A0A087X504_POEFO Loading...

Tubulin beta chain

Tubulin is the major constituent of microtubules, a cylinder consisting of laterally associated linear protofilaments composed of alpha- and beta-tubulin heterodimers. Microtubules grow by the addition of GTP-tubulin dimers to the microtubule end, where a stabilizing cap forms. Below the cap, tubulin dimers are in GDP-bound state, owing to GTPase activity of alpha-tubulin.

AlphaFold DB , UniProt , Accession A0A087X504, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 449 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

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	53.4	Low	89.5	Confident	149 Å²	149	34 Å²	34	73%	0.734	16%	0.155	S	C	*	.				0	128	0	-60.8	-170.9	-82.5	0	0	106.6	D128	M1-D128 HydrophobicContact CB-CB 4.3Å; M1-D128 WeakPolarHBondContact CE-OD2 3.5Å
2	R	78.4	Confident	89.6	Confident	99 Å²	99	33.7 Å²	33.7	37%	0.374	16%	0.159	S	C	.	.			trans	-157.8	79	-160.7	-71.2	-170.1	175.7	-171.8	-16.3	109.2	V49 C129 Q131 D249	R2-V49 WeakPolarHBondContact O-CG2 3.44Å; R2-C129 WeakPolarHBondContact CA-O 3.38Å; R2-Q131 HydrophobicContact CB-CG 3.67Å; R2-Q131 VanDerWaalsContact CB-NE2 3.3Å; R2-Q131 HydrophobicContact CG-CG 4.32Å; R2-Q131 PolarHBondContact O-NE2 3.28Å; R2-D249 IonicContact CZ-OD2 3.09Å; R2-D249 IonicContact NH1-OD2 2.92Å; R2-D249 PolarHBondContact NH1-OD2 3.34Å; R2-D249 IonicContact NH2-OD2 2.74Å; R2-D249 PolarHBondContact NH2-OD2 3.46Å
3	E	91.4	Very high	89.9	Confident	8 Å²	8	31.1 Å²	31.1	4%	0.037	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.6	150.6	-170.7	-58.9	93	152.3	0	0	112.7	N48 C127 D128 C129 Q131	E3-N48 WeakPolarHBondContact CG-O 3.3Å; E3-C127 HydrophobicContact CB-CB 4.08Å; E3-C127 HydrophobicContact CG-CB 4.3Å; E3-D128 WeakPolarHBondContact OE1-CB 3.27Å; E3-D128 PolarHBondContact OE1-N 3.44Å; E3-C129 PolarHBondContact N-O 3.3Å; E3-C129 WeakPolarHBondContact OE2-CA 3.32Å; E3-C129 PolarHBondContact OE2-N 3.17Å; E3-Q131 WeakPolarHBondContact O-CB 3.48Å; E3-Q131 PolarHBondContact O-N 3.03Å
4	I	94.3	Very high	90.2	Very high	1 Å²	1	28.9 Å²	28.9	1%	0.005	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	124.8	176.3	-62.8	169.4	0	0	0	108.2	V49 Y50 R62 Q131 Q134 L240 L250	I4-V49 HydrophobicContact CD1-CG1 3.7Å; I4-V49 HydrophobicContact CG1-CG1 4.03Å; I4-V49 PolarHBondContact N-O 2.8Å; I4-Y50 HydrophobicContact CB-CE1 4.44Å; I4-Y50 HydrophobicContact CD1-CE2 4.19Å; I4-Y50 HydrophobicContact CG2-CE1 4.27Å; I4-R62 WeakPolarHBondContact O-CD 3.37Å; I4-Q131 HydrophobicContact CG1-CB 4.21Å; I4-Q134 HydrophobicContact CG2-CB 3.97Å; I4-L240 HydrophobicContact CD1-CD1 3.72Å; I4-L250 HydrophobicContact CD1-CD1 3.73Å; I4-L250 HydrophobicContact CD1-CG 4.15Å; I4-L250 HydrophobicContact CG1-CD1 3.94Å
5	V	96.1	Very high	90.3	Very high	0 Å²	0	31.5 Å²	31.5	0%	0	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.3	120.7	172.4	175.4	0	0	0	0	108.3	I7 R62 I64 E123 L130 G132 F133 Q134	V5-I7 HydrophobicContact CG1-CG1 4.28Å; V5-R62 HydrophobicContact CG2-CG 4.07Å; V5-I64 HydrophobicContact CG1-CD1 3.84Å; V5-I64 HydrophobicContact CG1-CG1 4.47Å; V5-E123 HydrophobicContact CG1-CB 4.49Å; V5-E123 HydrophobicContact CG2-CB 4.19Å; V5-L130 HydrophobicContact CB-CD1 4.41Å; V5-L130 HydrophobicContact CG2-CD1 3.7Å; V5-G132 PolarHBondContact N-O 2.98Å; V5-F133 HydrophobicContact CB-CD1 3.71Å; V5-F133 HydrophobicContact CB-CE1 3.93Å; V5-F133 HydrophobicContact CG1-CD1 4Å; V5-F133 HydrophobicContact CG1-CE1 4.2Å; V5-F133 HydrophobicContact CG2-CE1 4.26Å; V5-F133 WeakPolarHBondContact O-CA 3.32Å; V5-Q134 PolarHBondContact O-N 2.81Å
6	H	97	Very high	90.5	Very high	0 Å²	0	29.9 Å²	29.9	0%	0	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	131.6	179.4	-175.8	78.9	0	0	0	110.5	Q8 W21 R62 A63 I64 Q134	H6-Q8 PolarHBondContact CD2-NE2 3.37Å; H6-Q8 VanDerWaalsContact NE2-CG 3.28Å; H6-Q8 WeakPolarHBondContact NE2-CG 3.29Å; H6-Q8 PolarHBondContact NE2-NE2 2.89Å; H6-W21 HydrophobicContact CB-CZ2 3.76Å; H6-W21 AromaticContact CD2-CE2 3.9Å; H6-W21 AromaticContact CD2-CZ2 3.98Å; H6-W21 AromaticContact CD2-NE1 3.3Å; H6-W21 PolarHBondContact CD2-NE1 2.88Å; H6-W21 VanDerWaalsContact CD2-NE1 3.3Å; H6-W21 AromaticContact CG-CZ2 3.98Å; H6-W21 AromaticContact NE2-NE1 3.71Å; H6-R62 PolarHBondContact N-O 2.64Å; H6-A63 CarbonylContact O-C 3.51Å; H6-A63 VanDerWaalsContact O-CA 3.28Å; H6-A63 WeakPolarHBondContact O-CA 3.42Å; H6-I64 PolarHBondContact O-N 2.95Å; H6-Q134 CarbonylContact C-O 3.57Å; H6-Q134 WeakPolarHBondContact CA-O 3.45Å; H6-Q134 PolarHBondContact ND1-O 2.79Å; H6-Q134 PolarHBondContact ND1-OE1 3.41Å
7	I	97.3	Very high	90.7	Very high	3 Å²	3	28.1 Å²	28.1	2%	0.015	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	136.1	-178.7	-53.8	174	0	0	0	107.9	V5 I64 V66 V120 F133 Q134 L135 T136 I155	V5-I7 HydrophobicContact CG1-CG1 4.28Å; I7-I64 WeakPolarHBondContact CA-O 3.44Å; I7-I64 HydrophobicContact CG1-CB 4.47Å; I7-I64 HydrophobicContact CG1-CD1 4.48Å; I7-V66 HydrophobicContact CG2-CG2 4.34Å; I7-V120 HydrophobicContact CD1-CG2 3.98Å; I7-F133 HydrophobicContact CD1-CD1 4.18Å; I7-Q134 PolarHBondContact N-O 2.8Å; I7-L135 HydrophobicContact CB-CD1 3.81Å; I7-L135 HydrophobicContact CG2-CD1 3.62Å; I7-L135 CarbonylContact O-C 3.58Å; I7-L135 VanDerWaalsContact O-CA 3.3Å; I7-L135 WeakPolarHBondContact O-CA 3.2Å; I7-T136 PolarHBondContact O-N 3.49Å; I7-I155 HydrophobicContact CD1-CD1 3.46Å; I7-I155 VanDerWaalsContact CD1-CD1 3.46Å
8	Q	95.9	Very high	90.8	Very high	0 Å²	0	27.5 Å²	27.5	0%	0	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	121.9	179	-51.6	-178.4	12.5	0	0	108.6	H6 N14 G17 I64 V66 T136	H6-Q8 PolarHBondContact CD2-NE2 3.37Å; H6-Q8 VanDerWaalsContact NE2-CG 3.28Å; H6-Q8 WeakPolarHBondContact NE2-CG 3.29Å; H6-Q8 PolarHBondContact NE2-NE2 2.89Å; Q8-N14 PolarHBondContact OE1-O 2.99Å; Q8-G17 VanDerWaalsContact CD-CA 3.43Å; Q8-G17 VanDerWaalsContact NE2-C 3.33Å; Q8-G17 VanDerWaalsContact NE2-CA 3.33Å; Q8-I64 PolarHBondContact N-O 2.85Å; Q8-V66 WeakPolarHBondContact O-CA 3.25Å; Q8-V66 WeakPolarHBondContact O-CB 3.48Å; Q8-V66 PolarHBondContact O-N 2.92Å; Q8-T136 WeakPolarHBondContact CG-OG1 3.3Å
9	A	95.3	Very high	90.9	Very high	0 Å²	0	29.5 Å²	29.5	0%	0	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120	127.5	-176.4	0	0	0	0	0	112.3	V66 L135 T136 H137 G144	A9-V66 WeakPolarHBondContact CA-O 3.18Å; A9-L135 HydrophobicContact CB-CD1 4.04Å; A9-T136 PolarHBondContact N-O 2.99Å; A9-H137 HydrophobicContact CB-CB 4.29Å; A9-G144 WeakPolarHBondContact O-CA 3.02Å
10	G	93.5	Very high	91.1	Very high	1 Å²	1	28.1 Å²	28.1	1%	0.01	13%	0.134	C	C	.	.	H	α-helix	trans	73.2	176.6	176.7	0	0	0	0	0	114.2	C12 G13 N14 V66	G10-C12 PolarHBondContact O-N 2.94Å; G10-G13 PolarHBondContact O-N 3.41Å; G10-N14 WeakPolarHBondContact O-CB 3.34Å; G10-N14 PolarHBondContact O-N 3.39Å; G10-N14 PolarHBondContact O-ND2 3.29Å; G10-V66 PolarHBondContact N-O 3.29Å
11	Q	91.6	Very high	91.3	Very high	113 Å²	113	26.7 Å²	26.7	53%	0.528	13%	0.128	S	C	.	.	H	α-helix	trans	-55.7	-50.8	-173.8	-173.1	-176.1	5.2	0	0	113.4	Q15 D67	Q11-Q15 VanDerWaalsContact O-CG 3.31Å; Q11-Q15 WeakPolarHBondContact O-CG 3.46Å; Q11-Q15 PolarHBondContact O-N 3.23Å; Q11-Q15 VanDerWaalsContact O-N 3.08Å; Q11-D67 PolarHBondContact N-OD2 2.86Å
12	C	91.3	Very high	93.1	Very high	30 Å²	30	21.2 Å²	21.2	20%	0.203	10%	0.1	C	C	.	.	H	α-helix	trans	-65.7	-45	-179.1	-178.6	0	0	0	0	111.8	G10 N14 Q15 I16	G10-C12 PolarHBondContact O-N 2.94Å; C12-N14 VanDerWaalsContact C-N 3.35Å; C12-N14 PolarHBondContact O-N 3.14Å; C12-Q15 PolarHBondContact O-N 3.13Å; C12-I16 PolarHBondContact O-N 2.78Å; C12-I16 VanDerWaalsContact SG-CD1 3.54Å
13	G	93.1	Very high	93.7	Very high	0 Å²	0	18 Å²	18	0%	0	9%	0.092	C	C	.	.	H	α-helix	trans	-59.1	-44	178.6	0	0	0	0	0	112.7	G10 G17 T136	G10-G13 PolarHBondContact O-N 3.41Å; G13-G17 WeakPolarHBondContact O-CA 3.34Å; G13-G17 PolarHBondContact O-N 3.42Å; G13-T136 VanDerWaalsContact CA-O 3.23Å; G13-T136 WeakPolarHBondContact CA-O 3.2Å; G13-T136 PolarHBondContact O-OG1 2.83Å; G13-T136 VanDerWaalsContact O-OG1 3.1Å
14	N	94.3	Very high	93.8	Very high	0 Å²	0	17.6 Å²	17.6	0%	0	9%	0.09	C	C	.	.	H	α-helix	trans	-69.1	-36.6	177.4	-76.7	-68.9	0	0	0	112.9	Q8 G10 C12 A18 V66 T72 V76	Q8-N14 PolarHBondContact OE1-O 2.99Å; G10-N14 WeakPolarHBondContact O-CB 3.34Å; G10-N14 PolarHBondContact O-N 3.39Å; G10-N14 PolarHBondContact O-ND2 3.29Å; C12-N14 VanDerWaalsContact C-N 3.35Å; C12-N14 PolarHBondContact O-N 3.14Å; N14-A18 WeakPolarHBondContact O-CB 3.46Å; N14-A18 PolarHBondContact O-N 3.14Å; N14-V66 PolarHBondContact ND2-O 2.65Å; N14-T72 HydrophobicContact CB-CG2 3.63Å; N14-V76 HydrophobicContact CB-CG2 4.07Å
15	Q	92.3	Very high	93.7	Very high	68 Å²	68	17.6 Å²	17.6	32%	0.318	9%	0.09	S	C	.	.	H	α-helix	trans	-67.8	-45.5	177.1	-74.4	178.5	20.8	0	0	112.5	Q11 C12 K19	Q11-Q15 VanDerWaalsContact O-CG 3.31Å; Q11-Q15 WeakPolarHBondContact O-CG 3.46Å; Q11-Q15 PolarHBondContact O-N 3.23Å; Q11-Q15 VanDerWaalsContact O-N 3.08Å; C12-Q15 PolarHBondContact O-N 3.13Å; Q15-K19 WeakPolarHBondContact O-CG 3.35Å; Q15-K19 PolarHBondContact O-N 2.91Å; Q15-K19 VanDerWaalsContact O-N 3.15Å
16	I	93.1	Very high	93.5	Very high	6 Å²	6	20.4 Å²	20.4	3%	0.031	11%	0.105	C	C	.	.	H	α-helix	trans	-67.5	-44.9	177.7	-71.4	167.8	0	0	0	110	C12 A18 K19 F20 V169 N226 V229 M233	C12-I16 PolarHBondContact O-N 2.78Å; C12-I16 VanDerWaalsContact SG-CD1 3.54Å; I16-A18 PolarHBondContact O-N 2.9Å; I16-K19 CarbonylContact O-C 3.4Å; I16-K19 PolarHBondContact O-N 2.75Å; I16-F20 WeakPolarHBondContact O-CB 3.46Å; I16-F20 PolarHBondContact O-N 3.24Å; I16-V169 HydrophobicContact CD1-CG2 3.39Å; I16-N226 WeakPolarHBondContact CG1-OD1 3.44Å; I16-V229 HydrophobicContact CB-CG1 4.48Å; I16-V229 HydrophobicContact CD1-CG1 4.19Å; I16-V229 HydrophobicContact CG1-CG1 4.29Å; I16-V229 HydrophobicContact CG2-CB 4.33Å; I16-V229 HydrophobicContact CG2-CG1 3.41Å; I16-V229 VanDerWaalsContact CG2-CG1 3.41Å; I16-M233 HydrophobicContact CG2-SD 3.48Å; I16-M233 WeakPolarHBondContact CG2-SD 3.26Å
17	G	93.8	Very high	93.1	Very high	0 Å²	0	21 Å²	21	0%	0	11%	0.107	C	C	.	.	H	α-helix	trans	-62.4	-42	178.1	0	0	0	0	0	112.4	Q8 G13 K19 F20 W21	Q8-G17 VanDerWaalsContact CD-CA 3.43Å; Q8-G17 VanDerWaalsContact NE2-C 3.33Å; Q8-G17 VanDerWaalsContact NE2-CA 3.33Å; G13-G17 WeakPolarHBondContact O-CA 3.34Å; G13-G17 PolarHBondContact O-N 3.42Å; G17-K19 VanDerWaalsContact C-N 3.35Å; G17-K19 PolarHBondContact O-N 3.09Å; G17-F20 WeakPolarHBondContact O-CB 3.36Å; G17-F20 PolarHBondContact O-N 3.42Å; G17-W21 PolarHBondContact O-N 2.92Å
18	A	93.1	Very high	92.8	Very high	17 Å²	17	21 Å²	21	14%	0.14	11%	0.107	C	C	.	.	H	α-helix	trans	-57.9	-46.6	172.1	0	0	0	0	0	111.5	N14 I16 F20 W21 E22 V76	N14-A18 WeakPolarHBondContact O-CB 3.46Å; N14-A18 PolarHBondContact O-N 3.14Å; I16-A18 PolarHBondContact O-N 2.9Å; A18-F20 VanDerWaalsContact C-N 3.34Å; A18-F20 PolarHBondContact O-N 3.31Å; A18-W21 PolarHBondContact O-N 3.41Å; A18-E22 WeakPolarHBondContact O-CG 3.26Å; A18-E22 PolarHBondContact O-N 3.04Å; A18-V76 HydrophobicContact CB-CG1 4.46Å
19	K	92.4	Very high	92.5	Very high	66 Å²	66	21.7 Å²	21.7	29%	0.287	12%	0.115	S	C	.	.	H	α-helix	trans	-65.1	-36	176.5	-72.9	-70.3	168.1	-138.3	0	113.2	Q15 I16 G17 E22 V23 N226	Q15-K19 WeakPolarHBondContact O-CG 3.35Å; Q15-K19 PolarHBondContact O-N 2.91Å; Q15-K19 VanDerWaalsContact O-N 3.15Å; I16-K19 CarbonylContact O-C 3.4Å; I16-K19 PolarHBondContact O-N 2.75Å; G17-K19 VanDerWaalsContact C-N 3.35Å; G17-K19 PolarHBondContact O-N 3.09Å; K19-E22 WeakPolarHBondContact CD-OE2 3.33Å; K19-E22 IonicContact NZ-OE1 3.55Å; K19-E22 PolarHBondContact NZ-OE1 2.59Å; K19-E22 IonicContact NZ-OE2 2.89Å; K19-E22 PolarHBondContact NZ-OE2 2.82Å; K19-E22 PolarHBondContact O-N 2.96Å; K19-V23 WeakPolarHBondContact O-CG2 3.46Å; K19-V23 PolarHBondContact O-N 3.02Å; K19-N226 HydrophobicContact CG-CB 4.16Å
20	F	94.4	Very high	92.4	Very high	0 Å²	0	21.9 Å²	21.9	0%	0	12%	0.116	C	C	.	.	H	α-helix	trans	-58.8	-51	172.6	169.1	-107.7	0	0	0	110.8	I16 G17 A18 E22 V23 I24 Y50 M233 T237	I16-F20 WeakPolarHBondContact O-CB 3.46Å; I16-F20 PolarHBondContact O-N 3.24Å; G17-F20 WeakPolarHBondContact O-CB 3.36Å; G17-F20 PolarHBondContact O-N 3.42Å; A18-F20 VanDerWaalsContact C-N 3.34Å; A18-F20 PolarHBondContact O-N 3.31Å; F20-E22 VanDerWaalsContact C-N 3.35Å; F20-E22 PolarHBondContact O-N 3.23Å; F20-V23 PolarHBondContact O-N 2.74Å; F20-V23 VanDerWaalsContact O-N 3.16Å; F20-I24 HydrophobicContact CD1-CD1 4.33Å; F20-I24 HydrophobicContact CD2-CG2 4.02Å; F20-I24 HydrophobicContact CE1-CD1 3.68Å; F20-I24 HydrophobicContact CE1-CG1 4.35Å; F20-I24 HydrophobicContact CE2-CD1 4.47Å; F20-I24 HydrophobicContact CE2-CG2 3.6Å; F20-I24 HydrophobicContact CZ-CD1 3.77Å; F20-I24 HydrophobicContact CZ-CG1 4.39Å; F20-I24 HydrophobicContact CZ-CG2 3.98Å; F20-I24 WeakPolarHBondContact O-CG1 3.44Å; F20-I24 PolarHBondContact O-N 2.77Å; F20-Y50 HydrophobicContact CE1-CD1 4.25Å; F20-Y50 AromaticContact CE1-CE1 3.94Å; F20-Y50 HydrophobicContact CE1-CE1 3.94Å; F20-Y50 HydrophobicContact CZ-CD1 4.38Å; F20-Y50 AromaticContact CZ-CE1 3.85Å; F20-Y50 HydrophobicContact CZ-CE1 3.85Å; F20-M233 HydrophobicContact CB-CE 3.79Å; F20-M233 HydrophobicContact CB-SD 4.05Å; F20-M233 HydrophobicContact CD1-CE 4.1Å; F20-M233 HydrophobicContact CD2-CB 3.56Å; F20-M233 HydrophobicContact CD2-CE 3.74Å; F20-M233 HydrophobicContact CD2-SD 4.31Å; F20-M233 HydrophobicContact CE2-CB 3.99Å; F20-M233 HydrophobicContact CE2-CE 4.31Å; F20-M233 HydrophobicContact CG-CB 4.47Å; F20-M233 HydrophobicContact CG-CE 3.6Å; F20-M233 HydrophobicContact CG-SD 4.34Å; F20-T237 HydrophobicContact CE2-CG2 4.27Å; F20-T237 HydrophobicContact CZ-CG2 4.31Å
21	W	94.9	Very high	92.2	Very high	0 Å²	0	23.4 Å²	23.4	0%	0	12%	0.123	C	C	.	.	H	α-helix	trans	-61.7	-38.5	177.6	-73.9	110.4	0	0	0	113.3	H6 G17 A18 I24 S25 Y50 Y51 P61 A63 F85	H6-W21 HydrophobicContact CB-CZ2 3.76Å; H6-W21 AromaticContact CD2-CE2 3.9Å; H6-W21 AromaticContact CD2-CZ2 3.98Å; H6-W21 AromaticContact CD2-NE1 3.3Å; H6-W21 PolarHBondContact CD2-NE1 2.88Å; H6-W21 VanDerWaalsContact CD2-NE1 3.3Å; H6-W21 AromaticContact CG-CZ2 3.98Å; H6-W21 AromaticContact NE2-NE1 3.71Å; G17-W21 PolarHBondContact O-N 2.92Å; A18-W21 PolarHBondContact O-N 3.41Å; W21-I24 HydrophobicContact CD2-CD1 4.23Å; W21-I24 HydrophobicContact CE3-CD1 3.49Å; W21-I24 VanDerWaalsContact CE3-CD1 3.49Å; W21-I24 HydrophobicContact CE3-CG1 3.98Å; W21-I24 HydrophobicContact CH2-CD1 4.32Å; W21-I24 HydrophobicContact CZ3-CD1 3.55Å; W21-I24 HydrophobicContact CZ3-CG1 4.49Å; W21-S25 WeakPolarHBondContact O-CB 3.46Å; W21-S25 PolarHBondContact O-N 3.23Å; W21-S25 PolarHBondContact O-OG 2.76Å; W21-Y50 AromaticContact CH2-CD1 3.75Å; W21-Y50 HydrophobicContact CH2-CD1 3.75Å; W21-Y50 HydrophobicContact CH2-CG 4.25Å; W21-Y50 VanDerWaalsContact CH2-O 3.3Å; W21-Y50 WeakPolarHBondContact CH2-O 3.4Å; W21-Y50 HydrophobicContact CZ2-CD1 4.31Å; W21-Y50 HydrophobicContact CZ3-CD1 4.36Å; W21-Y51 HydrophobicContact CE3-CE1 4.09Å; W21-Y51 AromaticContact CE3-CZ 3.91Å; W21-Y51 HydrophobicContact CZ3-CD1 4.4Å; W21-Y51 AromaticContact CZ3-CE1 3.89Å; W21-Y51 HydrophobicContact CZ3-CE1 3.89Å; W21-Y51 HydrophobicContact CZ3-CE2 4.14Å; W21-Y51 AromaticContact CZ3-CZ 3.75Å; W21-P61 HydrophobicContact CD2-CB 3.92Å; W21-P61 HydrophobicContact CD2-CG 4.28Å; W21-P61 HydrophobicContact CE3-CB 3.68Å; W21-P61 HydrophobicContact CE3-CG 3.87Å; W21-P61 HydrophobicContact CH2-CB 3.72Å; W21-P61 HydrophobicContact CZ2-CB 3.94Å; W21-P61 HydrophobicContact CZ3-CB 3.57Å; W21-P61 HydrophobicContact CZ3-CG 4.09Å; W21-A63 HydrophobicContact CZ2-CB 3.68Å; W21-F85 HydrophobicContact CB-CE1 4.33Å; W21-F85 HydrophobicContact CB-CZ 3.9Å; W21-F85 AromaticContact CD1-CE1 3.44Å; W21-F85 VanDerWaalsContact CD1-CE1 3.44Å; W21-F85 AromaticContact CD1-CZ 3.51Å; W21-F85 HydrophobicContact CD2-CE1 4.24Å; W21-F85 AromaticContact CG-CE1 3.76Å; W21-F85 HydrophobicContact CG-CE1 3.76Å; W21-F85 AromaticContact CG-CZ 3.77Å; W21-F85 HydrophobicContact CG-CZ 3.77Å; W21-F85 AromaticContact NE1-CE1 3.78Å
22	E	92.3	Very high	92.1	Very high	33 Å²	33	19.9 Å²	19.9	15%	0.154	11%	0.114	C	C	.	.	H	α-helix	trans	-57.1	-50.5	172.3	-69	178.9	-160	0	0	111	A18 K19 F20 S25 D26 P80 F81	A18-E22 WeakPolarHBondContact O-CG 3.26Å; A18-E22 PolarHBondContact O-N 3.04Å; K19-E22 WeakPolarHBondContact CD-OE2 3.33Å; K19-E22 IonicContact NZ-OE1 3.55Å; K19-E22 PolarHBondContact NZ-OE1 2.59Å; K19-E22 IonicContact NZ-OE2 2.89Å; K19-E22 PolarHBondContact NZ-OE2 2.82Å; K19-E22 PolarHBondContact O-N 2.96Å; F20-E22 VanDerWaalsContact C-N 3.35Å; F20-E22 PolarHBondContact O-N 3.23Å; E22-S25 PolarHBondContact O-N 3.41Å; E22-D26 WeakPolarHBondContact O-CB 3.43Å; E22-D26 PolarHBondContact O-N 3.01Å; E22-P80 WeakPolarHBondContact OE1-CD 3.28Å; E22-F81 HydrophobicContact CB-CD2 4.24Å; E22-F81 HydrophobicContact CB-CE2 4.49Å; E22-F81 HydrophobicContact CG-CB 4.38Å; E22-F81 HydrophobicContact CG-CD2 3.72Å; E22-F81 HydrophobicContact CG-CE2 4.4Å; E22-F81 HydrophobicContact CG-CG 4.35Å
23	V	91.8	Very high	91.9	Very high	32 Å²	32	22.6 Å²	22.6	19%	0.194	13%	0.13	C	C	.	.	H	α-helix	trans	-65.5	-45.4	-177.1	171.3	0	0	0	0	111.7	K19 F20 D26 E27	K19-V23 WeakPolarHBondContact O-CG2 3.46Å; K19-V23 PolarHBondContact O-N 3.02Å; F20-V23 PolarHBondContact O-N 2.74Å; F20-V23 VanDerWaalsContact O-N 3.16Å; V23-D26 PolarHBondContact O-N 2.77Å; V23-E27 WeakPolarHBondContact O-CG 3.36Å; V23-E27 PolarHBondContact O-N 3.28Å
24	I	92.9	Very high	91.6	Very high	0 Å²	0	22.6 Å²	22.6	0%	0	13%	0.13	C	C	.	.	H	α-helix	trans	-74.4	-31.6	-179.5	64.6	159.3	0	0	0	112.1	F20 W21 D26 E27 H28 Y50 Y51	F20-I24 HydrophobicContact CD1-CD1 4.33Å; F20-I24 HydrophobicContact CD2-CG2 4.02Å; F20-I24 HydrophobicContact CE1-CD1 3.68Å; F20-I24 HydrophobicContact CE1-CG1 4.35Å; F20-I24 HydrophobicContact CE2-CD1 4.47Å; F20-I24 HydrophobicContact CE2-CG2 3.6Å; F20-I24 HydrophobicContact CZ-CD1 3.77Å; F20-I24 HydrophobicContact CZ-CG1 4.39Å; F20-I24 HydrophobicContact CZ-CG2 3.98Å; F20-I24 WeakPolarHBondContact O-CG1 3.44Å; F20-I24 PolarHBondContact O-N 2.77Å; W21-I24 HydrophobicContact CD2-CD1 4.23Å; W21-I24 HydrophobicContact CE3-CD1 3.49Å; W21-I24 VanDerWaalsContact CE3-CD1 3.49Å; W21-I24 HydrophobicContact CE3-CG1 3.98Å; W21-I24 HydrophobicContact CH2-CD1 4.32Å; W21-I24 HydrophobicContact CZ3-CD1 3.55Å; W21-I24 HydrophobicContact CZ3-CG1 4.49Å; I24-D26 VanDerWaalsContact C-N 3.35Å; I24-E27 PolarHBondContact O-N 3.24Å; I24-H28 WeakPolarHBondContact O-CB 3.47Å; I24-H28 PolarHBondContact O-CD2 2.99Å; I24-H28 PolarHBondContact O-N 2.98Å; I24-Y50 HydrophobicContact CD1-CD1 4.32Å; I24-Y50 HydrophobicContact CD1-CG 4.18Å; I24-Y51 HydrophobicContact CD1-CE2 4.28Å
25	S	92.5	Very high	91.4	Very high	0 Å²	0	24.5 Å²	24.5	0%	0	14%	0.143	C	C	.	.	H	α-helix	trans	-61.6	-46.5	172.5	-61.6	0	0	0	0	110.3	W21 E22 E27 H28 G29 I30 Y51 F81	W21-S25 WeakPolarHBondContact O-CB 3.46Å; W21-S25 PolarHBondContact O-N 3.23Å; W21-S25 PolarHBondContact O-OG 2.76Å; E22-S25 PolarHBondContact O-N 3.41Å; S25-E27 VanDerWaalsContact C-N 3.33Å; S25-E27 PolarHBondContact O-N 2.87Å; S25-H28 CarbonylContact O-C 3.58Å; S25-H28 PolarHBondContact O-N 3.42Å; S25-G29 PolarHBondContact O-N 2.84Å; S25-I30 PolarHBondContact O-N 3.37Å; S25-Y51 VanDerWaalsContact CA-OH 3.3Å; S25-Y51 WeakPolarHBondContact CA-OH 2.94Å; S25-Y51 PolarHBondContact N-OH 3.05Å; S25-Y51 PolarHBondContact OG-OH 3.31Å; S25-F81 VanDerWaalsContact CB-CE1 3.46Å
26	D	90.4	Very high	91.4	Very high	60 Å²	60	24.1 Å²	24.1	32%	0.321	14%	0.139	S	C	.	.	H	α-helix	trans	-59.7	-41.6	175.3	-79.7	-20.2	0	0	0	112.3	E22 V23 I24 H28 G29 R359	E22-D26 WeakPolarHBondContact O-CB 3.43Å; E22-D26 PolarHBondContact O-N 3.01Å; V23-D26 PolarHBondContact O-N 2.77Å; I24-D26 VanDerWaalsContact C-N 3.35Å; D26-H28 VanDerWaalsContact C-N 3.34Å; D26-G29 PolarHBondContact O-N 3.2Å; D26-R359 IonicContact OD1-NH1 3.36Å; D26-R359 PolarHBondContact OD1-NH1 3.42Å; D26-R359 IonicContact OD2-CZ 2.86Å; D26-R359 IonicContact OD2-NH1 2.82Å; D26-R359 PolarHBondContact OD2-NH1 2.94Å
