trans	-67	-45.2	177.6	170.8	0	0	0	0	111.5	W11 V12 F17 G18 L19	W11-V15 WeakPolarHBondContact O-CG2 3.47Å; W11-V15 PolarHBondContact O-N 3.47Å; V12-V15 PolarHBondContact O-N 3.45Å; V15-F17 VanDerWaalsContact C-N 3.33Å; V15-F17 PolarHBondContact O-N 3.17Å; V15-G18 PolarHBondContact O-N 3.27Å; V15-L19 HydrophobicContact CG1-CD1 4.03Å; V15-L19 WeakPolarHBondContact O-CG 3.24Å; V15-L19 PolarHBondContact O-N 2.95Å
16	V	92.4	Very high	84.3	Confident	92 Å²	92	111.2 Å²	111.2	56%	0.558	55%	0.551	S	S	*	*	H	α-helix	trans	-62.4	-42.8	178.1	173	0	0	0	0	110.9	V12 L13 L19 S20	V12-V16 WeakPolarHBondContact O-CG2 3.34Å; V12-V16 PolarHBondContact O-N 3.2Å; L13-V16 PolarHBondContact O-N 3.49Å; V16-L19 PolarHBondContact O-N 2.99Å; V16-S20 PolarHBondContact O-N 3.19Å; V16-S20 PolarHBondContact O-OG 3.37Å
17	F	91.9	Very high	85.5	Confident	141 Å²	141	110.2 Å²	110.2	62%	0.618	55%	0.546	S	S	*	.	H	α-helix	trans	-66.8	-38.1	177	-169.2	-96.9	0	0	0	112.4	L13 V15 S20 L21	L13-F17 WeakPolarHBondContact O-CB 3.42Å; L13-F17 PolarHBondContact O-N 2.94Å; V15-F17 VanDerWaalsContact C-N 3.33Å; V15-F17 PolarHBondContact O-N 3.17Å; F17-S20 WeakPolarHBondContact CA-OG 3.3Å; F17-S20 PolarHBondContact O-N 2.87Å; F17-S20 PolarHBondContact O-OG 2.87Å; F17-L21 HydrophobicContact CE1-CD1 4.28Å; F17-L21 WeakPolarHBondContact O-CB 3.44Å; F17-L21 PolarHBondContact O-N 3.46Å
18	G	93.8	Very high	86.7	Confident	27 Å²	27	108.4 Å²	108.4	28%	0.278	54%	0.539	S	S	.	.	H	α-helix	trans	-63.2	-45.3	174.6	0	0	0	0	0	112.4	G14 V15 L21 I22	G14-G18 PolarHBondContact O-N 2.98Å; V15-G18 PolarHBondContact O-N 3.27Å; G18-L21 PolarHBondContact O-N 3.29Å; G18-I22 WeakPolarHBondContact O-CB 3.31Å; G18-I22 WeakPolarHBondContact O-CD1 3.47Å; G18-I22 VanDerWaalsContact O-CG1 3.24Å; G18-I22 WeakPolarHBondContact O-CG1 3.46Å; G18-I22 PolarHBondContact O-N 3.37Å
19	L	93.6	Very high	87.5	Confident	112 Å²	112	104.4 Å²	104.4	59%	0.586	53%	0.531	S	S	*	.	H	α-helix	trans	-65.7	-38.9	177.8	-70.8	172.2	0	0	0	112.2	V15 V16 Y23	V15-L19 HydrophobicContact CG1-CD1 4.03Å; V15-L19 WeakPolarHBondContact O-CG 3.24Å; V15-L19 PolarHBondContact O-N 2.95Å; V16-L19 PolarHBondContact O-N 2.99Å; L19-Y23 WeakPolarHBondContact O-CB 3.35Å; L19-Y23 PolarHBondContact O-N 3.42Å
20	S	91.8	Very high	88.3	Confident	61 Å²	61	102.3 Å²	102.3	43%	0.427	52%	0.523	S	S	.	.	H	α-helix	trans	-68	-38.5	176.1	66.1	0	0	0	0	112.2	V16 F17 Y23 F24	V16-S20 PolarHBondContact O-N 3.19Å; V16-S20 PolarHBondContact O-OG 3.37Å; F17-S20 WeakPolarHBondContact CA-OG 3.3Å; F17-S20 PolarHBondContact O-N 2.87Å; F17-S20 PolarHBondContact O-OG 2.87Å; S20-Y23 PolarHBondContact O-N 3.05Å; S20-F24 WeakPolarHBondContact O-CB 3.22Å; S20-F24 PolarHBondContact O-N 3.34Å
21	L	92.6	Very high	88.2	Confident	85 Å²	85	98.3 Å²	98.3	45%	0.445	51%	0.512	S	S	.	.	H	α-helix	trans	-65.9	-44	176.1	-164.9	102.9	0	0	0	111.5	F17 G18 F24 L25	F17-L21 HydrophobicContact CE1-CD1 4.28Å; F17-L21 WeakPolarHBondContact O-CB 3.44Å; F17-L21 PolarHBondContact O-N 3.46Å; G18-L21 PolarHBondContact O-N 3.29Å; L21-F24 PolarHBondContact O-N 2.99Å; L21-L25 HydrophobicContact CD2-CD1 3.9Å; L21-L25 HydrophobicContact CG-CD1 4.18Å; L21-L25 WeakPolarHBondContact O-CB 3.36Å; L21-L25 VanDerWaalsContact O-CG 3.31Å; L21-L25 WeakPolarHBondContact O-CG 3.32Å; L21-L25 PolarHBondContact O-N 3.02Å
22	I	93.4	Very high	88	Confident	101 Å²	101	94.9 Å²	94.9	52%	0.518	50%	0.504	S	S	.	.	H	α-helix	trans	-63.4	-43.1	176.8	-68.8	164.4	0	0	0	110.6	G18 F24 L25 T26	G18-I22 WeakPolarHBondContact O-CB 3.31Å; G18-I22 WeakPolarHBondContact O-CD1 3.47Å; G18-I22 VanDerWaalsContact O-CG1 3.24Å; G18-I22 WeakPolarHBondContact O-CG1 3.46Å; G18-I22 PolarHBondContact O-N 3.37Å; I22-F24 VanDerWaalsContact C-N 3.34Å; I22-F24 PolarHBondContact O-N 3.46Å; I22-L25 PolarHBondContact O-N 2.9Å; I22-T26 HydrophobicContact CG2-CG2 4.42Å; I22-T26 WeakPolarHBondContact O-CB 3.28Å; I22-T26 WeakPolarHBondContact O-CG2 3.35Å; I22-T26 PolarHBondContact O-N 3.24Å; I22-T26 PolarHBondContact O-OG1 3.48Å
23	Y	93.8	Very high	87.5	Confident	156 Å²	156	96.8 Å²	96.8	61%	0.612	51%	0.507	S	S	*	.	H	α-helix	trans	-61.1	-43.8	175	179.3	-98	0	0	0	111.5	L19 S20 T26 N27	L19-Y23 WeakPolarHBondContact O-CB 3.35Å; L19-Y23 PolarHBondContact O-N 3.42Å; S20-Y23 PolarHBondContact O-N 3.05Å; Y23-T26 WeakPolarHBondContact CA-OG1 3.5Å; Y23-T26 PolarHBondContact O-OG1 3.26Å; Y23-N27 VanDerWaalsContact O-CB 3.28Å; Y23-N27 WeakPolarHBondContact O-CB 3.36Å; Y23-N27 PolarHBondContact O-N 2.95Å
24	F	91.6	Very high	86.8	Confident	136 Å²	136	97.4 Å²	97.4	60%	0.596	50%	0.501	S	S	*	.	H	α-helix	trans	-62.5	-49.7	177.6	-174.3	-97.1	0	0	0	111.6	S20 L21 I22 T26 N27 T28	S20-F24 WeakPolarHBondContact O-CB 3.22Å; S20-F24 PolarHBondContact O-N 3.34Å; L21-F24 PolarHBondContact O-N 2.99Å; I22-F24 VanDerWaalsContact C-N 3.34Å; I22-F24 PolarHBondContact O-N 3.46Å; F24-T26 PolarHBondContact O-N 3.44Å; F24-N27 PolarHBondContact O-N 2.99Å; F24-T28 HydrophobicContact CD1-CG2 4.11Å; F24-T28 HydrophobicContact CE1-CG2 3.77Å; F24-T28 HydrophobicContact CE2-CG2 4.3Å; F24-T28 HydrophobicContact CZ-CG2 3.87Å; F24-T28 WeakPolarHBondContact O-CG2 3.42Å; F24-T28 PolarHBondContact O-N 3.49Å; F24-T28 PolarHBondContact O-OG1 2.98Å
25	L	89.6	Confident	85.8	Confident	84 Å²	84	98.6 Å²	98.6	44%	0.44	50%	0.499	S	S	.	.	H	α-helix	trans	-61.3	-46.5	179.2	-70.6	170.9	0	0	0	111.8	L21 I22 N27 T28 L29	L21-L25 HydrophobicContact CD2-CD1 3.9Å; L21-L25 HydrophobicContact CG-CD1 4.18Å; L21-L25 WeakPolarHBondContact O-CB 3.36Å; L21-L25 VanDerWaalsContact O-CG 3.31Å; L21-L25 WeakPolarHBondContact O-CG 3.32Å; L21-L25 PolarHBondContact O-N 3.02Å; I22-L25 PolarHBondContact O-N 2.9Å; L25-N27 VanDerWaalsContact C-N 3.31Å; L25-N27 PolarHBondContact O-N 3.33Å; L25-T28 WeakPolarHBondContact CA-OG1 3.39Å; L25-T28 PolarHBondContact O-N 2.9Å; L25-T28 PolarHBondContact O-OG1 3.46Å; L25-L29 WeakPolarHBondContact O-CG 3.38Å; L25-L29 PolarHBondContact O-N 2.97Å
26	T	89	Confident	84.7	Confident	79 Å²	79	99 Å²	99	49%	0.485	50%	0.497	S	S	.	.	H	α-helix	trans	-62.7	-36.7	177.1	48.4	0	0	0	0	112.5	I22 Y23 F24 K30	I22-T26 HydrophobicContact CG2-CG2 4.42Å; I22-T26 WeakPolarHBondContact O-CB 3.28Å; I22-T26 WeakPolarHBondContact O-CG2 3.35Å; I22-T26 PolarHBondContact O-N 3.24Å; I22-T26 PolarHBondContact O-OG1 3.48Å; Y23-T26 WeakPolarHBondContact CA-OG1 3.5Å; Y23-T26 PolarHBondContact O-OG1 3.26Å; F24-T26 PolarHBondContact O-N 3.44Å; T26-K30 WeakPolarHBondContact O-CB 3.46Å; T26-K30 PolarHBondContact O-N 2.95Å; T26-K30 VanDerWaalsContact O-N 3.1Å
27	N	85	Confident	83.4	Confident	77 Å²	77	102.2 Å²	102.2	41%	0.412	50%	0.499	S	S	.	.	H	α-helix	trans	-73.5	-37.4	178.4	-151.6	28.6	0	0	0	112.3	Y23 F24 L25 Q31	Y23-N27 VanDerWaalsContact O-CB 3.28Å; Y23-N27 WeakPolarHBondContact O-CB 3.36Å; Y23-N27 PolarHBondContact O-N 2.95Å; F24-N27 PolarHBondContact O-N 2.99Å; L25-N27 VanDerWaalsContact C-N 3.31Å; L25-N27 PolarHBondContact O-N 3.33Å; N27-Q31 WeakPolarHBondContact O-CB 3.37Å; N27-Q31 PolarHBondContact O-N 2.71Å
28	T	84.9	Confident	81.8	Confident	56 Å²	56	100.3 Å²	100.3	34%	0.344	50%	0.495	S	S	.	.	H	α-helix	trans	-67.2	-45	175.9	55.9	0	0	0	0	112.7	F24 L25 K30 Q31 E32	F24-T28 HydrophobicContact CD1-CG2 4.11Å; F24-T28 HydrophobicContact CE1-CG2 3.77Å; F24-T28 HydrophobicContact CE2-CG2 4.3Å; F24-T28 HydrophobicContact CZ-CG2 3.87Å; F24-T28 WeakPolarHBondContact O-CG2 3.42Å; F24-T28 PolarHBondContact O-N 3.49Å; F24-T28 PolarHBondContact O-OG1 2.98Å; L25-T28 WeakPolarHBondContact CA-OG1 3.39Å; L25-T28 PolarHBondContact O-N 2.9Å; L25-T28 PolarHBondContact O-OG1 3.46Å; T28-K30 VanDerWaalsContact C-N 3.33Å; T28-K30 PolarHBondContact O-N 3.01Å; T28-Q31 WeakPolarHBondContact O-CB 3.42Å; T28-Q31 PolarHBondContact O-N 3.36Å; T28-E32 PolarHBondContact O-N 2.89Å
29	L	82.4	Confident	80.3	Confident	107 Å²	107	107.7 Å²	107.7	56%	0.56	52%	0.515	S	S	*	.	H	α-helix	trans	-64.4	-38.7	176.3	-67.7	173.3	0	0	0	111.7	L25 Q31 E32 E33	L25-L29 WeakPolarHBondContact O-CG 3.38Å; L25-L29 PolarHBondContact O-N 2.97Å; L29-Q31 VanDerWaalsContact C-N 3.32Å; L29-Q31 PolarHBondContact O-N 3.1Å; L29-E32 PolarHBondContact O-N 3.36Å; L29-E33 WeakPolarHBondContact O-CB 3.44Å; L29-E33 PolarHBondContact O-N 3Å
30	K	82.5	Confident	78.7	Confident	113 Å²	113	105.9 Å²	105.9	49%	0.491	51%	0.509	S	S	.	.	H	α-helix	trans	-67.6	-31.4	175.7	-168.6	176.4	-174.6	175.9	0	112.8	T26 T28 R34	T26-K30 WeakPolarHBondContact O-CB 3.46Å; T26-K30 PolarHBondContact O-N 2.95Å; T26-K30 VanDerWaalsContact O-N 3.1Å; T28-K30 VanDerWaalsContact C-N 3.33Å; T28-K30 PolarHBondContact O-N 3.01Å; K30-R34 WeakPolarHBondContact O-CG 3.36Å; K30-R34 PolarHBondContact O-N 3.03Å; K30-R34 VanDerWaalsContact O-N 3.16Å
31	Q	74.8	Confident	77.1	Confident	115 Å²	115	108.6 Å²	108.6	54%	0.537	52%	0.518	S	S	.	.	H	α-helix	trans	-67.9	-45.7	173	-168.8	93	-11.3	0	0	110.4	N27 T28 L29 R34 T35	N27-Q31 WeakPolarHBondContact O-CB 3.37Å; N27-Q31 PolarHBondContact O-N 2.71Å; T28-Q31 WeakPolarHBondContact O-CB 3.42Å; T28-Q31 PolarHBondContact O-N 3.36Å; L29-Q31 VanDerWaalsContact C-N 3.32Å; L29-Q31 PolarHBondContact O-N 3.1Å; Q31-R34 PolarHBondContact O-N 3.01Å; Q31-T35 WeakPolarHBondContact O-CG2 3.18Å; Q31-T35 PolarHBondContact O-N 3.3Å; Q31-T35 PolarHBondContact O-OG1 2.99Å
32	E	75.6	Confident	75.4	Confident	110 Å²	110	111.2 Å²	111.2	51%	0.514	53%	0.531	S	S	.	.	H	α-helix	trans	-61.7	-46.1	177.9	-170.6	173.6	-173.3	0	0	111.4	T28 L29 R34 T35 I36	T28-E32 PolarHBondContact O-N 2.89Å; L29-E32 PolarHBondContact O-N 3.36Å; E32-R34 VanDerWaalsContact C-N 3.32Å; E32-R34 PolarHBondContact O-N 2.93Å; E32-T35 WeakPolarHBondContact CA-OG1 3.39Å; E32-T35 PolarHBondContact O-N 3.47Å; E32-T35 VanDerWaalsContact O-N 3.1Å; E32-T35 PolarHBondContact O-OG1 3.16Å; E32-I36 HydrophobicContact CG-CD1 3.96Å; E32-I36 WeakPolarHBondContact O-CG1 3.41Å; E32-I36 PolarHBondContact O-N 3.31Å
33	E	75.5	Confident	73.5	Confident	129 Å²	129	114.3 Å²	114.3	60%	0.603	54%	0.544	S	S	*	.	H	α-helix	trans	-61.3	-38.2	176.9	-162.1	-177.2	-175.8	0	0	112.4	L29 R37	L29-E33 WeakPolarHBondContact O-CB 3.44Å; L29-E33 PolarHBondContact O-N 3Å; E33-R37 VanDerWaalsContact O-CB 3.25Å; E33-R37 WeakPolarHBondContact O-CB 3.43Å; E33-R37 PolarHBondContact O-N 3.1Å
34	R	68.4	Low	71.4	Confident	135 Å²	135	110.6 Å²	110.6	51%	0.509	55%	0.546	S	S	.	.	H	α-helix	trans	-64.1	-43.6	172.1	-80.9	177.7	179.1	172.6	-3.1	112.2	K30 Q31 E32 R37 D38	K30-R34 WeakPolarHBondContact O-CG 3.36Å; K30-R34 PolarHBondContact O-N 3.03Å; K30-R34 VanDerWaalsContact O-N 3.16Å; Q31-R34 PolarHBondContact O-N 3.01Å; E32-R34 VanDerWaalsContact C-N 3.32Å; E32-R34 PolarHBondContact O-N 2.93Å; R34-R37 PolarHBondContact O-N 2.75Å; R34-D38 PolarHBondContact O-N 3.37Å
35	T	66.9	Low	69.2	Low	71 Å²	71	114.1 Å²	114.1	44%	0.436	56%	0.555	S	S	.	*	H	α-helix	trans	-67.9	-36	179.4	54.7	0	0	0	0	113	Q31 E32 R39	Q31-T35 WeakPolarHBondContact O-CG2 3.18Å; Q31-T35 PolarHBondContact O-N 3.3Å; Q31-T35 PolarHBondContact O-OG1 2.99Å; E32-T35 WeakPolarHBondContact CA-OG1 3.39Å; E32-T35 PolarHBondContact O-N 3.47Å; E32-T35 VanDerWaalsContact O-N 3.1Å; E32-T35 PolarHBondContact O-OG1 3.16Å; T35-R39 WeakPolarHBondContact O-CB 3.43Å; T35-R39 PolarHBondContact O-N 3.2Å
36	I	69.1	Low	67.1	Low	92 Å²	92	114.1 Å²	114.1	47%	0.472	56%	0.555	S	S	.	*	H	α-helix	trans	-68.8	-40.1	174	-66.7	168.5	0	0	0	110	E32 R39 T40	E32-I36 HydrophobicContact CG-CD1 3.96Å; E32-I36 WeakPolarHBondContact O-CG1 3.41Å; E32-I36 PolarHBondContact O-N 3.31Å; I36-R39 PolarHBondContact O-N 3.17Å; I36-T40 WeakPolarHBondContact O-CB 3.42Å; I36-T40 PolarHBondContact O-N 3.4Å; I36-T40 PolarHBondContact O-OG1 3.45Å
37	R	64.5	Low	65.2	Low	160 Å²	160	116.5 Å²	116.5	60%	0.604	57%	0.572	S	S	*	*	H	α-helix	trans	-67	-40.4	177	-164.1	165.9	70.4	-169.7	7	112.9	E33 R34 T40 L41	E33-R37 VanDerWaalsContact O-CB 3.25Å; E33-R37 WeakPolarHBondContact O-CB 3.43Å; E33-R37 PolarHBondContact O-N 3.1Å; R34-R37 PolarHBondContact O-N 2.75Å; R37-T40 VanDerWaalsContact CA-OG1 3.28Å; R37-T40 WeakPolarHBondContact CA-OG1 3.05Å; R37-T40 PolarHBondContact O-N 3.47Å; R37-T40 PolarHBondContact O-OG1 2.92Å; R37-T40 VanDerWaalsContact O-OG1 3.12Å; R37-L41 VanDerWaalsContact O-CB 3.26Å; R37-L41 WeakPolarHBondContact O-CB 3.46Å; R37-L41 PolarHBondContact O-N 3.41Å
38	D	60	Low	63.3	Low	100 Å²	100	118.7 Å²	118.7	54%	0.535	58%	0.584	S	S	.	*	H	α-helix	trans	-66.6	-38.5	174.1	-83.4	-19.1	0	0	0	111.7	R34 L41 L42	R34-D38 PolarHBondContact O-N 3.37Å; D38-L41 PolarHBondContact O-N 2.89Å; D38-L42 WeakPolarHBondContact O-CB 3.28Å; D38-L42 WeakPolarHBondContact O-CD1 3.49Å; D38-L42 VanDerWaalsContact O-CG 3.28Å; D38-L42 WeakPolarHBondContact O-CG 3.47Å; D38-L42 PolarHBondContact O-N 2.85Å