27	E	90.1	Very high	91.1	Very high	12 Å²	12	30.8 Å²	30.8	6%	0.056	17%	0.17	C	C	.	.	H	α-helix	trans	-67.4	-33.7	178.3	-75.7	-174.5	-171	0	0	113.2	V23 I24 S25 G29 Q43 S234 R241 F242 R318	V23-E27 WeakPolarHBondContact O-CG 3.36Å; V23-E27 PolarHBondContact O-N 3.28Å; I24-E27 PolarHBondContact O-N 3.24Å; S25-E27 VanDerWaalsContact C-N 3.33Å; S25-E27 PolarHBondContact O-N 2.87Å; E27-G29 VanDerWaalsContact C-N 3.34Å; E27-Q43 PolarHBondContact O-NE2 3.23Å; E27-S234 VanDerWaalsContact CD-OG 3.23Å; E27-S234 PolarHBondContact OE1-OG 3.07Å; E27-S234 PolarHBondContact OE2-OG 3.31Å; E27-R241 IonicContact OE2-CZ 3.53Å; E27-R241 VanDerWaalsContact OE2-CZ 3.24Å; E27-R241 IonicContact OE2-NH1 3.48Å; E27-R241 PolarHBondContact OE2-NH1 3.09Å; E27-R241 IonicContact OE2-NH2 3.8Å; E27-R241 PolarHBondContact OE2-NH2 3.08Å; E27-F242 HydrophobicContact CB-CZ 4.21Å; E27-R318 VanDerWaalsContact CD-NH2 3.26Å; E27-R318 IonicContact OE1-CZ 2.64Å; E27-R318 IonicContact OE1-NH1 2.83Å; E27-R318 PolarHBondContact OE1-NH1 3.42Å; E27-R318 IonicContact OE1-NH2 3.24Å; E27-R318 PolarHBondContact OE1-NH2 2.98Å; E27-R318 IonicContact OE2-CZ 3.76Å; E27-R318 IonicContact OE2-NH1 2.74Å; E27-R318 PolarHBondContact OE2-NH1 2.75Å; E27-R318 IonicContact OE2-NH2 3.46Å; E27-R318 PolarHBondContact OE2-NH2 3.43Å
28	H	90.5	Very high	90.6	Very high	2 Å²	2	31.9 Å²	31.9	1%	0.009	18%	0.181	C	C	.	.	T	Hydrogen-bonded Turn	trans	-88.5	1.1	175.9	-74	-77.4	0	0	0	113.3	I24 S25 D26 I30 Y36 Q43 I47 R241 F242	I24-H28 WeakPolarHBondContact O-CB 3.47Å; I24-H28 PolarHBondContact O-CD2 2.99Å; I24-H28 PolarHBondContact O-N 2.98Å; S25-H28 CarbonylContact O-C 3.58Å; S25-H28 PolarHBondContact O-N 3.42Å; D26-H28 VanDerWaalsContact C-N 3.34Å; H28-I30 VanDerWaalsContact C-N 3.29Å; H28-I30 HydrophobicContact CB-CD1 4.26Å; H28-I30 HydrophobicContact CB-CG1 4.36Å; H28-I30 PolarHBondContact O-N 3.39Å; H28-Y36 VanDerWaalsContact O-CD2 3.32Å; H28-Y36 WeakPolarHBondContact O-CD2 3.43Å; H28-Y36 WeakPolarHBondContact O-CE2 3.29Å; H28-Q43 PolarHBondContact ND1-O 2.78Å; H28-I47 HydrophobicContact CB-CD1 3.96Å; H28-R241 PolarHBondContact NE2-NH1 3.19Å; H28-F242 AromaticContact CE1-CE1 3.64Å; H28-F242 AromaticContact CE1-CZ 3.9Å; H28-F242 AromaticContact ND1-CE1 3.98Å
29	G	90.1	Very high	90.2	Very high	15 Å²	15	38.3 Å²	38.3	16%	0.155	21%	0.213	C	C	.	.	T	Hydrogen-bonded Turn	trans	66.2	27.6	-179.7	0	0	0	0	0	114	S25 D26 E27 Q37 G38	S25-G29 PolarHBondContact O-N 2.84Å; D26-G29 PolarHBondContact O-N 3.2Å; E27-G29 VanDerWaalsContact C-N 3.34Å; G29-Q37 PolarHBondContact O-N 3.22Å; G29-G38 PolarHBondContact O-N 3.29Å
30	I	91.8	Very high	89.8	Confident	4 Å²	4	37 Å²	37	2%	0.021	21%	0.213	C	C	.	.	B	Isolated β-bridge	trans	-88.8	128.8	175.4	-64	168.2	0	0	0	109.2	S25 H28 I47 Y51 F59 F81 L84	S25-I30 PolarHBondContact O-N 3.37Å; H28-I30 VanDerWaalsContact C-N 3.29Å; H28-I30 HydrophobicContact CB-CD1 4.26Å; H28-I30 HydrophobicContact CB-CG1 4.36Å; H28-I30 PolarHBondContact O-N 3.39Å; I30-I47 HydrophobicContact CD1-CD1 3.65Å; I30-I47 HydrophobicContact CD1-CG1 4.19Å; I30-I47 HydrophobicContact CG1-CD1 4.13Å; I30-Y51 HydrophobicContact CD1-CD1 3.66Å; I30-Y51 HydrophobicContact CD1-CD2 3.87Å; I30-Y51 HydrophobicContact CD1-CE1 3.47Å; I30-Y51 VanDerWaalsContact CD1-CE1 3.47Å; I30-Y51 HydrophobicContact CD1-CE2 3.69Å; I30-Y51 HydrophobicContact CD1-CG 3.86Å; I30-Y51 VanDerWaalsContact CD1-CZ 3.49Å; I30-F59 HydrophobicContact CD1-CB 3.66Å; I30-F59 HydrophobicContact CD1-CD2 4.44Å; I30-F59 HydrophobicContact CD1-CG 4.16Å; I30-F59 HydrophobicContact CG1-CB 4.29Å; I30-F59 HydrophobicContact CG1-CD2 4.39Å; I30-F81 WeakPolarHBondContact O-CE1 3.49Å; I30-L84 HydrophobicContact CG2-CD1 4.45Å; I30-L84 HydrophobicContact CG2-CD2 4.44Å
31	D	90.8	Very high	89.4	Confident	33 Å²	33	43.8 Å²	43.8	18%	0.176	25%	0.249	C	C	.	.			trans	-82.3	172.1	173.8	72.5	20.6	0	0	0	112.9	T33 G34 S35 Q37	D31-T33 VanDerWaalsContact CG-OG1 3.27Å; D31-T33 PolarHBondContact O-N 3.26Å; D31-T33 VanDerWaalsContact OD1-CA 3.26Å; D31-T33 WeakPolarHBondContact OD1-CA 3.3Å; D31-T33 WeakPolarHBondContact OD1-CB 3.37Å; D31-T33 PolarHBondContact OD1-N 2.71Å; D31-T33 PolarHBondContact OD1-OG1 2.93Å; D31-T33 PolarHBondContact OD2-OG1 3.41Å; D31-G34 PolarHBondContact O-N 3.32Å; D31-G34 PolarHBondContact OD1-N 2.88Å; D31-S35 PolarHBondContact N-O 3.28Å; D31-S35 PolarHBondContact OD1-N 3.04Å; D31-Q37 PolarHBondContact OD2-NE2 3.44Å
32	A	88.1	Confident	88.9	Confident	40 Å²	40	47 Å²	47	33%	0.331	27%	0.266	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.5	-12.2	178.6	0	0	0	0	0	114.4	P80 F81	A32-P80 WeakPolarHBondContact CB-O 3.36Å; A32-F81 HydrophobicContact CB-CD1 4.37Å
33	T	86.9	Confident	88.6	Confident	86 Å²	86	46.4 Å²	46.4	53%	0.528	26%	0.263	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.6	-5	175.9	77.1	0	0	0	0	113.1	D31 S35	D31-T33 VanDerWaalsContact CG-OG1 3.27Å; D31-T33 PolarHBondContact O-N 3.26Å; D31-T33 VanDerWaalsContact OD1-CA 3.26Å; D31-T33 WeakPolarHBondContact OD1-CA 3.3Å; D31-T33 WeakPolarHBondContact OD1-CB 3.37Å; D31-T33 PolarHBondContact OD1-N 2.71Å; D31-T33 PolarHBondContact OD1-OG1 2.93Å; D31-T33 PolarHBondContact OD2-OG1 3.41Å; T33-S35 PolarHBondContact OG1-OG 2.94Å
34	G	87.3	Confident	88.4	Confident	1 Å²	1	47.6 Å²	47.6	1%	0.01	27%	0.268	C	S	.	.	S	Bend	trans	84.7	7.9	-175.6	0	0	0	0	0	113.9	D31 K58 F59	D31-G34 PolarHBondContact O-N 3.32Å; D31-G34 PolarHBondContact OD1-N 2.88Å; G34-K58 CarbonylContact O-C 3.52Å; G34-K58 VanDerWaalsContact O-CA 3.32Å; G34-K58 WeakPolarHBondContact O-CA 3.25Å; G34-F59 PolarHBondContact O-N 3.48Å
35	S	90.3	Very high	88.1	Confident	39 Å²	39	53 Å²	53	27%	0.273	29%	0.294	S	S	.	.	B	Isolated β-bridge	trans	-88.1	138.8	-179.4	-50.1	0	0	0	0	110.2	D31 T33 Q37	D31-S35 PolarHBondContact N-O 3.28Å; D31-S35 PolarHBondContact OD1-N 3.04Å; T33-S35 PolarHBondContact OG1-OG 2.94Å; S35-Q37 PolarHBondContact O-N 3.26Å
36	Y	91.6	Very high	87.8	Confident	60 Å²	60	55.5 Å²	55.5	24%	0.235	30%	0.303	C	S	.	.	B	Isolated β-bridge	trans	-77.1	122.3	175.2	177.1	-102.2	0	0	0	110.9	H28 G38 S40 Q43 L44	H28-Y36 VanDerWaalsContact O-CD2 3.32Å; H28-Y36 WeakPolarHBondContact O-CD2 3.43Å; H28-Y36 WeakPolarHBondContact O-CE2 3.29Å; Y36-G38 VanDerWaalsContact OH-C 3.28Å; Y36-G38 WeakPolarHBondContact OH-CA 3.47Å; Y36-S40 PolarHBondContact OH-N 3.5Å; Y36-S40 PolarHBondContact OH-O 3.29Å; Y36-Q43 HydrophobicContact CE2-CB 4.02Å; Y36-Q43 PolarHBondContact OH-OE1 3.11Å; Y36-L44 HydrophobicContact CD1-CD1 3.97Å; Y36-L44 HydrophobicContact CD1-CD2 4.33Å; Y36-L44 HydrophobicContact CD1-CG 4.42Å; Y36-L44 HydrophobicContact CD2-CD1 4.48Å; Y36-L44 HydrophobicContact CD2-CD2 3.54Å; Y36-L44 HydrophobicContact CD2-CG 4.06Å; Y36-L44 HydrophobicContact CE1-CD1 3.75Å; Y36-L44 HydrophobicContact CE1-CG 4.15Å; Y36-L44 HydrophobicContact CE2-CD1 4.28Å; Y36-L44 HydrophobicContact CE2-CD2 3.74Å; Y36-L44 HydrophobicContact CE2-CG 3.76Å; Y36-L44 HydrophobicContact CG-CD1 4.33Å; Y36-L44 HydrophobicContact CG-CD2 3.85Å; Y36-L44 HydrophobicContact CG-CG 4.37Å
37	Q	87.9	Confident	87.8	Confident	146 Å²	146	53.2 Å²	53.2	68%	0.682	29%	0.291	S	S	*	.			trans	-123	20.1	173.7	-57.3	-170.2	14.1	0	0	111.7	G29 D31 S35	G29-Q37 PolarHBondContact O-N 3.22Å; D31-Q37 PolarHBondContact OD2-NE2 3.44Å; S35-Q37 PolarHBondContact O-N 3.26Å
38	G	83.3	Confident	87.8	Confident	23 Å²	23	55 Å²	55	24%	0.237	30%	0.301	C	S	.	.			trans	-72.4	168.9	179.8	0	0	0	0	0	113.5	G29 Y36	G29-G38 PolarHBondContact O-N 3.29Å; Y36-G38 VanDerWaalsContact OH-C 3.28Å; Y36-G38 WeakPolarHBondContact OH-CA 3.47Å
39	D	84.3	Confident	87.8	Confident	152 Å²	152	55.1 Å²	55.1	81%	0.813	30%	0.301	S	S	*	.	S	Bend	trans	-114.6	-3.9	-173.7	59.8	-25.8	0	0	0	113.3
40	S	84.4	Confident	88	Confident	40 Å²	40	54.6 Å²	54.6	28%	0.28	30%	0.295	S	S	.	.			trans	-134.7	126.5	-172.8	179.3	0	0	0	0	112.6	Y36 L42 Q43	Y36-S40 PolarHBondContact OH-N 3.5Å; Y36-S40 PolarHBondContact OH-O 3.29Å; S40-L42 PolarHBondContact O-N 3.11Å; S40-L42 VanDerWaalsContact O-N 3.14Å; S40-Q43 VanDerWaalsContact O-CB 3.29Å; S40-Q43 WeakPolarHBondContact O-CB 3.26Å; S40-Q43 PolarHBondContact O-N 2.84Å; S40-Q43 PolarHBondContact O-OE1 2.89Å
41	D	84.7	Confident	88.1	Confident	142 Å²	142	54.6 Å²	54.6	76%	0.759	29%	0.294	S	S	*	.	G	3₁₀ helix	trans	-58.4	-28.7	177.8	-62.5	-26.3	0	0	0	112.9	Q43 L44 E45	D41-Q43 PolarHBondContact O-N 3.1Å; D41-Q43 VanDerWaalsContact O-N 3.17Å; D41-L44 PolarHBondContact O-N 2.87Å; D41-E45 PolarHBondContact O-N 2.86Å
42	L	85.1	Confident	88.2	Confident	68 Å²	68	54 Å²	54	36%	0.356	29%	0.291	S	S	.	.	G	3₁₀ helix	trans	-63.3	-21.1	177.5	-62.8	175	0	0	0	112.8	S40 L44 P243 I356	S40-L42 PolarHBondContact O-N 3.11Å; S40-L42 VanDerWaalsContact O-N 3.14Å; L42-L44 VanDerWaalsContact C-N 3.32Å; L42-P243 HydrophobicContact CD2-CG 3.89Å; L42-I356 HydrophobicContact CB-CD1 3.68Å; L42-I356 HydrophobicContact CD1-CD1 4.17Å; L42-I356 HydrophobicContact CD1-CG1 4.47Å
43	Q	86.8	Confident	88.2	Confident	19 Å²	19	58.9 Å²	58.9	9%	0.089	31%	0.307	C	S	.	.	G	3₁₀ helix	trans	-71	-29.6	175	-68	166.3	-29.5	0	0	111.9	E27 H28 Y36 S40 D41	E27-Q43 PolarHBondContact O-NE2 3.23Å; H28-Q43 PolarHBondContact ND1-O 2.78Å; Y36-Q43 HydrophobicContact CE2-CB 4.02Å; Y36-Q43 PolarHBondContact OH-OE1 3.11Å; S40-Q43 VanDerWaalsContact O-CB 3.29Å; S40-Q43 WeakPolarHBondContact O-CB 3.26Å; S40-Q43 PolarHBondContact O-N 2.84Å; S40-Q43 PolarHBondContact O-OE1 2.89Å; D41-Q43 PolarHBondContact O-N 3.1Å; D41-Q43 VanDerWaalsContact O-N 3.17Å
44	L	87.7	Confident	88.1	Confident	58 Å²	58	56.5 Å²	56.5	30%	0.304	30%	0.296	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.3	-23.3	-178.6	-68.3	177.4	0	0	0	112.9	Y36 D41 L42 R46 I47 F59	Y36-L44 HydrophobicContact CD1-CD1 3.97Å; Y36-L44 HydrophobicContact CD1-CD2 4.33Å; Y36-L44 HydrophobicContact CD1-CG 4.42Å; Y36-L44 HydrophobicContact CD2-CD1 4.48Å; Y36-L44 HydrophobicContact CD2-CD2 3.54Å; Y36-L44 HydrophobicContact CD2-CG 4.06Å; Y36-L44 HydrophobicContact CE1-CD1 3.75Å; Y36-L44 HydrophobicContact CE1-CG 4.15Å; Y36-L44 HydrophobicContact CE2-CD1 4.28Å; Y36-L44 HydrophobicContact CE2-CD2 3.74Å; Y36-L44 HydrophobicContact CE2-CG 3.76Å; Y36-L44 HydrophobicContact CG-CD1 4.33Å; Y36-L44 HydrophobicContact CG-CD2 3.85Å; Y36-L44 HydrophobicContact CG-CG 4.37Å; D41-L44 PolarHBondContact O-N 2.87Å; L42-L44 VanDerWaalsContact C-N 3.32Å; L44-R46 VanDerWaalsContact C-N 3.27Å; L44-R46 PolarHBondContact O-N 3.3Å; L44-R46 VanDerWaalsContact O-N 3.13Å; L44-I47 HydrophobicContact CD2-CD1 3.76Å; L44-I47 HydrophobicContact CD2-CG2 4.45Å; L44-I47 WeakPolarHBondContact O-CG2 3.42Å; L44-I47 PolarHBondContact O-N 3.25Å; L44-F59 HydrophobicContact CD2-CE2 3.99Å; L44-F59 HydrophobicContact CD2-CZ 3.87Å
45	E	86.1	Confident	87.7	Confident	114 Å²	114	62 Å²	62	53%	0.533	34%	0.335	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.5	-35.9	-170.2	-168.7	175.7	155.6	0	0	114.5	D41 P243	D41-E45 PolarHBondContact O-N 2.86Å; E45-P243 WeakPolarHBondContact OE2-CG 3.44Å
46	R	86.8	Confident	87	Confident	52 Å²	52	63.4 Å²	63.4	20%	0.196	36%	0.355	C	S	.	.	T	Hydrogen-bonded Turn	trans	-126.8	28.4	178.2	-68.1	-170.8	-179.5	-179.4	1.8	113.1	L44 N48 V49 C239 L240 R241 N247	L44-R46 VanDerWaalsContact C-N 3.27Å; L44-R46 PolarHBondContact O-N 3.3Å; L44-R46 VanDerWaalsContact O-N 3.13Å; R46-N48 PolarHBondContact O-N 3.08Å; R46-V49 HydrophobicContact CB-CG2 4.1Å; R46-V49 WeakPolarHBondContact O-CB 3.27Å; R46-V49 VanDerWaalsContact O-CG2 3.29Å; R46-V49 WeakPolarHBondContact O-CG2 3.44Å; R46-V49 PolarHBondContact O-N 3.17Å; R46-C239 PolarHBondContact NH1-O 3.01Å; R46-L240 WeakPolarHBondContact CD-O 3.48Å; R46-R241 WeakPolarHBondContact CB-O 3.29Å; R46-N247 PolarHBondContact NH2-OD1 3.38Å
47	I	89.8	Confident	86.6	Confident	12 Å²	12	64.3 Å²	64.3	6%	0.062	37%	0.37	C	S	.	.	G	3₁₀ helix	trans	-65.5	-28.3	-179.1	-155.9	151.3	0	0	0	112.3	H28 I30 L44 V49 Y50 Y51 F59	H28-I47 HydrophobicContact CB-CD1 3.96Å; I30-I47 HydrophobicContact CD1-CD1 3.65Å; I30-I47 HydrophobicContact CD1-CG1 4.19Å; I30-I47 HydrophobicContact CG1-CD1 4.13Å; L44-I47 HydrophobicContact CD2-CD1 3.76Å; L44-I47 HydrophobicContact CD2-CG2 4.45Å; L44-I47 WeakPolarHBondContact O-CG2 3.42Å; L44-I47 PolarHBondContact O-N 3.25Å; I47-V49 PolarHBondContact O-N 3.31Å; I47-V49 VanDerWaalsContact O-N 3.11Å; I47-Y50 PolarHBondContact O-N 3.13Å; I47-Y51 HydrophobicContact CG1-CD2 3.67Å; I47-Y51 HydrophobicContact CG1-CE2 4.41Å; I47-Y51 HydrophobicContact CG1-CG 4.2Å; I47-Y51 WeakPolarHBondContact O-CB 3.41Å; I47-Y51 PolarHBondContact O-N 2.84Å; I47-F59 HydrophobicContact CD1-CD1 4.31Å; I47-F59 HydrophobicContact CD1-CD2 4.46Å; I47-F59 HydrophobicContact CD1-CE1 4.43Å; I47-F59 HydrophobicContact CD1-CG 4.32Å; I47-F59 HydrophobicContact CG1-CD1 4.26Å; I47-F59 HydrophobicContact CG1-CE1 4.5Å; I47-F59 HydrophobicContact CG2-CD1 4.01Å; I47-F59 HydrophobicContact CG2-CE1 3.54Å; I47-F59 HydrophobicContact CG2-CZ 4.2Å
48	N	90.2	Very high	86.6	Confident	50 Å²	50	62 Å²	62	27%	0.267	36%	0.358	S	S	.	.	G	3₁₀ helix	trans	-62.4	-14.5	176.9	64.6	-36.7	0	0	0	114.6	E3 R46 Y50 Y51	E3-N48 WeakPolarHBondContact CG-O 3.3Å; R46-N48 PolarHBondContact O-N 3.08Å; N48-Y50 VanDerWaalsContact C-N 3.32Å; N48-Y50 PolarHBondContact O-N 3.23Å; N48-Y51 WeakPolarHBondContact CA-O 3.29Å
49	V	91.1	Very high	87.1	Confident	4 Å²	4	61.6 Å²	61.6	2%	0.024	35%	0.35	C	S	.	.	G	3₁₀ helix	trans	-62.4	-42.6	176.4	177.3	0	0	0	0	110.8	R2 I4 R46 I47 L240	R2-V49 WeakPolarHBondContact O-CG2 3.44Å; I4-V49 HydrophobicContact CD1-CG1 3.7Å; I4-V49 HydrophobicContact CG1-CG1 4.03Å; I4-V49 PolarHBondContact N-O 2.8Å; R46-V49 HydrophobicContact CB-CG2 4.1Å; R46-V49 WeakPolarHBondContact O-CB 3.27Å; R46-V49 VanDerWaalsContact O-CG2 3.29Å; R46-V49 WeakPolarHBondContact O-CG2 3.44Å; R46-V49 PolarHBondContact O-N 3.17Å; I47-V49 PolarHBondContact O-N 3.31Å; I47-V49 VanDerWaalsContact O-N 3.11Å; V49-L240 HydrophobicContact CG1-CB 4.38Å
50	Y	93.8	Very high	87.5	Confident	3 Å²	3	55.6 Å²	55.6	1%	0.012	32%	0.318	C	S	.	.	T	Hydrogen-bonded Turn	trans	-115.5	-20.8	-176.8	-80.2	-83.3	0	0	0	113.8	I4 F20 W21 I24 I47 N48 R62 Q134 T237 R241	I4-Y50 HydrophobicContact CB-CE1 4.44Å; I4-Y50 HydrophobicContact CD1-CE2 4.19Å; I4-Y50 HydrophobicContact CG2-CE1 4.27Å; F20-Y50 HydrophobicContact CE1-CD1 4.25Å; F20-Y50 AromaticContact CE1-CE1 3.94Å; F20-Y50 HydrophobicContact CE1-CE1 3.94Å; F20-Y50 HydrophobicContact CZ-CD1 4.38Å; F20-Y50 AromaticContact CZ-CE1 3.85Å; F20-Y50 HydrophobicContact CZ-CE1 3.85Å; W21-Y50 AromaticContact CH2-CD1 3.75Å; W21-Y50 HydrophobicContact CH2-CD1 3.75Å; W21-Y50 HydrophobicContact CH2-CG 4.25Å; W21-Y50 VanDerWaalsContact CH2-O 3.3Å; W21-Y50 WeakPolarHBondContact CH2-O 3.4Å; W21-Y50 HydrophobicContact CZ2-CD1 4.31Å; W21-Y50 HydrophobicContact CZ3-CD1 4.36Å; I24-Y50 HydrophobicContact CD1-CD1 4.32Å; I24-Y50 HydrophobicContact CD1-CG 4.18Å; I47-Y50 PolarHBondContact O-N 3.13Å; N48-Y50 VanDerWaalsContact C-N 3.32Å; N48-Y50 PolarHBondContact O-N 3.23Å; Y50-R62 WeakPolarHBondContact O-CB 3.38Å; Y50-R62 PolarHBondContact O-N 2.97Å; Y50-Q134 VanDerWaalsContact CE1-OE1 3.29Å; Y50-Q134 PolarHBondContact OH-OE1 2.72Å; Y50-T237 WeakPolarHBondContact OH-CG2 3.44Å; Y50-R241 HydrophobicContact CD2-CG 3.57Å; Y50-R241 HydrophobicContact CE2-CG 3.57Å
51	Y	94.1	Very high	88	Confident	4 Å²	4	53.7 Å²	53.7	2%	0.016	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	139.9	-176.6	-63	-91.1	0	0	0	111.8	W21 I24 S25 I30 I47 N48 F59 V60 P61 L84	W21-Y51 HydrophobicContact CE3-CE1 4.09Å; W21-Y51 AromaticContact CE3-CZ 3.91Å; W21-Y51 HydrophobicContact CZ3-CD1 4.4Å; W21-Y51 AromaticContact CZ3-CE1 3.89Å; W21-Y51 HydrophobicContact CZ3-CE1 3.89Å; W21-Y51 HydrophobicContact CZ3-CE2 4.14Å; W21-Y51 AromaticContact CZ3-CZ 3.75Å; I24-Y51 HydrophobicContact CD1-CE2 4.28Å; S25-Y51 VanDerWaalsContact CA-OH 3.3Å; S25-Y51 WeakPolarHBondContact CA-OH 2.94Å; S25-Y51 PolarHBondContact N-OH 3.05Å; S25-Y51 PolarHBondContact OG-OH 3.31Å; I30-Y51 HydrophobicContact CD1-CD1 3.66Å; I30-Y51 HydrophobicContact CD1-CD2 3.87Å; I30-Y51 HydrophobicContact CD1-CE1 3.47Å; I30-Y51 VanDerWaalsContact CD1-CE1 3.47Å; I30-Y51 HydrophobicContact CD1-CE2 3.69Å; I30-Y51 HydrophobicContact CD1-CG 3.86Å; I30-Y51 VanDerWaalsContact CD1-CZ 3.49Å; I47-Y51 HydrophobicContact CG1-CD2 3.67Å; I47-Y51 HydrophobicContact CG1-CE2 4.41Å; I47-Y51 HydrophobicContact CG1-CG 4.2Å; I47-Y51 WeakPolarHBondContact O-CB 3.41Å; I47-Y51 PolarHBondContact O-N 2.84Å; N48-Y51 WeakPolarHBondContact CA-O 3.29Å; Y51-F59 HydrophobicContact CD1-CB 3.96Å; Y51-F59 HydrophobicContact CG-CB 4.15Å; Y51-V60 CarbonylContact C-O 3.53Å; Y51-V60 WeakPolarHBondContact CA-O 2.87Å; Y51-P61 HydrophobicContact CD1-CG 4.22Å; Y51-P61 HydrophobicContact CE1-CG 3.89Å; Y51-L84 HydrophobicContact CE1-CD2 4.37Å
52	N	91.6	Very high	88.4	Confident	20 Å²	20	47.1 Å²	47.1	11%	0.107	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86	130.5	165.3	-70.1	-34.5	0	0	0	109.3	A54 F59 V60 R62 E123	N52-A54 PolarHBondContact O-N 2.92Å; N52-F59 WeakPolarHBondContact O-CA 3.35Å; N52-V60 PolarHBondContact N-O 3.04Å; N52-V60 PolarHBondContact O-N 3.11Å; N52-R62 PolarHBondContact OD1-NE 3.46Å; N52-R62 PolarHBondContact OD1-NH2 3.01Å; N52-E123 PolarHBondContact ND2-OE2 2.7Å
53	E	88.7	Confident	88.9	Confident	144 Å²	144	44 Å²	44	67%	0.673	25%	0.253	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-81.5	108.6	171.6	-169.8	175.8	-177.8	0	0	109.4	F59	E53-F59 HydrophobicContact CB-CD1 4.45Å; E53-F59 HydrophobicContact CB-CE1 4.17Å; E53-F59 HydrophobicContact CG-CE1 4.07Å
54	A	84.9	Confident	89.4	Confident	35 Å²	35	43 Å²	43	29%	0.289	25%	0.249	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.2	165.8	175.6	0	0	0	0	0	111.4	N52 G56 S57 K58 V60	N52-A54 PolarHBondContact O-N 2.92Å; A54-G56 PolarHBondContact O-N 2.88Å; A54-S57 PolarHBondContact O-N 3.27Å; A54-K58 HydrophobicContact CB-CB 4.45Å; A54-K58 WeakPolarHBondContact CB-O 3.46Å; A54-K58 PolarHBondContact N-O 2.99Å; A54-V60 HydrophobicContact CB-CG2 4.13Å
55	S	78.7	Confident	89.8	Confident	117 Å²	117	40.3 Å²	40.3	82%	0.818	24%	0.235	S	C	*	.	T	Hydrogen-bonded Turn	trans	-54	130.8	177.1	57.9	0	0	0	0	112
56	G	76.4	Confident	90.2	Very high	68 Å²	68	34.9 Å²	34.9	70%	0.701	21%	0.209	S	C	*	.	T	Hydrogen-bonded Turn	trans	90.4	27.2	179.8	0	0	0	0	0	114.7	A54 K58	A54-G56 PolarHBondContact O-N 2.88Å; G56-K58 PolarHBondContact O-N 3.11Å
57	S	81.6	Confident	90.6	Very high	80 Å²	80	32.5 Å²	32.5	56%	0.559	20%	0.2	S	C	*	.	T	Hydrogen-bonded Turn	trans	56.7	36.8	179.2	-56.6	0	0	0	0	112.8	A54	A54-S57 PolarHBondContact O-N 3.27Å
58	K	89.3	Confident	90.7	Very high	98 Å²	98	32 Å²	32	43%	0.426	20%	0.198	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-100	130.3	175.5	-71.2	-169.7	175.2	-167	0	109.8	G34 A54 G56	G34-K58 CarbonylContact O-C 3.52Å; G34-K58 VanDerWaalsContact O-CA 3.32Å; G34-K58 WeakPolarHBondContact O-CA 3.25Å; A54-K58 HydrophobicContact CB-CB 4.45Å; A54-K58 WeakPolarHBondContact CB-O 3.46Å; A54-K58 PolarHBondContact N-O 2.99Å; G56-K58 PolarHBondContact O-N 3.11Å
59	F	92.3	Very high	90.5	Very high	14 Å²	14	33.4 Å²	33.4	6%	0.061	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.2	122.2	177.2	-65	-76	0	0	0	109.6	I30 G34 L44 I47 Y51 N52 E53 L84	I30-F59 HydrophobicContact CD1-CB 3.66Å; I30-F59 HydrophobicContact CD1-CD2 4.44Å; I30-F59 HydrophobicContact CD1-CG 4.16Å; I30-F59 HydrophobicContact CG1-CB 4.29Å; I30-F59 HydrophobicContact CG1-CD2 4.39Å; G34-F59 PolarHBondContact O-N 3.48Å; L44-F59 HydrophobicContact CD2-CE2 3.99Å; L44-F59 HydrophobicContact CD2-CZ 3.87Å; I47-F59 HydrophobicContact CD1-CD1 4.31Å; I47-F59 HydrophobicContact CD1-CD2 4.46Å; I47-F59 HydrophobicContact CD1-CE1 4.43Å; I47-F59 HydrophobicContact CD1-CG 4.32Å; I47-F59 HydrophobicContact CG1-CD1 4.26Å; I47-F59 HydrophobicContact CG1-CE1 4.5Å; I47-F59 HydrophobicContact CG2-CD1 4.01Å; I47-F59 HydrophobicContact CG2-CE1 3.54Å; I47-F59 HydrophobicContact CG2-CZ 4.2Å; Y51-F59 HydrophobicContact CD1-CB 3.96Å; Y51-F59 HydrophobicContact CG-CB 4.15Å; N52-F59 WeakPolarHBondContact O-CA 3.35Å; E53-F59 HydrophobicContact CB-CD1 4.45Å; E53-F59 HydrophobicContact CB-CE1 4.17Å; E53-F59 HydrophobicContact CG-CE1 4.07Å; F59-L84 WeakPolarHBondContact O-CD1 3.23Å