39	R	60.5	Low	61.6	Low	182 Å²	182	122.5 Å²	122.5	69%	0.687	60%	0.597	S	S	*	*	H	α-helix	trans	-62.7	-49	172.6	-87.1	-176.2	145.2	124	-2.3	112.3	T35 I36 L41 L42 E43	T35-R39 WeakPolarHBondContact O-CB 3.43Å; T35-R39 PolarHBondContact O-N 3.2Å; I36-R39 PolarHBondContact O-N 3.17Å; R39-L41 VanDerWaalsContact C-N 3.3Å; R39-L41 PolarHBondContact O-N 2.98Å; R39-L42 WeakPolarHBondContact O-CB 3.26Å; R39-L42 PolarHBondContact O-N 3.39Å; R39-E43 WeakPolarHBondContact O-CB 3.48Å; R39-E43 PolarHBondContact O-N 3.45Å
40	T	61	Low	60	Low	74 Å²	74	127 Å²	127	45%	0.454	61%	0.607	S	S	.	*	H	α-helix	trans	-67	-28.6	178.3	41.8	0	0	0	0	112.9	I36 R37 A44	I36-T40 WeakPolarHBondContact O-CB 3.42Å; I36-T40 PolarHBondContact O-N 3.4Å; I36-T40 PolarHBondContact O-OG1 3.45Å; R37-T40 VanDerWaalsContact CA-OG1 3.28Å; R37-T40 WeakPolarHBondContact CA-OG1 3.05Å; R37-T40 PolarHBondContact O-N 3.47Å; R37-T40 PolarHBondContact O-OG1 2.92Å; R37-T40 VanDerWaalsContact O-OG1 3.12Å; T40-A44 WeakPolarHBondContact O-CB 3.25Å; T40-A44 PolarHBondContact O-N 2.86Å
41	L	58.6	Low	58.5	Low	119 Å²	119	124.3 Å²	124.3	62%	0.623	60%	0.598	S	S	*	*	H	α-helix	trans	-72.3	-36.8	172.1	-156.6	165	0	0	0	111.5	R37 D38 R39 R45	R37-L41 VanDerWaalsContact O-CB 3.26Å; R37-L41 WeakPolarHBondContact O-CB 3.46Å; R37-L41 PolarHBondContact O-N 3.41Å; D38-L41 PolarHBondContact O-N 2.89Å; R39-L41 VanDerWaalsContact C-N 3.3Å; R39-L41 PolarHBondContact O-N 2.98Å; L41-R45 PolarHBondContact O-N 2.88Å
42	L	56	Low	57.4	Low	139 Å²	139	124.5 Å²	124.5	73%	0.728	61%	0.608	S	S	*	*	H	α-helix	trans	-66.9	-36.3	172	-74.1	164.5	0	0	0	112.2	D38 R39	D38-L42 WeakPolarHBondContact O-CB 3.28Å; D38-L42 WeakPolarHBondContact O-CD1 3.49Å; D38-L42 VanDerWaalsContact O-CG 3.28Å; D38-L42 WeakPolarHBondContact O-CG 3.47Å; D38-L42 PolarHBondContact O-N 2.85Å; R39-L42 WeakPolarHBondContact O-CB 3.26Å; R39-L42 PolarHBondContact O-N 3.39Å
43	E	53.7	Low	56.7	Low	166 Å²	166	121.9 Å²	121.9	78%	0.776	59%	0.594	S	S	*	*	H	α-helix	trans	-82.2	-27.1	-180	-136.1	160.9	167.9	0	0	112.8	R39 R45	R39-E43 WeakPolarHBondContact O-CB 3.48Å; R39-E43 PolarHBondContact O-N 3.45Å; E43-R45 VanDerWaalsContact C-N 3.3Å
44	A	49.8	Very low	55.7	Low	79 Å²	79	122.7 Å²	122.7	65%	0.653	60%	0.596	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.5	7.2	174	0	0	0	0	0	113.6	T40 D46	T40-A44 WeakPolarHBondContact O-CB 3.25Å; T40-A44 PolarHBondContact O-N 2.86Å; A44-D46 PolarHBondContact O-N 3.12Å
45	R	46.3	Very low	55.4	Low	210 Å²	210	117.1 Å²	117.1	79%	0.792	58%	0.576	S	S	*	*	S	Bend	trans	-73.6	85.9	167.3	-167.1	160.7	-175.7	161.2	-1.7	108.3	L41 E43	L41-R45 PolarHBondContact O-N 2.88Å; E43-R45 VanDerWaalsContact C-N 3.3Å
46	D	43.6	Very low	55.1	Low	83 Å²	83	122 Å²	122	44%	0.444	59%	0.587	S	S	.	*			trans	-17	117.2	171.5	-170.2	8.7	0	0	0	114.7	A44 D48 H49	A44-D46 PolarHBondContact O-N 3.12Å; D46-D48 PolarHBondContact O-N 2.71Å; D46-D48 VanDerWaalsContact O-N 3.08Å; D46-D48 WeakPolarHBondContact OD1-CB 3.28Å; D46-D48 PolarHBondContact OD1-N 3.31Å; D46-D48 VanDerWaalsContact OD1-N 3.15Å; D46-H49 PolarHBondContact O-N 2.93Å; D46-H49 IonicContact OD2-ND1 3.59Å
47	P	51	Low	54.7	Low	130 Å²	130	120.2 Å²	120.2	84%	0.844	58%	0.576	S	S	*	*	T	Hydrogen-bonded Turn	trans	-64.6	-6.9	175.5	26.9	-33.2	0	0	0	113.4
48	D	44.6	Very low	54.4	Low	123 Å²	123	117.3 Å²	117.3	66%	0.658	57%	0.572	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90.6	0.1	-178.3	-141.5	10.4	0	0	0	114.5	D46 R50	D46-D48 PolarHBondContact O-N 2.71Å; D46-D48 VanDerWaalsContact O-N 3.08Å; D46-D48 WeakPolarHBondContact OD1-CB 3.28Å; D46-D48 PolarHBondContact OD1-N 3.31Å; D46-D48 VanDerWaalsContact OD1-N 3.15Å; D48-R50 PolarHBondContact O-N 2.81Å
49	H	48.8	Very low	54	Low	135 Å²	135	118.2 Å²	118.2	63%	0.625	58%	0.577	S	S	*	*			trans	-77.6	66.9	164.6	-81.1	65.7	0	0	0	110.3	D46 I51	D46-H49 PolarHBondContact O-N 2.93Å; D46-H49 IonicContact OD2-ND1 3.59Å; H49-I51 VanDerWaalsContact C-N 3.3Å; H49-I51 PolarHBondContact O-N 3.37Å
50	R	48.9	Very low	53.5	Low	201 Å²	201	113.7 Å²	113.7	76%	0.758	59%	0.586	S	S	*	*			trans	-56.6	102.1	156.1	-69.6	-173.5	-178.4	-163.4	0.3	106.3	D48 P52	D48-R50 PolarHBondContact O-N 2.81Å; R50-P52 VanDerWaalsContact O-CD 3.25Å; R50-P52 WeakPolarHBondContact O-CD 3.04Å
51	I	50.1	Low	52.7	Low	58 Å²	58	116.9 Å²	116.9	30%	0.297	60%	0.601	S	S	.	*			trans	-53	118.5	174.7	-59.1	-172.7	0	0	0	105.9	H49 W53 Q150 T154	H49-I51 VanDerWaalsContact C-N 3.3Å; H49-I51 PolarHBondContact O-N 3.37Å; I51-W53 VanDerWaalsContact C-N 3.32Å; I51-W53 PolarHBondContact O-N 3.08Å; I51-Q150 HydrophobicContact CD1-CB 4.47Å; I51-Q150 HydrophobicContact CD1-CG 3.66Å; I51-Q150 HydrophobicContact CG1-CG 4.3Å; I51-T154 HydrophobicContact CD1-CG2 3.49Å; I51-T154 VanDerWaalsContact CD1-CG2 3.49Å; I51-T154 HydrophobicContact CG2-CG2 4.49Å
52	P	53.4	Low	52.2	Low	118 Å²	118	114.4 Å²	114.4	77%	0.766	59%	0.593	S	S	*	*			trans	-64.5	102.1	176.7	24.5	-30.8	0	0	0	106.5	R50 K54	R50-P52 VanDerWaalsContact O-CD 3.25Å; R50-P52 WeakPolarHBondContact O-CD 3.04Å; P52-K54 PolarHBondContact O-N 3.15Å; P52-K54 VanDerWaalsContact O-N 3.12Å
53	W	59.4	Low	51.8	Low	56 Å²	56	113.3 Å²	113.3	21%	0.212	60%	0.597	C	S	.	*			trans	-57.7	120.7	-179.5	-65.8	114.1	0	0	0	108.4	I51 V55 L142 A146 F153	I51-W53 VanDerWaalsContact C-N 3.32Å; I51-W53 PolarHBondContact O-N 3.08Å; W53-V55 VanDerWaalsContact C-N 3.25Å; W53-V55 PolarHBondContact O-N 2.87Å; W53-L142 HydrophobicContact CE3-CD2 4.48Å; W53-L142 WeakPolarHBondContact CZ2-O 3.5Å; W53-L142 PolarHBondContact NE1-O 2.97Å; W53-A146 HydrophobicContact CZ2-CB 3.68Å; W53-F153 HydrophobicContact CH2-CB 3.8Å; W53-F153 HydrophobicContact CZ3-CB 3.55Å
54	K	56	Low	51.7	Low	146 Å²	146	115 Å²	115	64%	0.635	60%	0.596	S	S	*	*			trans	-88.7	8.7	-175.1	-156.2	-176.3	174.8	-169	0	112.5	P52 R56	P52-K54 PolarHBondContact O-N 3.15Å; P52-K54 VanDerWaalsContact O-N 3.12Å; K54-R56 PolarHBondContact O-N 2.71Å
55	V	60.8	Low	52	Low	17 Å²	17	116.4 Å²	116.4	10%	0.103	60%	0.599	C	S	.	*			trans	-65	107.5	-178.9	-176.8	0	0	0	0	108.4	W53 F57 L142 V156 H159 L162	W53-V55 VanDerWaalsContact C-N 3.25Å; W53-V55 PolarHBondContact O-N 2.87Å; V55-F57 HydrophobicContact CB-CE2 4.28Å; V55-F57 HydrophobicContact CB-CZ 4.44Å; V55-F57 HydrophobicContact CG1-CD1 4.44Å; V55-F57 HydrophobicContact CG1-CD2 4.34Å; V55-F57 HydrophobicContact CG1-CE1 4.05Å; V55-F57 HydrophobicContact CG1-CE2 3.93Å; V55-F57 HydrophobicContact CG1-CZ 3.77Å; V55-F57 PolarHBondContact O-N 2.96Å; V55-L142 HydrophobicContact CG2-CD1 4.24Å; V55-V156 HydrophobicContact CG2-CG1 4.36Å; V55-H159 HydrophobicContact CG1-CB 4.35Å; V55-L162 HydrophobicContact CG1-CD2 4.47Å
56	R	62.1	Low	52.8	Low	174 Å²	174	109.9 Å²	109.9	66%	0.657	58%	0.579	S	S	*	*	B	Isolated β-bridge	trans	-85.6	102.1	175	-67.3	-170.5	178.2	-147.5	-0.8	108.7	K54 N58	K54-R56 PolarHBondContact O-N 2.71Å; R56-N58 VanDerWaalsContact C-N 3.25Å; R56-N58 PolarHBondContact O-N 2.84Å; R56-N58 PolarHBondContact O-ND2 3.48Å
57	F	60.3	Low	54.3	Low	54 Å²	54	111.2 Å²	111.2	24%	0.237	59%	0.59	C	S	.	*			trans	-71.4	86.6	166.7	-60.1	-81.7	0	0	0	108.5	V55 L59 Q135 L142 H159 L162	V55-F57 HydrophobicContact CB-CE2 4.28Å; V55-F57 HydrophobicContact CB-CZ 4.44Å; V55-F57 HydrophobicContact CG1-CD1 4.44Å; V55-F57 HydrophobicContact CG1-CD2 4.34Å; V55-F57 HydrophobicContact CG1-CE1 4.05Å; V55-F57 HydrophobicContact CG1-CE2 3.93Å; V55-F57 HydrophobicContact CG1-CZ 3.77Å; V55-F57 PolarHBondContact O-N 2.96Å; F57-L59 VanDerWaalsContact C-N 3.35Å; F57-L59 PolarHBondContact O-N 3.28Å; F57-Q135 HydrophobicContact CD1-CB 4.47Å; F57-Q135 HydrophobicContact CD1-CG 3.81Å; F57-Q135 HydrophobicContact CE1-CG 4.27Å; F57-Q135 HydrophobicContact CG-CG 4.37Å; F57-L142 HydrophobicContact CZ-CD1 4.43Å; F57-H159 HydrophobicContact CD1-CB 3.93Å; F57-H159 AromaticContact CD1-CD2 3.72Å; F57-H159 AromaticContact CD1-CE1 3.87Å; F57-H159 AromaticContact CD1-CG 3.5Å; F57-H159 AromaticContact CD1-ND1 3.61Å; F57-H159 AromaticContact CD1-NE2 3.93Å; F57-H159 HydrophobicContact CE1-CB 4.26Å; F57-H159 AromaticContact CE1-CD2 3.43Å; F57-H159 VanDerWaalsContact CE1-CD2 3.43Å; F57-H159 WeakPolarHBondContact CE1-CD2 3.46Å; F57-H159 AromaticContact CE1-CG 3.71Å; F57-H159 AromaticContact CE1-NE2 3.68Å; F57-L162 HydrophobicContact CZ-CD2 4.49Å
58	N	58.3	Low	56	Low	99 Å²	99	112 Å²	112	53%	0.529	58%	0.583	S	S	.	*			trans	-71.2	92.4	177.7	-68.4	-62.9	0	0	0	109	R56 G60	R56-N58 VanDerWaalsContact C-N 3.25Å; R56-N58 PolarHBondContact O-N 2.84Å; R56-N58 PolarHBondContact O-ND2 3.48Å; N58-G60 PolarHBondContact O-N 3.48Å
59	L	51	Low	58.1	Low	120 Å²	120	106.6 Å²	106.6	63%	0.628	56%	0.555	S	S	*	*			trans	-73.5	89.4	176.7	-162.5	78.3	0	0	0	109.4	F57 N61 P132	F57-L59 VanDerWaalsContact C-N 3.35Å; F57-L59 PolarHBondContact O-N 3.28Å; L59-N61 PolarHBondContact O-N 2.93Å; L59-P132 HydrophobicContact CD1-CB 4.17Å
60	G	49.7	Very low	60.2	Low	86 Å²	86	104.8 Å²	104.8	89%	0.887	54%	0.542	S	S	*	.	S	Bend	trans	56.9	2.7	154.1	0	0	0	0	0	119.5	N58	N58-G60 PolarHBondContact O-N 3.48Å
61	N	43.7	Very low	62.3	Low	142 Å²	142	96.6 Å²	96.6	76%	0.759	51%	0.513	S	S	*	.			trans	-115.1	23.6	-175	-154.8	21	0	0	0	113.1	L59 S63	L59-N61 PolarHBondContact O-N 2.93Å; N61-S63 PolarHBondContact O-N 3.21Å
62	S	48.6	Very low	64.2	Low	67 Å²	67	94.1 Å²	94.1	47%	0.469	50%	0.501	S	S	.	.			trans	-73.6	88.6	163.3	-75.2	0	0	0	0	108.5	R64	S62-R64 PolarHBondContact O-N 2.66Å
63	S	47.2	Very low	65.7	Low	116 Å²	116	94.7 Å²	94.7	81%	0.811	50%	0.497	S	S	*	.			trans	-61.1	16	160.6	43.5	0	0	0	0	113.3	N61	N61-S63 PolarHBondContact O-N 3.21Å
64	R	53.3	Low	66.4	Low	200 Å²	200	97.4 Å²	97.4	76%	0.755	51%	0.512	S	S	*	.	S	Bend	trans	-86.4	120.5	166.7	-68.1	-172.2	174.2	-164.5	-2.3	106.6	S62 I66	S62-R64 PolarHBondContact O-N 2.66Å; R64-I66 PolarHBondContact O-N 3.43Å
65	P	55.3	Low	67.6	Low	109 Å²	109	91 Å²	91	71%	0.708	49%	0.486	S	S	*	.			trans	-57.8	113.2	168	25	-30.6	0	0	0	106.3	T67	P65-T67 HydrophobicContact CB-CG2 4.44Å; P65-T67 PolarHBondContact O-N 3.02Å
66	I	63.9	Low	68.7	Low	74 Å²	74	99 Å²	99	38%	0.379	52%	0.52	S	S	.	.			trans	-73	90.3	177.9	-62.6	173.3	0	0	0	105.1	R64 Q68 L83	R64-I66 PolarHBondContact O-N 3.43Å; I66-Q68 VanDerWaalsContact CG2-O 3.26Å; I66-Q68 WeakPolarHBondContact CG2-O 3.46Å; I66-L83 HydrophobicContact CD1-CD2 3.54Å
67	T	73.6	Confident	70	Confident	111 Å²	111	94.5 Å²	94.5	68%	0.681	52%	0.515	S	S	*	.			trans	-75.8	-17.2	-177.9	49.5	0	0	0	0	111.6	P65 N95	P65-T67 HydrophobicContact CB-CG2 4.44Å; P65-T67 PolarHBondContact O-N 3.02Å; T67-N95 WeakPolarHBondContact O-CB 3.42Å; T67-N95 PolarHBondContact O-ND2 2.77Å
68	Q	87.4	Confident	71.6	Confident	147 Å²	147	93.7 Å²	93.7	69%	0.687	51%	0.513	S	S	*	.	S	Bend	trans	-145.8	133.7	-178.4	-173.7	172.9	9.9	0	0	109.6	I66 N95	I66-Q68 VanDerWaalsContact CG2-O 3.26Å; I66-Q68 WeakPolarHBondContact CG2-O 3.46Å; Q68-N95 WeakPolarHBondContact CA-O 3.34Å
69	C	89.6	Confident	73.3	Confident	9 Å²	9	89.2 Å²	89.2	6%	0.061	49%	0.489	C	S	.	.			trans	-110.7	146	175.7	-58.3	0	0	0	0	111.2	D81 E82 N95 C97	C69-D81 HydrophobicContact CB-CB 4.3Å; C69-E82 WeakPolarHBondContact CA-OE1 3.47Å; C69-E82 HydrophobicContact CB-CG 4.14Å; C69-N95 PolarHBondContact N-O 2.72Å; C69-C97 HydrophobicContact CB-CB 3.79Å; C69-C97 WeakPolarHBondContact CB-SG 3.31Å; C69-C97 PolarHBondContact N-SG 3Å; C69-C97 VanDerWaalsContact N-SG 3.4Å; C69-C97 WeakPolarHBondContact SG-CB 3.43Å; C69-C97 CovalentContact SG-SG 2.02Å; C69-C97 PolarHBondContact SG-SG 3.06Å
70	R	91.6	Very high	75.4	Confident	96 Å²	96	83.5 Å²	83.5	36%	0.362	46%	0.459	S	S	.	.			trans	-78.3	151.3	157.5	-64.1	175	-66.9	179.8	-2	109.4	D81 E82 D158 F160 E161	R70-D81 CarbonylContact O-C 3.44Å; R70-D81 WeakPolarHBondContact O-CA 3.02Å; R70-E82 HydrophobicContact CB-CB 4.43Å; R70-E82 IonicContact CZ-OE2 3.75Å; R70-E82 IonicContact NE-OE2 2.79Å; R70-E82 PolarHBondContact NE-OE2 3.28Å; R70-E82 IonicContact NH2-OE2 3.41Å; R70-E82 PolarHBondContact NH2-OE2 3.4Å; R70-E82 VanDerWaalsContact NH2-OE2 3.13Å; R70-E82 PolarHBondContact O-N 3.3Å; R70-D158 IonicContact CZ-OD2 3.13Å; R70-D158 IonicContact NH2-OD2 3.37Å; R70-D158 PolarHBondContact NH2-OD2 2.03Å; R70-F160 HydrophobicContact CB-CD1 4.16Å; R70-F160 HydrophobicContact CB-CE1 3.77Å; R70-E161 IonicContact NH1-OE1 2.9Å; R70-E161 PolarHBondContact NH1-OE1 3.37Å; R70-E161 VanDerWaalsContact NH1-OE1 3.14Å