60	V	93	Very high	90.3	Very high	25 Å²	25	35.9 Å²	35.9	15%	0.152	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	126	179.6	-179.4	0	0	0	0	108.9	Y51 N52 A54 R62 R86	Y51-V60 CarbonylContact C-O 3.53Å; Y51-V60 WeakPolarHBondContact CA-O 2.87Å; N52-V60 PolarHBondContact N-O 3.04Å; N52-V60 PolarHBondContact O-N 3.11Å; A54-V60 HydrophobicContact CB-CG2 4.13Å; V60-R62 PolarHBondContact O-N 3.48Å; V60-R86 HydrophobicContact CG1-CB 4.19Å
61	P	94.6	Very high	90	Very high	1 Å²	1	37.7 Å²	37.7	1%	0.006	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-52	132	175.1	-30.7	36.2	0	0	0	112.5	W21 Y51 A63 L84 F85	W21-P61 HydrophobicContact CD2-CB 3.92Å; W21-P61 HydrophobicContact CD2-CG 4.28Å; W21-P61 HydrophobicContact CE3-CB 3.68Å; W21-P61 HydrophobicContact CE3-CG 3.87Å; W21-P61 HydrophobicContact CH2-CB 3.72Å; W21-P61 HydrophobicContact CZ2-CB 3.94Å; W21-P61 HydrophobicContact CZ3-CB 3.57Å; W21-P61 HydrophobicContact CZ3-CG 4.09Å; Y51-P61 HydrophobicContact CD1-CG 4.22Å; Y51-P61 HydrophobicContact CE1-CG 3.89Å; P61-A63 HydrophobicContact CB-CB 4.06Å; P61-A63 PolarHBondContact O-N 3.2Å; P61-L84 VanDerWaalsContact CD-CG 3.43Å; P61-L84 WeakPolarHBondContact CD-O 3.41Å; P61-L84 HydrophobicContact CG-CD2 3.58Å; P61-L84 HydrophobicContact CG-CG 3.68Å; P61-F85 HydrophobicContact CB-CD1 4.02Å; P61-F85 HydrophobicContact CB-CE1 4.04Å; P61-F85 HydrophobicContact CG-CD1 4.2Å; P61-F85 HydrophobicContact CG-CE1 4.2Å
62	R	94.9	Very high	89.5	Confident	4 Å²	4	38 Å²	38	2%	0.015	24%	0.241	C	C	.	.			trans	-79.6	62.6	167.8	-166.8	-176.9	-71.8	-91.2	18.5	109.4	I4 V5 H6 Y50 N52 V60 E123 N126 C127	I4-R62 WeakPolarHBondContact O-CD 3.37Å; V5-R62 HydrophobicContact CG2-CG 4.07Å; H6-R62 PolarHBondContact N-O 2.64Å; Y50-R62 WeakPolarHBondContact O-CB 3.38Å; Y50-R62 PolarHBondContact O-N 2.97Å; N52-R62 PolarHBondContact OD1-NE 3.46Å; N52-R62 PolarHBondContact OD1-NH2 3.01Å; V60-R62 PolarHBondContact O-N 3.48Å; R62-E123 HydrophobicContact CG-CB 4.46Å; R62-E123 PolarHBondContact NH1-O 3.42Å; R62-E123 IonicContact NH1-OE2 3.94Å; R62-N126 PolarHBondContact NH2-O 3.41Å; R62-N126 VanDerWaalsContact NH2-O 3.14Å; R62-C127 PolarHBondContact NH1-SG 2.94Å
63	A	95.5	Very high	89.2	Confident	1 Å²	1	37.3 Å²	37.3	1%	0.008	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	143	-175.7	0	0	0	0	0	111.2	H6 W21 P61 L65 F85 N89	H6-A63 CarbonylContact O-C 3.51Å; H6-A63 VanDerWaalsContact O-CA 3.28Å; H6-A63 WeakPolarHBondContact O-CA 3.42Å; W21-A63 HydrophobicContact CZ2-CB 3.68Å; P61-A63 HydrophobicContact CB-CB 4.06Å; P61-A63 PolarHBondContact O-N 3.2Å; A63-L65 HydrophobicContact CB-CD1 4.33Å; A63-F85 HydrophobicContact CB-CD1 3.9Å; A63-F85 HydrophobicContact CB-CE1 3.84Å; A63-N89 VanDerWaalsContact O-CB 3.27Å; A63-N89 WeakPolarHBondContact O-CB 3.14Å; A63-N89 PolarHBondContact O-ND2 2.93Å
64	I	96.5	Very high	89.1	Confident	0 Å²	0	35.8 Å²	35.8	0%	0	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	122.4	173.5	-55.3	173.2	0	0	0	107.2	V5 H6 I7 Q8 V66 V116 V119 V120 E123	V5-I64 HydrophobicContact CG1-CD1 3.84Å; V5-I64 HydrophobicContact CG1-CG1 4.47Å; H6-I64 PolarHBondContact O-N 2.95Å; I7-I64 WeakPolarHBondContact CA-O 3.44Å; I7-I64 HydrophobicContact CG1-CB 4.47Å; I7-I64 HydrophobicContact CG1-CD1 4.48Å; Q8-I64 PolarHBondContact N-O 2.85Å; I64-V66 HydrophobicContact CG2-CG2 3.99Å; I64-V116 HydrophobicContact CG2-CG1 4.21Å; I64-V119 HydrophobicContact CD1-CB 4.47Å; I64-V119 HydrophobicContact CD1-CG1 3.95Å; I64-V119 HydrophobicContact CG1-CG1 3.91Å; I64-V119 HydrophobicContact CG2-CG1 4.15Å; I64-V120 HydrophobicContact CD1-CB 4.1Å; I64-V120 HydrophobicContact CD1-CG2 3.46Å; I64-V120 VanDerWaalsContact CD1-CG2 3.46Å; I64-E123 HydrophobicContact CD1-CG 4.36Å; I64-E123 HydrophobicContact CG1-CG 4.47Å
65	L	96	Very high	89.2	Confident	0 Å²	0	37.8 Å²	37.8	0%	0	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	120.7	-175.8	-65.1	90.8	0	0	0	108.6	A63 M73 V76 F85 N89 F90 V91	A63-L65 HydrophobicContact CB-CD1 4.33Å; L65-M73 HydrophobicContact CB-CE 4.34Å; L65-M73 HydrophobicContact CB-SD 4.09Å; L65-V76 HydrophobicContact CD2-CB 4.39Å; L65-V76 HydrophobicContact CD2-CG1 3.62Å; L65-V76 HydrophobicContact CD2-CG2 4.48Å; L65-F85 HydrophobicContact CD1-CB 4.27Å; L65-F85 HydrophobicContact CD1-CD1 3.83Å; L65-F85 HydrophobicContact CD1-CE1 4.37Å; L65-F85 HydrophobicContact CD1-CG 4.03Å; L65-N89 PolarHBondContact N-O 2.71Å; L65-F90 HydrophobicContact CB-CD1 4.26Å; L65-F90 HydrophobicContact CD1-CE1 4.43Å; L65-F90 HydrophobicContact CD1-CZ 4.43Å; L65-F90 HydrophobicContact CD2-CD1 4.45Å; L65-F90 HydrophobicContact CD2-CE1 3.92Å; L65-F90 HydrophobicContact CD2-CZ 4.43Å; L65-V91 PolarHBondContact O-N 3.2Å
66	V	95.3	Very high	89.7	Confident	0 Å²	0	32.7 Å²	32.7	0%	0	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	126.6	-172.8	-171.5	0	0	0	0	109.6	I7 Q8 A9 G10 N14 I64 V91 V116 M147 L151	I7-V66 HydrophobicContact CG2-CG2 4.34Å; Q8-V66 WeakPolarHBondContact O-CA 3.25Å; Q8-V66 WeakPolarHBondContact O-CB 3.48Å; Q8-V66 PolarHBondContact O-N 2.92Å; A9-V66 WeakPolarHBondContact CA-O 3.18Å; G10-V66 PolarHBondContact N-O 3.29Å; N14-V66 PolarHBondContact ND2-O 2.65Å; I64-V66 HydrophobicContact CG2-CG2 3.99Å; V66-V91 WeakPolarHBondContact CA-O 3.46Å; V66-V116 HydrophobicContact CB-CG2 4.44Å; V66-V116 HydrophobicContact CG1-CG2 3.72Å; V66-V116 HydrophobicContact CG2-CB 4.42Å; V66-V116 HydrophobicContact CG2-CG1 3.66Å; V66-V116 HydrophobicContact CG2-CG2 3.79Å; V66-M147 HydrophobicContact CG1-CE 3.47Å; V66-M147 VanDerWaalsContact CG1-CE 3.47Å; V66-M147 HydrophobicContact CG1-SD 3.66Å; V66-L151 HydrophobicContact CG1-CD1 4.48Å
67	D	94.9	Very high	90.2	Very high	2 Å²	2	34.4 Å²	34.4	1%	0.011	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.6	144.8	166.6	-155.2	-19.7	0	0	0	110.7	Q11 E69 T72 M73 V91 F92 G93	Q11-D67 PolarHBondContact N-OD2 2.86Å; D67-E69 PolarHBondContact O-N 3.31Å; D67-E69 PolarHBondContact OD1-N 3.04Å; D67-T72 WeakPolarHBondContact OD2-CB 3.13Å; D67-T72 WeakPolarHBondContact OD2-CG2 3.44Å; D67-T72 PolarHBondContact OD2-OG1 3.36Å; D67-M73 HydrophobicContact CB-CE 3.29Å; D67-V91 PolarHBondContact N-O 3.03Å; D67-F92 CarbonylContact O-C 3.57Å; D67-F92 WeakPolarHBondContact O-CA 3.4Å; D67-F92 WeakPolarHBondContact O-CB 3.33Å; D67-G93 PolarHBondContact O-N 3.1Å
68	L	91.4	Very high	90.6	Very high	1 Å²	1	35.5 Å²	35.5	1%	0.005	20%	0.202	C	C	.	.	S	Bend	trans	-76.4	-18.3	173.2	-69.4	171.4	0	0	0	110.9	G93 S95 A97 E108 L112 T143 M147	L68-G93 CarbonylContact O-C 3.57Å; L68-G93 WeakPolarHBondContact O-CA 3.24Å; L68-S95 CarbonylContact C-O 3.2Å; L68-S95 VanDerWaalsContact CB-O 3.31Å; L68-S95 WeakPolarHBondContact CB-O 3.45Å; L68-S95 CarbonylContact O-C 3.57Å; L68-S95 PolarHBondContact O-N 3.38Å; L68-A97 HydrophobicContact CD1-CB 3.98Å; L68-E108 HydrophobicContact CD1-CB 4.22Å; L68-E108 HydrophobicContact CD2-CB 4.24Å; L68-L112 HydrophobicContact CD2-CB 4.11Å; L68-L112 HydrophobicContact CD2-CD2 3.67Å; L68-T143 HydrophobicContact CB-CG2 4.06Å; L68-T143 HydrophobicContact CD1-CG2 3.93Å; L68-T143 HydrophobicContact CG-CG2 3.75Å; L68-M147 HydrophobicContact CD1-SD 4.43Å; L68-M147 HydrophobicContact CD2-SD 4.1Å; L68-M147 HydrophobicContact CG-SD 4.04Å
69	E	86.8	Confident	90.4	Very high	80 Å²	80	32 Å²	32	37%	0.374	19%	0.194	S	C	.	.	S	Bend	trans	-100.2	129.1	175.1	-65.8	-174.7	179	0	0	112.8	D67 G71 G96	D67-E69 PolarHBondContact O-N 3.31Å; D67-E69 PolarHBondContact OD1-N 3.04Å; E69-G71 VanDerWaalsContact C-N 3.32Å; E69-G71 PolarHBondContact O-N 3.46Å; E69-G96 VanDerWaalsContact CG-CA 3.45Å
70	P	86.2	Confident	90.2	Very high	57 Å²	57	35.5 Å²	35.5	37%	0.37	22%	0.218	S	C	.	.	H	α-helix	trans	-70.4	-27.2	-179.5	26.9	-33.8	0	0	0	113.1	T72 M73 F92	P70-T72 VanDerWaalsContact C-N 3.27Å; P70-T72 PolarHBondContact O-N 3.48Å; P70-M73 WeakPolarHBondContact O-CB 3.27Å; P70-M73 PolarHBondContact O-N 3.01Å; P70-M73 VanDerWaalsContact O-N 3.07Å; P70-F92 HydrophobicContact CB-CD2 4.1Å
71	G	86.7	Confident	90	Very high	41 Å²	41	35.5 Å²	35.5	42%	0.423	22%	0.217	S	C	.	.	H	α-helix	trans	-64.3	-27.7	-173.9	0	0	0	0	0	114.5	E69 M73 S75	E69-G71 VanDerWaalsContact C-N 3.32Å; E69-G71 PolarHBondContact O-N 3.46Å; G71-M73 VanDerWaalsContact C-N 3.3Å; G71-M73 PolarHBondContact O-N 3.16Å; G71-S75 PolarHBondContact O-N 2.89Å; G71-S75 PolarHBondContact O-OG 2.92Å; G71-S75 VanDerWaalsContact O-OG 3.11Å
72	T	84.8	Confident	89.6	Confident	10 Å²	10	35.6 Å²	35.6	6%	0.061	22%	0.218	C	C	.	.	H	α-helix	trans	-64.5	-37.4	175	-55.9	0	0	0	0	111.1	N14 D67 P70 S75 V76	N14-T72 HydrophobicContact CB-CG2 3.63Å; D67-T72 WeakPolarHBondContact OD2-CB 3.13Å; D67-T72 WeakPolarHBondContact OD2-CG2 3.44Å; D67-T72 PolarHBondContact OD2-OG1 3.36Å; P70-T72 VanDerWaalsContact C-N 3.27Å; P70-T72 PolarHBondContact O-N 3.48Å; T72-S75 WeakPolarHBondContact O-CB 3.36Å; T72-S75 PolarHBondContact O-N 3.23Å; T72-V76 WeakPolarHBondContact O-CG2 3.39Å; T72-V76 PolarHBondContact O-N 3.46Å
73	M	84.9	Confident	89.2	Confident	6 Å²	6	42.4 Å²	42.4	3%	0.03	25%	0.249	C	C	.	.	H	α-helix	trans	-69	-38.8	-176.7	-60.2	-58.6	145.9	0	0	112.3	L65 D67 P70 G71 S75 V76 R77 F90 F92	L65-M73 HydrophobicContact CB-CE 4.34Å; L65-M73 HydrophobicContact CB-SD 4.09Å; D67-M73 HydrophobicContact CB-CE 3.29Å; P70-M73 WeakPolarHBondContact O-CB 3.27Å; P70-M73 PolarHBondContact O-N 3.01Å; P70-M73 VanDerWaalsContact O-N 3.07Å; G71-M73 VanDerWaalsContact C-N 3.3Å; G71-M73 PolarHBondContact O-N 3.16Å; M73-S75 VanDerWaalsContact C-N 3.28Å; M73-S75 PolarHBondContact O-N 3.27Å; M73-V76 PolarHBondContact O-N 3.03Å; M73-R77 VanDerWaalsContact O-CB 3.32Å; M73-R77 WeakPolarHBondContact O-CB 3.45Å; M73-R77 PolarHBondContact O-N 3.26Å; M73-F90 HydrophobicContact CB-CD1 4.39Å; M73-F90 HydrophobicContact CG-CD1 4.43Å; M73-F90 HydrophobicContact SD-CD1 3.63Å; M73-F90 HydrophobicContact SD-CE1 4.27Å; M73-F92 HydrophobicContact CG-CB 3.93Å; M73-F92 HydrophobicContact CG-CD1 4.07Å; M73-F92 HydrophobicContact CG-CG 4.14Å
74	D	86.8	Confident	88.9	Confident	111 Å²	111	42.8 Å²	42.8	59%	0.594	25%	0.252	S	S	*	.	H	α-helix	trans	-62.2	-40.9	174	-71.6	-28.8	0	0	0	111	R77 S78	D74-R77 PolarHBondContact O-N 3.07Å; D74-S78 VanDerWaalsContact O-CB 3.3Å; D74-S78 WeakPolarHBondContact O-CB 3.3Å; D74-S78 PolarHBondContact O-N 3.48Å; D74-S78 PolarHBondContact O-OG 3.44Å
75	S	87.6	Confident	88.7	Confident	77 Å²	77	43.3 Å²	43.3	54%	0.538	25%	0.254	S	S	.	.	H	α-helix	trans	-62.8	-46.9	177.3	-58.9	0	0	0	0	111.2	G71 T72 M73 S78 G79	G71-S75 PolarHBondContact O-N 2.89Å; G71-S75 PolarHBondContact O-OG 2.92Å; G71-S75 VanDerWaalsContact O-OG 3.11Å; T72-S75 WeakPolarHBondContact O-CB 3.36Å; T72-S75 PolarHBondContact O-N 3.23Å; M73-S75 VanDerWaalsContact C-N 3.28Å; M73-S75 PolarHBondContact O-N 3.27Å; S75-S78 PolarHBondContact O-N 2.96Å; S75-S78 PolarHBondContact O-OG 2.96Å; S75-G79 PolarHBondContact O-N 2.74Å
76	V	88.3	Confident	88.4	Confident	11 Å²	11	46.3 Å²	46.3	7%	0.067	27%	0.265	C	S	.	.	H	α-helix	trans	-64.4	-43.9	177.4	177.2	0	0	0	0	111.5	N14 A18 L65 T72 M73 S78 G79 G82 F85	N14-V76 HydrophobicContact CB-CG2 4.07Å; A18-V76 HydrophobicContact CB-CG1 4.46Å; L65-V76 HydrophobicContact CD2-CB 4.39Å; L65-V76 HydrophobicContact CD2-CG1 3.62Å; L65-V76 HydrophobicContact CD2-CG2 4.48Å; T72-V76 WeakPolarHBondContact O-CG2 3.39Å; T72-V76 PolarHBondContact O-N 3.46Å; M73-V76 PolarHBondContact O-N 3.03Å; V76-S78 VanDerWaalsContact C-N 3.3Å; V76-S78 PolarHBondContact O-N 2.98Å; V76-G79 PolarHBondContact O-N 2.83Å; V76-G82 WeakPolarHBondContact O-CA 3.25Å; V76-F85 HydrophobicContact CG1-CD2 4.28Å; V76-F85 HydrophobicContact CG1-CE2 4.05Å
77	R	87.4	Confident	88.2	Confident	104 Å²	104	50.6 Å²	50.6	39%	0.392	29%	0.293	S	S	.	.	H	α-helix	trans	-66	-32.5	180	-170.1	-178.1	-63.9	-140.7	-2.4	112.8	M73 D74 Q83	M73-R77 VanDerWaalsContact O-CB 3.32Å; M73-R77 WeakPolarHBondContact O-CB 3.45Å; M73-R77 PolarHBondContact O-N 3.26Å; D74-R77 PolarHBondContact O-N 3.07Å; R77-Q83 PolarHBondContact O-NE2 2.62Å
78	S	88.5	Confident	88	Confident	102 Å²	102	55.4 Å²	55.4	71%	0.713	32%	0.318	S	S	*	.	H	α-helix	trans	-75.6	-13	173.6	76.6	0	0	0	0	113.6	D74 S75 V76	D74-S78 VanDerWaalsContact O-CB 3.3Å; D74-S78 WeakPolarHBondContact O-CB 3.3Å; D74-S78 PolarHBondContact O-N 3.48Å; D74-S78 PolarHBondContact O-OG 3.44Å; S75-S78 PolarHBondContact O-N 2.96Å; S75-S78 PolarHBondContact O-OG 2.96Å; V76-S78 VanDerWaalsContact C-N 3.3Å; V76-S78 PolarHBondContact O-N 2.98Å
79	G	86.9	Confident	88.1	Confident	25 Å²	25	55.4 Å²	55.4	26%	0.258	32%	0.318	S	S	.	.	S	Bend	trans	-67	165.9	178.1	0	0	0	0	0	113.3	S75 V76 F81 G82	S75-G79 PolarHBondContact O-N 2.74Å; V76-G79 PolarHBondContact O-N 2.83Å; G79-F81 VanDerWaalsContact C-N 3.27Å; G79-F81 PolarHBondContact O-N 3.13Å; G79-G82 PolarHBondContact O-N 3.03Å
80	P	87	Confident	88.4	Confident	88 Å²	88	52.4 Å²	52.4	57%	0.571	30%	0.304	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.3	-35.8	-173.4	-22.3	32.2	0	0	0	114.1	E22 A32	E22-P80 WeakPolarHBondContact OE1-CD 3.28Å; A32-P80 WeakPolarHBondContact CB-O 3.36Å
81	F	88.8	Confident	88.8	Confident	25 Å²	25	50.4 Å²	50.4	11%	0.11	29%	0.291	C	S	.	.	T	Hydrogen-bonded Turn	trans	-109.4	15.8	178.1	-75.6	-100.8	0	0	0	112.5	E22 S25 I30 A32 G79 Q83 L84	E22-F81 HydrophobicContact CB-CD2 4.24Å; E22-F81 HydrophobicContact CB-CE2 4.49Å; E22-F81 HydrophobicContact CG-CB 4.38Å; E22-F81 HydrophobicContact CG-CD2 3.72Å; E22-F81 HydrophobicContact CG-CE2 4.4Å; E22-F81 HydrophobicContact CG-CG 4.35Å; S25-F81 VanDerWaalsContact CB-CE1 3.46Å; I30-F81 WeakPolarHBondContact O-CE1 3.49Å; A32-F81 HydrophobicContact CB-CD1 4.37Å; G79-F81 VanDerWaalsContact C-N 3.27Å; G79-F81 PolarHBondContact O-N 3.13Å; F81-Q83 PolarHBondContact O-N 3.28Å; F81-L84 HydrophobicContact CD1-CD2 3.91Å; F81-L84 WeakPolarHBondContact O-CB 3.43Å; F81-L84 PolarHBondContact O-N 2.81Å
82	G	86.2	Confident	89	Confident	3 Å²	3	53.4 Å²	53.4	3%	0.031	29%	0.292	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62.1	-28.1	-176.5	0	0	0	0	0	114.3	V76 G79 L84	V76-G82 WeakPolarHBondContact O-CA 3.25Å; G79-G82 PolarHBondContact O-N 3.03Å; G82-L84 VanDerWaalsContact C-N 3.27Å; G82-L84 PolarHBondContact O-N 3.37Å
83	Q	87.2	Confident	89.3	Confident	146 Å²	146	53.5 Å²	53.5	68%	0.682	30%	0.296	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.7	-9.5	178.4	-57	-58.5	-42.5	0	0	113.5	R77 F81	R77-Q83 PolarHBondContact O-NE2 2.62Å; F81-Q83 PolarHBondContact O-N 3.28Å
84	L	89.4	Confident	89.3	Confident	10 Å²	10	62.4 Å²	62.4	5%	0.052	34%	0.337	C	S	.	.	T	Hydrogen-bonded Turn	trans	-77	-30.2	-179.2	-174.1	64	0	0	0	111.6	I30 Y51 F59 P61 F81 G82	I30-L84 HydrophobicContact CG2-CD1 4.45Å; I30-L84 HydrophobicContact CG2-CD2 4.44Å; Y51-L84 HydrophobicContact CE1-CD2 4.37Å; F59-L84 WeakPolarHBondContact O-CD1 3.23Å; P61-L84 VanDerWaalsContact CD-CG 3.43Å; P61-L84 WeakPolarHBondContact CD-O 3.41Å; P61-L84 HydrophobicContact CG-CD2 3.58Å; P61-L84 HydrophobicContact CG-CG 3.68Å; F81-L84 HydrophobicContact CD1-CD2 3.91Å; F81-L84 WeakPolarHBondContact O-CB 3.43Å; F81-L84 PolarHBondContact O-N 2.81Å; G82-L84 VanDerWaalsContact C-N 3.27Å; G82-L84 PolarHBondContact O-N 3.37Å
85	F	91.8	Very high	89.2	Confident	10 Å²	10	59.2 Å²	59.2	4%	0.044	32%	0.323	C	S	.	.	S	Bend	trans	-70.8	142.9	-179.7	-61.9	-69.9	0	0	0	112.2	W21 P61 A63 L65 V76 P87 F90	W21-F85 HydrophobicContact CB-CE1 4.33Å; W21-F85 HydrophobicContact CB-CZ 3.9Å; W21-F85 AromaticContact CD1-CE1 3.44Å; W21-F85 VanDerWaalsContact CD1-CE1 3.44Å; W21-F85 AromaticContact CD1-CZ 3.51Å; W21-F85 HydrophobicContact CD2-CE1 4.24Å; W21-F85 AromaticContact CG-CE1 3.76Å; W21-F85 HydrophobicContact CG-CE1 3.76Å; W21-F85 AromaticContact CG-CZ 3.77Å; W21-F85 HydrophobicContact CG-CZ 3.77Å; W21-F85 AromaticContact NE1-CE1 3.78Å; P61-F85 HydrophobicContact CB-CD1 4.02Å; P61-F85 HydrophobicContact CB-CE1 4.04Å; P61-F85 HydrophobicContact CG-CD1 4.2Å; P61-F85 HydrophobicContact CG-CE1 4.2Å; A63-F85 HydrophobicContact CB-CD1 3.9Å; A63-F85 HydrophobicContact CB-CE1 3.84Å; L65-F85 HydrophobicContact CD1-CB 4.27Å; L65-F85 HydrophobicContact CD1-CD1 3.83Å; L65-F85 HydrophobicContact CD1-CE1 4.37Å; L65-F85 HydrophobicContact CD1-CG 4.03Å; V76-F85 HydrophobicContact CG1-CD2 4.28Å; V76-F85 HydrophobicContact CG1-CE2 4.05Å; F85-P87 WeakPolarHBondContact O-CD 3.35Å; F85-F90 HydrophobicContact CB-CE2 3.6Å; F85-F90 HydrophobicContact CB-CZ 3.63Å; F85-F90 HydrophobicContact CD2-CZ 4.39Å; F85-F90 HydrophobicContact CG-CZ 4.31Å
86	R	90.6	Very high	89.1	Confident	64 Å²	64	56.7 Å²	56.7	24%	0.242	31%	0.31	C	S	.	.			trans	-66.8	125.3	175.8	-172.9	178.1	-73.5	163.9	-5.5	109.7	V60 D88 N89 F90 E123	V60-R86 HydrophobicContact CG1-CB 4.19Å; R86-D88 HydrophobicContact CG-CB 4.09Å; R86-D88 PolarHBondContact O-N 2.92Å; R86-N89 HydrophobicContact CB-CB 4.31Å; R86-N89 WeakPolarHBondContact CD-OD1 3.05Å; R86-N89 PolarHBondContact O-N 3.26Å; R86-F90 VanDerWaalsContact O-CD2 3.25Å; R86-F90 WeakPolarHBondContact O-CD2 3.42Å; R86-F90 WeakPolarHBondContact O-CE2 3.31Å; R86-E123 IonicContact CZ-OE1 3.75Å; R86-E123 IonicContact NH1-OE1 2.76Å; R86-E123 PolarHBondContact NH1-OE1 2.95Å
87	P	89.9	Confident	89	Confident	89 Å²	89	56.2 Å²	56.2	58%	0.578	31%	0.307	S	S	*	.	G	3₁₀ helix	trans	-56.8	-33.3	179.1	-28.4	36.6	0	0	0	114.1	F85 N89 F90	F85-P87 WeakPolarHBondContact O-CD 3.35Å; P87-N89 PolarHBondContact O-N 3.21Å; P87-F90 WeakPolarHBondContact O-CD2 3.47Å; P87-F90 PolarHBondContact O-N 2.99Å
88	D	90.9	Very high	89	Confident	103 Å²	103	53.8 Å²	53.8	55%	0.551	32%	0.315	S	S	*	.	G	3₁₀ helix	trans	-65.9	-20.5	177.3	-60.3	-2.9	0	0	0	113.4	R86 F90 K122	R86-D88 HydrophobicContact CG-CB 4.09Å; R86-D88 PolarHBondContact O-N 2.92Å; D88-F90 VanDerWaalsContact C-N 3.32Å; D88-K122 IonicContact OD2-NZ 3.2Å; D88-K122 PolarHBondContact OD2-NZ 2.82Å
89	N	93.4	Very high	89.1	Confident	1 Å²	1	52.1 Å²	52.1	1%	0.005	30%	0.298	C	S	.	.	G	3₁₀ helix	trans	-93.3	6.5	-175.9	-64.8	15.2	0	0	0	112.6	A63 L65 R86 P87 V119 E123	A63-N89 VanDerWaalsContact O-CB 3.27Å; A63-N89 WeakPolarHBondContact O-CB 3.14Å; A63-N89 PolarHBondContact O-ND2 2.93Å; L65-N89 PolarHBondContact N-O 2.71Å; R86-N89 HydrophobicContact CB-CB 4.31Å; R86-N89 WeakPolarHBondContact CD-OD1 3.05Å; R86-N89 PolarHBondContact O-N 3.26Å; P87-N89 PolarHBondContact O-N 3.21Å; N89-V119 HydrophobicContact CB-CG1 4.25Å; N89-E123 PolarHBondContact ND2-OE1 3.16Å
90	F	93.6	Very high	89.4	Confident	18 Å²	18	51.3 Å²	51.3	8%	0.079	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.3	107.3	171.3	-70.2	-99	0	0	0	108.8	L65 M73 F85 R86 P87 D88 F92	L65-F90 HydrophobicContact CB-CD1 4.26Å; L65-F90 HydrophobicContact CD1-CE1 4.43Å; L65-F90 HydrophobicContact CD1-CZ 4.43Å; L65-F90 HydrophobicContact CD2-CD1 4.45Å; L65-F90 HydrophobicContact CD2-CE1 3.92Å; L65-F90 HydrophobicContact CD2-CZ 4.43Å; M73-F90 HydrophobicContact CB-CD1 4.39Å; M73-F90 HydrophobicContact CG-CD1 4.43Å; M73-F90 HydrophobicContact SD-CD1 3.63Å; M73-F90 HydrophobicContact SD-CE1 4.27Å; F85-F90 HydrophobicContact CB-CE2 3.6Å; F85-F90 HydrophobicContact CB-CZ 3.63Å; F85-F90 HydrophobicContact CD2-CZ 4.39Å; F85-F90 HydrophobicContact CG-CZ 4.31Å; R86-F90 VanDerWaalsContact O-CD2 3.25Å; R86-F90 WeakPolarHBondContact O-CD2 3.42Å; R86-F90 WeakPolarHBondContact O-CE2 3.31Å; P87-F90 WeakPolarHBondContact O-CD2 3.47Å; P87-F90 PolarHBondContact O-N 2.99Å; D88-F90 VanDerWaalsContact C-N 3.32Å; F90-F92 HydrophobicContact CB-CD1 4.39Å
91	V	93.8	Very high	89.8	Confident	14 Å²	14	47.3 Å²	47.3	9%	0.085	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	113.5	176.9	-174.9	0	0	0	0	107.9	L65 V66 D67 L112 V116 V119	L65-V91 PolarHBondContact O-N 3.2Å; V66-V91 WeakPolarHBondContact CA-O 3.46Å; D67-V91 PolarHBondContact N-O 3.03Å; V91-L112 HydrophobicContact CG1-CD1 3.69Å; V91-L112 HydrophobicContact CG1-CD2 4.35Å; V91-L112 HydrophobicContact CG1-CG 3.96Å; V91-V116 HydrophobicContact CB-CG2 3.95Å; V91-V116 HydrophobicContact CG1-CG2 3.55Å; V91-V116 HydrophobicContact CG2-CG2 4.43Å; V91-V119 HydrophobicContact CG2-CG2 3.84Å
92	F	92.2	Very high	90.1	Very high	104 Å²	104	46.1 Å²	46.1	46%	0.456	26%	0.256	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.5	146.3	-177.3	59.5	-88.1	0	0	0	113.8	D67 P70 M73 F90	D67-F92 CarbonylContact O-C 3.57Å; D67-F92 WeakPolarHBondContact O-CA 3.4Å; D67-F92 WeakPolarHBondContact O-CB 3.33Å; P70-F92 HydrophobicContact CB-CD2 4.1Å; M73-F92 HydrophobicContact CG-CB 3.93Å; M73-F92 HydrophobicContact CG-CD1 4.07Å; M73-F92 HydrophobicContact CG-CG 4.14Å; F90-F92 HydrophobicContact CB-CD1 4.39Å
93	G	89.3	Confident	90.4	Very high	13 Å²	13	49 Å²	49	13%	0.134	27%	0.267	C	S	.	.			trans	-84.7	178.1	174.4	0	0	0	0	0	113	D67 L68	D67-G93 PolarHBondContact O-N 3.1Å; L68-G93 CarbonylContact O-C 3.57Å; L68-G93 WeakPolarHBondContact O-CA 3.24Å
94	Q	86.5	Confident	90.7	Very high	193 Å²	193	42.1 Å²	42.1	90%	0.902	24%	0.235	S	C	*	.	S	Bend	trans	-105.2	-14.9	170.3	-62.8	-168.5	-0.1	0	0	112.9
95	S	84.6	Confident	91	Very high	43 Å²	43	42.4 Å²	42.4	30%	0.301	24%	0.236	S	C	.	.	S	Bend	trans	-121.6	122.7	-171.9	-175.1	0	0	0	0	108.7	L68 E108	L68-S95 CarbonylContact C-O 3.2Å; L68-S95 VanDerWaalsContact CB-O 3.31Å; L68-S95 WeakPolarHBondContact CB-O 3.45Å; L68-S95 CarbonylContact O-C 3.57Å; L68-S95 PolarHBondContact O-N 3.38Å; S95-E108 VanDerWaalsContact CB-CD 3.45Å; S95-E108 VanDerWaalsContact CB-OE1 3.28Å; S95-E108 WeakPolarHBondContact CB-OE1 3.26Å; S95-E108 WeakPolarHBondContact CB-OE2 3.49Å; S95-E108 VanDerWaalsContact OG-CD 3.29Å; S95-E108 PolarHBondContact OG-OE1 3.2Å
96	G	85.3	Confident	91	Very high	25 Å²	25	46.5 Å²	46.5	26%	0.258	25%	0.252	S	S	.	.			trans	-78.8	151.4	179.1	0	0	0	0	0	112.9	E69 G98	E69-G96 VanDerWaalsContact CG-CA 3.45Å; G96-G98 PolarHBondContact O-N 3.23Å
97	A	85.8	Confident	91.1	Very high	1 Å²	1	45.4 Å²	45.4	1%	0.008	25%	0.252	C	S	.	.			trans	-70.6	-16.3	176.5	0	0	0	0	0	113.7	L68 N99 N100 K103	L68-A97 HydrophobicContact CD1-CB 3.98Å; A97-N99 VanDerWaalsContact C-N 3.35Å; A97-N99 PolarHBondContact O-N 3.21Å; A97-N100 WeakPolarHBondContact O-CB 2.91Å; A97-N100 PolarHBondContact O-N 3.37Å; A97-K103 HydrophobicContact CB-CB 4.4Å
98	G	87.6	Confident	91.1	Very high	53 Å²	53	43.9 Å²	43.9	55%	0.546	24%	0.238	S	C	.	.	T	Hydrogen-bonded Turn	trans	58.3	40	175.6	0	0	0	0	0	114.5	G96 N100	G96-G98 PolarHBondContact O-N 3.23Å; G98-N100 PolarHBondContact O-N 3.1Å
99	N	90.5	Very high	91	Very high	67 Å²	67	39 Å²	39	36%	0.358	21%	0.211	S	C	.	.	T	Hydrogen-bonded Turn	trans	58	26.9	-174.5	-63.3	-33.8	0	0	0	115	A97 T178 V180 N184	A97-N99 VanDerWaalsContact C-N 3.35Å; A97-N99 PolarHBondContact O-N 3.21Å; N99-T178 HydrophobicContact CB-CG2 4.07Å; N99-V180 HydrophobicContact CB-CG2 4.26Å; N99-V180 WeakPolarHBondContact O-CG2 3.19Å; N99-N184 PolarHBondContact O-ND2 2.76Å
100	N	93.3	Very high	91	Very high	8 Å²	8	40.7 Å²	40.7	4%	0.043	23%	0.225	C	C	.	.			trans	-109.3	114.9	174.6	-173.2	-19.1	0	0	0	110.4	A97 G98 A102 K103 G104 G142 W397 Y398	A97-N100 WeakPolarHBondContact O-CB 2.91Å; A97-N100 PolarHBondContact O-N 3.37Å; G98-N100 PolarHBondContact O-N 3.1Å; N100-A102 WeakPolarHBondContact OD1-CB 3.38Å; N100-A102 PolarHBondContact OD1-N 3.01Å; N100-K103 HydrophobicContact CB-CB 4.2Å; N100-K103 HydrophobicContact CB-CD 4.26Å; N100-K103 HydrophobicContact CB-CG 4.08Å; N100-K103 PolarHBondContact O-N 3.49Å; N100-G104 PolarHBondContact O-N 2.78Å; N100-G142 WeakPolarHBondContact O-CA 3.46Å; N100-W397 PolarHBondContact ND2-O 2.71Å; N100-Y398 WeakPolarHBondContact OD1-CD1 3.4Å
101	W	95.6	Very high	90.9	Very high	4 Å²	4	47.3 Å²	47.3	2%	0.015	26%	0.257	C	S	.	.	H	α-helix	trans	-61.2	-41.3	177	-177.5	98.8	0	0	0	112.5	K103 G104 H105 Y106 G146 N184 L187 S188 Q191 Y398 M403	W101-K103 VanDerWaalsContact C-N 3.27Å; W101-K103 PolarHBondContact O-N 3.09Å; W101-G104 CarbonylContact O-C 3.58Å; W101-G104 WeakPolarHBondContact O-CA 3.5Å; W101-G104 PolarHBondContact O-N 3.24Å; W101-H105 HydrophobicContact CD2-CB 4.13Å; W101-H105 HydrophobicContact CE3-CB 3.92Å; W101-H105 HydrophobicContact CH2-CB 3.74Å; W101-H105 AromaticContact CH2-CD2 3.49Å; W101-H105 VanDerWaalsContact CH2-CD2 3.49Å; W101-H105 WeakPolarHBondContact CH2-CD2 3.29Å; W101-H105 AromaticContact CH2-CE1 3.94Å; W101-H105 AromaticContact CH2-CG 3.33Å; W101-H105 AromaticContact CH2-ND1 3.64Å; W101-H105 AromaticContact CH2-NE2 3.89Å; W101-H105 HydrophobicContact CZ2-CB 3.96Å; W101-H105 AromaticContact CZ2-CE1 3.86Å; W101-H105 AromaticContact CZ2-CG 3.56Å; W101-H105 AromaticContact CZ2-ND1 3.41Å; W101-H105 WeakPolarHBondContact CZ2-ND1 3.43Å; W101-H105 HydrophobicContact CZ3-CB 3.72Å; W101-H105 AromaticContact CZ3-CG 3.82Å; W101-H105 WeakPolarHBondContact O-CB 3.36Å; W101-H105 PolarHBondContact O-N 3.37Å; W101-Y106 HydrophobicContact CH2-CE2 4.49Å; W101-Y106 HydrophobicContact CZ3-CD2 4.42Å; W101-Y106 AromaticContact CZ3-CE2 3.85Å; W101-Y106 HydrophobicContact CZ3-CE2 3.85Å; W101-G146 VanDerWaalsContact CD1-CA 3.41Å; W101-G146 VanDerWaalsContact CD1-N 3.3Å; W101-N184 HydrophobicContact CB-CB 4.13Å; W101-N184 WeakPolarHBondContact CB-OD1 3.01Å; W101-N184 PolarHBondContact N-OD1 3.38Å; W101-L187 HydrophobicContact CB-CD1 4.34Å; W101-L187 HydrophobicContact CD2-CB 3.83Å; W101-L187 HydrophobicContact CD2-CD1 3.9Å; W101-L187 HydrophobicContact CE3-CB 4.2Å; W101-L187 HydrophobicContact CE3-CD1 3.68Å; W101-L187 HydrophobicContact CE3-CG 4.49Å; W101-L187 HydrophobicContact CG-CB 4.19Å; W101-L187 HydrophobicContact CG-CD1 4.2Å; W101-L187 HydrophobicContact CZ2-CB 4.16Å; W101-L187 HydrophobicContact CZ3-CD1 4.3Å; W101-S188 VanDerWaalsContact CD1-OG 3.27Å; W101-S188 PolarHBondContact NE1-OG 3.4Å; W101-Q191 HydrophobicContact CZ2-CG 4.23Å; W101-Y398 HydrophobicContact CB-CE1 4.1Å; W101-M403 HydrophobicContact CE3-SD 4.34Å; W101-M403 HydrophobicContact CZ3-SD 4.26Å
102	A	94.6	Very high	90.9	Very high	0 Å²	0	47.7 Å²	47.7	0%	0	26%	0.258	C	S	.	.	H	α-helix	trans	-63.2	-34.6	-178.6	0	0	0	0	0	111.9	N100 H105 Y106 Y398 E401 M403	N100-A102 WeakPolarHBondContact OD1-CB 3.38Å; N100-A102 PolarHBondContact OD1-N 3.01Å; A102-H105 PolarHBondContact O-N 3.18Å; A102-Y106 HydrophobicContact CB-CD2 4.38Å; A102-Y106 WeakPolarHBondContact O-CB 3.37Å; A102-Y106 PolarHBondContact O-N 2.72Å; A102-Y398 HydrophobicContact CB-CD1 3.95Å; A102-E401 HydrophobicContact CB-CB 3.89Å; A102-E401 HydrophobicContact CB-CG 4.36Å; A102-M403 HydrophobicContact CB-CB 4.45Å; A102-M403 HydrophobicContact CB-SD 4.28Å
103	K	93.6	Very high	91	Very high	64 Å²	64	43.1 Å²	43.1	28%	0.278	24%	0.239	S	C	.	.	H	α-helix	trans	-63.6	-44.1	172.3	-75.4	-168.7	168.2	-166.1	0	113	A97 N100 W101 H105 T107 E108 G109 E401	A97-K103 HydrophobicContact CB-CB 4.4Å; N100-K103 HydrophobicContact CB-CB 4.2Å; N100-K103 HydrophobicContact CB-CD 4.26Å; N100-K103 HydrophobicContact CB-CG 4.08Å; N100-K103 PolarHBondContact O-N 3.49Å; W101-K103 VanDerWaalsContact C-N 3.27Å; W101-K103 PolarHBondContact O-N 3.09Å; K103-H105 VanDerWaalsContact C-N 3.29Å; K103-H105 PolarHBondContact O-N 2.81Å; K103-T107 VanDerWaalsContact CA-OG1 3.3Å; K103-T107 WeakPolarHBondContact CA-OG1 3.37Å; K103-T107 CarbonylContact O-C 3.57Å; K103-T107 PolarHBondContact O-N 2.89Å; K103-T107 PolarHBondContact O-OG1 3.26Å; K103-E108 PolarHBondContact O-N 3.34Å; K103-G109 PolarHBondContact O-N 2.97Å; K103-E401 VanDerWaalsContact CE-CD 3.44Å; K103-E401 WeakPolarHBondContact CE-OE1 3.47Å; K103-E401 VanDerWaalsContact CG-CD 3.46Å; K103-E401 HydrophobicContact CG-CG 3.72Å; K103-E401 WeakPolarHBondContact CG-OE2 3.46Å; K103-E401 IonicContact NZ-OE1 3.96Å
104	G	93.1	Very high	91.2	Very high	0 Å²	0	47.1 Å²	47.1	0%	0	26%	0.257	C	S	.	.	H	α-helix	trans	-67	-30.7	176.8	0	0	0	0	0	112.8	N100 W101 G109 G146 M147	N100-G104 PolarHBondContact O-N 2.78Å; W101-G104 CarbonylContact O-C 3.58Å; W101-G104 WeakPolarHBondContact O-CA 3.5Å; W101-G104 PolarHBondContact O-N 3.24Å; G104-G109 VanDerWaalsContact O-CA 3.23Å; G104-G109 WeakPolarHBondContact O-CA 3.31Å; G104-G146 CarbonylContact O-C 3.53Å; G104-M147 WeakPolarHBondContact O-CA 3.45Å; G104-M147 WeakPolarHBondContact O-CB 3.36Å; G104-M147 PolarHBondContact O-N 3.19Å
105	H	94.4	Very high	91.6	Very high	17 Å²	17	40.9 Å²	40.9	8%	0.079	24%	0.235	C	C	.	.	H	α-helix	trans	-94.9	-39.8	-173.2	-159.7	84.2	0	0	0	113.8	W101 A102 K103 G146 L150	W101-H105 HydrophobicContact CD2-CB 4.13Å; W101-H105 HydrophobicContact CE3-CB 3.92Å; W101-H105 HydrophobicContact CH2-CB 3.74Å; W101-H105 AromaticContact CH2-CD2 3.49Å; W101-H105 VanDerWaalsContact CH2-CD2 3.49Å; W101-H105 WeakPolarHBondContact CH2-CD2 3.29Å; W101-H105 AromaticContact CH2-CE1 3.94Å; W101-H105 AromaticContact CH2-CG 3.33Å; W101-H105 AromaticContact CH2-ND1 3.64Å; W101-H105 AromaticContact CH2-NE2 3.89Å; W101-H105 HydrophobicContact CZ2-CB 3.96Å; W101-H105 AromaticContact CZ2-CE1 3.86Å; W101-H105 AromaticContact CZ2-CG 3.56Å; W101-H105 AromaticContact CZ2-ND1 3.41Å; W101-H105 WeakPolarHBondContact CZ2-ND1 3.43Å; W101-H105 HydrophobicContact CZ3-CB 3.72Å; W101-H105 AromaticContact CZ3-CG 3.82Å; W101-H105 WeakPolarHBondContact O-CB 3.36Å; W101-H105 PolarHBondContact O-N 3.37Å; A102-H105 PolarHBondContact O-N 3.18Å; K103-H105 VanDerWaalsContact C-N 3.29Å; K103-H105 PolarHBondContact O-N 2.81Å; H105-G146 PolarHBondContact ND1-O 3.09Å; H105-L150 WeakPolarHBondContact O-CD2 3.44Å
106	Y	93	Very high	92.1	Very high	96 Å²	96	38.9 Å²	38.9	38%	0.376	22%	0.221	S	C	.	.	H	α-helix	trans	-111.8	-27.1	-170.6	-67	-60.6	0	0	0	114.9	W101 A102 M403 E407	W101-Y106 HydrophobicContact CH2-CE2 4.49Å; W101-Y106 HydrophobicContact CZ3-CD2 4.42Å; W101-Y106 AromaticContact CZ3-CE2 3.85Å; W101-Y106 HydrophobicContact CZ3-CE2 3.85Å; A102-Y106 HydrophobicContact CB-CD2 4.38Å; A102-Y106 WeakPolarHBondContact O-CB 3.37Å; A102-Y106 PolarHBondContact O-N 2.72Å; Y106-M403 HydrophobicContact CE2-CB 4.34Å; Y106-M403 HydrophobicContact CE2-CG 4.12Å; Y106-E407 PolarHBondContact OH-OE2 3.23Å
107	T	91.5	Very high	92.5	Very high	40 Å²	40	37.9 Å²	37.9	25%	0.245	21%	0.209	C	C	.	.	S	Bend	trans	-111.4	-95.8	-174.8	62.4	0	0	0	0	111.9	K103 G109 A110 E111 E401	K103-T107 VanDerWaalsContact CA-OG1 3.3Å; K103-T107 WeakPolarHBondContact CA-OG1 3.37Å; K103-T107 CarbonylContact O-C 3.57Å; K103-T107 PolarHBondContact O-N 2.89Å; K103-T107 PolarHBondContact O-OG1 3.26Å; T107-G109 VanDerWaalsContact C-N 3.34Å; T107-G109 PolarHBondContact O-N 2.91Å; T107-A110 PolarHBondContact O-N 2.87Å; T107-A110 VanDerWaalsContact O-N 3.13Å; T107-E111 PolarHBondContact O-N 3.41Å; T107-E401 HydrophobicContact CG2-CB 4.22Å; T107-E401 VanDerWaalsContact CG2-OE2 3.23Å; T107-E401 WeakPolarHBondContact CG2-OE2 3.39Å; T107-E401 PolarHBondContact OG1-OE2 2.71Å
108	E	90.5	Very high	93	Very high	58 Å²	58	42.3 Å²	42.3	27%	0.271	23%	0.233	S	C	.	.	H	α-helix	trans	-59.7	-41.1	-173.4	-62.3	-77.2	-173.8	0	0	112.8	L68 S95 K103 E111 L112	L68-E108 HydrophobicContact CD1-CB 4.22Å; L68-E108 HydrophobicContact CD2-CB 4.24Å; S95-E108 VanDerWaalsContact CB-CD 3.45Å; S95-E108 VanDerWaalsContact CB-OE1 3.28Å; S95-E108 WeakPolarHBondContact CB-OE1 3.26Å; S95-E108 WeakPolarHBondContact CB-OE2 3.49Å; S95-E108 VanDerWaalsContact OG-CD 3.29Å; S95-E108 PolarHBondContact OG-OE1 3.2Å; K103-E108 PolarHBondContact O-N 3.34Å; E108-E111 PolarHBondContact O-N 3.25Å; E108-L112 PolarHBondContact O-N 3.36Å
109	G	89.6	Confident	93.4	Very high	0 Å²	0	40.7 Å²	40.7	0%	0	21%	0.213	C	C	.	.	H	α-helix	trans	-73	-29	178.8	0	0	0	0	0	113.6	K103 G104 T107 E111 L112 V113	K103-G109 PolarHBondContact O-N 2.97Å; G104-G109 VanDerWaalsContact O-CA 3.23Å; G104-G109 WeakPolarHBondContact O-CA 3.31Å; T107-G109 VanDerWaalsContact C-N 3.34Å; T107-G109 PolarHBondContact O-N 2.91Å; G109-E111 VanDerWaalsContact C-N 3.33Å; G109-L112 PolarHBondContact O-N 2.83Å; G109-V113 WeakPolarHBondContact O-CB 3.24Å; G109-V113 PolarHBondContact O-N 2.84Å
110	A	91.9	Very high	93.6	Very high	36 Å²	36	37.5 Å²	37.5	30%	0.298	20%	0.195	S	C	.	.	H	α-helix	trans	-70.2	-30	175	0	0	0	0	0	112.2	T107 V113 L150	T107-A110 PolarHBondContact O-N 2.87Å; T107-A110 VanDerWaalsContact O-N 3.13Å; A110-V113 WeakPolarHBondContact O-CG1 3.5Å; A110-L150 HydrophobicContact CB-CD2 4.18Å
111	E	91.9	Very high	93.7	Very high	157 Å²	157	40.9 Å²	40.9	73%	0.734	21%	0.208	S	C	*	.	H	α-helix	trans	-72.1	-34	172.8	-65.1	-173.7	-179	0	0	112.3	T107 E108 G109	T107-E111 PolarHBondContact O-N 3.41Å; E108-E111 PolarHBondContact O-N 3.25Å; G109-E111 VanDerWaalsContact C-N 3.33Å
112	L	93.4	Very high	93.7	Very high	22 Å²	22	45 Å²	45	12%	0.115	23%	0.226	C	C	.	.	H	α-helix	trans	-86.3	-23.4	-177.7	-168.3	63.3	0	0	0	113.5	L68 V91 E108 G109 D114 S115 V116 M147	L68-L112 HydrophobicContact CD2-CB 4.11Å; L68-L112 HydrophobicContact CD2-CD2 3.67Å; V91-L112 HydrophobicContact CG1-CD1 3.69Å; V91-L112 HydrophobicContact CG1-CD2 4.35Å; V91-L112 HydrophobicContact CG1-CG 3.96Å; E108-L112 PolarHBondContact O-N 3.36Å; G109-L112 PolarHBondContact O-N 2.83Å; L112-D114 VanDerWaalsContact C-N 3.3Å; L112-D114 PolarHBondContact O-N 3.43Å; L112-S115 WeakPolarHBondContact O-CB 3.3Å; L112-S115 PolarHBondContact O-N 2.96Å; L112-S115 VanDerWaalsContact O-N 3.14Å; L112-V116 PolarHBondContact O-N 3.47Å; L112-M147 HydrophobicContact CB-CE 3.75Å; L112-M147 HydrophobicContact CD2-CE 3.84Å; L112-M147 HydrophobicContact CD2-SD 4.28Å; L112-M147 HydrophobicContact CG-CE 3.81Å
113	V	94.3	Very high	93.6	Very high	8 Å²	8	45 Å²	45	5%	0.048	23%	0.226	C	C	.	.	H	α-helix	trans	-56.8	-40.5	-171.9	76.3	0	0	0	0	112.8	G109 A110 S115 V116 L117 L150 L151	G109-V113 WeakPolarHBondContact O-CB 3.24Å; G109-V113 PolarHBondContact O-N 2.84Å; A110-V113 WeakPolarHBondContact O-CG1 3.5Å; V113-S115 VanDerWaalsContact C-N 3.3Å; V113-S115 PolarHBondContact O-N 3.47Å; V113-V116 WeakPolarHBondContact O-CB 3.2Å; V113-V116 PolarHBondContact O-N 3.26Å; V113-V116 VanDerWaalsContact O-N 3.09Å; V113-L117 HydrophobicContact CG2-CD1 4.24Å; V113-L117 HydrophobicContact CG2-CG 4.4Å; V113-L117 WeakPolarHBondContact O-CG 3.49Å; V113-L117 PolarHBondContact O-N 3.22Å; V113-L150 HydrophobicContact CB-CD2 3.98Å; V113-L150 HydrophobicContact CG1-CD2 4.16Å; V113-L150 HydrophobicContact CG2-CD2 4.04Å; V113-L150 HydrophobicContact CG2-CG 4.19Å; V113-L151 HydrophobicContact CG2-CD2 3.46Å; V113-L151 VanDerWaalsContact CG2-CD2 3.46Å; V113-L151 HydrophobicContact CG2-CG 3.97Å
114	D	93.9	Very high	93.6	Very high	98 Å²	98	42.5 Å²	42.5	52%	0.524	22%	0.216	S	C	.	.	H	α-helix	trans	-63.6	-38.6	-178	-72.6	-28.4	0	0	0	111.7	L112 V116 L117 D118	L112-D114 VanDerWaalsContact C-N 3.3Å; L112-D114 PolarHBondContact O-N 3.43Å; D114-V116 VanDerWaalsContact C-N 3.31Å; D114-V116 PolarHBondContact O-N 2.94Å; D114-L117 PolarHBondContact O-N 3.49Å; D114-D118 PolarHBondContact O-N 3.27Å
115	S	94.5	Very high	93.6	Very high	62 Å²	62	50.3 Å²	50.3	43%	0.434	25%	0.253	S	S	.	.	H	α-helix	trans	-65.2	-36.6	175.9	-62.5	0	0	0	0	111.7	L112 V113 V119	L112-S115 WeakPolarHBondContact O-CB 3.3Å; L112-S115 PolarHBondContact O-N 2.96Å; L112-S115 VanDerWaalsContact O-N 3.14Å; V113-S115 VanDerWaalsContact C-N 3.3Å; V113-S115 PolarHBondContact O-N 3.47Å; S115-V119 PolarHBondContact O-N 3.4Å
116	V	95.2	Very high	93.4	Very high	0 Å²	0	53.8 Å²	53.8	0%	0	27%	0.272	C	S	.	.	H	α-helix	trans	-68.4	-45.2	175	-179.2	0	0	0	0	110.3	I64 V66 V91 L112 V113 D114 D118 V119 V120 M147 L151	I64-V116 HydrophobicContact CG2-CG1 4.21Å; V66-V116 HydrophobicContact CB-CG2 4.44Å; V66-V116 HydrophobicContact CG1-CG2 3.72Å; V66-V116 HydrophobicContact CG2-CB 4.42Å; V66-V116 HydrophobicContact CG2-CG1 3.66Å; V66-V116 HydrophobicContact CG2-CG2 3.79Å; V91-V116 HydrophobicContact CB-CG2 3.95Å; V91-V116 HydrophobicContact CG1-CG2 3.55Å; V91-V116 HydrophobicContact CG2-CG2 4.43Å; L112-V116 PolarHBondContact O-N 3.47Å; V113-V116 WeakPolarHBondContact O-CB 3.2Å; V113-V116 PolarHBondContact O-N 3.26Å; V113-V116 VanDerWaalsContact O-N 3.09Å; D114-V116 VanDerWaalsContact C-N 3.31Å; D114-V116 PolarHBondContact O-N 2.94Å; V116-D118 VanDerWaalsContact C-N 3.27Å; V116-D118 PolarHBondContact O-N 3.1Å; V116-V119 PolarHBondContact O-N 2.73Å; V116-V120 HydrophobicContact CG1-CG2 4.18Å; V116-V120 WeakPolarHBondContact O-CG2 3.47Å; V116-V120 PolarHBondContact O-N 3.29Å; V116-M147 HydrophobicContact CG2-CE 3.72Å; V116-L151 HydrophobicContact CB-CD2 3.83Å; V116-L151 HydrophobicContact CG1-CD1 4.13Å; V116-L151 HydrophobicContact CG1-CD2 3.58Å
117	L	95.1	Very high	93.3	Very high	4 Å²	4	50 Å²	50	2%	0.021	26%	0.26	C	S	.	.	H	α-helix	trans	-60.5	-36.5	179.8	-71.7	171.3	0	0	0	112	V113 D114 V119 V120 R121 K154 I155	V113-L117 HydrophobicContact CG2-CD1 4.24Å; V113-L117 HydrophobicContact CG2-CG 4.4Å; V113-L117 WeakPolarHBondContact O-CG 3.49Å; V113-L117 PolarHBondContact O-N 3.22Å; D114-L117 PolarHBondContact O-N 3.49Å; L117-V119 VanDerWaalsContact C-N 3.33Å; L117-V119 PolarHBondContact O-N 2.94Å; L117-V120 WeakPolarHBondContact O-CB 3.37Å; L117-V120 PolarHBondContact O-N 3.19Å; L117-R121 WeakPolarHBondContact O-CB 3.48Å; L117-R121 VanDerWaalsContact O-CG 3.31Å; L117-R121 WeakPolarHBondContact O-CG 3.41Å; L117-R121 PolarHBondContact O-N 3.04Å; L117-K154 HydrophobicContact CD1-CB 3.83Å; L117-K154 HydrophobicContact CD1-CG 4.24Å; L117-K154 HydrophobicContact CD2-CB 4.08Å; L117-I155 HydrophobicContact CD2-CG1 3.97Å
118	D	95.8	Very high	93.2	Very high	94 Å²	94	53.9 Å²	53.9	50%	0.503	28%	0.278	S	S	.	.	H	α-helix	trans	-61.8	-39.4	173.8	-76.2	-16.3	0	0	0	112.7	D114 V116 R121 K122	D114-D118 PolarHBondContact O-N 3.27Å; V116-D118 VanDerWaalsContact C-N 3.27Å; V116-D118 PolarHBondContact O-N 3.1Å; D118-R121 IonicContact OD1-CZ 2.92Å; D118-R121 IonicContact OD1-NH1 3.19Å; D118-R121 PolarHBondContact OD1-NH1 2.92Å; D118-K122 WeakPolarHBondContact O-CB 3.46Å; D118-K122 PolarHBondContact O-N 3.3Å
119	V	95.6	Very high	93.2	Very high	20 Å²	20	54.1 Å²	54.1	12%	0.121	29%	0.286	C	S	.	.	H	α-helix	trans	-70	-40.5	174.4	-178.7	0	0	0	0	110.8	I64 N89 V91 S115 V116 L117 R121 K122 E123	I64-V119 HydrophobicContact CD1-CB 4.47Å; I64-V119 HydrophobicContact CD1-CG1 3.95Å; I64-V119 HydrophobicContact CG1-CG1 3.91Å; I64-V119 HydrophobicContact CG2-CG1 4.15Å; N89-V119 HydrophobicContact CB-CG1 4.25Å; V91-V119 HydrophobicContact CG2-CG2 3.84Å; S115-V119 PolarHBondContact O-N 3.4Å; V116-V119 PolarHBondContact O-N 2.73Å; L117-V119 VanDerWaalsContact C-N 3.33Å; L117-V119 PolarHBondContact O-N 2.94Å; V119-R121 VanDerWaalsContact C-N 3.33Å; V119-R121 PolarHBondContact O-N 2.89Å; V119-K122 PolarHBondContact O-N 2.95Å; V119-E123 PolarHBondContact O-N 3.15Å
120	V	95.5	Very high	93.3	Very high	0 Å²	0	54.6 Å²	54.6	0%	0	29%	0.289	C	S	.	.	H	α-helix	trans	-59.2	-44.1	175.4	174.4	0	0	0	0	110.7	I7 I64 V116 L117 E123 S124 F133 I155	I7-V120 HydrophobicContact CD1-CG2 3.98Å; I64-V120 HydrophobicContact CD1-CB 4.1Å; I64-V120 HydrophobicContact CD1-CG2 3.46Å; I64-V120 VanDerWaalsContact CD1-CG2 3.46Å; V116-V120 HydrophobicContact CG1-CG2 4.18Å; V116-V120 WeakPolarHBondContact O-CG2 3.47Å; V116-V120 PolarHBondContact O-N 3.29Å; L117-V120 WeakPolarHBondContact O-CB 3.37Å; L117-V120 PolarHBondContact O-N 3.19Å; V120-E123 PolarHBondContact O-N 3.42Å; V120-S124 VanDerWaalsContact O-CB 3.27Å; V120-S124 WeakPolarHBondContact O-CB 3.28Å; V120-S124 PolarHBondContact O-N 3.46Å; V120-S124 PolarHBondContact O-OG 3.23Å; V120-F133 HydrophobicContact CG1-CD1 4.26Å; V120-F133 HydrophobicContact CG1-CE1 3.5Å; V120-F133 VanDerWaalsContact CG1-CE1 3.5Å; V120-F133 HydrophobicContact CG1-CZ 4.08Å; V120-I155 HydrophobicContact CG1-CD1 4.42Å; V120-I155 HydrophobicContact CG1-CG1 4.44Å