71	N	92.5	Very high	77.5	Confident	29 Å²	29	79.4 Å²	79.4	16%	0.155	42%	0.417	C	S	.	.	B	Isolated β-bridge	trans	-135.8	172.3	172.6	63.1	57.5	0	0	0	110.7	I73 T80 G96	N71-I73 PolarHBondContact O-N 3.27Å; N71-I73 WeakPolarHBondContact OD1-CA 3.48Å; N71-I73 WeakPolarHBondContact OD1-CG1 3.43Å; N71-I73 PolarHBondContact OD1-N 3.04Å; N71-T80 CarbonylContact C-O 3.59Å; N71-T80 WeakPolarHBondContact CA-O 3.23Å; N71-T80 VanDerWaalsContact CB-O 3.3Å; N71-T80 WeakPolarHBondContact CB-O 3.46Å; N71-G96 PolarHBondContact ND2-O 3.44Å; N71-G96 VanDerWaalsContact ND2-O 3.15Å
72	S	91.4	Very high	79.8	Confident	7 Å²	7	74.7 Å²	74.7	5%	0.049	39%	0.391	C	S	.	.			trans	-66.5	-19.3	-177.2	58	0	0	0	0	113.9	Q74 T80 E123	S72-Q74 WeakPolarHBondContact O-CG 3.45Å; S72-Q74 PolarHBondContact O-N 2.76Å; S72-T80 PolarHBondContact N-O 3.19Å; S72-T80 PolarHBondContact OG-N 3.08Å; S72-E123 WeakPolarHBondContact CB-OE2 3.2Å; S72-E123 PolarHBondContact OG-OE1 3.48Å; S72-E123 VanDerWaalsContact OG-OE1 3.05Å; S72-E123 PolarHBondContact OG-OE2 3.32Å
73	I	84.1	Confident	81.7	Confident	130 Å²	130	74.2 Å²	74.2	67%	0.667	38%	0.382	S	S	*	.			trans	58.6	-34.5	-179.1	-58.4	171.2	0	0	0	114.8	N71	N71-I73 PolarHBondContact O-N 3.27Å; N71-I73 WeakPolarHBondContact OD1-CA 3.48Å; N71-I73 WeakPolarHBondContact OD1-CG1 3.43Å; N71-I73 PolarHBondContact OD1-N 3.04Å
74	Q	75.1	Confident	83.8	Confident	113 Å²	113	68.7 Å²	68.7	53%	0.528	34%	0.344	S	S	.	.			trans	-78.1	-24.9	-167	-67.4	-179.5	-38.8	0	0	113.8	S72 K76	S72-Q74 WeakPolarHBondContact O-CG 3.45Å; S72-Q74 PolarHBondContact O-N 2.76Å; Q74-K76 PolarHBondContact O-N 3.38Å
75	G	80.2	Confident	85.8	Confident	10 Å²	10	61.7 Å²	61.7	10%	0.103	32%	0.318	C	S	.	.			trans	-71.4	128.6	-173.6	0	0	0	0	0	113.3	L78 R89 E123	G75-L78 CarbonylContact C-O 3.44Å; G75-L78 WeakPolarHBondContact CA-O 3.22Å; G75-R89 PolarHBondContact O-NH2 3.36Å; G75-E123 VanDerWaalsContact CA-OE1 3.3Å; G75-E123 WeakPolarHBondContact CA-OE1 3.43Å; G75-E123 PolarHBondContact N-OE1 3.39Å
76	K	84	Confident	87.7	Confident	187 Å²	187	56.7 Å²	56.7	81%	0.813	29%	0.285	S	S	*	.	S	Bend	trans	-67.8	-41	-176.4	-178.6	-179.9	176.8	-178.1	0	113.4	Q74 R89	Q74-K76 PolarHBondContact O-N 3.38Å; K76-R89 PolarHBondContact O-NH1 3.22Å
77	S	89.7	Confident	89.1	Confident	79 Å²	79	53.1 Å²	53.1	55%	0.552	27%	0.267	S	S	*	.	S	Bend	trans	-119.1	-40.4	-175.9	49.9	0	0	0	0	112.4	E88 R89	S77-E88 WeakPolarHBondContact O-CA 3.27Å; S77-R89 PolarHBondContact O-N 3.28Å
78	L	93.8	Very high	90.1	Very high	37 Å²	37	51.4 Å²	51.4	19%	0.194	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	149.4	178.2	-63.8	171.4	0	0	0	109.8	G75 V86 C87 E88 I121 E123 Y124	G75-L78 CarbonylContact C-O 3.44Å; G75-L78 WeakPolarHBondContact CA-O 3.22Å; L78-V86 HydrophobicContact CB-CG1 4.26Å; L78-V86 HydrophobicContact CD2-CG1 4.45Å; L78-C87 CarbonylContact C-O 3.55Å; L78-C87 WeakPolarHBondContact CA-O 3.24Å; L78-E88 HydrophobicContact CD2-CG 4.03Å; L78-I121 HydrophobicContact CD1-CG2 4.45Å; L78-E123 HydrophobicContact CB-CB 4.36Å; L78-E123 HydrophobicContact CB-CG 4.02Å; L78-E123 WeakPolarHBondContact O-CG 3.48Å; L78-Y124 HydrophobicContact CD1-CE1 4.04Å
79	L	94.6	Very high	90.3	Very high	4 Å²	4	50.4 Å²	50.4	2%	0.021	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.9	150	175.8	-71.4	140.2	0	0	0	109	V86 C87 R89 L92	L79-V86 VanDerWaalsContact O-CA 3.26Å; L79-V86 WeakPolarHBondContact O-CA 3.3Å; L79-C87 PolarHBondContact N-O 3.45Å; L79-C87 PolarHBondContact O-N 2.8Å; L79-R89 HydrophobicContact CD1-CB 3.8Å; L79-R89 HydrophobicContact CD1-CG 3.94Å; L79-L92 HydrophobicContact CD1-CD2 4.28Å
80	T	94.9	Very high	90.4	Very high	0 Å²	0	57.1 Å²	57.1	0%	0	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	131.1	174.1	-45.8	0	0	0	0	109.6	N71 S72 Y85 V86 E123 V126 L130	N71-T80 CarbonylContact C-O 3.59Å; N71-T80 WeakPolarHBondContact CA-O 3.23Å; N71-T80 VanDerWaalsContact CB-O 3.3Å; N71-T80 WeakPolarHBondContact CB-O 3.46Å; S72-T80 PolarHBondContact N-O 3.19Å; S72-T80 PolarHBondContact OG-N 3.08Å; T80-Y85 CarbonylContact C-O 3.58Å; T80-Y85 VanDerWaalsContact CA-O 3.28Å; T80-Y85 WeakPolarHBondContact CA-O 3.48Å; T80-V86 HydrophobicContact CG2-CG2 4Å; T80-E123 WeakPolarHBondContact CB-OE2 3.49Å; T80-E123 PolarHBondContact N-OE2 2.84Å; T80-E123 VanDerWaalsContact OG1-CA 3.23Å; T80-E123 WeakPolarHBondContact OG1-CA 3.03Å; T80-E123 VanDerWaalsContact OG1-CB 3.23Å; T80-E123 WeakPolarHBondContact OG1-CB 3.09Å; T80-E123 PolarHBondContact OG1-O 3.49Å; T80-E123 PolarHBondContact OG1-OE2 3.02Å; T80-V126 HydrophobicContact CG2-CB 4.32Å; T80-V126 HydrophobicContact CG2-CG1 4Å; T80-L130 HydrophobicContact CG2-CD1 4.49Å
81	D	93.1	Very high	90.5	Very high	1 Å²	1	54 Å²	54	1%	0.005	26%	0.26	C	S	.	.	B	Isolated β-bridge	trans	-89.6	168	172	70.3	19.6	0	0	0	112.7	C69 R70 L83 G84 Y85 C98	C69-D81 HydrophobicContact CB-CB 4.3Å; R70-D81 CarbonylContact O-C 3.44Å; R70-D81 WeakPolarHBondContact O-CA 3.02Å; D81-L83 PolarHBondContact O-N 3.14Å; D81-L83 VanDerWaalsContact O-N 3.16Å; D81-L83 WeakPolarHBondContact OD1-CA 3.16Å; D81-L83 WeakPolarHBondContact OD1-CB 3.13Å; D81-L83 PolarHBondContact OD1-N 3.43Å; D81-L83 VanDerWaalsContact OD1-N 3.1Å; D81-G84 PolarHBondContact O-N 3.05Å; D81-G84 PolarHBondContact OD1-N 3.11Å; D81-G84 VanDerWaalsContact OD1-N 3.07Å; D81-Y85 PolarHBondContact N-O 3.42Å; D81-Y85 WeakPolarHBondContact OD1-CB 3.4Å; D81-Y85 PolarHBondContact OD1-N 3.01Å; D81-C98 WeakPolarHBondContact OD2-CB 3.43Å; D81-C98 PolarHBondContact OD2-N 3.12Å
82	E	91.3	Very high	90.4	Very high	43 Å²	43	55.1 Å²	55.1	20%	0.201	27%	0.266	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65.4	-14.5	-179.3	69.7	-176.3	174.3	0	0	114.2	C69 R70 G84 F160	C69-E82 WeakPolarHBondContact CA-OE1 3.47Å; C69-E82 HydrophobicContact CB-CG 4.14Å; R70-E82 HydrophobicContact CB-CB 4.43Å; R70-E82 IonicContact CZ-OE2 3.75Å; R70-E82 IonicContact NE-OE2 2.79Å; R70-E82 PolarHBondContact NE-OE2 3.28Å; R70-E82 IonicContact NH2-OE2 3.41Å; R70-E82 PolarHBondContact NH2-OE2 3.4Å; R70-E82 VanDerWaalsContact NH2-OE2 3.13Å; R70-E82 PolarHBondContact O-N 3.3Å; E82-G84 VanDerWaalsContact C-N 3.29Å; E82-F160 HydrophobicContact CB-CB 4.18Å; E82-F160 HydrophobicContact CB-CD1 3.7Å; E82-F160 HydrophobicContact CB-CD2 4.14Å; E82-F160 HydrophobicContact CB-CE1 4.04Å; E82-F160 HydrophobicContact CB-CE2 4.44Å; E82-F160 HydrophobicContact CB-CG 3.74Å; E82-F160 HydrophobicContact CB-CZ 4.39Å
83	L	89.4	Confident	90.5	Very high	57 Å²	57	58.4 Å²	58.4	30%	0.298	28%	0.282	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.4	-6	174.9	-55	-179.7	0	0	0	112.3	I66 D81 Y85 Q107 Y108	I66-L83 HydrophobicContact CD1-CD2 3.54Å; D81-L83 PolarHBondContact O-N 3.14Å; D81-L83 VanDerWaalsContact O-N 3.16Å; D81-L83 WeakPolarHBondContact OD1-CA 3.16Å; D81-L83 WeakPolarHBondContact OD1-CB 3.13Å; D81-L83 PolarHBondContact OD1-N 3.43Å; D81-L83 VanDerWaalsContact OD1-N 3.1Å; L83-Y85 HydrophobicContact CB-CD2 3.86Å; L83-Y85 HydrophobicContact CB-CE2 4.17Å; L83-Q107 PolarHBondContact O-NE2 2.85Å; L83-Y108 PolarHBondContact O-OH 3.32Å
84	G	92.1	Very high	90.8	Very high	0 Å²	0	60 Å²	60	0%	0	30%	0.297	C	S	.	.	S	Bend	trans	85.2	13.9	179.7	0	0	0	0	0	114.3	D81 E82 Q107 Y108 S127	D81-G84 PolarHBondContact O-N 3.05Å; D81-G84 PolarHBondContact OD1-N 3.11Å; D81-G84 VanDerWaalsContact OD1-N 3.07Å; E82-G84 VanDerWaalsContact C-N 3.29Å; G84-Q107 WeakPolarHBondContact O-CA 3.2Å; G84-Y108 PolarHBondContact O-N 3.41Å; G84-S127 PolarHBondContact O-OG 3.14Å
85	Y	94.1	Very high	91.5	Very high	52 Å²	52	57.1 Å²	57.1	20%	0.204	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.8	136.5	168.2	-69.4	-91.1	0	0	0	110.5	T80 D81 L83 V100 R106 Q107	T80-Y85 CarbonylContact C-O 3.58Å; T80-Y85 VanDerWaalsContact CA-O 3.28Å; T80-Y85 WeakPolarHBondContact CA-O 3.48Å; D81-Y85 PolarHBondContact N-O 3.42Å; D81-Y85 WeakPolarHBondContact OD1-CB 3.4Å; D81-Y85 PolarHBondContact OD1-N 3.01Å; L83-Y85 HydrophobicContact CB-CD2 3.86Å; L83-Y85 HydrophobicContact CB-CE2 4.17Å; Y85-V100 HydrophobicContact CD1-CG1 4.28Å; Y85-V100 HydrophobicContact CD2-CG1 4.41Å; Y85-V100 HydrophobicContact CE1-CB 4.35Å; Y85-V100 HydrophobicContact CE1-CG1 3.82Å; Y85-V100 HydrophobicContact CE2-CG1 4Å; Y85-R106 CarbonylContact C-O 3.43Å; Y85-R106 WeakPolarHBondContact CA-O 3.47Å; Y85-Q107 HydrophobicContact CD1-CB 3.79Å; Y85-Q107 HydrophobicContact CD1-CG 4.1Å; Y85-Q107 HydrophobicContact CD2-CG 4.07Å; Y85-Q107 HydrophobicContact CE1-CB 3.69Å; Y85-Q107 HydrophobicContact CE1-CG 4.02Å; Y85-Q107 HydrophobicContact CE2-CG 3.96Å; Y85-Q107 HydrophobicContact CG-CB 4.27Å; Y85-Q107 HydrophobicContact CG-CG 4.12Å; Y85-Q107 PolarHBondContact OH-OE1 2.81Å
86	V	95.1	Very high	91.9	Very high	4 Å²	4	57.2 Å²	57.2	2%	0.024	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	125.5	170.4	-174.3	0	0	0	0	108.6	L78 L79 T80 S105 R106 I109 E123 Y124	L78-V86 HydrophobicContact CB-CG1 4.26Å; L78-V86 HydrophobicContact CD2-CG1 4.45Å; L79-V86 VanDerWaalsContact O-CA 3.26Å; L79-V86 WeakPolarHBondContact O-CA 3.3Å; T80-V86 HydrophobicContact CG2-CG2 4Å; V86-S105 VanDerWaalsContact O-CA 3.32Å; V86-S105 WeakPolarHBondContact O-CA 3.49Å; V86-R106 PolarHBondContact N-O 3.15Å; V86-R106 PolarHBondContact O-N 2.97Å; V86-I109 HydrophobicContact CB-CG2 4.01Å; V86-I109 HydrophobicContact CG2-CG2 3.57Å; V86-E123 HydrophobicContact CG1-CB 4.15Å; V86-Y124 HydrophobicContact CB-CE1 4.44Å; V86-Y124 HydrophobicContact CG1-CD1 4.07Å; V86-Y124 HydrophobicContact CG1-CE1 3.82Å; V86-Y124 HydrophobicContact CG2-CD1 4.28Å
87	C	94.1	Very high	92.3	Very high	0 Å²	0	48.9 Å²	48.9	0%	0	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.4	164	177.7	61.9	0	0	0	0	111.5	L78 L79 D91 C98	L78-C87 CarbonylContact C-O 3.55Å; L78-C87 WeakPolarHBondContact CA-O 3.24Å; L79-C87 PolarHBondContact N-O 3.45Å; L79-C87 PolarHBondContact O-N 2.8Å; C87-D91 HydrophobicContact CB-CB 4.22Å; C87-C98 HydrophobicContact CB-CB 3.59Å; C87-C98 WeakPolarHBondContact CB-SG 3.4Å; C87-C98 PolarHBondContact N-SG 3.31Å; C87-C98 VanDerWaalsContact N-SG 3.41Å; C87-C98 WeakPolarHBondContact SG-CA 3.13Å; C87-C98 WeakPolarHBondContact SG-CB 3.15Å; C87-C98 CovalentContact SG-SG 2.04Å; C87-C98 PolarHBondContact SG-SG 2.87Å
88	E	93.9	Very high	92.5	Very high	75 Å²	75	45.2 Å²	45.2	35%	0.35	23%	0.226	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.8	153.5	166.1	-70.6	-178.1	-141.7	0	0	110.3	S77 L78 K90 D91 L92	S77-E88 WeakPolarHBondContact O-CA 3.27Å; L78-E88 HydrophobicContact CD2-CG 4.03Å; E88-K90 HydrophobicContact CB-CD 4.47Å; E88-K90 HydrophobicContact CB-CG 4.07Å; E88-K90 VanDerWaalsContact CD-NZ 3.26Å; E88-K90 PolarHBondContact O-N 3.03Å; E88-K90 VanDerWaalsContact O-N 3.07Å; E88-K90 IonicContact OE1-NZ 3.29Å; E88-K90 PolarHBondContact OE1-NZ 3.25Å; E88-K90 WeakPolarHBondContact OE2-CD 3.29Å; E88-K90 WeakPolarHBondContact OE2-CE 3.31Å; E88-K90 IonicContact OE2-NZ 2.69Å; E88-K90 PolarHBondContact OE2-NZ 3.17Å; E88-D91 PolarHBondContact O-N 2.88Å; E88-L92 PolarHBondContact O-N 3.41Å
89	R	91.3	Very high	92.4	Very high	125 Å²	125	45.7 Å²	45.7	47%	0.472	23%	0.229	S	C	.	.	G	3₁₀ helix	trans	-56.6	-29.2	179.1	-174.2	175.9	-73.9	137.8	-4.5	113.8	G75 K76 S77 L79 D91 L92	G75-R89 PolarHBondContact O-NH2 3.36Å; K76-R89 PolarHBondContact O-NH1 3.22Å; S77-R89 PolarHBondContact O-N 3.28Å; L79-R89 HydrophobicContact CD1-CB 3.8Å; L79-R89 HydrophobicContact CD1-CG 3.94Å; R89-D91 PolarHBondContact O-N 3.13Å; R89-L92 WeakPolarHBondContact O-CB 3.04Å; R89-L92 PolarHBondContact O-N 3.1Å
90	K	91.9	Very high	92.2	Very high	150 Å²	150	49.5 Å²	49.5	65%	0.652	25%	0.252	S	S	*	.	G	3₁₀ helix	trans	-67.3	-23.8	177.2	73.9	-168.9	-175.2	-153.4	0	113.3	E88	E88-K90 HydrophobicContact CB-CD 4.47Å; E88-K90 HydrophobicContact CB-CG 4.07Å; E88-K90 VanDerWaalsContact CD-NZ 3.26Å; E88-K90 PolarHBondContact O-N 3.03Å; E88-K90 VanDerWaalsContact O-N 3.07Å; E88-K90 IonicContact OE1-NZ 3.29Å; E88-K90 PolarHBondContact OE1-NZ 3.25Å; E88-K90 WeakPolarHBondContact OE2-CD 3.29Å; E88-K90 WeakPolarHBondContact OE2-CE 3.31Å; E88-K90 IonicContact OE2-NZ 2.69Å; E88-K90 PolarHBondContact OE2-NZ 3.17Å
91	D	93.1	Very high	91.9	Very high	31 Å²	31	56.4 Å²	56.4	17%	0.166	29%	0.289	C	S	.	.	G	3₁₀ helix	trans	-101.3	8	-177.3	-56.8	-54	0	0	0	111.7	C87 E88 R89 N99 A102 S104	C87-D91 HydrophobicContact CB-CB 4.22Å; E88-D91 PolarHBondContact O-N 2.88Å; R89-D91 PolarHBondContact O-N 3.13Å; D91-N99 WeakPolarHBondContact O-CB 3.39Å; D91-N99 PolarHBondContact O-N 3.38Å; D91-A102 HydrophobicContact CB-CB 3.97Å; D91-S104 VanDerWaalsContact CG-OG 3.27Å; D91-S104 WeakPolarHBondContact OD2-CB 3.12Å; D91-S104 PolarHBondContact OD2-OG 3.18Å