121	R	95.6	Very high	93.2	Very high	79 Å²	79	54.1 Å²	54.1	30%	0.298	28%	0.28	S	S	.	.	H	α-helix	trans	-59.7	-50.7	174.3	-76.3	169.5	-162.4	133	6.3	111.3	L117 D118 V119 E123 S124 E125 E158	L117-R121 WeakPolarHBondContact O-CB 3.48Å; L117-R121 VanDerWaalsContact O-CG 3.31Å; L117-R121 WeakPolarHBondContact O-CG 3.41Å; L117-R121 PolarHBondContact O-N 3.04Å; D118-R121 IonicContact OD1-CZ 2.92Å; D118-R121 IonicContact OD1-NH1 3.19Å; D118-R121 PolarHBondContact OD1-NH1 2.92Å; V119-R121 VanDerWaalsContact C-N 3.33Å; V119-R121 PolarHBondContact O-N 2.89Å; R121-E123 VanDerWaalsContact C-N 3.31Å; R121-E123 PolarHBondContact O-N 2.99Å; R121-S124 PolarHBondContact O-N 3.19Å; R121-S124 VanDerWaalsContact O-N 3.1Å; R121-E125 WeakPolarHBondContact O-CG 3.31Å; R121-E125 PolarHBondContact O-N 3.4Å; R121-E158 WeakPolarHBondContact CD-OE1 3.34Å; R121-E158 WeakPolarHBondContact CG-OE1 3.36Å; R121-E158 IonicContact CZ-OE1 3.37Å; R121-E158 IonicContact CZ-OE2 2.81Å; R121-E158 VanDerWaalsContact CZ-OE2 3.31Å; R121-E158 VanDerWaalsContact NE-CD 3.34Å; R121-E158 IonicContact NE-OE1 3.61Å; R121-E158 PolarHBondContact NE-OE1 3.3Å; R121-E158 IonicContact NE-OE2 3.49Å; R121-E158 PolarHBondContact NE-OE2 2.64Å; R121-E158 IonicContact NH2-OE2 3.26Å; R121-E158 PolarHBondContact NH2-OE2 3.02Å
122	K	94.8	Very high	93.2	Very high	90 Å²	90	46.7 Å²	46.7	39%	0.391	25%	0.245	S	C	.	.	H	α-helix	trans	-57.8	-41.8	179.2	-175.9	-177.9	176.6	-174.2	0	112.1	D88 D118 V119 N126	D88-K122 IonicContact OD2-NZ 3.2Å; D88-K122 PolarHBondContact OD2-NZ 2.82Å; D118-K122 WeakPolarHBondContact O-CB 3.46Å; D118-K122 PolarHBondContact O-N 3.3Å; V119-K122 PolarHBondContact O-N 2.95Å; K122-N126 VanDerWaalsContact O-CG 3.26Å; K122-N126 PolarHBondContact O-N 2.8Å; K122-N126 PolarHBondContact O-ND2 2.74Å
123	E	93.4	Very high	93.3	Very high	0 Å²	0	45.7 Å²	45.7	0%	0	24%	0.24	C	C	.	.	H	α-helix	trans	-71.4	-39.5	175.7	-69.4	-62.5	156.1	0	0	111.7	V5 N52 R62 I64 R86 N89 V119 V120 R121 N126 C127	V5-E123 HydrophobicContact CG1-CB 4.49Å; V5-E123 HydrophobicContact CG2-CB 4.19Å; N52-E123 PolarHBondContact ND2-OE2 2.7Å; R62-E123 HydrophobicContact CG-CB 4.46Å; R62-E123 PolarHBondContact NH1-O 3.42Å; R62-E123 IonicContact NH1-OE2 3.94Å; I64-E123 HydrophobicContact CD1-CG 4.36Å; I64-E123 HydrophobicContact CG1-CG 4.47Å; R86-E123 IonicContact CZ-OE1 3.75Å; R86-E123 IonicContact NH1-OE1 2.76Å; R86-E123 PolarHBondContact NH1-OE1 2.95Å; N89-E123 PolarHBondContact ND2-OE1 3.16Å; V119-E123 PolarHBondContact O-N 3.15Å; V120-E123 PolarHBondContact O-N 3.42Å; R121-E123 VanDerWaalsContact C-N 3.31Å; R121-E123 PolarHBondContact O-N 2.99Å; E123-N126 PolarHBondContact O-N 3.44Å; E123-C127 PolarHBondContact O-N 3.29Å; E123-C127 PolarHBondContact O-SG 2.97Å
124	S	92.8	Very high	93.4	Very high	12 Å²	12	45.6 Å²	45.6	8%	0.084	24%	0.239	C	C	.	.	H	α-helix	trans	-63.2	-42.3	178.3	-59.7	0	0	0	0	112.5	V120 R121 N126 C127	V120-S124 VanDerWaalsContact O-CB 3.27Å; V120-S124 WeakPolarHBondContact O-CB 3.28Å; V120-S124 PolarHBondContact O-N 3.46Å; V120-S124 PolarHBondContact O-OG 3.23Å; R121-S124 PolarHBondContact O-N 3.19Å; R121-S124 VanDerWaalsContact O-N 3.1Å; S124-N126 VanDerWaalsContact C-N 3.26Å; S124-N126 PolarHBondContact O-N 3.05Å; S124-C127 VanDerWaalsContact O-CB 3.29Å; S124-C127 WeakPolarHBondContact O-CB 3.42Å; S124-C127 PolarHBondContact O-N 3Å; S124-C127 VanDerWaalsContact O-N 3.09Å
125	E	92.7	Very high	93.5	Very high	163 Å²	163	41.1 Å²	41.1	76%	0.762	22%	0.215	S	C	*	.	H	α-helix	trans	-66.5	-27.2	175.6	-72.1	-174.5	165.6	0	0	112.9	R121 C127	R121-E125 WeakPolarHBondContact O-CG 3.31Å; R121-E125 PolarHBondContact O-N 3.4Å; E125-C127 PolarHBondContact O-N 3.29Å
126	N	90	Very high	93.6	Very high	91 Å²	91	38.2 Å²	38.2	49%	0.487	20%	0.195	S	C	.	.	T	Hydrogen-bonded Turn	trans	-81.9	5.9	173.7	-71.8	-38.8	0	0	0	113.1	R62 K122 E123 S124	R62-N126 PolarHBondContact NH2-O 3.41Å; R62-N126 VanDerWaalsContact NH2-O 3.14Å; K122-N126 VanDerWaalsContact O-CG 3.26Å; K122-N126 PolarHBondContact O-N 2.8Å; K122-N126 PolarHBondContact O-ND2 2.74Å; E123-N126 PolarHBondContact O-N 3.44Å; S124-N126 VanDerWaalsContact C-N 3.26Å; S124-N126 PolarHBondContact O-N 3.05Å
127	C	91.1	Very high	93.7	Very high	17 Å²	17	38.2 Å²	38.2	12%	0.115	20%	0.195	C	C	.	.			trans	-93.9	141.6	172.7	-59.3	0	0	0	0	110.5	E3 R62 E123 S124 E125 L130	E3-C127 HydrophobicContact CB-CB 4.08Å; E3-C127 HydrophobicContact CG-CB 4.3Å; R62-C127 PolarHBondContact NH1-SG 2.94Å; E123-C127 PolarHBondContact O-N 3.29Å; E123-C127 PolarHBondContact O-SG 2.97Å; S124-C127 VanDerWaalsContact O-CB 3.29Å; S124-C127 WeakPolarHBondContact O-CB 3.42Å; S124-C127 PolarHBondContact O-N 3Å; S124-C127 VanDerWaalsContact O-N 3.09Å; E125-C127 PolarHBondContact O-N 3.29Å; C127-L130 HydrophobicContact CB-CB 4.09Å
128	D	89.8	Confident	93.6	Very high	120 Å²	120	38.9 Å²	38.9	64%	0.642	20%	0.2	S	C	*	.	S	Bend	trans	-73.7	-42.7	168.7	-69.3	-24.9	0	0	0	110.7	M1 E3	M1-D128 HydrophobicContact CB-CB 4.3Å; M1-D128 WeakPolarHBondContact CE-OD2 3.5Å; E3-D128 WeakPolarHBondContact OE1-CB 3.27Å; E3-D128 PolarHBondContact OE1-N 3.44Å
129	C	89.9	Confident	93.6	Very high	64 Å²	64	34.4 Å²	34.4	43%	0.432	18%	0.176	S	C	.	.	S	Bend	trans	-150.4	85.9	177.7	-170	0	0	0	0	111.8	R2 E3 Q131	R2-C129 WeakPolarHBondContact CA-O 3.38Å; E3-C129 PolarHBondContact N-O 3.3Å; E3-C129 WeakPolarHBondContact OE2-CA 3.32Å; E3-C129 PolarHBondContact OE2-N 3.17Å; C129-Q131 PolarHBondContact O-N 2.87Å
130	L	92.5	Very high	93.3	Very high	10 Å²	10	33.7 Å²	33.7	5%	0.052	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-56.9	120.5	177.1	-178.3	65.8	0	0	0	111.6	V5 C127 F133 Y159 R162	V5-L130 HydrophobicContact CB-CD1 4.41Å; V5-L130 HydrophobicContact CG2-CD1 3.7Å; C127-L130 HydrophobicContact CB-CB 4.09Å; L130-F133 HydrophobicContact CD2-CE1 4.21Å; L130-F133 HydrophobicContact CD2-CE2 4.05Å; L130-F133 HydrophobicContact CD2-CZ 3.63Å; L130-Y159 HydrophobicContact CD2-CD1 4.49Å; L130-R162 HydrophobicContact CD2-CG 4.34Å; L130-R162 WeakPolarHBondContact O-CD 3.2Å; L130-R162 PolarHBondContact O-NH1 3.34Å
131	Q	89.4	Confident	93	Very high	26 Å²	26	34.2 Å²	34.2	12%	0.121	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.3	-44	171.8	-68.5	-169.2	74.1	0	0	111.5	R2 E3 I4 C129 I163 L250	R2-Q131 HydrophobicContact CB-CG 3.67Å; R2-Q131 VanDerWaalsContact CB-NE2 3.3Å; R2-Q131 HydrophobicContact CG-CG 4.32Å; R2-Q131 PolarHBondContact O-NE2 3.28Å; E3-Q131 WeakPolarHBondContact O-CB 3.48Å; E3-Q131 PolarHBondContact O-N 3.03Å; I4-Q131 HydrophobicContact CG1-CB 4.21Å; C129-Q131 PolarHBondContact O-N 2.87Å; Q131-I163 PolarHBondContact O-N 3.09Å; Q131-L250 HydrophobicContact CB-CD1 4.22Å
132	G	92.8	Very high	92.8	Very high	0 Å²	0	30.6 Å²	30.6	0%	0	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	166.7	-172.1	-166.8	0	0	0	0	0	113.7	V5 I163	V5-G132 PolarHBondContact N-O 2.98Å; G132-I163 CarbonylContact C-O 3.43Å; G132-I163 WeakPolarHBondContact CA-O 3.32Å
133	F	95.8	Very high	92.8	Very high	2 Å²	2	26.9 Å²	26.9	1%	0.009	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	143.8	-177.7	-57.5	-85.2	0	0	0	110.1	V5 I7 V120 L130 I155 Y159 R162 I163 M164 N165	V5-F133 HydrophobicContact CB-CD1 3.71Å; V5-F133 HydrophobicContact CB-CE1 3.93Å; V5-F133 HydrophobicContact CG1-CD1 4Å; V5-F133 HydrophobicContact CG1-CE1 4.2Å; V5-F133 HydrophobicContact CG2-CE1 4.26Å; V5-F133 WeakPolarHBondContact O-CA 3.32Å; I7-F133 HydrophobicContact CD1-CD1 4.18Å; V120-F133 HydrophobicContact CG1-CD1 4.26Å; V120-F133 HydrophobicContact CG1-CE1 3.5Å; V120-F133 VanDerWaalsContact CG1-CE1 3.5Å; V120-F133 HydrophobicContact CG1-CZ 4.08Å; L130-F133 HydrophobicContact CD2-CE1 4.21Å; L130-F133 HydrophobicContact CD2-CE2 4.05Å; L130-F133 HydrophobicContact CD2-CZ 3.63Å; F133-I155 HydrophobicContact CD1-CG2 4.32Å; F133-I155 HydrophobicContact CD2-CG2 3.31Å; F133-I155 HydrophobicContact CE1-CG2 4.33Å; F133-I155 HydrophobicContact CE2-CG2 3.29Å; F133-I155 HydrophobicContact CG-CG2 3.84Å; F133-I155 HydrophobicContact CZ-CG2 3.83Å; F133-Y159 AromaticContact CE2-CD2 3.94Å; F133-Y159 HydrophobicContact CE2-CD2 3.94Å; F133-Y159 AromaticContact CE2-CG 3.84Å; F133-Y159 HydrophobicContact CE2-CG 3.84Å; F133-Y159 HydrophobicContact CZ-CD1 4.34Å; F133-Y159 AromaticContact CZ-CD2 3.74Å; F133-Y159 HydrophobicContact CZ-CD2 3.74Å; F133-Y159 HydrophobicContact CZ-CE2 4.1Å; F133-Y159 AromaticContact CZ-CG 3.9Å; F133-Y159 HydrophobicContact CZ-CG 3.9Å; F133-R162 HydrophobicContact CE2-CB 4.22Å; F133-I163 PolarHBondContact N-O 3.3Å; F133-M164 HydrophobicContact CB-CE 3.81Å; F133-M164 HydrophobicContact CB-SD 3.89Å; F133-M164 HydrophobicContact CD2-CE 4.08Å; F133-M164 HydrophobicContact CG-CE 4.19Å; F133-N165 PolarHBondContact O-N 2.9Å
134	Q	95.4	Very high	92.7	Very high	5 Å²	5	27 Å²	27	2%	0.023	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	110.7	174	-176.9	-170.3	0.3	0	0	109.3	I4 V5 H6 I7 Y50 N165 F167	I4-Q134 HydrophobicContact CG2-CB 3.97Å; V5-Q134 PolarHBondContact O-N 2.81Å; H6-Q134 CarbonylContact C-O 3.57Å; H6-Q134 WeakPolarHBondContact CA-O 3.45Å; H6-Q134 PolarHBondContact ND1-O 2.79Å; H6-Q134 PolarHBondContact ND1-OE1 3.41Å; I7-Q134 PolarHBondContact N-O 2.8Å; Y50-Q134 VanDerWaalsContact CE1-OE1 3.29Å; Y50-Q134 PolarHBondContact OH-OE1 2.72Å; Q134-N165 CarbonylContact C-O 3.5Å; Q134-N165 WeakPolarHBondContact CA-O 3.25Å; Q134-F167 HydrophobicContact CG-CD2 3.77Å; Q134-F167 HydrophobicContact CG-CE2 3.66Å; Q134-F167 VanDerWaalsContact NE2-CD2 3.31Å
135	L	96.6	Very high	92.8	Very high	4 Å²	4	26.4 Å²	26.4	2%	0.021	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	131.8	176.3	-176.8	68.6	0	0	0	111.3	I7 A9 H137 I152 N165 T166 F167	I7-L135 HydrophobicContact CB-CD1 3.81Å; I7-L135 HydrophobicContact CG2-CD1 3.62Å; I7-L135 CarbonylContact O-C 3.58Å; I7-L135 VanDerWaalsContact O-CA 3.3Å; I7-L135 WeakPolarHBondContact O-CA 3.2Å; A9-L135 HydrophobicContact CB-CD1 4.04Å; L135-H137 HydrophobicContact CD2-CB 4.35Å; L135-H137 WeakPolarHBondContact CD2-ND1 3.45Å; L135-H137 HydrophobicContact CG-CB 4.31Å; L135-I152 HydrophobicContact CD2-CD1 3.45Å; L135-I152 VanDerWaalsContact CD2-CD1 3.45Å; L135-I152 HydrophobicContact CD2-CG1 3.74Å; L135-N165 PolarHBondContact N-O 2.9Å; L135-T166 HydrophobicContact CB-CG2 4.25Å; L135-T166 CarbonylContact O-C 3.46Å; L135-T166 WeakPolarHBondContact O-CA 3.35Å; L135-F167 PolarHBondContact O-N 3.33Å
136	T	96.4	Very high	92.8	Very high	1 Å²	1	18.7 Å²	18.7	1%	0.006	11%	0.111	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	122.8	163.9	53	0	0	0	0	110.3	I7 Q8 A9 G13 F167 M233	I7-T136 PolarHBondContact O-N 3.49Å; Q8-T136 WeakPolarHBondContact CG-OG1 3.3Å; A9-T136 PolarHBondContact N-O 2.99Å; G13-T136 VanDerWaalsContact CA-O 3.23Å; G13-T136 WeakPolarHBondContact CA-O 3.2Å; G13-T136 PolarHBondContact O-OG1 2.83Å; G13-T136 VanDerWaalsContact O-OG1 3.1Å; T136-F167 HydrophobicContact CG2-CB 3.96Å; T136-F167 HydrophobicContact CG2-CD2 4.44Å; T136-F167 HydrophobicContact CG2-CG 4.48Å; T136-M233 HydrophobicContact CG2-CE 3.32Å; T136-M233 HydrophobicContact CG2-SD 4.16Å
137	H	96.3	Very high	93	Very high	1 Å²	1	14.3 Å²	14.3	1%	0.005	9%	0.088	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-155.7	169.8	-178.5	70.2	170.1	0	0	0	112.3	A9 L135 L139 G144 F167 S168 V169	A9-H137 HydrophobicContact CB-CB 4.29Å; L135-H137 HydrophobicContact CD2-CB 4.35Å; L135-H137 WeakPolarHBondContact CD2-ND1 3.45Å; L135-H137 HydrophobicContact CG-CB 4.31Å; H137-L139 WeakPolarHBondContact NE2-CD2 3.37Å; H137-G144 WeakPolarHBondContact CB-O 3.44Å; H137-G144 PolarHBondContact ND1-O 2.84Å; H137-F167 PolarHBondContact N-O 3.43Å; H137-S168 PolarHBondContact CD2-OG 3.38Å; H137-S168 PolarHBondContact NE2-OG 3.49Å; H137-V169 PolarHBondContact O-N 2.81Å
138	S	94.5	Very high	93.2	Very high	18 Å²	18	13.5 Å²	13.5	13%	0.126	8%	0.082	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	139.1	171.3	58.5	0	0	0	0	110.5	G144 S145	S138-G144 CarbonylContact O-C 3.49Å; S138-S145 WeakPolarHBondContact O-CB 3.35Å; S138-S145 PolarHBondContact O-N 3.06Å
139	L	93.9	Very high	93.5	Very high	0 Å²	0	7.8 Å²	7.8	0%	0	5%	0.052	C	C	.	.	S	Bend	trans	-82.8	-19.6	179.3	-51	-167.3	0	0	0	113.1	H137 S145 V169 M170 N184 A185 V189 L192	H137-L139 WeakPolarHBondContact NE2-CD2 3.37Å; L139-S145 VanDerWaalsContact O-CB 3.3Å; L139-S145 WeakPolarHBondContact O-CB 3.5Å; L139-V169 PolarHBondContact N-O 2.92Å; L139-M170 HydrophobicContact CD1-CE 3.89Å; L139-M170 HydrophobicContact CD1-SD 3.48Å; L139-M170 WeakPolarHBondContact CD1-SD 3.47Å; L139-M170 HydrophobicContact CG-SD 4.29Å; L139-N184 CarbonylContact O-C 3.49Å; L139-N184 VanDerWaalsContact O-CB 3.29Å; L139-N184 WeakPolarHBondContact O-CB 3.29Å; L139-A185 HydrophobicContact CB-CB 4.08Å; L139-A185 PolarHBondContact O-N 2.89Å; L139-V189 HydrophobicContact CD1-CG2 3.78Å; L139-L192 HydrophobicContact CD1-CD1 3.83Å; L139-L192 HydrophobicContact CD2-CD1 3.78Å; L139-L192 HydrophobicContact CG-CD1 4.49Å
140	G	89.5	Confident	93.7	Very high	4 Å²	4	5.7 Å²	5.7	4%	0.041	4%	0.036	C	C	.	.	S	Bend	trans	-79.6	-22.1	-179.4	0	0	0	0	0	115.4	N184	G140-N184 PolarHBondContact O-ND2 3.42Å
141	G	90.6	Very high	93.9	Very high	12 Å²	12	5.3 Å²	5.3	12%	0.124	3%	0.034	C	C	.	.	S	Bend	trans	-75.8	-165.8	-178	0	0	0	0	0	113.4	S145 N184	G141-S145 WeakPolarHBondContact O-CB 3.5Å; G141-S145 PolarHBondContact O-OG 3.47Å; G141-N184 WeakPolarHBondContact O-CB 3.47Å; G141-N184 PolarHBondContact O-ND2 3.39Å
142	G	91.1	Very high	94.2	Very high	3 Å²	3	4.3 Å²	4.3	3%	0.031	3%	0.029	C	C	.	.	S	Bend	trans	-106	-48.5	169.6	0	0	0	0	0	112.8	N100 S145 G146	N100-G142 WeakPolarHBondContact O-CA 3.46Å; G142-S145 PolarHBondContact O-OG 3.49Å; G142-G146 WeakPolarHBondContact O-CA 3.42Å; G142-G146 PolarHBondContact O-N 3.48Å
143	T	93.3	Very high	94.3	Very high	12 Å²	12	5.5 Å²	5.5	7%	0.074	4%	0.038	C	C	.	.	I	π-helix	trans	-68.3	-57.5	179.6	-49.6	0	0	0	0	111.8	L68 S145 M147 G148	L68-T143 HydrophobicContact CB-CG2 4.06Å; L68-T143 HydrophobicContact CD1-CG2 3.93Å; L68-T143 HydrophobicContact CG-CG2 3.75Å; T143-S145 PolarHBondContact O-N 2.94Å; T143-M147 HydrophobicContact CG2-CB 4.44Å; T143-M147 HydrophobicContact CG2-SD 4.33Å; T143-M147 WeakPolarHBondContact O-CA 3.38Å; T143-M147 WeakPolarHBondContact O-CB 3.29Å; T143-M147 PolarHBondContact O-N 3.26Å; T143-G148 PolarHBondContact O-N 2.77Å
144	G	92.6	Very high	94.2	Very high	2 Å²	2	8.8 Å²	8.8	2%	0.021	5%	0.052	C	C	.	.	I	π-helix	trans	-61.1	-35.9	-176	0	0	0	0	0	112.5	A9 H137 S138 G148	A9-G144 WeakPolarHBondContact O-CA 3.02Å; H137-G144 WeakPolarHBondContact CB-O 3.44Å; H137-G144 PolarHBondContact ND1-O 2.84Å; S138-G144 CarbonylContact O-C 3.49Å; G144-G148 VanDerWaalsContact O-CA 3.29Å; G144-G148 WeakPolarHBondContact O-CA 3.41Å; G144-G148 PolarHBondContact O-N 3.36Å
145	S	93.7	Very high	94.2	Very high	0 Å²	0	8.7 Å²	8.7	0%	0	5%	0.052	C	C	.	.	I	π-helix	trans	-80.7	-63.3	-178	61.1	0	0	0	0	111.5	S138 L139 G141 G142 T143 T149 S188	S138-S145 WeakPolarHBondContact O-CB 3.35Å; S138-S145 PolarHBondContact O-N 3.06Å; L139-S145 VanDerWaalsContact O-CB 3.3Å; L139-S145 WeakPolarHBondContact O-CB 3.5Å; G141-S145 WeakPolarHBondContact O-CB 3.5Å; G141-S145 PolarHBondContact O-OG 3.47Å; G142-S145 PolarHBondContact O-OG 3.49Å; T143-S145 PolarHBondContact O-N 2.94Å; S145-T149 WeakPolarHBondContact O-CB 3.24Å; S145-T149 VanDerWaalsContact O-CG2 3.28Å; S145-T149 WeakPolarHBondContact O-CG2 3Å; S145-T149 PolarHBondContact O-N 3.42Å; S145-T149 PolarHBondContact O-OG1 2.88Å; S145-S188 VanDerWaalsContact CB-OG 3.25Å; S145-S188 WeakPolarHBondContact CB-OG 3.21Å
146	G	94.1	Very high	94	Very high	0 Å²	0	11.8 Å²	11.8	0%	0	6%	0.063	C	C	.	.	I	π-helix	trans	-67.2	-56.3	-175.6	0	0	0	0	0	112.8	W101 G104 H105 G142 T149 L150	W101-G146 VanDerWaalsContact CD1-CA 3.41Å; W101-G146 VanDerWaalsContact CD1-N 3.3Å; G104-G146 CarbonylContact O-C 3.53Å; H105-G146 PolarHBondContact ND1-O 3.09Å; G142-G146 WeakPolarHBondContact O-CA 3.42Å; G142-G146 PolarHBondContact O-N 3.48Å; G146-T149 PolarHBondContact O-N 2.87Å; G146-T149 PolarHBondContact O-OG1 2.84Å; G146-L150 PolarHBondContact O-N 2.77Å
147	M	94.8	Very high	93.9	Very high	0 Å²	0	17.5 Å²	17.5	0%	0	9%	0.09	C	C	.	.	I	π-helix	trans	-70.1	-35.7	179.7	-169	-170.9	177.3	0	0	111.3	V66 L68 G104 L112 V116 T143 L150 L151	V66-M147 HydrophobicContact CG1-CE 3.47Å; V66-M147 VanDerWaalsContact CG1-CE 3.47Å; V66-M147 HydrophobicContact CG1-SD 3.66Å; L68-M147 HydrophobicContact CD1-SD 4.43Å; L68-M147 HydrophobicContact CD2-SD 4.1Å; L68-M147 HydrophobicContact CG-SD 4.04Å; G104-M147 WeakPolarHBondContact O-CA 3.45Å; G104-M147 WeakPolarHBondContact O-CB 3.36Å; G104-M147 PolarHBondContact O-N 3.19Å; L112-M147 HydrophobicContact CB-CE 3.75Å; L112-M147 HydrophobicContact CD2-CE 3.84Å; L112-M147 HydrophobicContact CD2-SD 4.28Å; L112-M147 HydrophobicContact CG-CE 3.81Å; V116-M147 HydrophobicContact CG2-CE 3.72Å; T143-M147 HydrophobicContact CG2-CB 4.44Å; T143-M147 HydrophobicContact CG2-SD 4.33Å; T143-M147 WeakPolarHBondContact O-CA 3.38Å; T143-M147 WeakPolarHBondContact O-CB 3.29Å; T143-M147 PolarHBondContact O-N 3.26Å; M147-L150 PolarHBondContact O-N 2.99Å; M147-L151 HydrophobicContact CE-CD1 4.34Å; M147-L151 HydrophobicContact CG-CD1 4.37Å; M147-L151 WeakPolarHBondContact O-CB 3.37Å; M147-L151 WeakPolarHBondContact O-CG 3.43Å; M147-L151 PolarHBondContact O-N 3.16Å
148	G	94.5	Very high	93.8	Very high	0 Å²	0	20.8 Å²	20.8	0%	0	11%	0.105	C	C	.	.	H	α-helix	trans	-61.9	-43.6	176.5	0	0	0	0	0	112.7	T143 G144 L151 I152	T143-G148 PolarHBondContact O-N 2.77Å; G144-G148 VanDerWaalsContact O-CA 3.29Å; G144-G148 WeakPolarHBondContact O-CA 3.41Å; G144-G148 PolarHBondContact O-N 3.36Å; G148-L151 WeakPolarHBondContact O-CB 3.33Å; G148-L151 PolarHBondContact O-N 2.77Å; G148-I152 VanDerWaalsContact O-CG1 3.31Å; G148-I152 WeakPolarHBondContact O-CG1 3.34Å; G148-I152 PolarHBondContact O-N 3.09Å
149	T	94.9	Very high	93.8	Very high	0 Å²	0	22 Å²	22	0%	0	11%	0.107	C	C	.	.	H	α-helix	trans	-70.3	-36.3	176.1	50.4	0	0	0	0	113	S145 G146 L151 I152 S153 Q191 L192	S145-T149 WeakPolarHBondContact O-CB 3.24Å; S145-T149 VanDerWaalsContact O-CG2 3.28Å; S145-T149 WeakPolarHBondContact O-CG2 3Å; S145-T149 PolarHBondContact O-N 3.42Å; S145-T149 PolarHBondContact O-OG1 2.88Å; G146-T149 PolarHBondContact O-N 2.87Å; G146-T149 PolarHBondContact O-OG1 2.84Å; T149-L151 VanDerWaalsContact C-N 3.35Å; T149-L151 PolarHBondContact O-N 3.36Å; T149-I152 PolarHBondContact O-N 3.31Å; T149-S153 PolarHBondContact O-N 3.47Å; T149-Q191 HydrophobicContact CG2-CB 3.82Å; T149-L192 HydrophobicContact CG2-CG 4.47Å
150	L	95.4	Very high	93.7	Very high	20 Å²	20	25.5 Å²	25.5	11%	0.105	13%	0.13	C	C	.	.	H	α-helix	trans	-59.5	-45.9	171	-178.2	68	0	0	0	111.5	H105 A110 V113 G146 M147 I152 S153 K154	H105-L150 WeakPolarHBondContact O-CD2 3.44Å; A110-L150 HydrophobicContact CB-CD2 4.18Å; V113-L150 HydrophobicContact CB-CD2 3.98Å; V113-L150 HydrophobicContact CG1-CD2 4.16Å; V113-L150 HydrophobicContact CG2-CD2 4.04Å; V113-L150 HydrophobicContact CG2-CG 4.19Å; G146-L150 PolarHBondContact O-N 2.77Å; M147-L150 PolarHBondContact O-N 2.99Å; L150-I152 VanDerWaalsContact C-N 3.33Å; L150-I152 PolarHBondContact O-N 2.88Å; L150-S153 PolarHBondContact O-N 3.43Å; L150-K154 WeakPolarHBondContact O-CG 3.47Å; L150-K154 PolarHBondContact O-N 2.91Å