92	L	92.3	Very high	91.8	Very high	53 Å²	53	57.1 Å²	57.1	28%	0.277	30%	0.295	S	S	.	.	B	Isolated β-bridge	trans	-77.2	125.9	173.2	-168.3	76.7	0	0	0	109.6	L79 E88 R89 G96	L79-L92 HydrophobicContact CD1-CD2 4.28Å; E88-L92 PolarHBondContact O-N 3.41Å; R89-L92 WeakPolarHBondContact O-CB 3.04Å; R89-L92 PolarHBondContact O-N 3.1Å; L92-G96 WeakPolarHBondContact CD1-O 3Å
93	L	92.5	Very high	91.6	Very high	76 Å²	76	62.5 Å²	62.5	40%	0.398	32%	0.324	S	S	.	.			trans	-79	159.6	177.5	-63.3	175.6	0	0	0	110.8	N95 G96 C97 N99	L93-N95 WeakPolarHBondContact CB-OD1 3.46Å; L93-N95 PolarHBondContact O-N 3.48Å; L93-N95 VanDerWaalsContact O-N 3.13Å; L93-G96 PolarHBondContact O-N 3.34Å; L93-C97 WeakPolarHBondContact CB-O 3.25Å; L93-C97 PolarHBondContact N-O 3.41Å; L93-N99 HydrophobicContact CD1-CB 4.38Å; L93-N99 HydrophobicContact CD2-CB 4.04Å; L93-N99 HydrophobicContact CG-CB 4.05Å
94	V	90.1	Very high	91.4	Very high	162 Å²	162	61.5 Å²	61.5	98%	0.982	32%	0.322	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.2	-25.2	-179.4	-173.2	0	0	0	0	112.2	G96	V94-G96 PolarHBondContact O-N 2.98Å
95	N	89.8	Confident	91.5	Very high	54 Å²	54	62.1 Å²	62.1	29%	0.289	33%	0.326	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.2	2.2	175.2	69.8	-14.9	0	0	0	114.2	T67 Q68 C69 L93 C97	T67-N95 WeakPolarHBondContact O-CB 3.42Å; T67-N95 PolarHBondContact O-ND2 2.77Å; Q68-N95 WeakPolarHBondContact CA-O 3.34Å; C69-N95 PolarHBondContact N-O 2.72Å; L93-N95 WeakPolarHBondContact CB-OD1 3.46Å; L93-N95 PolarHBondContact O-N 3.48Å; L93-N95 VanDerWaalsContact O-N 3.13Å; N95-C97 VanDerWaalsContact C-N 3.3Å; N95-C97 PolarHBondContact ND2-SG 3.49Å; N95-C97 PolarHBondContact O-N 2.92Å; N95-C97 WeakPolarHBondContact OD1-CB 3.24Å; N95-C97 PolarHBondContact OD1-N 3.05Å
96	G	90	Very high	91.4	Very high	12 Å²	12	66.3 Å²	66.3	12%	0.124	34%	0.342	C	S	.	.	S	Bend	trans	83.6	-2.5	178.9	0	0	0	0	0	115	N71 L92 L93 V94	N71-G96 PolarHBondContact ND2-O 3.44Å; N71-G96 VanDerWaalsContact ND2-O 3.15Å; L92-G96 WeakPolarHBondContact CD1-O 3Å; L93-G96 PolarHBondContact O-N 3.34Å; V94-G96 PolarHBondContact O-N 2.98Å
97	C	91.8	Very high	91.4	Very high	11 Å²	11	69.9 Å²	69.9	7%	0.074	36%	0.358	C	S	.	.	S	Bend	trans	-86.8	156.9	175.9	-51.4	0	0	0	0	111.3	C69 L93 N95	C69-C97 HydrophobicContact CB-CB 3.79Å; C69-C97 WeakPolarHBondContact CB-SG 3.31Å; C69-C97 PolarHBondContact N-SG 3Å; C69-C97 VanDerWaalsContact N-SG 3.4Å; C69-C97 WeakPolarHBondContact SG-CB 3.43Å; C69-C97 CovalentContact SG-SG 2.02Å; C69-C97 PolarHBondContact SG-SG 3.06Å; L93-C97 WeakPolarHBondContact CB-O 3.25Å; L93-C97 PolarHBondContact N-O 3.41Å; N95-C97 VanDerWaalsContact C-N 3.3Å; N95-C97 PolarHBondContact ND2-SG 3.49Å; N95-C97 PolarHBondContact O-N 2.92Å; N95-C97 WeakPolarHBondContact OD1-CB 3.24Å; N95-C97 PolarHBondContact OD1-N 3.05Å
98	C	92.7	Very high	91.3	Very high	3 Å²	3	73.5 Å²	73.5	2%	0.02	37%	0.373	C	S	.	.	B	Isolated β-bridge	trans	-75.6	142.5	169.3	-77.3	0	0	0	0	111.4	D81 C87 V100	D81-C98 WeakPolarHBondContact OD2-CB 3.43Å; D81-C98 PolarHBondContact OD2-N 3.12Å; C87-C98 HydrophobicContact CB-CB 3.59Å; C87-C98 WeakPolarHBondContact CB-SG 3.4Å; C87-C98 PolarHBondContact N-SG 3.31Å; C87-C98 VanDerWaalsContact N-SG 3.41Å; C87-C98 WeakPolarHBondContact SG-CA 3.13Å; C87-C98 WeakPolarHBondContact SG-CB 3.15Å; C87-C98 CovalentContact SG-SG 2.04Å; C87-C98 PolarHBondContact SG-SG 2.87Å; C98-V100 PolarHBondContact O-N 3.14Å; C98-V100 VanDerWaalsContact O-N 3.12Å
99	N	92.8	Very high	91.3	Very high	47 Å²	47	70.8 Å²	70.8	25%	0.251	36%	0.36	S	S	.	.			trans	-69.9	108	173	-175.9	-3.1	0	0	0	110.5	D91 L93 N101 A102 S105	D91-N99 WeakPolarHBondContact O-CB 3.39Å; D91-N99 PolarHBondContact O-N 3.38Å; L93-N99 HydrophobicContact CD1-CB 4.38Å; L93-N99 HydrophobicContact CD2-CB 4.04Å; L93-N99 HydrophobicContact CG-CB 4.05Å; N99-N101 PolarHBondContact O-N 3.21Å; N99-N101 WeakPolarHBondContact OD1-CB 3.48Å; N99-N101 PolarHBondContact OD1-N 3.15Å; N99-A102 HydrophobicContact CB-CB 4.15Å; N99-A102 WeakPolarHBondContact O-CB 3.46Å; N99-A102 PolarHBondContact O-N 3.04Å; N99-A102 VanDerWaalsContact O-N 3.16Å; N99-S105 WeakPolarHBondContact O-CB 3.42Å; N99-S105 PolarHBondContact O-OG 2.83Å
100	V	89.9	Confident	91.4	Very high	83 Å²	83	66.7 Å²	66.7	50%	0.503	35%	0.35	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.4	-22.1	179.8	-59.5	0	0	0	0	113.7	Y85 C98	Y85-V100 HydrophobicContact CD1-CG1 4.28Å; Y85-V100 HydrophobicContact CD2-CG1 4.41Å; Y85-V100 HydrophobicContact CE1-CB 4.35Å; Y85-V100 HydrophobicContact CE1-CG1 3.82Å; Y85-V100 HydrophobicContact CE2-CG1 4Å; C98-V100 PolarHBondContact O-N 3.14Å; C98-V100 VanDerWaalsContact O-N 3.12Å
101	N	89.4	Confident	91.3	Very high	145 Å²	145	68.1 Å²	68.1	78%	0.775	36%	0.357	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.5	-11.6	-179.7	-59.9	-43.5	0	0	0	112.8	N99	N99-N101 PolarHBondContact O-N 3.21Å; N99-N101 WeakPolarHBondContact OD1-CB 3.48Å; N99-N101 PolarHBondContact OD1-N 3.15Å
102	A	89.9	Confident	91.1	Very high	16 Å²	16	67.8 Å²	67.8	13%	0.132	36%	0.356	C	S	.	.	S	Bend	trans	-75.2	135.7	178.5	0	0	0	0	0	110.6	D91 N99 S104 S105	D91-A102 HydrophobicContact CB-CB 3.97Å; N99-A102 HydrophobicContact CB-CB 4.15Å; N99-A102 WeakPolarHBondContact O-CB 3.46Å; N99-A102 PolarHBondContact O-N 3.04Å; N99-A102 VanDerWaalsContact O-N 3.16Å; A102-S104 PolarHBondContact O-N 3.33Å; A102-S105 WeakPolarHBondContact O-CB 3.3Å; A102-S105 PolarHBondContact O-N 3.39Å
103	L	87.1	Confident	91.1	Very high	156 Å²	156	66.5 Å²	66.5	82%	0.817	35%	0.352	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62	-25.7	180	-71.4	162.4	0	0	0	113.8	S105 R106	L103-S105 VanDerWaalsContact C-N 3.32Å; L103-R106 PolarHBondContact O-NH2 3.28Å
104	S	86.8	Confident	91	Very high	37 Å²	37	66.8 Å²	66.8	26%	0.259	35%	0.353	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.7	-21.9	176.1	51.9	0	0	0	0	112.6	D91 A102	D91-S104 VanDerWaalsContact CG-OG 3.27Å; D91-S104 WeakPolarHBondContact OD2-CB 3.12Å; D91-S104 PolarHBondContact OD2-OG 3.18Å; A102-S104 PolarHBondContact O-N 3.33Å
105	S	92.2	Very high	90.8	Very high	12 Å²	12	64.7 Å²	64.7	8%	0.084	35%	0.353	C	S	.	.			trans	-78.6	127.5	-177.5	-168.4	0	0	0	0	110.9	V86 N99 A102 L103	V86-S105 VanDerWaalsContact O-CA 3.32Å; V86-S105 WeakPolarHBondContact O-CA 3.49Å; N99-S105 WeakPolarHBondContact O-CB 3.42Å; N99-S105 PolarHBondContact O-OG 2.83Å; A102-S105 WeakPolarHBondContact O-CB 3.3Å; A102-S105 PolarHBondContact O-N 3.39Å; L103-S105 VanDerWaalsContact C-N 3.32Å
106	R	93.5	Very high	90.6	Very high	140 Å²	140	63.6 Å²	63.6	53%	0.528	35%	0.347	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.6	132.7	-179.9	-59.8	-67.3	-179.8	-169.2	-2.8	109.8	Y85 V86 L103 I109	Y85-R106 CarbonylContact C-O 3.43Å; Y85-R106 WeakPolarHBondContact CA-O 3.47Å; V86-R106 PolarHBondContact N-O 3.15Å; V86-R106 PolarHBondContact O-N 2.97Å; L103-R106 PolarHBondContact O-NH2 3.28Å; R106-I109 HydrophobicContact CB-CB 4.3Å; R106-I109 HydrophobicContact CB-CD1 4.12Å; R106-I109 HydrophobicContact CG-CD1 4.3Å
107	Q	93.9	Very high	90.6	Very high	79 Å²	79	63.1 Å²	63.1	37%	0.369	34%	0.342	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.9	143.5	176.8	-154	-177.7	9.7	0	0	111.5	L83 G84 Y85 I109	L83-Q107 PolarHBondContact O-NE2 2.85Å; G84-Q107 WeakPolarHBondContact O-CA 3.2Å; Y85-Q107 HydrophobicContact CD1-CB 3.79Å; Y85-Q107 HydrophobicContact CD1-CG 4.1Å; Y85-Q107 HydrophobicContact CD2-CG 4.07Å; Y85-Q107 HydrophobicContact CE1-CB 3.69Å; Y85-Q107 HydrophobicContact CE1-CG 4.02Å; Y85-Q107 HydrophobicContact CE2-CG 3.96Å; Y85-Q107 HydrophobicContact CG-CB 4.27Å; Y85-Q107 HydrophobicContact CG-CG 4.12Å; Y85-Q107 PolarHBondContact OH-OE1 2.81Å; Q107-I109 VanDerWaalsContact C-N 3.31Å; Q107-I109 PolarHBondContact O-N 2.66Å
108	Y	93.2	Very high	90.6	Very high	77 Å²	77	62.6 Å²	62.6	30%	0.302	34%	0.339	S	S	.	.	S	Bend	trans	49.1	47.2	174.5	-53.6	-49.6	0	0	0	113.6	L83 G84 C110 S127 L130 Q131	L83-Y108 PolarHBondContact O-OH 3.32Å; G84-Y108 PolarHBondContact O-N 3.41Å; Y108-C110 PolarHBondContact O-N 3.06Å; Y108-S127 VanDerWaalsContact CA-OG 3.23Å; Y108-S127 WeakPolarHBondContact CA-OG 3.42Å; Y108-S127 WeakPolarHBondContact CD1-O 3.31Å; Y108-S127 PolarHBondContact N-OG 3.07Å; Y108-S127 VanDerWaalsContact N-OG 3.13Å; Y108-L130 HydrophobicContact CD1-CB 4.24Å; Y108-L130 HydrophobicContact CE1-CB 3.92Å; Y108-Q131 HydrophobicContact CD1-CB 4.19Å; Y108-Q131 HydrophobicContact CG-CB 4.22Å; Y108-Q131 HydrophobicContact CG-CG 4.3Å
109	I	93.2	Very high	90.6	Very high	17 Å²	17	62.5 Å²	62.5	9%	0.087	34%	0.338	C	S	.	.			trans	-81.8	114.3	-173.7	-174.5	165.9	0	0	0	111.8	V86 R106 Q107 K111 Y124 S127	V86-I109 HydrophobicContact CB-CG2 4.01Å; V86-I109 HydrophobicContact CG2-CG2 3.57Å; R106-I109 HydrophobicContact CB-CB 4.3Å; R106-I109 HydrophobicContact CB-CD1 4.12Å; R106-I109 HydrophobicContact CG-CD1 4.3Å; Q107-I109 VanDerWaalsContact C-N 3.31Å; Q107-I109 PolarHBondContact O-N 2.66Å; I109-K111 HydrophobicContact CD1-CB 4.5Å; I109-K111 HydrophobicContact CD1-CD 4.1Å; I109-K111 HydrophobicContact CD1-CG 4.22Å; I109-K111 HydrophobicContact CG1-CB 4.19Å; I109-K111 HydrophobicContact CG1-CD 4.4Å; I109-K111 HydrophobicContact CG1-CG 3.97Å; I109-Y124 HydrophobicContact CD1-CE1 4.19Å; I109-Y124 HydrophobicContact CD1-CE2 4.22Å; I109-Y124 HydrophobicContact CG2-CD1 3.53Å; I109-Y124 HydrophobicContact CG2-CE1 3.82Å; I109-Y124 HydrophobicContact CG2-CG 4.05Å; I109-S127 PolarHBondContact N-OG 3.25Å
110	C	93.3	Very high	90.5	Very high	39 Å²	39	63.8 Å²	63.8	26%	0.264	34%	0.344	S	S	.	.			trans	-106.3	13.5	178.2	-58.5	0	0	0	0	114.3	Y108 S112 C113 C128	Y108-C110 PolarHBondContact O-N 3.06Å; C110-S112 PolarHBondContact O-N 2.03Å; C110-C113 HydrophobicContact CB-CB 4.49Å; C110-C113 WeakPolarHBondContact O-CB 3.24Å; C110-C113 PolarHBondContact O-N 3.04Å; C110-C128 HydrophobicContact CB-CB 3.9Å; C110-C128 WeakPolarHBondContact CB-SG 3.25Å; C110-C128 VanDerWaalsContact SG-CA 3.54Å; C110-C128 WeakPolarHBondContact SG-CB 3.43Å; C110-C128 CovalentContact SG-SG 2.03Å; C110-C128 PolarHBondContact SG-SG 3.43Å
111	K	89.8	Confident	90.7	Very high	181 Å²	181	62.4 Å²	62.4	79%	0.787	33%	0.334	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.6	-25.4	-167.5	-74.8	-171.3	-176.9	-178.6	0	115.5	I109	I109-K111 HydrophobicContact CD1-CB 4.5Å; I109-K111 HydrophobicContact CD1-CD 4.1Å; I109-K111 HydrophobicContact CD1-CG 4.22Å; I109-K111 HydrophobicContact CG1-CB 4.19Å; I109-K111 HydrophobicContact CG1-CD 4.4Å; I109-K111 HydrophobicContact CG1-CG 3.97Å
112	S	89.4	Confident	90.9	Very high	23 Å²	23	56.5 Å²	56.5	16%	0.161	30%	0.301	C	S	.	.	T	Hydrogen-bonded Turn	trans	-107.9	12.1	-179.2	78.4	0	0	0	0	114.2	C110 C119 N120 Y124	C110-S112 PolarHBondContact O-N 2.03Å; S112-C119 VanDerWaalsContact O-CA 3.29Å; S112-C119 WeakPolarHBondContact O-CA 3.09Å; S112-N120 VanDerWaalsContact CB-CG 3.48Å; S112-N120 WeakPolarHBondContact CB-OD1 2.84Å; S112-N120 PolarHBondContact O-N 2.89Å; S112-N120 PolarHBondContact OG-OD1 3.38Å; S112-Y124 VanDerWaalsContact OG-CD2 3.3Å; S112-Y124 WeakPolarHBondContact OG-CD2 3.36Å
113	C	92.4	Very high	91.1	Very high	27 Å²	27	56 Å²	56	18%	0.182	30%	0.296	C	S	.	.	B	Isolated β-bridge	trans	-95.8	136.5	178.8	-56.5	0	0	0	0	110.2	C110 C118 C119	C110-C113 HydrophobicContact CB-CB 4.49Å; C110-C113 WeakPolarHBondContact O-CB 3.24Å; C110-C113 PolarHBondContact O-N 3.04Å; C113-C118 CarbonylContact C-O 3.52Å; C113-C118 VanDerWaalsContact CA-O 3.31Å; C113-C118 WeakPolarHBondContact CA-O 3.02Å; C113-C119 HydrophobicContact CB-CB 3.98Å; C113-C119 WeakPolarHBondContact CB-SG 3.12Å; C113-C119 WeakPolarHBondContact SG-CB 3.46Å; C113-C119 CovalentContact SG-SG 2.03Å; C113-C119 PolarHBondContact SG-SG 2.03Å
114	L	90.7	Very high	91.5	Very high	82 Å²	82	51 Å²	51	43%	0.429	27%	0.266	S	S	.	.			trans	-82.3	169.4	171.3	-62.7	178.6	0	0	0	110.5	N116 G117 C118 A185	L114-N116 VanDerWaalsContact CB-OD1 3.23Å; L114-N116 WeakPolarHBondContact CB-OD1 3.3Å; L114-N116 PolarHBondContact O-N 3.09Å; L114-G117 PolarHBondContact O-N 3.41Å; L114-C118 PolarHBondContact N-O 3.27Å; L114-A185 HydrophobicContact CD1-CB 3.71Å
115	A	86.3	Confident	91.8	Very high	117 Å²	117	49.2 Å²	49.2	97%	0.967	25%	0.254	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.4	-26.1	-178.3	0	0	0	0	0	113.8	G117	A115-G117 PolarHBondContact O-N 2.05Å
116	N	84.4	Confident	91.9	Very high	32 Å²	32	48.6 Å²	48.6	17%	0.171	25%	0.25	C	C	.	.	T	Hydrogen-bonded Turn	trans	-75.8	2.1	175	68.6	-22.4	0	0	0	113.7	L114 C118	L114-N116 VanDerWaalsContact CB-OD1 3.23Å; L114-N116 WeakPolarHBondContact CB-OD1 3.3Å; L114-N116 PolarHBondContact O-N 3.09Å; N116-C118 VanDerWaalsContact C-N 3.34Å; N116-C118 PolarHBondContact ND2-SG 3.18Å; N116-C118 VanDerWaalsContact ND2-SG 3.4Å; N116-C118 WeakPolarHBondContact OD1-CB 3.29Å; N116-C118 PolarHBondContact OD1-N 3.03Å
117	G	89.1	Confident	92	Very high	2 Å²	2	42 Å²	42	2%	0.021	23%	0.225	C	C	.	.	S	Bend	trans	76	22.8	-179.5	0	0	0	0	0	113.6	L114 A115 C188 Y189 G190	L114-G117 PolarHBondContact O-N 3.41Å; A115-G117 PolarHBondContact O-N 2.05Å; G117-C188 WeakPolarHBondContact O-CA 3.47Å; G117-Y189 VanDerWaalsContact O-CD1 3.24Å; G117-Y189 WeakPolarHBondContact O-CD1 3.49Å; G117-Y189 WeakPolarHBondContact O-CE1 3.39Å; G117-Y189 PolarHBondContact O-N 2.91Å; G117-G190 PolarHBondContact O-N 3.13Å
118	C	91.9	Very high	92.1	Very high	0 Å²	0	38.2 Å²	38.2	0%	0	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	139.9	171.7	-66.8	0	0	0	0	111.4	C113 L114 N116 A185 Y187 C188	C113-C118 CarbonylContact C-O 3.52Å; C113-C118 VanDerWaalsContact CA-O 3.31Å; C113-C118 WeakPolarHBondContact CA-O 3.02Å; L114-C118 PolarHBondContact N-O 3.27Å; N116-C118 VanDerWaalsContact C-N 3.34Å; N116-C118 PolarHBondContact ND2-SG 3.18Å; N116-C118 VanDerWaalsContact ND2-SG 3.4Å; N116-C118 WeakPolarHBondContact OD1-CB 3.29Å; N116-C118 PolarHBondContact OD1-N 3.03Å; C118-A185 HydrophobicContact CB-CB 3.76Å; C118-Y187 CarbonylContact C-O 3.56Å; C118-Y187 WeakPolarHBondContact CA-O 2.98Å; C118-C188 HydrophobicContact CB-CB 4.01Å; C118-C188 WeakPolarHBondContact CB-SG 3.22Å; C118-C188 WeakPolarHBondContact SG-CB 3.27Å; C118-C188 CovalentContact SG-SG 2.03Å; C118-C188 PolarHBondContact SG-SG 3.44Å
119	C	93.1	Very high	92.1	Very high	0 Å²	0	34.5 Å²	34.5	0%	0	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128	158.7	-174.2	-35.9	0	0	0	0	111.9	S112 C113 C125 K186 Y187	S112-C119 VanDerWaalsContact O-CA 3.29Å; S112-C119 WeakPolarHBondContact O-CA 3.09Å; C113-C119 HydrophobicContact CB-CB 3.98Å; C113-C119 WeakPolarHBondContact CB-SG 3.12Å; C113-C119 WeakPolarHBondContact SG-CB 3.46Å; C113-C119 CovalentContact SG-SG 2.03Å; C113-C119 PolarHBondContact SG-SG 2.03Å; C119-C125 HydrophobicContact CB-CB 4.07Å; C119-C125 VanDerWaalsContact SG-CA 3.56Å; C119-K186 PolarHBondContact O-N 3.19Å; C119-K186 VanDerWaalsContact O-N 3.1Å; C119-Y187 PolarHBondContact N-O 3.39Å; C119-Y187 PolarHBondContact O-N 3.45Å; C119-Y187 VanDerWaalsContact O-N 3.13Å
120	N	91.8	Very high	92.1	Very high	74 Å²	74	34.3 Å²	34.3	40%	0.396	19%	0.192	S	C	.	.	S	Bend	trans	-80.3	-25.6	176.5	73.6	-3.3	0	0	0	113.6	S112 Q184 Y187	S112-N120 VanDerWaalsContact CB-CG 3.48Å; S112-N120 WeakPolarHBondContact CB-OD1 2.84Å; S112-N120 PolarHBondContact O-N 2.89Å; S112-N120 PolarHBondContact OG-OD1 3.38Å; N120-Q184 VanDerWaalsContact CA-O 3.27Å; N120-Q184 WeakPolarHBondContact CA-O 3.34Å; N120-Q184 WeakPolarHBondContact CB-O 3.09Å; N120-Q184 PolarHBondContact N-O 2.88Å; N120-Y187 WeakPolarHBondContact O-CE2 3.37Å
121	I	92.8	Very high	92	Very high	55 Å²	55	34.6 Å²	34.6	28%	0.282	19%	0.189	S	C	.	.	S	Bend	trans	-119.6	126	-173.3	-71.1	155.7	0	0	0	107	L78 E123 Y124 C125	L78-I121 HydrophobicContact CD1-CG2 4.45Å; I121-E123 VanDerWaalsContact C-N 3.35Å; I121-E123 HydrophobicContact CG2-CB 4.14Å; I121-E123 PolarHBondContact O-N 3.46Å; I121-Y124 HydrophobicContact CB-CD2 4.24Å; I121-Y124 HydrophobicContact CB-CG 4.18Å; I121-Y124 HydrophobicContact CD1-CD2 3.9Å; I121-Y124 HydrophobicContact CD1-CE2 3.76Å; I121-Y124 HydrophobicContact CG2-CD1 4.18Å; I121-Y124 HydrophobicContact CG2-CD2 4.48Å; I121-Y124 HydrophobicContact CG2-CG 4.07Å; I121-Y124 PolarHBondContact O-N 2.89Å; I121-C125 PolarHBondContact O-N 3.49Å; I121-C125 VanDerWaalsContact O-N 3.09Å
122	Y	93.4	Very high	91.9	Very high	21 Å²	21	28.4 Å²	28.4	8%	0.082	17%	0.168	C	C	.	.	H	α-helix	trans	-57.6	-46.5	-178.5	174.2	-110.6	0	0	0	112.3	Y124 C125 V126 L164 C167 R168 Y187	Y122-Y124 VanDerWaalsContact C-N 3.3Å; Y122-Y124 PolarHBondContact O-N 2.89Å; Y122-C125 WeakPolarHBondContact O-CA 3.03Å; Y122-C125 VanDerWaalsContact O-CB 3.27Å; Y122-C125 WeakPolarHBondContact O-CB 3.18Å; Y122-C125 PolarHBondContact O-N 2.05Å; Y122-V126 HydrophobicContact CD1-CG2 4.46Å; Y122-V126 HydrophobicContact CD2-CG2 4.3Å; Y122-V126 HydrophobicContact CE1-CG2 4.03Å; Y122-V126 HydrophobicContact CE2-CG2 3.86Å; Y122-V126 WeakPolarHBondContact O-CG2 3.2Å; Y122-V126 PolarHBondContact O-N 3.28Å; Y122-L164 HydrophobicContact CE1-CD2 4.49Å; Y122-L164 VanDerWaalsContact OH-CD2 3.28Å; Y122-L164 WeakPolarHBondContact OH-CD2 3.37Å; Y122-L164 PolarHBondContact OH-O 2.7Å; Y122-C167 HydrophobicContact CD2-CB 4.01Å; Y122-C167 HydrophobicContact CE2-CB 3.77Å; Y122-R168 HydrophobicContact CE2-CG 4.19Å; Y122-Y187 AromaticContact CD2-CD1 3.77Å; Y122-Y187 HydrophobicContact CD2-CD1 3.77Å; Y122-Y187 HydrophobicContact CD2-CE1 4.14Å; Y122-Y187 HydrophobicContact CD2-CG 4.27Å; Y122-Y187 HydrophobicContact CG-CD1 4.28Å; Y122-Y187 HydrophobicContact CG-CE1 4.34Å; Y122-Y187 VanDerWaalsContact N-CD2 3.25Å
123	E	94.9	Very high	91.9	Very high	6 Å²	6	32.8 Å²	32.8	3%	0.028	19%	0.189	C	C	.	.	H	α-helix	trans	-61.9	-36.8	-178.8	-55.1	-51.2	161.1	0	0	113	S72 G75 L78 T80 V86 I121 V126 S127	S72-E123 WeakPolarHBondContact CB-OE2 3.2Å; S72-E123 PolarHBondContact OG-OE1 3.48Å; S72-E123 VanDerWaalsContact OG-OE1 3.05Å; S72-E123 PolarHBondContact OG-OE2 3.32Å; G75-E123 VanDerWaalsContact CA-OE1 3.3Å; G75-E123 WeakPolarHBondContact CA-OE1 3.43Å; G75-E123 PolarHBondContact N-OE1 3.39Å; L78-E123 HydrophobicContact CB-CB 4.36Å; L78-E123 HydrophobicContact CB-CG 4.02Å; L78-E123 WeakPolarHBondContact O-CG 3.48Å; T80-E123 WeakPolarHBondContact CB-OE2 3.49Å; T80-E123 PolarHBondContact N-OE2 2.84Å; T80-E123 VanDerWaalsContact OG1-CA 3.23Å; T80-E123 WeakPolarHBondContact OG1-CA 3.03Å; T80-E123 VanDerWaalsContact OG1-CB 3.23Å; T80-E123 WeakPolarHBondContact OG1-CB 3.09Å; T80-E123 PolarHBondContact OG1-O 3.49Å; T80-E123 PolarHBondContact OG1-OE2 3.02Å; V86-E123 HydrophobicContact CG1-CB 4.15Å; I121-E123 VanDerWaalsContact C-N 3.35Å; I121-E123 HydrophobicContact CG2-CB 4.14Å; I121-E123 PolarHBondContact O-N 3.46Å; E123-V126 PolarHBondContact O-N 3.42Å; E123-S127 WeakPolarHBondContact O-CB 3Å; E123-S127 PolarHBondContact O-N 2.95Å
124	Y	94.6	Very high	91.7	Very high	49 Å²	49	34.5 Å²	34.5	19%	0.192	19%	0.194	C	C	.	.	H	α-helix	trans	-71.9	-33.9	175.4	-67.6	1.9	0	0	0	111.4	L78 V86 I109 S112 I121 Y122 C128	L78-Y124 HydrophobicContact CD1-CE1 4.04Å; V86-Y124 HydrophobicContact CB-CE1 4.44Å; V86-Y124 HydrophobicContact CG1-CD1 4.07Å; V86-Y124 HydrophobicContact CG1-CE1 3.82Å; V86-Y124 HydrophobicContact CG2-CD1 4.28Å; I109-Y124 HydrophobicContact CD1-CE1 4.19Å; I109-Y124 HydrophobicContact CD1-CE2 4.22Å; I109-Y124 HydrophobicContact CG2-CD1 3.53Å; I109-Y124 HydrophobicContact CG2-CE1 3.82Å; I109-Y124 HydrophobicContact CG2-CG 4.05Å; S112-Y124 VanDerWaalsContact OG-CD2 3.3Å; S112-Y124 WeakPolarHBondContact OG-CD2 3.36Å; I121-Y124 HydrophobicContact CB-CD2 4.24Å; I121-Y124 HydrophobicContact CB-CG 4.18Å; I121-Y124 HydrophobicContact CD1-CD2 3.9Å; I121-Y124 HydrophobicContact CD1-CE2 3.76Å; I121-Y124 HydrophobicContact CG2-CD1 4.18Å; I121-Y124 HydrophobicContact CG2-CD2 4.48Å; I121-Y124 HydrophobicContact CG2-CG 4.07Å; I121-Y124 PolarHBondContact O-N 2.89Å; Y122-Y124 VanDerWaalsContact C-N 3.3Å; Y122-Y124 PolarHBondContact O-N 2.89Å; Y124-C128 WeakPolarHBondContact O-CB 3.26Å; Y124-C128 PolarHBondContact O-N 3.29Å
125	C	94.6	Very high	91.3	Very high	0 Å²	0	32.7 Å²	32.7	0%	0	18%	0.183	C	C	.	.	H	α-helix	trans	-59.5	-49.6	170.9	-177.7	0	0	0	0	111.1	C119 I121 Y122 C128 C129 C167	C119-C125 HydrophobicContact CB-CB 4.07Å; C119-C125 VanDerWaalsContact SG-CA 3.56Å; I121-C125 PolarHBondContact O-N 3.49Å; I121-C125 VanDerWaalsContact O-N 3.09Å; Y122-C125 WeakPolarHBondContact O-CA 3.03Å; Y122-C125 VanDerWaalsContact O-CB 3.27Å; Y122-C125 WeakPolarHBondContact O-CB 3.18Å; Y122-C125 PolarHBondContact O-N 2.05Å; C125-C128 PolarHBondContact O-N 3.2Å; C125-C129 WeakPolarHBondContact O-CB 3.37Å; C125-C129 PolarHBondContact O-N 3.36Å; C125-C167 HydrophobicContact CB-CB 3.79Å; C125-C167 WeakPolarHBondContact CB-SG 3.44Å; C125-C167 PolarHBondContact O-SG 3.03Å; C125-C167 VanDerWaalsContact O-SG 3.38Å; C125-C167 WeakPolarHBondContact SG-CB 3.34Å; C125-C167 CovalentContact SG-SG 2.05Å; C125-C167 PolarHBondContact SG-SG 3.24Å
126	V	94.7	Very high	91.2	Very high	0 Å²	0	33.7 Å²	33.7	0%	0	17%	0.171	C	C	.	.	H	α-helix	trans	-63.1	-48.4	-178.6	178	0	0	0	0	110.5	T80 Y122 E123 C128 C129 L130 F160 C163 L164 C167	T80-V126 HydrophobicContact CG2-CB 4.32Å; T80-V126 HydrophobicContact CG2-CG1 4Å; Y122-V126 HydrophobicContact CD1-CG2 4.46Å; Y122-V126 HydrophobicContact CD2-CG2 4.3Å; Y122-V126 HydrophobicContact CE1-CG2 4.03Å; Y122-V126 HydrophobicContact CE2-CG2 3.86Å; Y122-V126 WeakPolarHBondContact O-CG2 3.2Å; Y122-V126 PolarHBondContact O-N 3.28Å; E123-V126 PolarHBondContact O-N 3.42Å; V126-C128 PolarHBondContact O-N 3.02Å; V126-C129 WeakPolarHBondContact O-CB 3.35Å; V126-C129 PolarHBondContact O-N 3.12Å; V126-L130 HydrophobicContact CG1-CD1 4.28Å; V126-L130 WeakPolarHBondContact O-CG 3.24Å; V126-L130 PolarHBondContact O-N 3.1Å; V126-L130 VanDerWaalsContact O-N 3.1Å; V126-F160 HydrophobicContact CG1-CD2 4.32Å; V126-F160 HydrophobicContact CG1-CE2 3.86Å; V126-C163 HydrophobicContact CG1-CB 4.27Å; V126-L164 HydrophobicContact CG1-CD2 4Å; V126-L164 HydrophobicContact CG2-CD2 4.06Å; V126-C167 HydrophobicContact CG2-CB 3.91Å; V126-C167 PolarHBondContact N-SG 2.99Å
127	S	95	Very high	91.3	Very high	0 Å²	0	35.7 Å²	35.7	0%	0	18%	0.182	C	C	.	.	H	α-helix	trans	-60.7	-44.9	178.1	179.8	0	0	0	0	112.4	G84 Y108 I109 E123 C129 L130	G84-S127 PolarHBondContact O-OG 3.14Å; Y108-S127 VanDerWaalsContact CA-OG 3.23Å; Y108-S127 WeakPolarHBondContact CA-OG 3.42Å; Y108-S127 WeakPolarHBondContact CD1-O 3.31Å; Y108-S127 PolarHBondContact N-OG 3.07Å; Y108-S127 VanDerWaalsContact N-OG 3.13Å; I109-S127 PolarHBondContact N-OG 3.25Å; E123-S127 WeakPolarHBondContact O-CB 3Å; E123-S127 PolarHBondContact O-N 2.95Å; S127-C129 PolarHBondContact O-N 3.31Å; S127-L130 PolarHBondContact O-N 3.24Å
128	C	94.9	Very high	91.1	Very high	0 Å²	0	35.6 Å²	35.6	0%	0	18%	0.181	C	C	.	.	H	α-helix	trans	-66.3	-36.7	177.9	-170.2	0	0	0	0	112.6	C110 Y124 C125 V126 L130 Q131 Y189	C110-C128 HydrophobicContact CB-CB 3.9Å; C110-C128 WeakPolarHBondContact CB-SG 3.25Å; C110-C128 VanDerWaalsContact SG-CA 3.54Å; C110-C128 WeakPolarHBondContact SG-CB 3.43Å; C110-C128 CovalentContact SG-SG 2.03Å; C110-C128 PolarHBondContact SG-SG 3.43Å; Y124-C128 WeakPolarHBondContact O-CB 3.26Å; Y124-C128 PolarHBondContact O-N 3.29Å; C125-C128 PolarHBondContact O-N 3.2Å; V126-C128 PolarHBondContact O-N 3.02Å; C128-L130 VanDerWaalsContact C-N 3.33Å; C128-L130 PolarHBondContact O-N 3.15Å; C128-Q131 VanDerWaalsContact O-CB 3.24Å; C128-Q131 WeakPolarHBondContact O-CB 3.23Å; C128-Q131 PolarHBondContact O-N 3.11Å; C128-Y189 HydrophobicContact CB-CE1 4.01Å; C128-Y189 PolarHBondContact SG-OH 3.34Å; C128-Y189 VanDerWaalsContact SG-OH 3.34Å
129	C	93.9	Very high	90.6	Very high	0 Å²	0	40.4 Å²	40.4	0%	0	20%	0.203	C	C	.	.	H	α-helix	trans	-63.7	-37.4	176.5	174	0	0	0	0	112.3	C125 V126 S127 Q131 C163 Y189	C125-C129 WeakPolarHBondContact O-CB 3.37Å; C125-C129 PolarHBondContact O-N 3.36Å; V126-C129 WeakPolarHBondContact O-CB 3.35Å; V126-C129 PolarHBondContact O-N 3.12Å; S127-C129 PolarHBondContact O-N 3.31Å; C129-Q131 PolarHBondContact O-N 2.99Å; C129-C163 HydrophobicContact CB-CB 3.68Å; C129-C163 WeakPolarHBondContact CB-SG 3.23Å; C129-C163 WeakPolarHBondContact SG-CA 3.39Å; C129-C163 WeakPolarHBondContact SG-CB 3.3Å; C129-C163 CovalentContact SG-SG 2.05Å; C129-C163 PolarHBondContact SG-SG 2.9Å; C129-Y189 HydrophobicContact CB-CD1 4.2Å; C129-Y189 HydrophobicContact CB-CG 3.99Å
130	L	92.8	Very high	90	Very high	12 Å²	12	45.7 Å²	45.7	6%	0.063	23%	0.228	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68.9	-11.6	179.1	-72.4	168.3	0	0	0	114	T80 Y108 V126 S127 C128 F160 C163	T80-L130 HydrophobicContact CG2-CD1 4.49Å; Y108-L130 HydrophobicContact CD1-CB 4.24Å; Y108-L130 HydrophobicContact CE1-CB 3.92Å; V126-L130 HydrophobicContact CG1-CD1 4.28Å; V126-L130 WeakPolarHBondContact O-CG 3.24Å; V126-L130 PolarHBondContact O-N 3.1Å; V126-L130 VanDerWaalsContact O-N 3.1Å; S127-L130 PolarHBondContact O-N 3.24Å; C128-L130 VanDerWaalsContact C-N 3.33Å; C128-L130 PolarHBondContact O-N 3.15Å; L130-F160 HydrophobicContact CD1-CD2 3.81Å; L130-F160 HydrophobicContact CD1-CE2 4.2Å; L130-F160 HydrophobicContact CD2-CB 4.19Å; L130-F160 HydrophobicContact CD2-CD2 4.08Å; L130-F160 HydrophobicContact CG-CD2 4.41Å; L130-C163 HydrophobicContact CD2-CB 4.37Å; L130-C163 HydrophobicContact CG-CB 4.37Å