151	L	95.5	Very high	93.8	Very high	2 Å²	2	31.4 Å²	31.4	1%	0.01	16%	0.161	C	C	.	.	H	α-helix	trans	-60.2	-43.2	176.6	-80	168.2	0	0	0	111.8	V66 V113 V116 M147 G148 T149 K154 I155	V66-L151 HydrophobicContact CG1-CD1 4.48Å; V113-L151 HydrophobicContact CG2-CD2 3.46Å; V113-L151 VanDerWaalsContact CG2-CD2 3.46Å; V113-L151 HydrophobicContact CG2-CG 3.97Å; V116-L151 HydrophobicContact CB-CD2 3.83Å; V116-L151 HydrophobicContact CG1-CD1 4.13Å; V116-L151 HydrophobicContact CG1-CD2 3.58Å; M147-L151 HydrophobicContact CE-CD1 4.34Å; M147-L151 HydrophobicContact CG-CD1 4.37Å; M147-L151 WeakPolarHBondContact O-CB 3.37Å; M147-L151 WeakPolarHBondContact O-CG 3.43Å; M147-L151 PolarHBondContact O-N 3.16Å; G148-L151 WeakPolarHBondContact O-CB 3.33Å; G148-L151 PolarHBondContact O-N 2.77Å; T149-L151 VanDerWaalsContact C-N 3.35Å; T149-L151 PolarHBondContact O-N 3.36Å; L151-K154 PolarHBondContact O-N 2.74Å; L151-I155 WeakPolarHBondContact O-CB 3.24Å; L151-I155 WeakPolarHBondContact O-CG1 3.42Å; L151-I155 PolarHBondContact O-N 3.07Å
152	I	95.8	Very high	93.8	Very high	4 Å²	4	35.3 Å²	35.3	2%	0.021	17%	0.172	C	C	.	.	H	α-helix	trans	-58.7	-49.6	177	-73.5	162.2	0	0	0	110.6	L135 G148 T149 L150 K154 I155 R156 M164 T166 L192 N195 T196	L135-I152 HydrophobicContact CD2-CD1 3.45Å; L135-I152 VanDerWaalsContact CD2-CD1 3.45Å; L135-I152 HydrophobicContact CD2-CG1 3.74Å; G148-I152 VanDerWaalsContact O-CG1 3.31Å; G148-I152 WeakPolarHBondContact O-CG1 3.34Å; G148-I152 PolarHBondContact O-N 3.09Å; T149-I152 PolarHBondContact O-N 3.31Å; L150-I152 VanDerWaalsContact C-N 3.33Å; L150-I152 PolarHBondContact O-N 2.88Å; I152-K154 PolarHBondContact O-N 2.82Å; I152-I155 PolarHBondContact O-N 2.94Å; I152-R156 WeakPolarHBondContact O-CB 3.43Å; I152-R156 PolarHBondContact O-N 3.29Å; I152-M164 HydrophobicContact CG1-SD 4.16Å; I152-M164 HydrophobicContact CG2-CG 4.06Å; I152-T166 HydrophobicContact CD1-CG2 3.76Å; I152-L192 HydrophobicContact CD1-CD2 3.69Å; I152-N195 HydrophobicContact CG2-CB 3.49Å; I152-N195 VanDerWaalsContact CG2-CB 3.49Å; I152-T196 HydrophobicContact CD1-CG2 4.1Å; I152-T196 HydrophobicContact CG2-CG2 3.87Å
153	S	94.7	Very high	93.9	Very high	26 Å²	26	35.5 Å²	35.5	18%	0.182	17%	0.172	C	C	.	.	H	α-helix	trans	-58.9	-46.6	179.4	175.8	0	0	0	0	111.3	T149 L150 I155 R156 E157	T149-S153 PolarHBondContact O-N 3.47Å; L150-S153 PolarHBondContact O-N 3.43Å; S153-I155 PolarHBondContact O-N 2.79Å; S153-R156 PolarHBondContact O-N 2.97Å; S153-R156 VanDerWaalsContact O-N 3.16Å; S153-E157 WeakPolarHBondContact O-CG 3.18Å; S153-E157 PolarHBondContact O-N 3.41Å
154	K	95.1	Very high	93.9	Very high	70 Å²	70	35.2 Å²	35.2	30%	0.304	17%	0.17	S	C	.	.	H	α-helix	trans	-66	-37.9	178.1	-67.3	-63.7	168.7	-151.3	0	114.1	L117 L150 L151 I152 R156 E157 E158	L117-K154 HydrophobicContact CD1-CB 3.83Å; L117-K154 HydrophobicContact CD1-CG 4.24Å; L117-K154 HydrophobicContact CD2-CB 4.08Å; L150-K154 WeakPolarHBondContact O-CG 3.47Å; L150-K154 PolarHBondContact O-N 2.91Å; L151-K154 PolarHBondContact O-N 2.74Å; I152-K154 PolarHBondContact O-N 2.82Å; K154-R156 VanDerWaalsContact C-N 3.31Å; K154-E157 VanDerWaalsContact NZ-CD 3.31Å; K154-E157 IonicContact NZ-OE1 2.64Å; K154-E157 PolarHBondContact NZ-OE1 3.19Å; K154-E157 IonicContact NZ-OE2 2.92Å; K154-E157 PolarHBondContact NZ-OE2 3.33Å; K154-E157 PolarHBondContact O-N 2.8Å; K154-E158 PolarHBondContact O-N 2.92Å; K154-E158 VanDerWaalsContact O-N 3.09Å
155	I	95.2	Very high	94	Very high	3 Å²	3	35.4 Å²	35.4	2%	0.015	17%	0.17	C	C	.	.	H	α-helix	trans	-67.6	-36.2	174.2	-68.5	168	0	0	0	110.5	I7 L117 V120 F133 L151 I152 S153 E158 Y159 M164	I7-I155 HydrophobicContact CD1-CD1 3.46Å; I7-I155 VanDerWaalsContact CD1-CD1 3.46Å; L117-I155 HydrophobicContact CD2-CG1 3.97Å; V120-I155 HydrophobicContact CG1-CD1 4.42Å; V120-I155 HydrophobicContact CG1-CG1 4.44Å; F133-I155 HydrophobicContact CD1-CG2 4.32Å; F133-I155 HydrophobicContact CD2-CG2 3.31Å; F133-I155 HydrophobicContact CE1-CG2 4.33Å; F133-I155 HydrophobicContact CE2-CG2 3.29Å; F133-I155 HydrophobicContact CG-CG2 3.84Å; F133-I155 HydrophobicContact CZ-CG2 3.83Å; L151-I155 WeakPolarHBondContact O-CB 3.24Å; L151-I155 WeakPolarHBondContact O-CG1 3.42Å; L151-I155 PolarHBondContact O-N 3.07Å; I152-I155 PolarHBondContact O-N 2.94Å; S153-I155 PolarHBondContact O-N 2.79Å; I155-E158 PolarHBondContact O-N 2.85Å; I155-Y159 HydrophobicContact CG2-CD2 4.09Å; I155-Y159 WeakPolarHBondContact O-CA 3.21Å; I155-Y159 WeakPolarHBondContact O-CB 3.21Å; I155-Y159 PolarHBondContact O-N 3.2Å; I155-M164 HydrophobicContact CB-CE 3.72Å; I155-M164 HydrophobicContact CD1-CE 4.23Å; I155-M164 HydrophobicContact CG2-CE 3.35Å
156	R	93.1	Very high	94.1	Very high	69 Å²	69	35.4 Å²	35.4	26%	0.26	17%	0.17	S	C	.	.	H	α-helix	trans	-67.9	-36.8	176.7	-168.6	60.6	167.7	-157.5	-12.9	112.1	I152 S153 K154 P160 R162 D197	I152-R156 WeakPolarHBondContact O-CB 3.43Å; I152-R156 PolarHBondContact O-N 3.29Å; S153-R156 PolarHBondContact O-N 2.97Å; S153-R156 VanDerWaalsContact O-N 3.16Å; K154-R156 VanDerWaalsContact C-N 3.31Å; R156-P160 WeakPolarHBondContact O-CA 3.15Å; R156-R162 PolarHBondContact NH1-O 2.98Å; R156-D197 IonicContact CZ-OD1 2.95Å; R156-D197 IonicContact CZ-OD2 2.74Å; R156-D197 IonicContact NH1-OD1 2.99Å; R156-D197 PolarHBondContact NH1-OD1 2.82Å; R156-D197 IonicContact NH1-OD2 3.15Å; R156-D197 PolarHBondContact NH1-OD2 3.34Å; R156-D197 IonicContact NH2-OD1 3.86Å; R156-D197 PolarHBondContact NH2-OD1 3.01Å; R156-D197 IonicContact NH2-OD2 2.88Å
157	E	93.9	Very high	94.2	Very high	121 Å²	121	35.6 Å²	35.6	57%	0.565	17%	0.171	S	C	*	.	H	α-helix	trans	-61.7	-44.4	171.6	-72.2	174.3	-162	0	0	111.9	S153 K154	S153-E157 WeakPolarHBondContact O-CG 3.18Å; S153-E157 PolarHBondContact O-N 3.41Å; K154-E157 VanDerWaalsContact NZ-CD 3.31Å; K154-E157 IonicContact NZ-OE1 2.64Å; K154-E157 PolarHBondContact NZ-OE1 3.19Å; K154-E157 IonicContact NZ-OE2 2.92Å; K154-E157 PolarHBondContact NZ-OE2 3.33Å; K154-E157 PolarHBondContact O-N 2.8Å
158	E	94.4	Very high	94.3	Very high	71 Å²	71	35.6 Å²	35.6	33%	0.332	17%	0.171	S	C	.	.	H	α-helix	trans	-83	-32.1	-175.4	-166.4	176	147.5	0	0	113.4	R121 K154 I155 P160	R121-E158 WeakPolarHBondContact CD-OE1 3.34Å; R121-E158 WeakPolarHBondContact CG-OE1 3.36Å; R121-E158 IonicContact CZ-OE1 3.37Å; R121-E158 IonicContact CZ-OE2 2.81Å; R121-E158 VanDerWaalsContact CZ-OE2 3.31Å; R121-E158 VanDerWaalsContact NE-CD 3.34Å; R121-E158 IonicContact NE-OE1 3.61Å; R121-E158 PolarHBondContact NE-OE1 3.3Å; R121-E158 IonicContact NE-OE2 3.49Å; R121-E158 PolarHBondContact NE-OE2 2.64Å; R121-E158 IonicContact NH2-OE2 3.26Å; R121-E158 PolarHBondContact NH2-OE2 3.02Å; K154-E158 PolarHBondContact O-N 2.92Å; K154-E158 VanDerWaalsContact O-N 3.09Å; I155-E158 PolarHBondContact O-N 2.85Å; E158-P160 VanDerWaalsContact C-CD 3.47Å
159	Y	94.3	Very high	94.3	Very high	44 Å²	44	35.8 Å²	35.8	17%	0.173	17%	0.172	C	C	.	.			trans	-128.5	61.9	-176.1	-57.6	-86.1	0	0	0	112.2	L130 F133 I155 D161 R162	L130-Y159 HydrophobicContact CD2-CD1 4.49Å; F133-Y159 AromaticContact CE2-CD2 3.94Å; F133-Y159 HydrophobicContact CE2-CD2 3.94Å; F133-Y159 AromaticContact CE2-CG 3.84Å; F133-Y159 HydrophobicContact CE2-CG 3.84Å; F133-Y159 HydrophobicContact CZ-CD1 4.34Å; F133-Y159 AromaticContact CZ-CD2 3.74Å; F133-Y159 HydrophobicContact CZ-CD2 3.74Å; F133-Y159 HydrophobicContact CZ-CE2 4.1Å; F133-Y159 AromaticContact CZ-CG 3.9Å; F133-Y159 HydrophobicContact CZ-CG 3.9Å; I155-Y159 HydrophobicContact CG2-CD2 4.09Å; I155-Y159 WeakPolarHBondContact O-CA 3.21Å; I155-Y159 WeakPolarHBondContact O-CB 3.21Å; I155-Y159 PolarHBondContact O-N 3.2Å; Y159-D161 VanDerWaalsContact C-N 3.26Å; Y159-D161 PolarHBondContact O-N 3.05Å; Y159-R162 HydrophobicContact CD1-CG 4.39Å; Y159-R162 PolarHBondContact O-N 2.86Å
160	P	92.3	Very high	94.1	Very high	72 Å²	72	35.8 Å²	35.8	47%	0.468	17%	0.172	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.6	-29.9	-175.3	25.5	-35.4	0	0	0	113.4	R156 E158 R162	R156-P160 WeakPolarHBondContact O-CA 3.15Å; E158-P160 VanDerWaalsContact C-CD 3.47Å; P160-R162 VanDerWaalsContact C-N 3.27Å; P160-R162 PolarHBondContact O-N 2.82Å
161	D	90.1	Very high	93.8	Very high	129 Å²	129	35.2 Å²	35.2	69%	0.69	17%	0.169	S	C	*	.	T	Hydrogen-bonded Turn	trans	-82.7	1.7	-178.5	-63.2	-38.1	0	0	0	113.8	Y159 R251	Y159-D161 VanDerWaalsContact C-N 3.26Å; Y159-D161 PolarHBondContact O-N 3.05Å; D161-R251 PolarHBondContact O-NH2 3.26Å
162	R	92.3	Very high	93.1	Very high	94 Å²	94	35.1 Å²	35.1	36%	0.355	17%	0.169	S	C	.	.	S	Bend	trans	-106.7	145.1	-175.5	-56.1	-58.8	177.2	-174.9	-8.9	110.8	L130 F133 R156 Y159 P160	L130-R162 HydrophobicContact CD2-CG 4.34Å; L130-R162 WeakPolarHBondContact O-CD 3.2Å; L130-R162 PolarHBondContact O-NH1 3.34Å; F133-R162 HydrophobicContact CE2-CB 4.22Å; R156-R162 PolarHBondContact NH1-O 2.98Å; Y159-R162 HydrophobicContact CD1-CG 4.39Å; Y159-R162 PolarHBondContact O-N 2.86Å; P160-R162 VanDerWaalsContact C-N 3.27Å; P160-R162 PolarHBondContact O-N 2.82Å
163	I	91.9	Very high	92.2	Very high	7 Å²	7	38.6 Å²	38.6	4%	0.036	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.3	132.6	-179.2	-66.3	-65.7	0	0	0	109.8	Q131 G132 F133 N165 D197 L250 R251 A254	Q131-I163 PolarHBondContact O-N 3.09Å; G132-I163 CarbonylContact C-O 3.43Å; G132-I163 WeakPolarHBondContact CA-O 3.32Å; F133-I163 PolarHBondContact N-O 3.3Å; I163-N165 WeakPolarHBondContact CG2-OD1 3.49Å; I163-D197 VanDerWaalsContact CA-OD2 3.29Å; I163-D197 WeakPolarHBondContact CA-OD2 3.32Å; I163-D197 HydrophobicContact CD1-CB 4.25Å; I163-D197 HydrophobicContact CG2-CB 4.29Å; I163-L250 HydrophobicContact CB-CB 4.38Å; I163-L250 HydrophobicContact CG2-CB 4.11Å; I163-L250 HydrophobicContact CG2-CD1 4.49Å; I163-R251 HydrophobicContact CD1-CB 4.35Å; I163-R251 HydrophobicContact CD1-CG 4.46Å; I163-R251 HydrophobicContact CG1-CB 4.11Å; I163-A254 HydrophobicContact CD1-CB 4.45Å
164	M	94.5	Very high	91.3	Very high	5 Å²	5	41.8 Å²	41.8	3%	0.025	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110	112.1	174.6	179.7	59.9	69.7	0	0	110.4	F133 I152 I155 T196 D197 E198	F133-M164 HydrophobicContact CB-CE 3.81Å; F133-M164 HydrophobicContact CB-SD 3.89Å; F133-M164 HydrophobicContact CD2-CE 4.08Å; F133-M164 HydrophobicContact CG-CE 4.19Å; I152-M164 HydrophobicContact CG1-SD 4.16Å; I152-M164 HydrophobicContact CG2-CG 4.06Å; I155-M164 HydrophobicContact CB-CE 3.72Å; I155-M164 HydrophobicContact CD1-CE 4.23Å; I155-M164 HydrophobicContact CG2-CE 3.35Å; M164-T196 HydrophobicContact CG-CG2 4.01Å; M164-D197 PolarHBondContact N-OD2 2.86Å; M164-D197 PolarHBondContact O-N 2.78Å; M164-E198 PolarHBondContact O-N 3.24Å
165	N	93.9	Very high	90.3	Very high	6 Å²	6	39.9 Å²	39.9	3%	0.032	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	138.3	178.6	-77.1	17.6	0	0	0	111.1	F133 Q134 L135 I163 E198 L250	F133-N165 PolarHBondContact O-N 2.9Å; Q134-N165 CarbonylContact C-O 3.5Å; Q134-N165 WeakPolarHBondContact CA-O 3.25Å; L135-N165 PolarHBondContact N-O 2.9Å; I163-N165 WeakPolarHBondContact CG2-OD1 3.49Å; N165-E198 CarbonylContact C-O 3.59Å; N165-E198 WeakPolarHBondContact CA-O 3.3Å; N165-E198 PolarHBondContact ND2-OE2 3.06Å; N165-E198 WeakPolarHBondContact OD1-CB 3.41Å; N165-E198 PolarHBondContact OD1-OE2 3.37Å; N165-L250 WeakPolarHBondContact ND2-CD2 3.46Å
166	T	96	Very high	89.3	Confident	0 Å²	0	41 Å²	41	0%	0	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	140.6	175.9	80.8	0	0	0	0	112.3	L135 I152 S168 L192 T196 E198 T199 F200	L135-T166 HydrophobicContact CB-CG2 4.25Å; L135-T166 CarbonylContact O-C 3.46Å; L135-T166 WeakPolarHBondContact O-CA 3.35Å; I152-T166 HydrophobicContact CD1-CG2 3.76Å; T166-S168 PolarHBondContact OG1-OG 3.01Å; T166-L192 HydrophobicContact CG2-CD2 4.02Å; T166-T196 HydrophobicContact CG2-CG2 3.56Å; T166-E198 PolarHBondContact N-O 3.17Å; T166-T199 WeakPolarHBondContact OG1-CG2 3.45Å; T166-T199 PolarHBondContact OG1-OG1 2.98Å; T166-F200 WeakPolarHBondContact O-CD2 3.37Å; T166-F200 PolarHBondContact O-N 3.39Å
167	F	96.3	Very high	88.2	Confident	5 Å²	5	45.5 Å²	45.5	2%	0.022	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	98.7	165.2	-70.6	-89.8	0	0	0	106.7	Q134 L135 T136 H137 F200 I202 M233 V236	Q134-F167 HydrophobicContact CG-CD2 3.77Å; Q134-F167 HydrophobicContact CG-CE2 3.66Å; Q134-F167 VanDerWaalsContact NE2-CD2 3.31Å; L135-F167 PolarHBondContact O-N 3.33Å; T136-F167 HydrophobicContact CG2-CB 3.96Å; T136-F167 HydrophobicContact CG2-CD2 4.44Å; T136-F167 HydrophobicContact CG2-CG 4.48Å; H137-F167 PolarHBondContact N-O 3.43Å; F167-F200 HydrophobicContact CD1-CB 3.66Å; F167-F200 AromaticContact CD1-CD2 3.95Å; F167-F200 HydrophobicContact CD1-CD2 3.95Å; F167-F200 AromaticContact CD1-CG 3.93Å; F167-F200 HydrophobicContact CD1-CG 3.93Å; F167-F200 HydrophobicContact CD2-CD2 4.37Å; F167-F200 HydrophobicContact CE1-CB 3.88Å; F167-F200 HydrophobicContact CE1-CD1 4.29Å; F167-F200 AromaticContact CE1-CD2 3.54Å; F167-F200 HydrophobicContact CE1-CD2 3.54Å; F167-F200 HydrophobicContact CE1-CE2 4.2Å; F167-F200 AromaticContact CE1-CG 3.62Å; F167-F200 HydrophobicContact CE1-CG 3.62Å; F167-F200 AromaticContact CE2-CD2 3.95Å; F167-F200 HydrophobicContact CE2-CD2 3.95Å; F167-F200 HydrophobicContact CE2-CE2 4.28Å; F167-F200 HydrophobicContact CG-CB 4.37Å; F167-F200 HydrophobicContact CG-CD2 4.36Å; F167-F200 AromaticContact CZ-CD2 3.56Å; F167-F200 HydrophobicContact CZ-CD2 3.56Å; F167-F200 AromaticContact CZ-CE2 3.84Å; F167-F200 HydrophobicContact CZ-CE2 3.84Å; F167-F200 HydrophobicContact CZ-CG 4.11Å; F167-I202 HydrophobicContact CB-CD1 4.37Å; F167-I202 HydrophobicContact CD1-CD1 4.2Å; F167-M233 HydrophobicContact CD1-CG 3.63Å; F167-M233 HydrophobicContact CD1-SD 4.47Å; F167-M233 HydrophobicContact CD2-CE 4.13Å; F167-M233 HydrophobicContact CE1-CB 4.39Å; F167-M233 HydrophobicContact CE1-CG 3.73Å; F167-M233 HydrophobicContact CG-CE 4.17Å; F167-M233 HydrophobicContact CG-CG 4.12Å; F167-M233 HydrophobicContact CG-SD 4.44Å; F167-M233 HydrophobicContact CZ-CG 4.32Å; F167-V236 HydrophobicContact CZ-CB 4.42Å; F167-V236 HydrophobicContact CZ-CG1 4.1Å
168	S	95.7	Very high	87.8	Confident	0 Å²	0	41.8 Å²	41.8	0%	0	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105	112.6	-168.3	-69	0	0	0	0	110.2	H137 T166 F200 I202	H137-S168 PolarHBondContact CD2-OG 3.38Å; H137-S168 PolarHBondContact NE2-OG 3.49Å; T166-S168 PolarHBondContact OG1-OG 3.01Å; S168-F200 PolarHBondContact N-O 2.96Å; S168-I202 PolarHBondContact O-N 3.36Å
169	V	94.4	Very high	87.4	Confident	4 Å²	4	42.3 Å²	42.3	2%	0.024	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83	118.1	176	-174.6	0	0	0	0	110.2	I16 H137 L139 I202 N204	I16-V169 HydrophobicContact CD1-CG2 3.39Å; H137-V169 PolarHBondContact O-N 2.81Å; L139-V169 PolarHBondContact N-O 2.92Å; V169-I202 CarbonylContact C-O 3.52Å; V169-I202 VanDerWaalsContact CA-O 3.27Å; V169-I202 WeakPolarHBondContact CA-O 3.5Å; V169-I202 HydrophobicContact CG2-CB 4.38Å; V169-N204 WeakPolarHBondContact CG1-ND2 3.35Å; V169-N204 WeakPolarHBondContact CG1-OD1 3.43Å
170	M	90.9	Very high	87.3	Confident	0 Å²	0	40.4 Å²	40.4	0%	0	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.4	135.9	178.6	-55.7	-66.5	-176.6	0	0	109.9	L139 S201 I202 D203 N204 L377 L381	L139-M170 HydrophobicContact CD1-CE 3.89Å; L139-M170 HydrophobicContact CD1-SD 3.48Å; L139-M170 WeakPolarHBondContact CD1-SD 3.47Å; L139-M170 HydrophobicContact CG-SD 4.29Å; M170-S201 WeakPolarHBondContact CE-OG 3.35Å; M170-I202 PolarHBondContact N-O 3.34Å; M170-D203 HydrophobicContact CB-CB 4.48Å; M170-N204 PolarHBondContact O-N 3.34Å; M170-L377 HydrophobicContact CB-CD1 4.35Å; M170-L377 HydrophobicContact CE-CD2 4.08Å; M170-L377 HydrophobicContact CG-CD1 3.93Å; M170-L377 HydrophobicContact CG-CD2 3.95Å; M170-L377 HydrophobicContact CG-CG 4.49Å; M170-L377 HydrophobicContact SD-CD2 3.92Å; M170-L381 HydrophobicContact SD-CD1 4.43Å
171	P	89.1	Confident	87.3	Confident	7 Å²	7	38 Å²	38	5%	0.045	20%	0.203	C	C	.	.	P	Polyproline II helix	trans	-69	153.8	178.4	28	-33	0	0	0	111.8	E181 A185 L381	P171-E181 HydrophobicContact CB-CB 3.68Å; P171-E181 HydrophobicContact CB-CG 4.25Å; P171-E181 WeakPolarHBondContact CB-OE2 3.42Å; P171-E181 HydrophobicContact CG-CB 4.1Å; P171-A185 HydrophobicContact CG-CB 3.8Å; P171-L381 HydrophobicContact CG-CD2 3.93Å
172	S	82.3	Confident	87.4	Confident	1 Å²	1	32.4 Å²	32.4	1%	0.007	17%	0.173	C	C	.	.			trans	-143.5	133.5	173.3	178.2	0	0	0	0	110.9	K174 V175 S176 E205	S172-K174 PolarHBondContact O-N 3.21Å; S172-K174 PolarHBondContact OG-N 3.15Å; S172-V175 PolarHBondContact O-N 3.49Å; S172-S176 PolarHBondContact O-N 3.44Å; S172-S176 VanDerWaalsContact O-N 3.14Å; S172-E205 WeakPolarHBondContact OG-CB 3.41Å
173	P	75.8	Confident	87.6	Confident	76 Å²	76	27.9 Å²	27.9	49%	0.494	16%	0.157	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.4	-17	174.1	-21.7	31.7	0	0	0	114.4	V175	P173-V175 VanDerWaalsContact C-N 3.3Å
174	K	75.7	Confident	87.7	Confident	93 Å²	93	27.6 Å²	27.6	40%	0.404	16%	0.155	S	C	.	.	T	Hydrogen-bonded Turn	trans	-75.3	-22.1	176.9	-67.7	-175.7	-175.9	160	0	112.8	S172 E205 D209	S172-K174 PolarHBondContact O-N 3.21Å; S172-K174 PolarHBondContact OG-N 3.15Å; K174-E205 HydrophobicContact CD-CG 4.05Å; K174-E205 WeakPolarHBondContact CE-OE1 3.47Å; K174-E205 IonicContact NZ-OE1 2.75Å; K174-E205 PolarHBondContact NZ-OE1 3.02Å; K174-D209 IonicContact NZ-OD1 3Å; K174-D209 PolarHBondContact NZ-OD1 2.83Å; K174-D209 IonicContact NZ-OD2 3Å; K174-D209 PolarHBondContact NZ-OD2 2.85Å
175	V	74.1	Confident	87.7	Confident	31 Å²	31	27.3 Å²	27.3	19%	0.188	15%	0.154	C	C	.	.	T	Hydrogen-bonded Turn	trans	-113.6	-30.2	-169.4	178.6	0	0	0	0	111.8	S172 P173 N204 Y208 Y222	S172-V175 PolarHBondContact O-N 3.49Å; P173-V175 VanDerWaalsContact C-N 3.3Å; V175-N204 HydrophobicContact CB-CB 4.17Å; V175-N204 HydrophobicContact CG1-CB 4.36Å; V175-N204 HydrophobicContact CG2-CB 3.98Å; V175-Y208 HydrophobicContact CG2-CD2 4.18Å; V175-Y208 HydrophobicContact CG2-CG 4.37Å; V175-Y222 HydrophobicContact CG1-CE1 3.68Å; V175-Y222 WeakPolarHBondContact CG1-OH 3.09Å; V175-Y222 PolarHBondContact O-OH 3.29Å
176	S	73.4	Confident	87.7	Confident	25 Å²	25	27.1 Å²	27.1	18%	0.175	15%	0.153	C	C	.	.			trans	-129.4	139.5	179.5	-177.1	0	0	0	0	112	S172 T178 E181	S172-S176 PolarHBondContact O-N 3.44Å; S172-S176 VanDerWaalsContact O-N 3.14Å; S176-T178 VanDerWaalsContact C-N 3.32Å; S176-T178 PolarHBondContact OG-N 3.13Å; S176-T178 PolarHBondContact OG-OG1 3.32Å; S176-E181 WeakPolarHBondContact CB-OE1 3.49Å; S176-E181 PolarHBondContact OG-OE1 2.89Å
177	D	71.7	Confident	87.7	Confident	164 Å²	164	27.4 Å²	27.4	88%	0.877	15%	0.154	S	C	*	.			trans	-88.3	0.8	175.9	-66.1	-43.3	0	0	0	112.5	V179	D177-V179 PolarHBondContact O-N 2.93Å
178	T	83.9	Confident	87.6	Confident	44 Å²	44	27.2 Å²	27.2	27%	0.27	15%	0.153	S	C	.	.			trans	-74.4	115.2	-177.1	-59.4	0	0	0	0	110.4	N99 S176 V180 E181	N99-T178 HydrophobicContact CB-CG2 4.07Å; S176-T178 VanDerWaalsContact C-N 3.32Å; S176-T178 PolarHBondContact OG-N 3.13Å; S176-T178 PolarHBondContact OG-OG1 3.32Å; T178-V180 VanDerWaalsContact C-N 3.32Å; T178-V180 HydrophobicContact CG2-CG2 3.63Å; T178-V180 PolarHBondContact O-N 3.27Å; T178-E181 HydrophobicContact CG2-CG 3.95Å; T178-E181 WeakPolarHBondContact O-CG 3.33Å
179	V	87	Confident	87.6	Confident	81 Å²	81	27.2 Å²	27.2	49%	0.491	15%	0.153	S	C	.	.	T	Hydrogen-bonded Turn	trans	-72.3	-23.2	-175.3	-62.6	0	0	0	0	113.8	D177 P182 M388 F394	D177-V179 PolarHBondContact O-N 2.93Å; V179-P182 VanDerWaalsContact O-CD 3.31Å; V179-P182 WeakPolarHBondContact O-CD 3.43Å; V179-M388 HydrophobicContact CB-SD 4.48Å; V179-M388 WeakPolarHBondContact O-CE 3.17Å; V179-M388 VanDerWaalsContact O-SD 3.37Å; V179-F394 HydrophobicContact CG2-CD2 4.03Å; V179-F394 HydrophobicContact CG2-CE2 3.53Å; V179-F394 HydrophobicContact CG2-CZ 4.02Å
180	V	92.1	Very high	87.6	Confident	4 Å²	4	28.7 Å²	28.7	2%	0.024	16%	0.16	C	C	.	.	T	Hydrogen-bonded Turn	trans	-86.4	-2.4	-175.1	-62	0	0	0	0	115	N99 T178 P182 Y183 N184 F394	N99-V180 HydrophobicContact CB-CG2 4.26Å; N99-V180 WeakPolarHBondContact O-CG2 3.19Å; T178-V180 VanDerWaalsContact C-N 3.32Å; T178-V180 HydrophobicContact CG2-CG2 3.63Å; T178-V180 PolarHBondContact O-N 3.27Å; V180-P182 VanDerWaalsContact C-CD 3.41Å; V180-P182 VanDerWaalsContact C-N 3.34Å; V180-Y183 WeakPolarHBondContact O-CB 3.46Å; V180-Y183 PolarHBondContact O-N 3.42Å; V180-N184 PolarHBondContact O-N 3.21Å; V180-F394 HydrophobicContact CG1-CB 3.81Å; V180-F394 HydrophobicContact CG1-CD2 4.13Å; V180-F394 HydrophobicContact CG1-CG 3.94Å