131	Q	92.3	Very high	89.3	Confident	45 Å²	45	43.2 Å²	43.2	21%	0.21	21%	0.213	C	C	.	.	S	Bend	trans	-61.8	134.9	-179.8	-168.5	176.5	9	0	0	110.5	Y108 C128 C129 D133 K134	Y108-Q131 HydrophobicContact CD1-CB 4.19Å; Y108-Q131 HydrophobicContact CG-CB 4.22Å; Y108-Q131 HydrophobicContact CG-CG 4.3Å; C128-Q131 VanDerWaalsContact O-CB 3.24Å; C128-Q131 WeakPolarHBondContact O-CB 3.23Å; C128-Q131 PolarHBondContact O-N 3.11Å; C129-Q131 PolarHBondContact O-N 2.99Å; Q131-D133 HydrophobicContact CG-CB 4.39Å; Q131-D133 PolarHBondContact NE2-OD2 2.94Å; Q131-D133 PolarHBondContact O-N 2.98Å; Q131-D133 VanDerWaalsContact O-N 3.15Å; Q131-K134 HydrophobicContact CB-CG 4.26Å; Q131-K134 PolarHBondContact O-N 3.25Å
132	P	87.4	Confident	88.5	Confident	52 Å²	52	40.8 Å²	40.8	34%	0.338	20%	0.201	S	C	.	.	G	3₁₀ helix	trans	-58.9	-31.7	-176.5	22.1	-34.1	0	0	0	113.2	L59 K134 Q135	L59-P132 HydrophobicContact CD1-CB 4.17Å; P132-K134 PolarHBondContact O-N 3.26Å; P132-K134 VanDerWaalsContact O-N 3.07Å; P132-Q135 WeakPolarHBondContact O-CB 3.48Å; P132-Q135 VanDerWaalsContact O-CG 3.26Å; P132-Q135 WeakPolarHBondContact O-CG 3.28Å; P132-Q135 PolarHBondContact O-N 3.4Å; P132-Q135 VanDerWaalsContact O-N 3.11Å
133	D	88.4	Confident	87.6	Confident	115 Å²	115	43.8 Å²	43.8	62%	0.615	22%	0.218	S	C	*	.	G	3₁₀ helix	trans	-63.2	-16.6	179.2	-50.1	-32.8	0	0	0	113.3	Q131	Q131-D133 HydrophobicContact CG-CB 4.39Å; Q131-D133 PolarHBondContact NE2-OD2 2.94Å; Q131-D133 PolarHBondContact O-N 2.98Å; Q131-D133 VanDerWaalsContact O-N 3.15Å
134	K	88.6	Confident	86.6	Confident	62 Å²	62	51.1 Å²	51.1	27%	0.27	25%	0.246	S	C	.	.	G	3₁₀ helix	trans	-95	-5	-179.6	-54.1	-54	179.8	-172.2	0	113.4	Q131 P132 L136 L137 L138 Y189	Q131-K134 HydrophobicContact CB-CG 4.26Å; Q131-K134 PolarHBondContact O-N 3.25Å; P132-K134 PolarHBondContact O-N 3.26Å; P132-K134 VanDerWaalsContact O-N 3.07Å; K134-L136 PolarHBondContact O-N 3.47Å; K134-L137 WeakPolarHBondContact O-CB 3.45Å; K134-L137 PolarHBondContact O-N 2.74Å; K134-L138 HydrophobicContact CB-CD1 4.41Å; K134-L138 WeakPolarHBondContact O-CG 3.03Å; K134-L138 PolarHBondContact O-N 2.95Å; K134-Y189 HydrophobicContact CD-CE2 4.23Å; K134-Y189 HydrophobicContact CG-CE2 4.36Å
135	Q	83.1	Confident	85.3	Confident	44 Å²	44	49 Å²	49	21%	0.206	24%	0.239	C	C	.	.	H	α-helix	trans	-58.7	-45.6	-177.8	-71.4	177.6	0.1	0	0	112.6	F57 P132 L137 L138 E139	F57-Q135 HydrophobicContact CD1-CB 4.47Å; F57-Q135 HydrophobicContact CD1-CG 3.81Å; F57-Q135 HydrophobicContact CE1-CG 4.27Å; F57-Q135 HydrophobicContact CG-CG 4.37Å; P132-Q135 WeakPolarHBondContact O-CB 3.48Å; P132-Q135 VanDerWaalsContact O-CG 3.26Å; P132-Q135 WeakPolarHBondContact O-CG 3.28Å; P132-Q135 PolarHBondContact O-N 3.4Å; P132-Q135 VanDerWaalsContact O-N 3.11Å; Q135-L137 VanDerWaalsContact C-N 3.28Å; Q135-L137 PolarHBondContact O-N 3.13Å; Q135-L138 PolarHBondContact O-N 3.38Å; Q135-L138 VanDerWaalsContact O-N 3.15Å; Q135-E139 WeakPolarHBondContact O-CB 3.23Å; Q135-E139 PolarHBondContact O-N 3.01Å
136	L	84.1	Confident	83.7	Confident	138 Å²	138	49.4 Å²	49.4	72%	0.723	24%	0.242	S	C	*	.	H	α-helix	trans	-60.5	-38.6	179	-68.1	174.7	0	0	0	112.5	K134 H140	K134-L136 PolarHBondContact O-N 3.47Å; L136-H140 WeakPolarHBondContact O-CB 3.36Å; L136-H140 PolarHBondContact O-N 3.26Å
137	L	86.2	Confident	82	Confident	74 Å²	74	56.8 Å²	56.8	39%	0.387	28%	0.281	S	S	.	.	H	α-helix	trans	-66.6	-43.2	176.9	179.4	151.5	0	0	0	110.9	K134 Q135 H140 F141 Y189	K134-L137 WeakPolarHBondContact O-CB 3.45Å; K134-L137 PolarHBondContact O-N 2.74Å; Q135-L137 VanDerWaalsContact C-N 3.28Å; Q135-L137 PolarHBondContact O-N 3.13Å; L137-H140 PolarHBondContact O-N 3.36Å; L137-F141 WeakPolarHBondContact O-CB 3.22Å; L137-F141 PolarHBondContact O-N 3.1Å; L137-Y189 HydrophobicContact CD2-CD2 4.47Å
138	L	84.1	Confident	80.3	Confident	1 Å²	1	59.5 Å²	59.5	1%	0.005	31%	0.309	C	S	.	.	H	α-helix	trans	-67.6	-40.4	179.1	-70.7	162.2	0	0	0	111.7	K134 Q135 F141 L142 H159 L162	K134-L138 HydrophobicContact CB-CD1 4.41Å; K134-L138 WeakPolarHBondContact O-CG 3.03Å; K134-L138 PolarHBondContact O-N 2.95Å; Q135-L138 PolarHBondContact O-N 3.38Å; Q135-L138 VanDerWaalsContact O-N 3.15Å; L138-F141 PolarHBondContact O-N 3.11Å; L138-L142 WeakPolarHBondContact O-CB 3.34Å; L138-L142 VanDerWaalsContact O-CG 3.3Å; L138-L142 WeakPolarHBondContact O-CG 3.4Å; L138-L142 PolarHBondContact O-N 2.88Å; L138-H159 VanDerWaalsContact CD1-NE2 3.31Å; L138-H159 WeakPolarHBondContact CD1-NE2 3.28Å; L138-L162 HydrophobicContact CB-CD2 4.31Å; L138-L162 HydrophobicContact CD2-CD2 4.21Å
139	E	81.1	Confident	78.8	Confident	100 Å²	100	64.3 Å²	64.3	47%	0.467	33%	0.33	S	S	.	.	H	α-helix	trans	-64.4	-44.1	175.9	-172.6	179.3	-177.7	0	0	111.4	Q135 F141 L142 N143	Q135-E139 WeakPolarHBondContact O-CB 3.23Å; Q135-E139 PolarHBondContact O-N 3.01Å; E139-F141 VanDerWaalsContact C-N 3.32Å; E139-F141 PolarHBondContact O-N 3.42Å; E139-L142 PolarHBondContact O-N 3.12Å; E139-N143 WeakPolarHBondContact O-CB 3.3Å; E139-N143 PolarHBondContact O-N 3.48Å; E139-N143 PolarHBondContact O-ND2 3.42Å; E139-N143 VanDerWaalsContact O-ND2 3.15Å
140	H	81.3	Confident	77.2	Confident	111 Å²	111	68.1 Å²	68.1	51%	0.514	35%	0.348	S	S	.	.	H	α-helix	trans	-58.2	-46	173.6	-173.4	72.5	0	0	0	111.5	L136 L137 N143 R144	L136-H140 WeakPolarHBondContact O-CB 3.36Å; L136-H140 PolarHBondContact O-N 3.26Å; L137-H140 PolarHBondContact O-N 3.36Å; H140-N143 PolarHBondContact O-N 3.35Å; H140-R144 PolarHBondContact O-N 2.99Å; H140-R144 VanDerWaalsContact O-N 3.11Å
141	F	78.3	Confident	75.7	Confident	22 Å²	22	74.6 Å²	74.6	10%	0.096	38%	0.383	C	S	.	.	H	α-helix	trans	-61.4	-45.7	176.5	175.6	-96.8	0	0	0	112.1	L137 L138 E139 N143 R144 A145 F153 K166 E191	L137-F141 WeakPolarHBondContact O-CB 3.22Å; L137-F141 PolarHBondContact O-N 3.1Å; L138-F141 PolarHBondContact O-N 3.11Å; E139-F141 VanDerWaalsContact C-N 3.32Å; E139-F141 PolarHBondContact O-N 3.42Å; F141-N143 VanDerWaalsContact C-N 3.34Å; F141-N143 PolarHBondContact O-N 2.89Å; F141-R144 PolarHBondContact O-N 2.92Å; F141-A145 HydrophobicContact CD1-CB 4.34Å; F141-A145 HydrophobicContact CE1-CB 3.87Å; F141-A145 HydrophobicContact CE2-CB 4.37Å; F141-A145 HydrophobicContact CZ-CB 3.86Å; F141-A145 WeakPolarHBondContact O-CB 3.32Å; F141-A145 PolarHBondContact O-N 3.39Å; F141-F153 AromaticContact CE1-CE2 3.96Å; F141-F153 HydrophobicContact CE1-CE2 3.96Å; F141-F153 AromaticContact CE1-CZ 3.84Å; F141-F153 HydrophobicContact CE1-CZ 3.84Å; F141-F153 HydrophobicContact CZ-CE2 4.28Å; F141-F153 HydrophobicContact CZ-CZ 4.31Å; F141-K166 HydrophobicContact CD1-CD 4.49Å; F141-K166 HydrophobicContact CE1-CD 3.96Å; F141-K166 HydrophobicContact CZ-CD 4.22Å; F141-E191 HydrophobicContact CD2-CB 4.24Å; F141-E191 HydrophobicContact CD2-CG 4.13Å
142	L	75.9	Confident	74.4	Confident	5 Å²	5	77.8 Å²	77.8	3%	0.026	40%	0.401	C	S	.	.	H	α-helix	trans	-61.2	-42.5	179	-76.4	171.8	0	0	0	111.9	W53 V55 F57 L138 E139 R144 A145 A146 F153 L162	W53-L142 HydrophobicContact CE3-CD2 4.48Å; W53-L142 WeakPolarHBondContact CZ2-O 3.5Å; W53-L142 PolarHBondContact NE1-O 2.97Å; V55-L142 HydrophobicContact CG2-CD1 4.24Å; F57-L142 HydrophobicContact CZ-CD1 4.43Å; L138-L142 WeakPolarHBondContact O-CB 3.34Å; L138-L142 VanDerWaalsContact O-CG 3.3Å; L138-L142 WeakPolarHBondContact O-CG 3.4Å; L138-L142 PolarHBondContact O-N 2.88Å; E139-L142 PolarHBondContact O-N 3.12Å; L142-R144 VanDerWaalsContact C-N 3.3Å; L142-R144 PolarHBondContact O-N 2.67Å; L142-A145 PolarHBondContact O-N 2.98Å; L142-A146 PolarHBondContact O-N 2.73Å; L142-F153 HydrophobicContact CD2-CB 4.48Å; L142-F153 HydrophobicContact CD2-CG 4.49Å; L142-L162 HydrophobicContact CD1-CD2 3.86Å; L142-L162 HydrophobicContact CD2-CD1 3.89Å; L142-L162 HydrophobicContact CG-CD2 4.36Å
143	N	74.1	Confident	73.3	Confident	83 Å²	83	75.7 Å²	75.7	44%	0.444	39%	0.387	S	S	.	.	H	α-helix	trans	-62.5	-38	176.9	-75.6	-37.6	0	0	0	112.1	E139 H140 F141 A146	E139-N143 WeakPolarHBondContact O-CB 3.3Å; E139-N143 PolarHBondContact O-N 3.48Å; E139-N143 PolarHBondContact O-ND2 3.42Å; E139-N143 VanDerWaalsContact O-ND2 3.15Å; H140-N143 PolarHBondContact O-N 3.35Å; F141-N143 VanDerWaalsContact C-N 3.34Å; F141-N143 PolarHBondContact O-N 2.89Å; N143-A146 WeakPolarHBondContact O-CB 3.4Å
144	R	74.3	Confident	72	Confident	160 Å²	160	73.9 Å²	73.9	60%	0.604	38%	0.38	S	S	*	.	H	α-helix	trans	-77.3	-37.8	176.5	-167.6	-176.4	-173	127.2	5.4	113	H140 F141 L142 A146 D147 E191	H140-R144 PolarHBondContact O-N 2.99Å; H140-R144 VanDerWaalsContact O-N 3.11Å; F141-R144 PolarHBondContact O-N 2.92Å; L142-R144 VanDerWaalsContact C-N 3.3Å; L142-R144 PolarHBondContact O-N 2.67Å; R144-A146 PolarHBondContact O-N 3.37Å; R144-D147 PolarHBondContact O-N 2.69Å; R144-E191 WeakPolarHBondContact CD-OE1 3.47Å; R144-E191 IonicContact CZ-OE1 3.14Å; R144-E191 IonicContact NE-OE1 3.91Å; R144-E191 PolarHBondContact NE-OE1 3.34Å; R144-E191 IonicContact NH1-OE1 3.5Å; R144-E191 PolarHBondContact NH1-OE1 3.4Å
145	A	67.2	Low	70.9	Confident	6 Å²	6	74.5 Å²	74.5	5%	0.05	40%	0.396	C	S	.	.	H	α-helix	trans	-71.3	-19	-179.3	0	0	0	0	0	112.4	F141 L142 D147 G148 F149 F153	F141-A145 HydrophobicContact CD1-CB 4.34Å; F141-A145 HydrophobicContact CE1-CB 3.87Å; F141-A145 HydrophobicContact CE2-CB 4.37Å; F141-A145 HydrophobicContact CZ-CB 3.86Å; F141-A145 WeakPolarHBondContact O-CB 3.32Å; F141-A145 PolarHBondContact O-N 3.39Å; L142-A145 PolarHBondContact O-N 2.98Å; A145-D147 PolarHBondContact O-N 3.21Å; A145-D147 VanDerWaalsContact O-N 3.14Å; A145-G148 PolarHBondContact O-N 2.62Å; A145-G148 VanDerWaalsContact O-N 3.08Å; A145-F149 PolarHBondContact O-N 3.05Å; A145-F153 HydrophobicContact CB-CE2 4.47Å
146	A	59.3	Low	70.3	Confident	8 Å²	8	73.1 Å²	73.1	7%	0.066	39%	0.391	C	S	.	.	T	Hydrogen-bonded Turn	trans	-51.9	-30.7	170.8	0	0	0	0	0	112.8	W53 L142 N143 R144 Q150	W53-A146 HydrophobicContact CZ2-CB 3.68Å; L142-A146 PolarHBondContact O-N 2.73Å; N143-A146 WeakPolarHBondContact O-CB 3.4Å; R144-A146 PolarHBondContact O-N 3.37Å; A146-Q150 WeakPolarHBondContact O-CG 3.43Å
147	D	59.3	Low	69.8	Low	154 Å²	154	72.8 Å²	72.8	82%	0.824	39%	0.386	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.8	-19.6	-178	-63.7	-18.6	0	0	0	113.2	R144 A145	R144-D147 PolarHBondContact O-N 2.69Å; A145-D147 PolarHBondContact O-N 3.21Å; A145-D147 VanDerWaalsContact O-N 3.14Å
148	G	60.4	Low	69.5	Low	57 Å²	57	71 Å²	71	59%	0.588	38%	0.377	S	S	*	.	T	Hydrogen-bonded Turn	trans	-126.9	-21.8	-171.1	0	0	0	0	0	116.6	A145	A145-G148 PolarHBondContact O-N 2.62Å; A145-G148 VanDerWaalsContact O-N 3.08Å
149	F	62.5	Low	69.6	Low	101 Å²	101	71.8 Å²	71.8	44%	0.443	38%	0.38	S	S	.	.			trans	-136.4	30.8	-172	-64.1	-77.6	0	0	0	112.9	A145 N151 L152 F153	A145-F149 PolarHBondContact O-N 3.05Å; F149-N151 PolarHBondContact O-N 3.23Å; F149-N151 VanDerWaalsContact O-N 3.12Å; F149-L152 PolarHBondContact O-N 3.26Å; F149-F153 HydrophobicContact CB-CD2 4Å; F149-F153 HydrophobicContact CB-CE2 3.94Å
150	Q	60.3	Low	70	Confident	81 Å²	81	67.2 Å²	67.2	38%	0.379	36%	0.359	S	S	.	.	H	α-helix	trans	-44.7	-46.6	179.8	-112.9	169	3.8	0	0	112.8	I51 A146 L152 T154	I51-Q150 HydrophobicContact CD1-CB 4.47Å; I51-Q150 HydrophobicContact CD1-CG 3.66Å; I51-Q150 HydrophobicContact CG1-CG 4.3Å; A146-Q150 WeakPolarHBondContact O-CG 3.43Å; Q150-L152 PolarHBondContact O-N 2.87Å; Q150-T154 WeakPolarHBondContact O-CG2 3.2Å; Q150-T154 PolarHBondContact O-N 3Å; Q150-T154 PolarHBondContact O-OG1 2.91Å; Q150-T154 VanDerWaalsContact O-OG1 3.14Å
151	N	61.8	Low	70.3	Confident	148 Å²	148	64.7 Å²	64.7	79%	0.791	35%	0.347	S	S	*	.	H	α-helix	trans	-71.7	-24.9	-175.6	-64.5	-23.6	0	0	0	115.2	F149 T154	F149-N151 PolarHBondContact O-N 3.23Å; F149-N151 VanDerWaalsContact O-N 3.12Å; N151-T154 WeakPolarHBondContact CA-OG1 3.26Å; N151-T154 PolarHBondContact O-OG1 2.99Å
152	L	64.8	Low	70.7	Confident	111 Å²	111	63.7 Å²	63.7	58%	0.581	34%	0.343	S	S	*	.	H	α-helix	trans	-79.3	-36.6	-175.9	-169.4	72	0	0	0	111.2	F149 Q150	F149-L152 PolarHBondContact O-N 3.26Å; Q150-L152 PolarHBondContact O-N 2.87Å
153	F	64	Low	71.5	Confident	9 Å²	9	63.5 Å²	63.5	4%	0.039	34%	0.342	C	S	.	.	H	α-helix	trans	-100.4	-8.4	-173.8	-62.2	-71.7	0	0	0	113.4	W53 F141 L142 A145 F149 A155 V156 L162	W53-F153 HydrophobicContact CH2-CB 3.8Å; W53-F153 HydrophobicContact CZ3-CB 3.55Å; F141-F153 AromaticContact CE1-CE2 3.96Å; F141-F153 HydrophobicContact CE1-CE2 3.96Å; F141-F153 AromaticContact CE1-CZ 3.84Å; F141-F153 HydrophobicContact CE1-CZ 3.84Å; F141-F153 HydrophobicContact CZ-CE2 4.28Å; F141-F153 HydrophobicContact CZ-CZ 4.31Å; L142-F153 HydrophobicContact CD2-CB 4.48Å; L142-F153 HydrophobicContact CD2-CG 4.49Å; A145-F153 HydrophobicContact CB-CE2 4.47Å; F149-F153 HydrophobicContact CB-CD2 4Å; F149-F153 HydrophobicContact CB-CE2 3.94Å; F153-A155 PolarHBondContact O-N 2.92Å; F153-V156 HydrophobicContact CD1-CG2 4.2Å; F153-V156 PolarHBondContact O-N 2.79Å; F153-V156 VanDerWaalsContact O-N 3.14Å; F153-L162 HydrophobicContact CD1-CD1 3.81Å; F153-L162 HydrophobicContact CE1-CD1 4.01Å
154	T	61.9	Low	72.3	Confident	77 Å²	77	61 Å²	61	47%	0.472	33%	0.328	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.9	-23.1	169.7	37.6	0	0	0	0	113.8	I51 Q150 N151	I51-T154 HydrophobicContact CD1-CG2 3.49Å; I51-T154 VanDerWaalsContact CD1-CG2 3.49Å; I51-T154 HydrophobicContact CG2-CG2 4.49Å; Q150-T154 WeakPolarHBondContact O-CG2 3.2Å; Q150-T154 PolarHBondContact O-N 3Å; Q150-T154 PolarHBondContact O-OG1 2.91Å; Q150-T154 VanDerWaalsContact O-OG1 3.14Å; N151-T154 WeakPolarHBondContact CA-OG1 3.26Å; N151-T154 PolarHBondContact O-OG1 2.99Å
155	A	64.8	Low	73	Confident	75 Å²	75	55 Å²	55	62%	0.62	31%	0.313	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.5	-5.6	178.4	0	0	0	0	0	113.6	F153	F153-A155 PolarHBondContact O-N 2.92Å
156	V	71.6	Confident	74	Confident	15 Å²	15	56.2 Å²	56.2	9%	0.091	32%	0.317	C	S	.	.			trans	-91.6	114.8	-176	175.3	0	0	0	0	109.2	V55 F153 E161 L162 A165	V55-V156 HydrophobicContact CG2-CG1 4.36Å; F153-V156 HydrophobicContact CD1-CG2 4.2Å; F153-V156 PolarHBondContact O-N 2.79Å; F153-V156 VanDerWaalsContact O-N 3.14Å; V156-E161 HydrophobicContact CG1-CB 4Å; V156-L162 VanDerWaalsContact CG1-CA 3.45Å; V156-L162 HydrophobicContact CG1-CB 3.65Å; V156-L162 HydrophobicContact CG1-CD1 4.24Å; V156-L162 VanDerWaalsContact CG1-N 3.25Å; V156-A165 HydrophobicContact CG2-CB 4.24Å
157	E	71.8	Confident	75.5	Confident	131 Å²	131	55.9 Å²	55.9	61%	0.612	31%	0.314	S	S	*	.			trans	-93.8	-28.3	-176.2	-59.9	-165.8	158.9	0	0	113.1	E161	E157-E161 PolarHBondContact N-OE2 3.04Å; E157-E161 VanDerWaalsContact N-OE2 3.11Å
158	D	80.5	Confident	76.9	Confident	37 Å²	37	54.9 Å²	54.9	20%	0.198	30%	0.299	C	S	.	.	B	Isolated β-bridge	trans	-137.9	159.7	-167.5	-162.7	8.1	0	0	0	112.5	R70 F160 E161 L162	R70-D158 IonicContact CZ-OD2 3.13Å; R70-D158 IonicContact NH2-OD2 3.37Å; R70-D158 PolarHBondContact NH2-OD2 2.03Å; D158-F160 PolarHBondContact O-N 2.99Å; D158-E161 PolarHBondContact O-N 3.16Å; D158-E161 VanDerWaalsContact O-N 3.12Å; D158-L162 PolarHBondContact O-N 3.33Å
159	H	85.7	Confident	78.2	Confident	16 Å²	16	55.2 Å²	55.2	7%	0.074	29%	0.29	C	S	.	.	H	α-helix	trans	-58.7	-37.5	-178.5	-174.5	-161.9	0	0	0	111.7	V55 F57 L138 L162 C163	V55-H159 HydrophobicContact CG1-CB 4.35Å; F57-H159 HydrophobicContact CD1-CB 3.93Å; F57-H159 AromaticContact CD1-CD2 3.72Å; F57-H159 AromaticContact CD1-CE1 3.87Å; F57-H159 AromaticContact CD1-CG 3.5Å; F57-H159 AromaticContact CD1-ND1 3.61Å; F57-H159 AromaticContact CD1-NE2 3.93Å; F57-H159 HydrophobicContact CE1-CB 4.26Å; F57-H159 AromaticContact CE1-CD2 3.43Å; F57-H159 VanDerWaalsContact CE1-CD2 3.43Å; F57-H159 WeakPolarHBondContact CE1-CD2 3.46Å; F57-H159 AromaticContact CE1-CG 3.71Å; F57-H159 AromaticContact CE1-NE2 3.68Å; L138-H159 VanDerWaalsContact CD1-NE2 3.31Å; L138-H159 WeakPolarHBondContact CD1-NE2 3.28Å; H159-L162 WeakPolarHBondContact O-CB 3.46Å; H159-L162 PolarHBondContact O-N 2.83Å; H159-C163 PolarHBondContact O-N 3.13Å; H159-C163 VanDerWaalsContact O-N 3.1Å
160	F	89.5	Confident	79	Confident	5 Å²	5	53.2 Å²	53.2	2%	0.022	29%	0.288	C	S	.	.	H	α-helix	trans	-62.8	-45.6	175.9	-178.4	-126.2	0	0	0	112.7	R70 E82 V126 L130 D158 L162 C163 L164	R70-F160 HydrophobicContact CB-CD1 4.16Å; R70-F160 HydrophobicContact CB-CE1 3.77Å; E82-F160 HydrophobicContact CB-CB 4.18Å; E82-F160 HydrophobicContact CB-CD1 3.7Å; E82-F160 HydrophobicContact CB-CD2 4.14Å; E82-F160 HydrophobicContact CB-CE1 4.04Å; E82-F160 HydrophobicContact CB-CE2 4.44Å; E82-F160 HydrophobicContact CB-CG 3.74Å; E82-F160 HydrophobicContact CB-CZ 4.39Å; V126-F160 HydrophobicContact CG1-CD2 4.32Å; V126-F160 HydrophobicContact CG1-CE2 3.86Å; L130-F160 HydrophobicContact CD1-CD2 3.81Å; L130-F160 HydrophobicContact CD1-CE2 4.2Å; L130-F160 HydrophobicContact CD2-CB 4.19Å; L130-F160 HydrophobicContact CD2-CD2 4.08Å; L130-F160 HydrophobicContact CG-CD2 4.41Å; D158-F160 PolarHBondContact O-N 2.99Å; F160-L162 VanDerWaalsContact C-N 3.29Å; F160-L162 PolarHBondContact O-N 2.99Å; F160-C163 PolarHBondContact O-N 2.79Å; F160-L164 HydrophobicContact CD1-CD1 3.94Å; F160-L164 HydrophobicContact CD2-CG 4.41Å; F160-L164 HydrophobicContact CE1-CD1 3.56Å; F160-L164 HydrophobicContact CE1-CG 4.26Å; F160-L164 HydrophobicContact CE2-CD1 4.31Å; F160-L164 HydrophobicContact CE2-CD2 4.19Å; F160-L164 HydrophobicContact CE2-CG 4.12Å; F160-L164 HydrophobicContact CG-CD1 4.47Å; F160-L164 HydrophobicContact CZ-CD1 3.78Å; F160-L164 HydrophobicContact CZ-CD2 4.06Å; F160-L164 HydrophobicContact CZ-CG 4.05Å; F160-L164 WeakPolarHBondContact O-CG 3.14Å; F160-L164 PolarHBondContact O-N 2.69Å
161	E	88.4	Confident	80	Confident	58 Å²	58	54.3 Å²	54.3	27%	0.271	31%	0.305	S	S	.	.	H	α-helix	trans	-66.1	-34.1	178.2	-68.4	-176.9	173.3	0	0	112	R70 V156 E157 D158 L164 A165	R70-E161 IonicContact NH1-OE1 2.9Å; R70-E161 PolarHBondContact NH1-OE1 3.37Å; R70-E161 VanDerWaalsContact NH1-OE1 3.14Å; V156-E161 HydrophobicContact CG1-CB 4Å; E157-E161 PolarHBondContact N-OE2 3.04Å; E157-E161 VanDerWaalsContact N-OE2 3.11Å; D158-E161 PolarHBondContact O-N 3.16Å; D158-E161 VanDerWaalsContact O-N 3.12Å; E161-L164 PolarHBondContact O-N 2.97Å; E161-A165 WeakPolarHBondContact O-CB 3.48Å; E161-A165 PolarHBondContact O-N 2.69Å
162	L	87.8	Confident	80.8	Confident	1 Å²	1	51.4 Å²	51.4	1%	0.005	29%	0.286	C	S	.	.	H	α-helix	trans	-59.6	-49.3	173.6	-178.5	62.7	0	0	0	110.5	V55 F57 L138 L142 F153 V156 D158 H159 F160 A165 K166	V55-L162 HydrophobicContact CG1-CD2 4.47Å; F57-L162 HydrophobicContact CZ-CD2 4.49Å; L138-L162 HydrophobicContact CB-CD2 4.31Å; L138-L162 HydrophobicContact CD2-CD2 4.21Å; L142-L162 HydrophobicContact CD1-CD2 3.86Å; L142-L162 HydrophobicContact CD2-CD1 3.89Å; L142-L162 HydrophobicContact CG-CD2 4.36Å; F153-L162 HydrophobicContact CD1-CD1 3.81Å; F153-L162 HydrophobicContact CE1-CD1 4.01Å; V156-L162 VanDerWaalsContact CG1-CA 3.45Å; V156-L162 HydrophobicContact CG1-CB 3.65Å; V156-L162 HydrophobicContact CG1-CD1 4.24Å; V156-L162 VanDerWaalsContact CG1-N 3.25Å; D158-L162 PolarHBondContact O-N 3.33Å; H159-L162 WeakPolarHBondContact O-CB 3.46Å; H159-L162 PolarHBondContact O-N 2.83Å; F160-L162 VanDerWaalsContact C-N 3.29Å; F160-L162 PolarHBondContact O-N 2.99Å; L162-A165 PolarHBondContact O-N 3.07Å; L162-K166 WeakPolarHBondContact O-CB 3.42Å; L162-K166 PolarHBondContact O-N 3.1Å
163	C	91.2	Very high	81.5	Confident	0 Å²	0	46.3 Å²	46.3	0%	0	26%	0.26	C	S	.	.	H	α-helix	trans	-64.8	-41.1	179	-70.5	0	0	0	0	112	V126 C129 L130 H159 F160 A165 C167	V126-C163 HydrophobicContact CG1-CB 4.27Å; C129-C163 HydrophobicContact CB-CB 3.68Å; C129-C163 WeakPolarHBondContact CB-SG 3.23Å; C129-C163 WeakPolarHBondContact SG-CA 3.39Å; C129-C163 WeakPolarHBondContact SG-CB 3.3Å; C129-C163 CovalentContact SG-SG 2.05Å; C129-C163 PolarHBondContact SG-SG 2.9Å; L130-C163 HydrophobicContact CD2-CB 4.37Å; L130-C163 HydrophobicContact CG-CB 4.37Å; H159-C163 PolarHBondContact O-N 3.13Å; H159-C163 VanDerWaalsContact O-N 3.1Å; F160-C163 PolarHBondContact O-N 2.79Å; C163-A165 PolarHBondContact O-N 3.14Å; C163-C167 WeakPolarHBondContact O-CB 3.11Å; C163-C167 PolarHBondContact O-N 3.29Å
164	L	91.6	Very high	82.4	Confident	30 Å²	30	47.3 Å²	47.3	16%	0.157	27%	0.267	C	S	.	.	H	α-helix	trans	-60.5	-43.8	174	-70.7	175.7	0	0	0	112.1	Y122 V126 F160 E161 R168	Y122-L164 HydrophobicContact CE1-CD2 4.49Å; Y122-L164 VanDerWaalsContact OH-CD2 3.28Å; Y122-L164 WeakPolarHBondContact OH-CD2 3.37Å; Y122-L164 PolarHBondContact OH-O 2.7Å; V126-L164 HydrophobicContact CG1-CD2 4Å; V126-L164 HydrophobicContact CG2-CD2 4.06Å; F160-L164 HydrophobicContact CD1-CD1 3.94Å; F160-L164 HydrophobicContact CD2-CG 4.41Å; F160-L164 HydrophobicContact CE1-CD1 3.56Å; F160-L164 HydrophobicContact CE1-CG 4.26Å; F160-L164 HydrophobicContact CE2-CD1 4.31Å; F160-L164 HydrophobicContact CE2-CD2 4.19Å; F160-L164 HydrophobicContact CE2-CG 4.12Å; F160-L164 HydrophobicContact CG-CD1 4.47Å; F160-L164 HydrophobicContact CZ-CD1 3.78Å; F160-L164 HydrophobicContact CZ-CD2 4.06Å; F160-L164 HydrophobicContact CZ-CG 4.05Å; F160-L164 WeakPolarHBondContact O-CG 3.14Å; F160-L164 PolarHBondContact O-N 2.69Å; E161-L164 PolarHBondContact O-N 2.97Å; L164-R168 WeakPolarHBondContact O-CG 3.39Å
165	A	88.6	Confident	83.2	Confident	35 Å²	35	46.2 Å²	46.2	29%	0.289	26%	0.257	S	S	.	.	H	α-helix	trans	-69.4	-46.4	-180	0	0	0	0	0	111.5	V156 E161 L162 C163 R168	V156-A165 HydrophobicContact CG2-CB 4.24Å; E161-A165 WeakPolarHBondContact O-CB 3.48Å; E161-A165 PolarHBondContact O-N 2.69Å; L162-A165 PolarHBondContact O-N 3.07Å; C163-A165 PolarHBondContact O-N 3.14Å; A165-R168 PolarHBondContact O-N 2.55Å
166	K	88.1	Confident	83.7	Confident	32 Å²	32	49.9 Å²	49.9	14%	0.139	26%	0.26	C	S	.	.	H	α-helix	trans	-69.1	-42.9	-175.4	-175.8	70.8	-178.5	-179.3	0	112	F141 L162 R168 C188 Y189 G190	F141-K166 HydrophobicContact CD1-CD 4.49Å; F141-K166 HydrophobicContact CE1-CD 3.96Å; F141-K166 HydrophobicContact CZ-CD 4.22Å; L162-K166 WeakPolarHBondContact O-CB 3.42Å; L162-K166 PolarHBondContact O-N 3.1Å; K166-R168 PolarHBondContact O-N 3.19Å; K166-C188 CarbonylContact C-O 3.48Å; K166-Y189 VanDerWaalsContact CE-O 3.25Å; K166-Y189 WeakPolarHBondContact CE-O 3.44Å; K166-G190 WeakPolarHBondContact CE-O 3.05Å; K166-G190 PolarHBondContact NZ-O 2.99Å
167	C	91.4	Very high	83.7	Confident	0 Å²	0	57.6 Å²	57.6	0%	0	30%	0.296	C	S	.	.	T	Hydrogen-bonded Turn	trans	-69.8	-8.8	-179.6	-78.3	0	0	0	0	114.3	Y122 C125 V126 C163 Y187	Y122-C167 HydrophobicContact CD2-CB 4.01Å; Y122-C167 HydrophobicContact CE2-CB 3.77Å; C125-C167 HydrophobicContact CB-CB 3.79Å; C125-C167 WeakPolarHBondContact CB-SG 3.44Å; C125-C167 PolarHBondContact O-SG 3.03Å; C125-C167 VanDerWaalsContact O-SG 3.38Å; C125-C167 WeakPolarHBondContact SG-CB 3.34Å; C125-C167 CovalentContact SG-SG 2.05Å; C125-C167 PolarHBondContact SG-SG 3.24Å; V126-C167 HydrophobicContact CG2-CB 3.91Å; V126-C167 PolarHBondContact N-SG 2.99Å; C163-C167 WeakPolarHBondContact O-CB 3.11Å; C163-C167 PolarHBondContact O-N 3.29Å; C167-Y187 WeakPolarHBondContact O-CA 3.49Å; C167-Y187 VanDerWaalsContact O-CB 3.29Å; C167-Y187 WeakPolarHBondContact O-CB 3.06Å; C167-Y187 VanDerWaalsContact O-CD1 3.24Å; C167-Y187 WeakPolarHBondContact O-CD1 3.44Å
168	R	89.3	Confident	84	Confident	134 Å²	134	58 Å²	58	51%	0.506	30%	0.302	S	S	.	.	S	Bend	trans	-65.6	148	174.1	-77.5	171	178.8	-172.4	1.9	110.8	Y122 L164 A165 K166 S170	Y122-R168 HydrophobicContact CE2-CG 4.19Å; L164-R168 WeakPolarHBondContact O-CG 3.39Å; A165-R168 PolarHBondContact O-N 2.55Å; K166-R168 PolarHBondContact O-N 3.19Å; R168-S170 PolarHBondContact O-N 3.5Å
169	T	85.9	Confident	84.1	Confident	64 Å²	64	60 Å²	60	39%	0.393	32%	0.316	S	S	.	.			trans	-60.7	137	172.8	48.5	0	0	0	0	110	Y180 K186 Y187	T169-Y180 HydrophobicContact CG2-CE1 3.84Å; T169-K186 HydrophobicContact CG2-CB 4.29Å; T169-Y187 HydrophobicContact CG2-CD1 3.86Å; T169-Y187 HydrophobicContact CG2-CE1 3.67Å
170	S	81.2	Confident	84	Confident	58 Å²	58	63.2 Å²	63.2	41%	0.406	33%	0.328	S	S	.	.			trans	-125.6	169.4	-178.9	72.5	0	0	0	0	110.8	R168 Q172 S173	R168-S170 PolarHBondContact O-N 3.5Å; S170-Q172 PolarHBondContact O-N 2.91Å; S170-Q172 PolarHBondContact OG-N 2.04Å; S170-S173 PolarHBondContact N-OG 3.35Å; S170-S173 PolarHBondContact O-N 3.41Å; S170-S173 PolarHBondContact O-OG 2.99Å
171	S	80.1	Confident	83.6	Confident	105 Å²	105	66.4 Å²	66.4	73%	0.734	34%	0.339	S	S	*	.	G	3₁₀ helix	trans	-58.1	-20.4	173.2	55	0	0	0	0	113	V174	S171-V174 VanDerWaalsContact O-CG2 3.22Å; S171-V174 WeakPolarHBondContact O-CG2 3.35Å
172	Q	78.4	Confident	83.4	Confident	86 Å²	86	64.2 Å²	64.2	40%	0.402	33%	0.33	S	S	.	.	G	3₁₀ helix	trans	-77.2	-23.3	177.3	-60	-177	5	0	0	113.2	S170 V174 R181 P193	S170-Q172 PolarHBondContact O-N 2.91Å; S170-Q172 PolarHBondContact OG-N 2.04Å; Q172-V174 VanDerWaalsContact C-N 3.3Å; Q172-R181 WeakPolarHBondContact O-CD 3.49Å; Q172-R181 PolarHBondContact O-NE 3.38Å; Q172-P193 HydrophobicContact CB-CB 4.35Å