181	E	91.8	Very high	87.8	Confident	22 Å²	22	30.4 Å²	30.4	10%	0.103	17%	0.168	C	C	.	.	H	α-helix	trans	-55.7	-37.4	-179.8	-62.9	-176.8	161.8	0	0	114.7	P171 S176 T178 Y183 N184 A185	P171-E181 HydrophobicContact CB-CB 3.68Å; P171-E181 HydrophobicContact CB-CG 4.25Å; P171-E181 WeakPolarHBondContact CB-OE2 3.42Å; P171-E181 HydrophobicContact CG-CB 4.1Å; S176-E181 WeakPolarHBondContact CB-OE1 3.49Å; S176-E181 PolarHBondContact OG-OE1 2.89Å; T178-E181 HydrophobicContact CG2-CG 3.95Å; T178-E181 WeakPolarHBondContact O-CG 3.33Å; E181-Y183 VanDerWaalsContact C-N 3.28Å; E181-Y183 PolarHBondContact O-N 3.46Å; E181-N184 PolarHBondContact O-N 2.81Å; E181-A185 WeakPolarHBondContact O-CB 3.07Å; E181-A185 PolarHBondContact O-N 3.36Å
182	P	93.3	Very high	88.1	Confident	11 Å²	11	30 Å²	30	7%	0.071	17%	0.166	C	C	.	.	H	α-helix	trans	-61.4	-34.8	176.3	-24.8	35.9	0	0	0	113.1	V179 V180 T186 Q384 F385	V179-P182 VanDerWaalsContact O-CD 3.31Å; V179-P182 WeakPolarHBondContact O-CD 3.43Å; V180-P182 VanDerWaalsContact C-CD 3.41Å; V180-P182 VanDerWaalsContact C-N 3.34Å; P182-T186 WeakPolarHBondContact O-CB 3.48Å; P182-T186 PolarHBondContact O-N 3.3Å; P182-T186 PolarHBondContact O-OG1 3.02Å; P182-Q384 HydrophobicContact CB-CB 3.95Å; P182-Q384 HydrophobicContact CG-CB 3.75Å; P182-F385 HydrophobicContact CB-CB 4.36Å
183	Y	94.6	Very high	88.6	Confident	0 Å²	0	30.3 Å²	30.3	0%	0	17%	0.167	C	C	.	.	H	α-helix	trans	-64.2	-52.5	174.5	-73.8	-49.5	0	0	0	111.1	V180 E181 A185 T186 L187 F385 M388 F389 A393 Y398 F408	V180-Y183 WeakPolarHBondContact O-CB 3.46Å; V180-Y183 PolarHBondContact O-N 3.42Å; E181-Y183 VanDerWaalsContact C-N 3.28Å; E181-Y183 PolarHBondContact O-N 3.46Å; Y183-A185 VanDerWaalsContact C-N 3.26Å; Y183-A185 PolarHBondContact O-N 2.99Å; Y183-T186 PolarHBondContact O-N 2.92Å; Y183-L187 VanDerWaalsContact O-CG 3.27Å; Y183-L187 WeakPolarHBondContact O-CG 3.33Å; Y183-L187 PolarHBondContact O-N 2.97Å; Y183-L187 VanDerWaalsContact O-N 3.09Å; Y183-F385 AromaticContact CD1-CD2 3.57Å; Y183-F385 HydrophobicContact CD1-CD2 3.57Å; Y183-F385 AromaticContact CD1-CE2 3.42Å; Y183-F385 HydrophobicContact CD1-CE2 3.42Å; Y183-F385 VanDerWaalsContact CD1-CE2 3.42Å; Y183-F385 HydrophobicContact CD1-CZ 4.19Å; Y183-F385 HydrophobicContact CE1-CD2 4.07Å; Y183-F385 AromaticContact CE1-CE2 3.91Å; Y183-F385 HydrophobicContact CE1-CE2 3.91Å; Y183-F385 HydrophobicContact CE1-CZ 4.28Å; Y183-M388 HydrophobicContact CD2-CE 3.5Å; Y183-M388 VanDerWaalsContact CD2-CE 3.5Å; Y183-M388 HydrophobicContact CE1-CB 4.43Å; Y183-M388 HydrophobicContact CE2-CB 4.07Å; Y183-M388 HydrophobicContact CE2-CE 3.39Å; Y183-M388 HydrophobicContact CG-CE 4.32Å; Y183-M388 WeakPolarHBondContact OH-CB 3.31Å; Y183-M388 PolarHBondContact OH-O 3.14Å; Y183-F389 HydrophobicContact CE1-CB 4.04Å; Y183-F389 HydrophobicContact CE1-CD2 4.14Å; Y183-F389 WeakPolarHBondContact OH-CA 3.44Å; Y183-F389 PolarHBondContact OH-N 2.81Å; Y183-A393 VanDerWaalsContact CE2-O 3.31Å; Y183-A393 WeakPolarHBondContact CE2-O 3.49Å; Y183-A393 PolarHBondContact OH-O 3.3Å; Y183-Y398 WeakPolarHBondContact CB-OH 3.48Å; Y183-Y398 HydrophobicContact CD2-CE2 4.01Å; Y183-Y398 HydrophobicContact CG-CE2 4.42Å; Y183-F408 AromaticContact CD1-CD1 3.78Å; Y183-F408 HydrophobicContact CD1-CD1 3.78Å; Y183-F408 AromaticContact CD1-CE1 3.59Å; Y183-F408 HydrophobicContact CD1-CE1 3.59Å; Y183-F408 HydrophobicContact CE1-CD1 4.07Å; Y183-F408 HydrophobicContact CE1-CE1 4.12Å; Y183-F408 HydrophobicContact CG-CE1 4.02Å
184	N	94.8	Very high	89.3	Confident	0 Å²	0	32 Å²	32	0%	0	17%	0.169	C	C	.	.	H	α-helix	trans	-58.8	-40.7	-179.6	-61.3	-28.4	0	0	0	111.4	N99 W101 L139 G140 G141 V180 E181 S188 Y398	N99-N184 PolarHBondContact O-ND2 2.76Å; W101-N184 HydrophobicContact CB-CB 4.13Å; W101-N184 WeakPolarHBondContact CB-OD1 3.01Å; W101-N184 PolarHBondContact N-OD1 3.38Å; L139-N184 CarbonylContact O-C 3.49Å; L139-N184 VanDerWaalsContact O-CB 3.29Å; L139-N184 WeakPolarHBondContact O-CB 3.29Å; G140-N184 PolarHBondContact O-ND2 3.42Å; G141-N184 WeakPolarHBondContact O-CB 3.47Å; G141-N184 PolarHBondContact O-ND2 3.39Å; V180-N184 PolarHBondContact O-N 3.21Å; E181-N184 PolarHBondContact O-N 2.81Å; N184-S188 VanDerWaalsContact O-CB 3.32Å; N184-S188 WeakPolarHBondContact O-CB 3.47Å; N184-S188 PolarHBondContact O-N 2.83Å; N184-S188 PolarHBondContact O-OG 2.86Å; N184-Y398 WeakPolarHBondContact OD1-CE1 3.5Å; N184-Y398 PolarHBondContact OD1-OH 3.42Å
185	A	94.4	Very high	90.2	Very high	0 Å²	0	28.8 Å²	28.8	0%	0	16%	0.156	C	C	.	.	H	α-helix	trans	-69.7	-45.7	-179.5	0	0	0	0	0	112.6	L139 P171 E181 Y183 L187 S188 V189 L381	L139-A185 HydrophobicContact CB-CB 4.08Å; L139-A185 PolarHBondContact O-N 2.89Å; P171-A185 HydrophobicContact CG-CB 3.8Å; E181-A185 WeakPolarHBondContact O-CB 3.07Å; E181-A185 PolarHBondContact O-N 3.36Å; Y183-A185 VanDerWaalsContact C-N 3.26Å; Y183-A185 PolarHBondContact O-N 2.99Å; A185-L187 PolarHBondContact O-N 2.82Å; A185-S188 PolarHBondContact O-N 3.43Å; A185-V189 WeakPolarHBondContact O-CG2 3.48Å; A185-V189 PolarHBondContact O-N 3.01Å; A185-L381 HydrophobicContact CB-CD1 4.33Å; A185-L381 HydrophobicContact CB-CD2 4.23Å
186	T	94.7	Very high	91.1	Very high	2 Å²	2	27.6 Å²	27.6	1%	0.012	15%	0.148	C	C	.	.	H	α-helix	trans	-61.6	-45.2	178.5	-62.5	0	0	0	0	111.6	P182 Y183 S188 V189 H190 F385 A411 M415	P182-T186 WeakPolarHBondContact O-CB 3.48Å; P182-T186 PolarHBondContact O-N 3.3Å; P182-T186 PolarHBondContact O-OG1 3.02Å; Y183-T186 PolarHBondContact O-N 2.92Å; T186-S188 VanDerWaalsContact C-N 3.31Å; T186-S188 PolarHBondContact O-N 2.86Å; T186-V189 PolarHBondContact O-N 3.23Å; T186-H190 PolarHBondContact O-N 2.76Å; T186-H190 VanDerWaalsContact O-N 3.13Å; T186-F385 VanDerWaalsContact CB-CD2 3.49Å; T186-F385 HydrophobicContact CG2-CD2 3.81Å; T186-F385 HydrophobicContact CG2-CE2 3.78Å; T186-F385 HydrophobicContact CG2-CG 4.26Å; T186-F385 HydrophobicContact CG2-CZ 4.29Å; T186-F385 WeakPolarHBondContact OG1-CD2 3.32Å; T186-A411 HydrophobicContact CG2-CB 4.08Å; T186-M415 HydrophobicContact CG2-CE 4.16Å
187	L	95.4	Very high	92.1	Very high	6 Å²	6	28 Å²	28	3%	0.031	15%	0.149	C	C	.	.	H	α-helix	trans	-62.8	-39.3	176.6	-64.2	171.4	0	0	0	111.9	W101 Y183 A185 Q191 Y398 M403 F408 A411	W101-L187 HydrophobicContact CB-CD1 4.34Å; W101-L187 HydrophobicContact CD2-CB 3.83Å; W101-L187 HydrophobicContact CD2-CD1 3.9Å; W101-L187 HydrophobicContact CE3-CB 4.2Å; W101-L187 HydrophobicContact CE3-CD1 3.68Å; W101-L187 HydrophobicContact CE3-CG 4.49Å; W101-L187 HydrophobicContact CG-CB 4.19Å; W101-L187 HydrophobicContact CG-CD1 4.2Å; W101-L187 HydrophobicContact CZ2-CB 4.16Å; W101-L187 HydrophobicContact CZ3-CD1 4.3Å; Y183-L187 VanDerWaalsContact O-CG 3.27Å; Y183-L187 WeakPolarHBondContact O-CG 3.33Å; Y183-L187 PolarHBondContact O-N 2.97Å; Y183-L187 VanDerWaalsContact O-N 3.09Å; A185-L187 PolarHBondContact O-N 2.82Å; L187-Q191 PolarHBondContact O-N 2.94Å; L187-Y398 HydrophobicContact CD1-CD1 4.39Å; L187-Y398 HydrophobicContact CD1-CE1 4.36Å; L187-M403 HydrophobicContact CD1-CE 3.64Å; L187-M403 HydrophobicContact CD1-SD 4.08Å; L187-M403 HydrophobicContact CD2-CE 3.37Å; L187-M403 HydrophobicContact CG-CE 4.14Å; L187-F408 HydrophobicContact CD1-CE1 3.94Å; L187-F408 HydrophobicContact CD1-CZ 4.13Å; L187-F408 HydrophobicContact CD2-CD1 4.46Å; L187-A411 HydrophobicContact CD2-CB 3.74Å
188	S	95.4	Very high	93.1	Very high	0 Å²	0	20.2 Å²	20.2	0%	0	11%	0.107	C	C	.	.	H	α-helix	trans	-69.6	-42.7	178.7	-57.6	0	0	0	0	112.7	W101 S145 N184 A185 T186 H190 Q191 L192	W101-S188 VanDerWaalsContact CD1-OG 3.27Å; W101-S188 PolarHBondContact NE1-OG 3.4Å; S145-S188 VanDerWaalsContact CB-OG 3.25Å; S145-S188 WeakPolarHBondContact CB-OG 3.21Å; N184-S188 VanDerWaalsContact O-CB 3.32Å; N184-S188 WeakPolarHBondContact O-CB 3.47Å; N184-S188 PolarHBondContact O-N 2.83Å; N184-S188 PolarHBondContact O-OG 2.86Å; A185-S188 PolarHBondContact O-N 3.43Å; T186-S188 VanDerWaalsContact C-N 3.31Å; T186-S188 PolarHBondContact O-N 2.86Å; S188-H190 VanDerWaalsContact C-N 3.29Å; S188-H190 PolarHBondContact O-N 3.19Å; S188-Q191 WeakPolarHBondContact O-CB 3.43Å; S188-Q191 PolarHBondContact O-N 3.15Å; S188-Q191 VanDerWaalsContact O-N 3.13Å; S188-L192 VanDerWaalsContact O-CG 3.29Å; S188-L192 WeakPolarHBondContact O-CG 3.3Å; S188-L192 PolarHBondContact O-N 3.5Å
189	V	94.7	Very high	93.7	Very high	1 Å²	1	18.1 Å²	18.1	1%	0.006	9%	0.094	C	C	.	.	H	α-helix	trans	-62.4	-39.6	178.8	169.8	0	0	0	0	110.7	L139 A185 T186 Q191 L192 V193 F265 F378 M415 L418	L139-V189 HydrophobicContact CD1-CG2 3.78Å; A185-V189 WeakPolarHBondContact O-CG2 3.48Å; A185-V189 PolarHBondContact O-N 3.01Å; T186-V189 PolarHBondContact O-N 3.23Å; V189-Q191 PolarHBondContact O-N 2.86Å; V189-L192 PolarHBondContact O-N 3.24Å; V189-V193 HydrophobicContact CG1-CG2 4.09Å; V189-V193 VanDerWaalsContact O-CG2 3.26Å; V189-V193 WeakPolarHBondContact O-CG2 3.4Å; V189-V193 PolarHBondContact O-N 3.14Å; V189-F265 HydrophobicContact CG1-CZ 4.21Å; V189-F378 HydrophobicContact CG1-CD1 4.29Å; V189-F378 HydrophobicContact CG1-CE1 3.8Å; V189-F378 HydrophobicContact CG2-CE1 4.1Å; V189-M415 HydrophobicContact CB-CE 3.37Å; V189-M415 HydrophobicContact CB-SD 4.37Å; V189-M415 HydrophobicContact CG1-CE 3.4Å; V189-M415 HydrophobicContact CG1-SD 3.73Å; V189-M415 HydrophobicContact CG2-CE 3.87Å; V189-L418 HydrophobicContact CG1-CD2 4.43Å
190	H	94.5	Very high	94.1	Very high	35 Å²	35	14.2 Å²	14.2	16%	0.162	7%	0.071	C	C	.	.	H	α-helix	trans	-53.4	-44	173.8	166.2	60	0	0	0	111.8	T186 S188 A411 N414	T186-H190 PolarHBondContact O-N 2.76Å; T186-H190 VanDerWaalsContact O-N 3.13Å; S188-H190 VanDerWaalsContact C-N 3.29Å; S188-H190 PolarHBondContact O-N 3.19Å; H190-A411 HydrophobicContact CB-CB 3.92Å; H190-N414 PolarHBondContact ND1-ND2 3.44Å
191	Q	94.6	Very high	94.2	Very high	35 Å²	35	14 Å²	14	16%	0.164	7%	0.07	C	C	.	.	H	α-helix	trans	-70.6	-34.7	175.6	-64.4	-61.7	-38.2	0	0	113.7	W101 T149 L187 S188 V189 N195	W101-Q191 HydrophobicContact CZ2-CG 4.23Å; T149-Q191 HydrophobicContact CG2-CB 3.82Å; L187-Q191 PolarHBondContact O-N 2.94Å; S188-Q191 WeakPolarHBondContact O-CB 3.43Å; S188-Q191 PolarHBondContact O-N 3.15Å; S188-Q191 VanDerWaalsContact O-N 3.13Å; V189-Q191 PolarHBondContact O-N 2.86Å; Q191-N195 WeakPolarHBondContact O-CB 3.44Å; Q191-N195 PolarHBondContact O-N 3.36Å; Q191-N195 VanDerWaalsContact O-N 3.16Å; Q191-N195 PolarHBondContact O-ND2 3.25Å; Q191-N195 PolarHBondContact OE1-ND2 2.93Å
192	L	94.8	Very high	94.3	Very high	0 Å²	0	13.1 Å²	13.1	0%	0	7%	0.065	C	C	.	.	H	α-helix	trans	-68.8	-38.3	-179.9	-68.4	170.8	0	0	0	112.3	L139 T149 I152 T166 S188 V189 E194 N195 T196 H264 F265	L139-L192 HydrophobicContact CD1-CD1 3.83Å; L139-L192 HydrophobicContact CD2-CD1 3.78Å; L139-L192 HydrophobicContact CG-CD1 4.49Å; T149-L192 HydrophobicContact CG2-CG 4.47Å; I152-L192 HydrophobicContact CD1-CD2 3.69Å; T166-L192 HydrophobicContact CG2-CD2 4.02Å; S188-L192 VanDerWaalsContact O-CG 3.29Å; S188-L192 WeakPolarHBondContact O-CG 3.3Å; S188-L192 PolarHBondContact O-N 3.5Å; V189-L192 PolarHBondContact O-N 3.24Å; L192-E194 PolarHBondContact O-N 3.05Å; L192-N195 PolarHBondContact O-N 3.14Å; L192-T196 HydrophobicContact CB-CG2 4.45Å; L192-T196 HydrophobicContact CD2-CG2 3.55Å; L192-T196 PolarHBondContact O-N 3.02Å; L192-T196 VanDerWaalsContact O-N 3.16Å; L192-T196 PolarHBondContact O-OG1 3.35Å; L192-H264 PolarHBondContact O-NE2 3.42Å; L192-F265 HydrophobicContact CB-CE1 4.33Å; L192-F265 HydrophobicContact CB-CZ 4.21Å
193	V	94.1	Very high	94.3	Very high	6 Å²	6	12.6 Å²	12.6	4%	0.036	6%	0.062	C	C	.	.	H	α-helix	trans	-57	-32.9	179	170.8	0	0	0	0	112	V189 R262 H264 F265 L418	V189-V193 HydrophobicContact CG1-CG2 4.09Å; V189-V193 VanDerWaalsContact O-CG2 3.26Å; V189-V193 WeakPolarHBondContact O-CG2 3.4Å; V189-V193 PolarHBondContact O-N 3.14Å; V193-R262 HydrophobicContact CG1-CB 4.25Å; V193-R262 HydrophobicContact CG1-CG 4.06Å; V193-H264 PolarHBondContact O-CE1 3.39Å; V193-F265 HydrophobicContact CG2-CE2 3.73Å; V193-F265 HydrophobicContact CG2-CZ 3.76Å; V193-L418 HydrophobicContact CG2-CD1 4.44Å; V193-L418 HydrophobicContact CG2-CD2 3.83Å
194	E	90.7	Very high	94	Very high	113 Å²	113	13.8 Å²	13.8	53%	0.528	7%	0.068	S	C	.	.	H	α-helix	trans	-97.9	-33.5	-175.7	-62.8	-175	176.2	0	0	113.1	L192	L192-E194 PolarHBondContact O-N 3.05Å
195	N	93.8	Very high	93.7	Very high	24 Å²	24	15.6 Å²	15.6	13%	0.128	8%	0.077	C	C	.	.	H	α-helix	trans	-107.3	-3.7	-166.6	-60.1	-68.4	0	0	0	114.9	I152 Q191 L192	I152-N195 HydrophobicContact CG2-CB 3.49Å; I152-N195 VanDerWaalsContact CG2-CB 3.49Å; Q191-N195 WeakPolarHBondContact O-CB 3.44Å; Q191-N195 PolarHBondContact O-N 3.36Å; Q191-N195 VanDerWaalsContact O-N 3.16Å; Q191-N195 PolarHBondContact O-ND2 3.25Å; Q191-N195 PolarHBondContact OE1-ND2 2.93Å; L192-N195 PolarHBondContact O-N 3.14Å
196	T	94.4	Very high	93.5	Very high	6 Å²	6	16 Å²	16	4%	0.037	8%	0.08	C	C	.	.			trans	-115.4	146.9	179.9	71.3	0	0	0	0	112.5	I152 M164 T166 L192 T199 H264	I152-T196 HydrophobicContact CD1-CG2 4.1Å; I152-T196 HydrophobicContact CG2-CG2 3.87Å; M164-T196 HydrophobicContact CG-CG2 4.01Å; T166-T196 HydrophobicContact CG2-CG2 3.56Å; L192-T196 HydrophobicContact CB-CG2 4.45Å; L192-T196 HydrophobicContact CD2-CG2 3.55Å; L192-T196 PolarHBondContact O-N 3.02Å; L192-T196 VanDerWaalsContact O-N 3.16Å; L192-T196 PolarHBondContact O-OG1 3.35Å; T196-T199 PolarHBondContact OG1-OG1 3.46Å; T196-H264 PolarHBondContact O-CE1 2.89Å; T196-H264 VanDerWaalsContact O-CE1 3.29Å; T196-H264 PolarHBondContact O-NE2 3.1Å; T196-H264 PolarHBondContact OG1-CD2 3.01Å; T196-H264 PolarHBondContact OG1-NE2 3.44Å
197	D	93.7	Very high	93.3	Very high	34 Å²	34	16 Å²	16	18%	0.182	8%	0.08	C	C	.	.	S	Bend	trans	-92.9	-31.7	177	-56	-66.4	0	0	0	111.2	R156 I163 M164 H264	R156-D197 IonicContact CZ-OD1 2.95Å; R156-D197 IonicContact CZ-OD2 2.74Å; R156-D197 IonicContact NH1-OD1 2.99Å; R156-D197 PolarHBondContact NH1-OD1 2.82Å; R156-D197 IonicContact NH1-OD2 3.15Å; R156-D197 PolarHBondContact NH1-OD2 3.34Å; R156-D197 IonicContact NH2-OD1 3.86Å; R156-D197 PolarHBondContact NH2-OD1 3.01Å; R156-D197 IonicContact NH2-OD2 2.88Å; I163-D197 VanDerWaalsContact CA-OD2 3.29Å; I163-D197 WeakPolarHBondContact CA-OD2 3.32Å; I163-D197 HydrophobicContact CD1-CB 4.25Å; I163-D197 HydrophobicContact CG2-CB 4.29Å; M164-D197 PolarHBondContact N-OD2 2.86Å; M164-D197 PolarHBondContact O-N 2.78Å; D197-H264 WeakPolarHBondContact O-CB 3.23Å
198	E	93.3	Very high	93	Very high	0 Å²	0	19 Å²	19	0%	0	9%	0.091	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143	127.4	176.2	-59.1	-178.2	166.4	0	0	111	M164 N165 T166 F200 A254 F266	M164-E198 PolarHBondContact O-N 3.24Å; N165-E198 CarbonylContact C-O 3.59Å; N165-E198 WeakPolarHBondContact CA-O 3.3Å; N165-E198 PolarHBondContact ND2-OE2 3.06Å; N165-E198 WeakPolarHBondContact OD1-CB 3.41Å; N165-E198 PolarHBondContact OD1-OE2 3.37Å; T166-E198 PolarHBondContact N-O 3.17Å; E198-F200 HydrophobicContact CB-CE2 4.45Å; E198-A254 HydrophobicContact CG-CB 4.08Å; E198-A254 WeakPolarHBondContact OE1-CA 3.48Å; E198-A254 VanDerWaalsContact OE1-CB 3.24Å; E198-A254 WeakPolarHBondContact OE1-CB 3.39Å; E198-A254 PolarHBondContact OE1-N 3.44Å; E198-F266 HydrophobicContact CB-CD2 4.4Å; E198-F266 HydrophobicContact CB-CE2 3.68Å; E198-F266 HydrophobicContact CB-CZ 4.43Å; E198-F266 HydrophobicContact CG-CE2 3.7Å; E198-F266 HydrophobicContact CG-CZ 4.14Å
199	T	95.6	Very high	92.8	Very high	0 Å²	0	20.7 Å²	20.7	0%	0	10%	0.1	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	115.3	174.6	-72.7	0	0	0	0	110.9	T166 T196 S201 H264 F265 F266	T166-T199 WeakPolarHBondContact OG1-CG2 3.45Å; T166-T199 PolarHBondContact OG1-OG1 2.98Å; T196-T199 PolarHBondContact OG1-OG1 3.46Å; T199-S201 PolarHBondContact O-N 2.9Å; T199-H264 PolarHBondContact N-O 2.99Å; T199-F265 HydrophobicContact CG2-CD1 3.57Å; T199-F265 HydrophobicContact CG2-CE1 3.71Å; T199-F265 CarbonylContact O-C 3.56Å; T199-F265 WeakPolarHBondContact O-CA 3.41Å; T199-F266 PolarHBondContact O-N 3.07Å
200	F	95.8	Very high	92.5	Very high	0 Å²	0	20.9 Å²	20.9	0%	0	10%	0.101	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.8	108	172.8	-62.5	-84.7	0	0	0	109.3	T166 F167 S168 E198 I202 V236 F266 I368	T166-F200 WeakPolarHBondContact O-CD2 3.37Å; T166-F200 PolarHBondContact O-N 3.39Å; F167-F200 HydrophobicContact CD1-CB 3.66Å; F167-F200 AromaticContact CD1-CD2 3.95Å; F167-F200 HydrophobicContact CD1-CD2 3.95Å; F167-F200 AromaticContact CD1-CG 3.93Å; F167-F200 HydrophobicContact CD1-CG 3.93Å; F167-F200 HydrophobicContact CD2-CD2 4.37Å; F167-F200 HydrophobicContact CE1-CB 3.88Å; F167-F200 HydrophobicContact CE1-CD1 4.29Å; F167-F200 AromaticContact CE1-CD2 3.54Å; F167-F200 HydrophobicContact CE1-CD2 3.54Å; F167-F200 HydrophobicContact CE1-CE2 4.2Å; F167-F200 AromaticContact CE1-CG 3.62Å; F167-F200 HydrophobicContact CE1-CG 3.62Å; F167-F200 AromaticContact CE2-CD2 3.95Å; F167-F200 HydrophobicContact CE2-CD2 3.95Å; F167-F200 HydrophobicContact CE2-CE2 4.28Å; F167-F200 HydrophobicContact CG-CB 4.37Å; F167-F200 HydrophobicContact CG-CD2 4.36Å; F167-F200 AromaticContact CZ-CD2 3.56Å; F167-F200 HydrophobicContact CZ-CD2 3.56Å; F167-F200 AromaticContact CZ-CE2 3.84Å; F167-F200 HydrophobicContact CZ-CE2 3.84Å; F167-F200 HydrophobicContact CZ-CG 4.11Å; S168-F200 PolarHBondContact N-O 2.96Å; E198-F200 HydrophobicContact CB-CE2 4.45Å; F200-I202 PolarHBondContact O-N 2.79Å; F200-V236 HydrophobicContact CD1-CG1 4.46Å; F200-V236 HydrophobicContact CD1-CG2 4.29Å; F200-V236 HydrophobicContact CE1-CB 4.49Å; F200-V236 HydrophobicContact CE1-CG1 3.63Å; F200-V236 HydrophobicContact CE1-CG2 3.98Å; F200-V236 HydrophobicContact CE2-CG1 4.04Å; F200-V236 HydrophobicContact CZ-CG1 3.4Å; F200-V236 VanDerWaalsContact CZ-CG1 3.4Å; F200-F266 HydrophobicContact CD1-CB 4.14Å; F200-F266 HydrophobicContact CD1-CD2 4.05Å; F200-F266 HydrophobicContact CE1-CB 4.4Å; F200-F266 AromaticContact CE1-CD2 3.67Å; F200-F266 HydrophobicContact CE1-CD2 3.67Å; F200-F266 HydrophobicContact CE1-CE2 4.48Å; F200-F266 HydrophobicContact CE1-CG 4.5Å; F200-F266 AromaticContact CZ-CD2 3.91Å; F200-F266 HydrophobicContact CZ-CD2 3.91Å; F200-F266 HydrophobicContact CZ-CE2 4.33Å; F200-I368 HydrophobicContact CD1-CG2 4.44Å; F200-I368 HydrophobicContact CE1-CD1 4.09Å; F200-I368 HydrophobicContact CE1-CG1 4.26Å; F200-I368 HydrophobicContact CE1-CG2 3.78Å
201	S	94.6	Very high	92.2	Very high	0 Å²	0	19.2 Å²	19.2	0%	0	9%	0.093	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.6	109.1	-178.8	-63.8	0	0	0	0	110.4	M170 T199 F266 P268	M170-S201 WeakPolarHBondContact CE-OG 3.35Å; T199-S201 PolarHBondContact O-N 2.9Å; S201-F266 WeakPolarHBondContact CB-O 3.34Å; S201-F266 PolarHBondContact N-O 3.5Å; S201-P268 WeakPolarHBondContact O-CD 3.41Å
202	I	94.1	Very high	91.9	Very high	2 Å²	2	22.2 Å²	22.2	1%	0.01	11%	0.106	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	111.4	-179.2	-53.3	-174.3	0	0	0	108.5	F167 S168 V169 M170 F200 L207 V229 P268	F167-I202 HydrophobicContact CB-CD1 4.37Å; F167-I202 HydrophobicContact CD1-CD1 4.2Å; S168-I202 PolarHBondContact O-N 3.36Å; V169-I202 CarbonylContact C-O 3.52Å; V169-I202 VanDerWaalsContact CA-O 3.27Å; V169-I202 WeakPolarHBondContact CA-O 3.5Å; V169-I202 HydrophobicContact CG2-CB 4.38Å; M170-I202 PolarHBondContact N-O 3.34Å; F200-I202 PolarHBondContact O-N 2.79Å; I202-L207 HydrophobicContact CG2-CD1 3.66Å; I202-L207 HydrophobicContact CG2-CG 4.29Å; I202-V229 HydrophobicContact CD1-CG1 3.56Å; I202-V229 HydrophobicContact CD1-CG2 4.44Å; I202-V229 HydrophobicContact CG2-CG2 3.69Å; I202-P268 HydrophobicContact CG1-CG 4.34Å