173	S	79.3	Confident	83.2	Confident	4 Å²	4	68 Å²	68	3%	0.028	36%	0.356	C	S	.	.	G	3₁₀ helix	trans	-86	-1.8	177.5	63.1	0	0	0	0	113.6	S170 Y180 R181	S170-S173 PolarHBondContact N-OG 3.35Å; S170-S173 PolarHBondContact O-N 3.41Å; S170-S173 PolarHBondContact O-OG 2.99Å; S173-Y180 WeakPolarHBondContact O-CA 3.04Å; S173-R181 PolarHBondContact O-N 3.07Å
174	V	83.4	Confident	82.9	Confident	31 Å²	31	74.4 Å²	74.4	19%	0.188	39%	0.386	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	161.9	176.6	-60.3	0	0	0	0	112.8	S171 Q172 T179 Y180 R181	S171-V174 VanDerWaalsContact O-CG2 3.22Å; S171-V174 WeakPolarHBondContact O-CG2 3.35Å; Q172-V174 VanDerWaalsContact C-N 3.3Å; V174-T179 CarbonylContact C-O 3.4Å; V174-T179 VanDerWaalsContact CA-O 3.24Å; V174-T179 WeakPolarHBondContact CA-O 3.48Å; V174-Y180 HydrophobicContact CG1-CD1 3.97Å; V174-Y180 HydrophobicContact CG1-CE1 4.04Å; V174-R181 PolarHBondContact O-NE 3.15Å
175	Q	78.4	Confident	82.6	Confident	54 Å²	54	73 Å²	73	25%	0.252	38%	0.379	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.5	140.7	177.2	-172	-174.3	4.2	0	0	106.6	E177 T179 R181 L196	Q175-E177 PolarHBondContact O-N 2.89Å; Q175-T179 PolarHBondContact N-O 2.96Å; Q175-T179 WeakPolarHBondContact O-CA 3.47Å; Q175-T179 VanDerWaalsContact O-CB 3.31Å; Q175-T179 WeakPolarHBondContact O-CB 3.01Å; Q175-T179 PolarHBondContact O-N 2.9Å; Q175-R181 HydrophobicContact CB-CG 4.23Å; Q175-L196 HydrophobicContact CB-CD2 4.42Å; Q175-L196 HydrophobicContact CG-CD2 4.34Å
176	H	75.4	Confident	82.7	Confident	151 Å²	151	74.3 Å²	74.3	70%	0.699	38%	0.378	S	S	*	.	T	Hydrogen-bonded Turn	trans	48.3	58.8	-178	-69.4	99.8	0	0	0	113.4	N178	H176-N178 PolarHBondContact O-N 2.02Å
177	E	72.8	Confident	82.9	Confident	178 Å²	178	75.8 Å²	75.8	83%	0.832	38%	0.383	S	S	*	.	T	Hydrogen-bonded Turn	trans	64.4	-37.8	173.3	-57.2	-179.3	-178.3	0	0	116	Q175	Q175-E177 PolarHBondContact O-N 2.89Å
178	N	77.6	Confident	82.8	Confident	140 Å²	140	76.6 Å²	76.6	75%	0.749	39%	0.389	S	S	*	.	T	Hydrogen-bonded Turn	trans	-142.1	-3	-173.2	-69.1	-46.2	0	0	0	116.1	H176	H176-N178 PolarHBondContact O-N 2.02Å
179	T	82.4	Confident	82.9	Confident	79 Å²	79	70.8 Å²	70.8	49%	0.485	37%	0.367	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94	126.2	-179.7	-54.1	0	0	0	0	109.8	V174 Q175 R181	V174-T179 CarbonylContact C-O 3.4Å; V174-T179 VanDerWaalsContact CA-O 3.24Å; V174-T179 WeakPolarHBondContact CA-O 3.48Å; Q175-T179 PolarHBondContact N-O 2.96Å; Q175-T179 WeakPolarHBondContact O-CA 3.47Å; Q175-T179 VanDerWaalsContact O-CB 3.31Å; Q175-T179 WeakPolarHBondContact O-CB 3.01Å; Q175-T179 PolarHBondContact O-N 2.9Å; T179-R181 PolarHBondContact O-N 3.35Å
180	Y	82.9	Confident	82.8	Confident	83 Å²	83	68 Å²	68	33%	0.325	35%	0.35	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.4	137.5	175.8	-70.1	-76.4	0	0	0	111	T169 S173 V174 N182 K186	T169-Y180 HydrophobicContact CG2-CE1 3.84Å; S173-Y180 WeakPolarHBondContact O-CA 3.04Å; V174-Y180 HydrophobicContact CG1-CD1 3.97Å; V174-Y180 HydrophobicContact CG1-CE1 4.04Å; Y180-N182 PolarHBondContact O-N 2.95Å; Y180-K186 HydrophobicContact CD1-CB 4.28Å; Y180-K186 HydrophobicContact CD1-CD 4.35Å; Y180-K186 HydrophobicContact CD1-CG 3.93Å; Y180-K186 HydrophobicContact CD2-CD 4.09Å; Y180-K186 HydrophobicContact CD2-CG 4.37Å; Y180-K186 HydrophobicContact CE1-CB 4.25Å; Y180-K186 HydrophobicContact CE1-CD 4.27Å; Y180-K186 HydrophobicContact CE1-CG 4.18Å; Y180-K186 HydrophobicContact CE2-CD 4.02Å; Y180-K186 HydrophobicContact CG-CD 4.25Å; Y180-K186 HydrophobicContact CG-CG 4.03Å
181	R	82.2	Confident	82.6	Confident	71 Å²	71	69 Å²	69	27%	0.268	35%	0.349	S	S	.	.	S	Bend	trans	-56.4	-38.4	174.8	-63.9	-172.1	171.1	-124.6	-3	112.2	Q172 S173 V174 Q175 T179 P194 L196 L197	Q172-R181 WeakPolarHBondContact O-CD 3.49Å; Q172-R181 PolarHBondContact O-NE 3.38Å; S173-R181 PolarHBondContact O-N 3.07Å; V174-R181 PolarHBondContact O-NE 3.15Å; Q175-R181 HydrophobicContact CB-CG 4.23Å; T179-R181 PolarHBondContact O-N 3.35Å; R181-P194 HydrophobicContact CB-CG 4.15Å; R181-L196 HydrophobicContact CB-CD2 3.8Å; R181-L196 HydrophobicContact CG-CD2 3.49Å; R181-L196 VanDerWaalsContact CG-CD2 3.49Å; R181-L196 HydrophobicContact CG-CG 4.47Å; R181-L197 PolarHBondContact O-N 3.45Å
182	N	83.7	Confident	82.3	Confident	12 Å²	12	66.9 Å²	66.9	6%	0.064	33%	0.334	C	S	.	.			trans	-142	117.1	173.4	-174.4	-26.6	0	0	0	108.8	Y180 Q184 A185 P194 L197	Y180-N182 PolarHBondContact O-N 2.95Å; N182-Q184 PolarHBondContact O-N 3.12Å; N182-Q184 WeakPolarHBondContact OD1-CA 3.09Å; N182-Q184 WeakPolarHBondContact OD1-CB 3.36Å; N182-Q184 PolarHBondContact OD1-N 3.01Å; N182-A185 HydrophobicContact CB-CB 4.06Å; N182-A185 CarbonylContact O-C 3.57Å; N182-A185 PolarHBondContact O-N 3.16Å; N182-A185 VanDerWaalsContact O-N 3.17Å; N182-A185 PolarHBondContact OD1-N 3.21Å; N182-P194 HydrophobicContact CB-CB 4.12Å; N182-L197 HydrophobicContact CB-CD1 4.16Å; N182-L197 HydrophobicContact CB-CG 4.25Å; N182-L197 WeakPolarHBondContact OD1-CD1 3.22Å
183	S	84	Confident	82.2	Confident	81 Å²	81	65.5 Å²	65.5	57%	0.566	33%	0.332	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.1	-18.8	-179.8	64.2	0	0	0	0	113.3	K186	S183-K186 WeakPolarHBondContact O-CE 3.46Å
184	Q	84.9	Confident	82.1	Confident	135 Å²	135	65.4 Å²	65.4	63%	0.631	33%	0.332	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.4	-4.2	176.5	-59	-165.3	-17.6	0	0	113.3	N120 N182	N120-Q184 VanDerWaalsContact CA-O 3.27Å; N120-Q184 WeakPolarHBondContact CA-O 3.34Å; N120-Q184 WeakPolarHBondContact CB-O 3.09Å; N120-Q184 PolarHBondContact N-O 2.88Å; N182-Q184 PolarHBondContact O-N 3.12Å; N182-Q184 WeakPolarHBondContact OD1-CA 3.09Å; N182-Q184 WeakPolarHBondContact OD1-CB 3.36Å; N182-Q184 PolarHBondContact OD1-N 3.01Å
185	A	85.8	Confident	81.9	Confident	0 Å²	0	70.8 Å²	70.8	0%	0	36%	0.355	C	S	.	.			trans	-140	68.1	-175.2	0	0	0	0	0	110.8	L114 C118 N182 P194	L114-A185 HydrophobicContact CD1-CB 3.71Å; C118-A185 HydrophobicContact CB-CB 3.76Å; N182-A185 HydrophobicContact CB-CB 4.06Å; N182-A185 CarbonylContact O-C 3.57Å; N182-A185 PolarHBondContact O-N 3.16Å; N182-A185 VanDerWaalsContact O-N 3.17Å; N182-A185 PolarHBondContact OD1-N 3.21Å; A185-P194 HydrophobicContact CB-CB 4.14Å; A185-P194 VanDerWaalsContact O-CB 3.3Å; A185-P194 WeakPolarHBondContact O-CB 3.41Å; A185-P194 WeakPolarHBondContact O-CG 3.26Å
186	K	89.3	Confident	81.8	Confident	63 Å²	63	72.6 Å²	72.6	27%	0.274	37%	0.366	S	S	.	.			trans	-90.5	-33.2	-172.7	-60.1	179.6	-175.5	171.9	0	113.6	C119 T169 Y180 S183	C119-K186 PolarHBondContact O-N 3.19Å; C119-K186 VanDerWaalsContact O-N 3.1Å; T169-K186 HydrophobicContact CG2-CB 4.29Å; Y180-K186 HydrophobicContact CD1-CB 4.28Å; Y180-K186 HydrophobicContact CD1-CD 4.35Å; Y180-K186 HydrophobicContact CD1-CG 3.93Å; Y180-K186 HydrophobicContact CD2-CD 4.09Å; Y180-K186 HydrophobicContact CD2-CG 4.37Å; Y180-K186 HydrophobicContact CE1-CB 4.25Å; Y180-K186 HydrophobicContact CE1-CD 4.27Å; Y180-K186 HydrophobicContact CE1-CG 4.18Å; Y180-K186 HydrophobicContact CE2-CD 4.02Å; Y180-K186 HydrophobicContact CG-CD 4.25Å; Y180-K186 HydrophobicContact CG-CG 4.03Å; S183-K186 WeakPolarHBondContact O-CE 3.46Å
187	Y	91.7	Very high	81.6	Confident	62 Å²	62	69.2 Å²	69.2	24%	0.243	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111	118.4	-171	-54.9	-71.4	0	0	0	109	C118 C119 N120 Y122 C167 T169	C118-Y187 CarbonylContact C-O 3.56Å; C118-Y187 WeakPolarHBondContact CA-O 2.98Å; C119-Y187 PolarHBondContact N-O 3.39Å; C119-Y187 PolarHBondContact O-N 3.45Å; C119-Y187 VanDerWaalsContact O-N 3.13Å; N120-Y187 WeakPolarHBondContact O-CE2 3.37Å; Y122-Y187 AromaticContact CD2-CD1 3.77Å; Y122-Y187 HydrophobicContact CD2-CD1 3.77Å; Y122-Y187 HydrophobicContact CD2-CE1 4.14Å; Y122-Y187 HydrophobicContact CD2-CG 4.27Å; Y122-Y187 HydrophobicContact CG-CD1 4.28Å; Y122-Y187 HydrophobicContact CG-CE1 4.34Å; Y122-Y187 VanDerWaalsContact N-CD2 3.25Å; C167-Y187 WeakPolarHBondContact O-CA 3.49Å; C167-Y187 VanDerWaalsContact O-CB 3.29Å; C167-Y187 WeakPolarHBondContact O-CB 3.06Å; C167-Y187 VanDerWaalsContact O-CD1 3.24Å; C167-Y187 WeakPolarHBondContact O-CD1 3.44Å; T169-Y187 HydrophobicContact CG2-CD1 3.86Å; T169-Y187 HydrophobicContact CG2-CE1 3.67Å
188	C	91.1	Very high	81.2	Confident	17 Å²	17	66.7 Å²	66.7	12%	0.115	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	130.5	-169.3	-56.5	0	0	0	0	112.1	G117 C118 K166	G117-C188 WeakPolarHBondContact O-CA 3.47Å; C118-C188 HydrophobicContact CB-CB 4.01Å; C118-C188 WeakPolarHBondContact CB-SG 3.22Å; C118-C188 WeakPolarHBondContact SG-CB 3.27Å; C118-C188 CovalentContact SG-SG 2.03Å; C118-C188 PolarHBondContact SG-SG 3.44Å; K166-C188 CarbonylContact C-O 3.48Å
189	Y	89.7	Confident	80.3	Confident	12 Å²	12	69.5 Å²	69.5	5%	0.047	36%	0.364	C	S	.	.			trans	-97.6	-16.8	166.8	65.3	-98	0	0	0	112.7	G117 C128 C129 K134 L137 K166	G117-Y189 VanDerWaalsContact O-CD1 3.24Å; G117-Y189 WeakPolarHBondContact O-CD1 3.49Å; G117-Y189 WeakPolarHBondContact O-CE1 3.39Å; G117-Y189 PolarHBondContact O-N 2.91Å; C128-Y189 HydrophobicContact CB-CE1 4.01Å; C128-Y189 PolarHBondContact SG-OH 3.34Å; C128-Y189 VanDerWaalsContact SG-OH 3.34Å; C129-Y189 HydrophobicContact CB-CD1 4.2Å; C129-Y189 HydrophobicContact CB-CG 3.99Å; K134-Y189 HydrophobicContact CD-CE2 4.23Å; K134-Y189 HydrophobicContact CG-CE2 4.36Å; L137-Y189 HydrophobicContact CD2-CD2 4.47Å; K166-Y189 VanDerWaalsContact CE-O 3.25Å; K166-Y189 WeakPolarHBondContact CE-O 3.44Å
190	G	85.1	Confident	80.2	Confident	5 Å²	5	69 Å²	69	5%	0.052	36%	0.358	C	S	.	.	S	Bend	trans	-66.6	170.9	177.6	0	0	0	0	0	114.9	G117 K166	G117-G190 PolarHBondContact O-N 3.13Å; K166-G190 WeakPolarHBondContact CE-O 3.05Å; K166-G190 PolarHBondContact NZ-O 2.99Å
191	E	76.8	Confident	80	Confident	80 Å²	80	68.3 Å²	68.3	37%	0.374	36%	0.36	S	S	.	.	S	Bend	trans	-77.4	-39.5	175.2	-175.8	177.1	179.6	0	0	112	F141 R144	F141-E191 HydrophobicContact CD2-CB 4.24Å; F141-E191 HydrophobicContact CD2-CG 4.13Å; R144-E191 WeakPolarHBondContact CD-OE1 3.47Å; R144-E191 IonicContact CZ-OE1 3.14Å; R144-E191 IonicContact NE-OE1 3.91Å; R144-E191 PolarHBondContact NE-OE1 3.34Å; R144-E191 IonicContact NH1-OE1 3.5Å; R144-E191 PolarHBondContact NH1-OE1 3.4Å
192	S	73.8	Confident	79.9	Confident	60 Å²	60	68.1 Å²	68.1	42%	0.42	37%	0.365	S	S	.	.	S	Bend	trans	-81.6	140.1	-176.4	51.1	0	0	0	0	112.3
193	P	75.9	Confident	79.7	Confident	57 Å²	57	71.4 Å²	71.4	37%	0.37	38%	0.383	S	S	.	.	P	Polyproline II helix	trans	-64.6	160.1	171.5	28.8	-34.4	0	0	0	110.8	Q172	Q172-P193 HydrophobicContact CB-CB 4.35Å
194	P	77.7	Confident	79.4	Confident	3 Å²	3	70.8 Å²	70.8	2%	0.019	37%	0.372	C	S	.	.	P	Polyproline II helix	trans	-59.5	141.8	174	23.5	-30.9	0	0	0	111.1	R181 N182 A185	R181-P194 HydrophobicContact CB-CG 4.15Å; N182-P194 HydrophobicContact CB-CB 4.12Å; A185-P194 HydrophobicContact CB-CB 4.14Å; A185-P194 VanDerWaalsContact O-CB 3.3Å; A185-P194 WeakPolarHBondContact O-CB 3.41Å; A185-P194 WeakPolarHBondContact O-CG 3.26Å
195	E	79.3	Confident	79	Confident	143 Å²	143	66.5 Å²	66.5	67%	0.668	35%	0.354	S	S	*	.	P	Polyproline II helix	trans	-56.2	139.9	176.5	-71	178.9	-177.3	0	0	110.7	L197	E195-L197 PolarHBondContact O-N 2.84Å
196	L	76.7	Confident	78.5	Confident	92 Å²	92	71.3 Å²	71.3	48%	0.482	38%	0.38	S	S	.	.			trans	-74.6	110.7	175	-72.6	166.3	0	0	0	108.4	Q175 R181	Q175-L196 HydrophobicContact CB-CD2 4.42Å; Q175-L196 HydrophobicContact CG-CD2 4.34Å; R181-L196 HydrophobicContact CB-CD2 3.8Å; R181-L196 HydrophobicContact CG-CD2 3.49Å; R181-L196 VanDerWaalsContact CG-CD2 3.49Å; R181-L196 HydrophobicContact CG-CG 4.47Å
197	L	70.7	Confident	77.7	Confident	81 Å²	81	71.9 Å²	71.9	42%	0.424	39%	0.388	S	S	.	.			trans	-76.6	137.1	169.1	-66.9	178.6	0	0	0	109.3	R181 N182 E195 I199	R181-L197 PolarHBondContact O-N 3.45Å; N182-L197 HydrophobicContact CB-CD1 4.16Å; N182-L197 HydrophobicContact CB-CG 4.25Å; N182-L197 WeakPolarHBondContact OD1-CD1 3.22Å; E195-L197 PolarHBondContact O-N 2.84Å; L197-I199 PolarHBondContact O-N 2.93Å
198	P	63.6	Low	76.6	Confident	125 Å²	125	72.8 Å²	72.8	81%	0.812	40%	0.4	S	S	*	.			trans	-61.9	133.5	169.9	26	-30.8	0	0	0	109
199	I	58.4	Low	75.2	Confident	198 Å²	198	77.8 Å²	77.8	100%	1.015	43%	0.426	S	S	*	.			trans	-72.6	0	179.1	-55.7	163.6	0	0	0	109.4	L197	L197-I199 PolarHBondContact O-N 2.93Å

Retrieved 199 of 199 residues in 1366.5 ms (Link to these results)

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