203	D	92	Very high	91.5	Very high	0 Å²	0	29.5 Å²	29.5	0%	0	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.1	120.2	-176.2	-168.3	-8.4	0	0	0	112	M170 E205 A206 L207 M300 A302 L377 R380	M170-D203 HydrophobicContact CB-CB 4.48Å; D203-E205 PolarHBondContact O-N 3.36Å; D203-E205 WeakPolarHBondContact OD1-CB 3.39Å; D203-E205 PolarHBondContact OD1-N 3.39Å; D203-A206 HydrophobicContact CB-CB 4.15Å; D203-A206 PolarHBondContact O-N 2.89Å; D203-A206 VanDerWaalsContact O-N 3.11Å; D203-L207 WeakPolarHBondContact O-CG 3.36Å; D203-L207 PolarHBondContact O-N 2.92Å; D203-M300 PolarHBondContact N-O 3.48Å; D203-A302 WeakPolarHBondContact OD2-CB 3.43Å; D203-A302 PolarHBondContact OD2-N 3.19Å; D203-L377 HydrophobicContact CB-CD1 4.12Å; D203-R380 IonicContact OD1-NH2 3.88Å; D203-R380 PolarHBondContact OD1-NH2 3.45Å; D203-R380 IonicContact OD2-CZ 2.77Å; D203-R380 IonicContact OD2-NH1 2.85Å; D203-R380 PolarHBondContact OD2-NH1 3.07Å; D203-R380 IonicContact OD2-NH2 3.81Å; D203-R380 PolarHBondContact OD2-NH2 2.72Å
204	N	89.3	Confident	91	Very high	25 Å²	25	31.1 Å²	31.1	13%	0.134	14%	0.144	C	C	.	.	H	α-helix	trans	-57.6	-30	173.2	-83.3	-24.8	0	0	0	112.6	V169 M170 V175 Y208	V169-N204 WeakPolarHBondContact CG1-ND2 3.35Å; V169-N204 WeakPolarHBondContact CG1-OD1 3.43Å; M170-N204 PolarHBondContact O-N 3.34Å; V175-N204 HydrophobicContact CB-CB 4.17Å; V175-N204 HydrophobicContact CG1-CB 4.36Å; V175-N204 HydrophobicContact CG2-CB 3.98Å; N204-Y208 VanDerWaalsContact O-CB 3.28Å; N204-Y208 WeakPolarHBondContact O-CB 3.43Å; N204-Y208 PolarHBondContact O-N 3.3Å
205	E	88.1	Confident	90.8	Very high	38 Å²	38	27.3 Å²	27.3	18%	0.178	13%	0.127	C	C	.	.	H	α-helix	trans	-63.8	-47.7	174.6	-176.6	153.6	-175.7	0	0	111.9	S172 K174 D203 Y208 D209 A302 R380	S172-E205 WeakPolarHBondContact OG-CB 3.41Å; K174-E205 HydrophobicContact CD-CG 4.05Å; K174-E205 WeakPolarHBondContact CE-OE1 3.47Å; K174-E205 IonicContact NZ-OE1 2.75Å; K174-E205 PolarHBondContact NZ-OE1 3.02Å; D203-E205 PolarHBondContact O-N 3.36Å; D203-E205 WeakPolarHBondContact OD1-CB 3.39Å; D203-E205 PolarHBondContact OD1-N 3.39Å; E205-Y208 PolarHBondContact O-N 2.88Å; E205-D209 WeakPolarHBondContact O-CB 3.25Å; E205-D209 PolarHBondContact O-N 2.89Å; E205-A302 HydrophobicContact CB-CB 4.05Å; E205-A302 HydrophobicContact CG-CB 4.06Å; E205-R380 IonicContact OE2-CZ 3.49Å; E205-R380 IonicContact OE2-NE 3.85Å; E205-R380 IonicContact OE2-NH1 3.24Å; E205-R380 PolarHBondContact OE2-NH1 3.31Å
206	A	90.3	Very high	90.4	Very high	9 Å²	9	33.4 Å²	33.4	7%	0.074	15%	0.152	C	C	.	.	H	α-helix	trans	-66.7	-44	179.7	0	0	0	0	0	111.2	D203 Y208 D209 I210 A302	D203-A206 HydrophobicContact CB-CB 4.15Å; D203-A206 PolarHBondContact O-N 2.89Å; D203-A206 VanDerWaalsContact O-N 3.11Å; A206-Y208 VanDerWaalsContact C-N 3.32Å; A206-Y208 PolarHBondContact O-N 2.93Å; A206-D209 PolarHBondContact O-N 2.93Å; A206-I210 WeakPolarHBondContact O-CB 3.38Å; A206-I210 VanDerWaalsContact O-CG1 3.27Å; A206-I210 WeakPolarHBondContact O-CG1 3.4Å; A206-I210 PolarHBondContact O-N 2.82Å; A206-A302 HydrophobicContact CB-CB 4.01Å
207	L	90.7	Very high	90	Very high	1 Å²	1	36 Å²	36	1%	0.005	17%	0.165	C	C	.	.	H	α-helix	trans	-59.2	-43.6	176.1	-67.5	177.1	0	0	0	112	I202 D203 I210 C211 L225 L228 V229 M300	I202-L207 HydrophobicContact CG2-CD1 3.66Å; I202-L207 HydrophobicContact CG2-CG 4.29Å; D203-L207 WeakPolarHBondContact O-CG 3.36Å; D203-L207 PolarHBondContact O-N 2.92Å; L207-I210 PolarHBondContact O-N 3.04Å; L207-C211 WeakPolarHBondContact O-CB 3.2Å; L207-C211 PolarHBondContact O-N 3.46Å; L207-C211 PolarHBondContact O-SG 3.47Å; L207-C211 VanDerWaalsContact O-SG 3.39Å; L207-L225 HydrophobicContact CB-CD2 3.4Å; L207-L225 HydrophobicContact CB-CG 4.11Å; L207-L225 HydrophobicContact CD1-CB 4.39Å; L207-L225 HydrophobicContact CD1-CD2 3.91Å; L207-L225 HydrophobicContact CG-CD2 4.32Å; L207-L228 HydrophobicContact CD2-CB 3.78Å; L207-L228 HydrophobicContact CD2-CD1 3.96Å; L207-V229 HydrophobicContact CD1-CG2 3.54Å; L207-V229 HydrophobicContact CD2-CG2 4.24Å; L207-M300 HydrophobicContact CD2-SD 3.39Å; L207-M300 WeakPolarHBondContact CD2-SD 3.48Å
208	Y	89.3	Confident	89.5	Confident	70 Å²	70	39.9 Å²	39.9	28%	0.275	19%	0.19	S	C	.	.	H	α-helix	trans	-63.6	-46.6	176.5	-172.1	-87.6	0	0	0	111.5	V175 N204 E205 A206 I210 C211 F212 P220	V175-Y208 HydrophobicContact CG2-CD2 4.18Å; V175-Y208 HydrophobicContact CG2-CG 4.37Å; N204-Y208 VanDerWaalsContact O-CB 3.28Å; N204-Y208 WeakPolarHBondContact O-CB 3.43Å; N204-Y208 PolarHBondContact O-N 3.3Å; E205-Y208 PolarHBondContact O-N 2.88Å; A206-Y208 VanDerWaalsContact C-N 3.32Å; A206-Y208 PolarHBondContact O-N 2.93Å; Y208-I210 VanDerWaalsContact C-N 3.33Å; Y208-I210 PolarHBondContact O-N 2.82Å; Y208-C211 PolarHBondContact O-N 3.39Å; Y208-F212 HydrophobicContact CE1-CB 4.29Å; Y208-F212 WeakPolarHBondContact O-CB 3.37Å; Y208-F212 PolarHBondContact O-N 3.01Å; Y208-P220 HydrophobicContact CD2-CB 4.08Å; Y208-P220 HydrophobicContact CD2-CG 4.06Å; Y208-P220 HydrophobicContact CE2-CB 4.04Å; Y208-P220 HydrophobicContact CE2-CG 3.77Å
209	D	89.6	Confident	89.1	Confident	35 Å²	35	45.1 Å²	45.1	19%	0.187	22%	0.223	C	C	.	.	H	α-helix	trans	-63.7	-37.5	179	-81.8	7.3	0	0	0	111.6	K174 E205 A206 R213	K174-D209 IonicContact NZ-OD1 3Å; K174-D209 PolarHBondContact NZ-OD1 2.83Å; K174-D209 IonicContact NZ-OD2 3Å; K174-D209 PolarHBondContact NZ-OD2 2.85Å; E205-D209 WeakPolarHBondContact O-CB 3.25Å; E205-D209 PolarHBondContact O-N 2.89Å; A206-D209 PolarHBondContact O-N 2.93Å; D209-R213 WeakPolarHBondContact O-CA 3.06Å; D209-R213 WeakPolarHBondContact O-CB 3.42Å; D209-R213 WeakPolarHBondContact O-CG 3.46Å; D209-R213 PolarHBondContact O-N 2.92Å; D209-R213 IonicContact OD2-CZ 3.32Å; D209-R213 IonicContact OD2-NH1 2.71Å
210	I	89.4	Confident	88.7	Confident	5 Å²	5	46 Å²	46	3%	0.026	23%	0.229	C	C	.	.	I	π-helix	trans	-61.6	-52	172.5	-73.4	166.5	0	0	0	110.6	A206 L207 Y208 F212 T214 L215 L228 L273 K297 M299 M300	A206-I210 WeakPolarHBondContact O-CB 3.38Å; A206-I210 VanDerWaalsContact O-CG1 3.27Å; A206-I210 WeakPolarHBondContact O-CG1 3.4Å; A206-I210 PolarHBondContact O-N 2.82Å; L207-I210 PolarHBondContact O-N 3.04Å; Y208-I210 VanDerWaalsContact C-N 3.33Å; Y208-I210 PolarHBondContact O-N 2.82Å; I210-F212 VanDerWaalsContact C-N 3.33Å; I210-F212 PolarHBondContact O-N 3.38Å; I210-T214 WeakPolarHBondContact O-CA 3.38Å; I210-T214 VanDerWaalsContact O-CB 3.23Å; I210-T214 WeakPolarHBondContact O-CB 3.48Å; I210-T214 PolarHBondContact O-N 2.98Å; I210-L215 HydrophobicContact CG2-CG 4.47Å; I210-L215 PolarHBondContact O-N 2.89Å; I210-L228 HydrophobicContact CB-CD1 4.2Å; I210-L228 HydrophobicContact CG2-CD1 3.66Å; I210-L273 HydrophobicContact CD1-CD1 4.11Å; I210-L273 HydrophobicContact CG1-CD1 4.39Å; I210-L273 HydrophobicContact CG2-CD1 3.84Å; I210-L273 HydrophobicContact CG2-CD2 4.41Å; I210-K297 VanDerWaalsContact CG1-O 3.31Å; I210-K297 WeakPolarHBondContact CG1-O 3.28Å; I210-M299 WeakPolarHBondContact CD1-O 3.41Å; I210-M300 HydrophobicContact CD1-CE 4.37Å; I210-M300 HydrophobicContact CD1-SD 3.7Å
211	C	88.7	Confident	88.3	Confident	0 Å²	0	49.9 Å²	49.9	0%	0	25%	0.252	C	S	.	.	I	π-helix	trans	-59.9	-44.9	-179.3	-76.4	0	0	0	0	111.7	L207 Y208 L215 K216 L217 P220	L207-C211 WeakPolarHBondContact O-CB 3.2Å; L207-C211 PolarHBondContact O-N 3.46Å; L207-C211 PolarHBondContact O-SG 3.47Å; L207-C211 VanDerWaalsContact O-SG 3.39Å; Y208-C211 PolarHBondContact O-N 3.39Å; C211-L215 CarbonylContact O-C 3.54Å; C211-L215 WeakPolarHBondContact O-CB 3.41Å; C211-K216 PolarHBondContact O-N 3.19Å; C211-L217 HydrophobicContact CB-CD1 4.28Å; C211-L217 WeakPolarHBondContact O-CB 3.22Å; C211-L217 PolarHBondContact O-N 3.16Å; C211-P220 HydrophobicContact CB-CB 3.71Å; C211-P220 HydrophobicContact CB-CG 3.75Å
212	F	87.4	Confident	87.8	Confident	98 Å²	98	55.6 Å²	55.6	43%	0.43	28%	0.275	S	S	.	.	I	π-helix	trans	-75.2	-51.1	-176.8	-173.4	-103.1	0	0	0	112.7	Y208 I210 K216 L217 P220	Y208-F212 HydrophobicContact CE1-CB 4.29Å; Y208-F212 WeakPolarHBondContact O-CB 3.37Å; Y208-F212 PolarHBondContact O-N 3.01Å; I210-F212 VanDerWaalsContact C-N 3.33Å; I210-F212 PolarHBondContact O-N 3.38Å; F212-K216 WeakPolarHBondContact O-CA 3.1Å; F212-L217 WeakPolarHBondContact CA-O 3.27Å; F212-L217 WeakPolarHBondContact CD2-O 3.31Å; F212-P220 HydrophobicContact CB-CG 4.26Å
213	R	85.9	Confident	87.4	Confident	154 Å²	154	57.5 Å²	57.5	58%	0.581	29%	0.294	S	S	*	.	I	π-helix	trans	-86.3	-41.3	-172.1	-59.6	179.9	175.9	177	0.4	112.9	D209 K216	D209-R213 WeakPolarHBondContact O-CA 3.06Å; D209-R213 WeakPolarHBondContact O-CB 3.42Å; D209-R213 WeakPolarHBondContact O-CG 3.46Å; D209-R213 PolarHBondContact O-N 2.92Å; D209-R213 IonicContact OD2-CZ 3.32Å; D209-R213 IonicContact OD2-NH1 2.71Å; R213-K216 WeakPolarHBondContact O-CD 3.2Å; R213-K216 WeakPolarHBondContact O-CE 3.49Å; R213-K216 PolarHBondContact O-NZ 3.16Å
214	T	84.9	Confident	87.2	Confident	40 Å²	40	59.6 Å²	59.6	25%	0.245	31%	0.306	C	S	.	.	I	π-helix	trans	-90.7	-51.1	-174.1	-56	0	0	0	0	111.2	I210 K216 L273	I210-T214 WeakPolarHBondContact O-CA 3.38Å; I210-T214 VanDerWaalsContact O-CB 3.23Å; I210-T214 WeakPolarHBondContact O-CB 3.48Å; I210-T214 PolarHBondContact O-N 2.98Å; T214-K216 VanDerWaalsContact C-N 3.3Å; T214-K216 PolarHBondContact O-N 3.49Å; T214-L273 HydrophobicContact CG2-CB 4.14Å
215	L	85.2	Confident	87.2	Confident	32 Å²	32	58.7 Å²	58.7	17%	0.168	30%	0.301	C	S	.	.	S	Bend	trans	-80.6	-10.5	-179.7	-58.3	179.9	0	0	0	113.7	I210 C211 L217 L228 T274 S275	I210-L215 HydrophobicContact CG2-CG 4.47Å; I210-L215 PolarHBondContact O-N 2.89Å; C211-L215 CarbonylContact O-C 3.54Å; C211-L215 WeakPolarHBondContact O-CB 3.41Å; L215-L217 VanDerWaalsContact C-N 3.27Å; L215-L217 HydrophobicContact CB-CD1 4.33Å; L215-L217 HydrophobicContact CB-CG 4.09Å; L215-L217 HydrophobicContact CD1-CD1 4.49Å; L215-L217 PolarHBondContact O-N 3.44Å; L215-L228 HydrophobicContact CD1-CD2 4.34Å; L215-T274 WeakPolarHBondContact CD2-O 3.09Å; L215-S275 WeakPolarHBondContact O-CB 3.5Å
216	K	86.7	Confident	87.3	Confident	153 Å²	153	57.5 Å²	57.5	67%	0.665	30%	0.296	S	S	*	.			trans	60.7	33.3	179.7	-54.3	-59.3	-174.8	-166.3	0	113.3	C211 F212 R213 T214	C211-K216 PolarHBondContact O-N 3.19Å; F212-K216 WeakPolarHBondContact O-CA 3.1Å; R213-K216 WeakPolarHBondContact O-CD 3.2Å; R213-K216 WeakPolarHBondContact O-CE 3.49Å; R213-K216 PolarHBondContact O-NZ 3.16Å; T214-K216 VanDerWaalsContact C-N 3.3Å; T214-K216 PolarHBondContact O-N 3.49Å
217	L	85.1	Confident	87.1	Confident	59 Å²	59	62.7 Å²	62.7	31%	0.309	32%	0.318	S	S	.	.			trans	-82.6	118.3	172.5	-59.1	177.7	0	0	0	108.8	C211 F212 L215 T219 D224	C211-L217 HydrophobicContact CB-CD1 4.28Å; C211-L217 WeakPolarHBondContact O-CB 3.22Å; C211-L217 PolarHBondContact O-N 3.16Å; F212-L217 WeakPolarHBondContact CA-O 3.27Å; F212-L217 WeakPolarHBondContact CD2-O 3.31Å; L215-L217 VanDerWaalsContact C-N 3.27Å; L215-L217 HydrophobicContact CB-CD1 4.33Å; L215-L217 HydrophobicContact CB-CG 4.09Å; L215-L217 HydrophobicContact CD1-CD1 4.49Å; L215-L217 PolarHBondContact O-N 3.44Å; L217-T219 VanDerWaalsContact C-N 3.31Å; L217-T219 PolarHBondContact O-N 2.96Å; L217-D224 HydrophobicContact CD1-CB 4.07Å
218	T	83.9	Confident	87.1	Confident	116 Å²	116	63 Å²	63	71%	0.712	32%	0.32	S	S	*	.	S	Bend	trans	-68.8	-30.4	-178.2	48	0	0	0	0	112.9
219	T	84.5	Confident	87.2	Confident	110 Å²	110	59.8 Å²	59.8	68%	0.675	31%	0.307	S	S	*	.	S	Bend	trans	-136	84.8	179.2	42	0	0	0	0	109.5	L217 T221	L217-T219 VanDerWaalsContact C-N 3.31Å; L217-T219 PolarHBondContact O-N 2.96Å; T219-T221 PolarHBondContact O-N 2.82Å
220	P	86.2	Confident	87.3	Confident	20 Å²	20	58.1 Å²	58.1	13%	0.13	30%	0.299	C	S	.	.			trans	-60.1	130.4	176.4	-23.1	34.5	0	0	0	111.4	Y208 C211 F212	Y208-P220 HydrophobicContact CD2-CB 4.08Å; Y208-P220 HydrophobicContact CD2-CG 4.06Å; Y208-P220 HydrophobicContact CE2-CB 4.04Å; Y208-P220 HydrophobicContact CE2-CG 3.77Å; C211-P220 HydrophobicContact CB-CB 3.71Å; C211-P220 HydrophobicContact CB-CG 3.75Å; F212-P220 HydrophobicContact CB-CG 4.26Å
221	T	88.1	Confident	87.4	Confident	80 Å²	80	58.7 Å²	58.7	49%	0.491	30%	0.304	S	S	.	.			trans	-102.6	159.4	174.6	67.8	0	0	0	0	110.9	T219 G223 D224 L225	T219-T221 PolarHBondContact O-N 2.82Å; T221-G223 PolarHBondContact O-N 2.94Å; T221-G223 VanDerWaalsContact O-N 3.09Å; T221-D224 PolarHBondContact N-OD2 3.5Å; T221-D224 WeakPolarHBondContact O-CA 3.47Å; T221-D224 WeakPolarHBondContact O-CB 3.4Å; T221-D224 PolarHBondContact O-N 2.82Å; T221-D224 PolarHBondContact OG1-OD2 3.32Å; T221-L225 WeakPolarHBondContact O-CD1 3.49Å; T221-L225 PolarHBondContact O-N 2.73Å
222	Y	84.7	Confident	87.5	Confident	121 Å²	121	58.8 Å²	58.8	48%	0.475	30%	0.304	S	S	.	.	H	α-helix	trans	-54.6	-29.6	173.7	-77.9	-69.7	0	0	0	113.2	V175 D224 L225 N226	V175-Y222 HydrophobicContact CG1-CE1 3.68Å; V175-Y222 WeakPolarHBondContact CG1-OH 3.09Å; V175-Y222 PolarHBondContact O-OH 3.29Å; Y222-D224 VanDerWaalsContact C-N 3.31Å; Y222-D224 PolarHBondContact O-N 3.47Å; Y222-L225 HydrophobicContact CD1-CD1 4.42Å; Y222-L225 PolarHBondContact O-N 3.24Å; Y222-N226 VanDerWaalsContact O-CB 3.26Å; Y222-N226 WeakPolarHBondContact O-CB 3.17Å; Y222-N226 PolarHBondContact O-N 2.95Å; Y222-N226 PolarHBondContact O-ND2 2.88Å; Y222-N226 PolarHBondContact O-OD1 2.72Å
223	G	85.8	Confident	87.7	Confident	41 Å²	41	54.1 Å²	54.1	42%	0.423	28%	0.284	S	S	.	.	H	α-helix	trans	-62.3	-36.8	172.9	0	0	0	0	0	113.3	T221 H227	T221-G223 PolarHBondContact O-N 2.94Å; T221-G223 VanDerWaalsContact O-N 3.09Å; G223-H227 PolarHBondContact O-N 3.36Å
224	D	87.3	Confident	88	Confident	45 Å²	45	46.9 Å²	46.9	24%	0.241	26%	0.257	C	S	.	.	H	α-helix	trans	-72.5	-42.2	177.2	-56	-58.5	0	0	0	111.4	L217 T221 Y222 H227 L228	L217-D224 HydrophobicContact CD1-CB 4.07Å; T221-D224 PolarHBondContact N-OD2 3.5Å; T221-D224 WeakPolarHBondContact O-CA 3.47Å; T221-D224 WeakPolarHBondContact O-CB 3.4Å; T221-D224 PolarHBondContact O-N 2.82Å; T221-D224 PolarHBondContact OG1-OD2 3.32Å; Y222-D224 VanDerWaalsContact C-N 3.31Å; Y222-D224 PolarHBondContact O-N 3.47Å; D224-H227 WeakPolarHBondContact O-CB 3.36Å; D224-H227 PolarHBondContact O-N 2.97Å; D224-L228 PolarHBondContact O-N 2.8Å
225	L	89	Confident	88.3	Confident	5 Å²	5	45 Å²	45	3%	0.026	25%	0.245	C	C	.	.	H	α-helix	trans	-58.6	-51.4	172.5	-76.2	114.2	0	0	0	110.6	L207 T221 Y222 H227 L228 V229	L207-L225 HydrophobicContact CB-CD2 3.4Å; L207-L225 HydrophobicContact CB-CG 4.11Å; L207-L225 HydrophobicContact CD1-CB 4.39Å; L207-L225 HydrophobicContact CD1-CD2 3.91Å; L207-L225 HydrophobicContact CG-CD2 4.32Å; T221-L225 WeakPolarHBondContact O-CD1 3.49Å; T221-L225 PolarHBondContact O-N 2.73Å; Y222-L225 HydrophobicContact CD1-CD1 4.42Å; Y222-L225 PolarHBondContact O-N 3.24Å; L225-H227 PolarHBondContact O-N 3.4Å; L225-L228 WeakPolarHBondContact O-CB 3.3Å; L225-L228 PolarHBondContact O-N 2.81Å; L225-L228 VanDerWaalsContact O-N 3.07Å; L225-V229 WeakPolarHBondContact O-CG2 3.09Å; L225-V229 PolarHBondContact O-N 3.34Å; L225-V229 VanDerWaalsContact O-N 3.08Å
226	N	90.3	Very high	88.4	Confident	13 Å²	13	43.8 Å²	43.8	7%	0.07	24%	0.239	C	C	.	.	H	α-helix	trans	-62.5	-29.8	-178.9	-66.4	-13	0	0	0	112.1	I16 K19 Y222 V229 S230	I16-N226 WeakPolarHBondContact CG1-OD1 3.44Å; K19-N226 HydrophobicContact CG-CB 4.16Å; Y222-N226 VanDerWaalsContact O-CB 3.26Å; Y222-N226 WeakPolarHBondContact O-CB 3.17Å; Y222-N226 PolarHBondContact O-N 2.95Å; Y222-N226 PolarHBondContact O-ND2 2.88Å; Y222-N226 PolarHBondContact O-OD1 2.72Å; N226-V229 PolarHBondContact O-N 2.83Å; N226-S230 WeakPolarHBondContact O-CB 3.45Å; N226-S230 PolarHBondContact O-N 3.39Å; N226-S230 PolarHBondContact O-OG 3.08Å
227	H	87.4	Confident	88.6	Confident	119 Å²	119	36.6 Å²	36.6	55%	0.551	21%	0.208	S	C	*	.	H	α-helix	trans	-63.1	-46.4	173.5	-176.7	58.6	0	0	0	111.8	G223 D224 L225 V229 S230 A231	G223-H227 PolarHBondContact O-N 3.36Å; D224-H227 WeakPolarHBondContact O-CB 3.36Å; D224-H227 PolarHBondContact O-N 2.97Å; L225-H227 PolarHBondContact O-N 3.4Å; H227-V229 VanDerWaalsContact C-N 3.33Å; H227-V229 PolarHBondContact O-N 3.28Å; H227-S230 PolarHBondContact O-N 2.97Å; H227-S230 PolarHBondContact O-OG 2.92Å; H227-A231 PolarHBondContact O-N 3.36Å
228	L	89.7	Confident	88.8	Confident	8 Å²	8	33.8 Å²	33.8	4%	0.042	19%	0.194	C	C	.	.	H	α-helix	trans	-62.2	-40.8	176	-67.1	178.9	0	0	0	112.3	L207 I210 L215 D224 L225 A231 T232 L273 M300	L207-L228 HydrophobicContact CD2-CB 3.78Å; L207-L228 HydrophobicContact CD2-CD1 3.96Å; I210-L228 HydrophobicContact CB-CD1 4.2Å; I210-L228 HydrophobicContact CG2-CD1 3.66Å; L215-L228 HydrophobicContact CD1-CD2 4.34Å; D224-L228 PolarHBondContact O-N 2.8Å; L225-L228 WeakPolarHBondContact O-CB 3.3Å; L225-L228 PolarHBondContact O-N 2.81Å; L225-L228 VanDerWaalsContact O-N 3.07Å; L228-A231 PolarHBondContact O-N 3.45Å; L228-T232 PolarHBondContact O-N 3.44Å; L228-T232 VanDerWaalsContact O-N 3.07Å; L228-T232 PolarHBondContact O-OG1 3.48Å; L228-L273 HydrophobicContact CD2-CD2 3.51Å; L228-M300 HydrophobicContact CB-CE 4.15Å; L228-M300 HydrophobicContact CB-SD 4.38Å; L228-M300 HydrophobicContact CD2-CE 4.38Å
229	V	92.3	Very high	88.7	Confident	1 Å²	1	29.3 Å²	29.3	1%	0.006	17%	0.167	C	C	.	.	H	α-helix	trans	-64.1	-47.2	176.8	178.8	0	0	0	0	111	I16 I202 L207 L225 N226 H227 A231 T232 M233	I16-V229 HydrophobicContact CB-CG1 4.48Å; I16-V229 HydrophobicContact CD1-CG1 4.19Å; I16-V229 HydrophobicContact CG1-CG1 4.29Å; I16-V229 HydrophobicContact CG2-CB 4.33Å; I16-V229 HydrophobicContact CG2-CG1 3.41Å; I16-V229 VanDerWaalsContact CG2-CG1 3.41Å; I202-V229 HydrophobicContact CD1-CG1 3.56Å; I202-V229 HydrophobicContact CD1-CG2 4.44Å; I202-V229 HydrophobicContact CG2-CG2 3.69Å; L207-V229 HydrophobicContact CD1-CG2 3.54Å; L207-V229 HydrophobicContact CD2-CG2 4.24Å; L225-V229 WeakPolarHBondContact O-CG2 3.09Å; L225-V229 PolarHBondContact O-N 3.34Å; L225-V229 VanDerWaalsContact O-N 3.08Å; N226-V229 PolarHBondContact O-N 2.83Å; H227-V229 VanDerWaalsContact C-N 3.33Å; H227-V229 PolarHBondContact O-N 3.28Å; V229-A231 VanDerWaalsContact C-N 3.3Å; V229-A231 PolarHBondContact O-N 3.1Å; V229-T232 WeakPolarHBondContact O-CB 3.39Å; V229-T232 PolarHBondContact O-N 3.07Å; V229-M233 HydrophobicContact CG1-CG 4.23Å; V229-M233 HydrophobicContact CG1-SD 3.96Å; V229-M233 WeakPolarHBondContact O-CG 3.42Å; V229-M233 PolarHBondContact O-N 3.14Å
230	S	91.4	Very high	88.7	Confident	1 Å²	1	24.6 Å²	24.6	1%	0.007	14%	0.137	C	C	.	.	H	α-helix	trans	-61.8	-36.7	178.8	69.2	0	0	0	0	112.7	N226 H227 M233 S234	N226-S230 WeakPolarHBondContact O-CB 3.45Å; N226-S230 PolarHBondContact O-N 3.39Å; N226-S230 PolarHBondContact O-OG 3.08Å; H227-S230 PolarHBondContact O-N 2.97Å; H227-S230 PolarHBondContact O-OG 2.92Å; S230-M233 PolarHBondContact O-N 3.33Å; S230-S234 VanDerWaalsContact O-CB 3.31Å; S230-S234 WeakPolarHBondContact O-CB 3.48Å; S230-S234 PolarHBondContact O-N 3.01Å
231	A	90.2	Very high	88.8	Confident	17 Å²	17	23.7 Å²	23.7	14%	0.14	13%	0.131	C	C	.	.	H	α-helix	trans	-65.5	-43.5	175.4	0	0	0	0	0	111.6	H227 L228 V229 S234 G235 F270	H227-A231 PolarHBondContact O-N 3.36Å; L228-A231 PolarHBondContact O-N 3.45Å; V229-A231 VanDerWaalsContact C-N 3.3Å; V229-A231 PolarHBondContact O-N 3.1Å; A231-S234 PolarHBondContact O-N 3.42Å; A231-G235 PolarHBondContact O-N 3.5Å; A231-F270 HydrophobicContact CB-CD2 4.39Å; A231-F270 HydrophobicContact CB-CE1 4.39Å; A231-F270 HydrophobicContact CB-CE2 4.25Å; A231-F270 HydrophobicContact CB-CZ 4.25Å
232	T	91.4	Very high	88.7	Confident	1 Å²	1	19.9 Å²	19.9	1%	0.006	11%	0.108	C	C	.	.	H	α-helix	trans	-60.9	-50.6	174.2	-59.1	0	0	0	0	111.3	L228 V229 S234 G235 V236 P268	L228-T232 PolarHBondContact O-N 3.44Å; L228-T232 VanDerWaalsContact O-N 3.07Å; L228-T232 PolarHBondContact O-OG1 3.48Å; V229-T232 WeakPolarHBondContact O-CB 3.39Å; V229-T232 PolarHBondContact O-N 3.07Å; T232-S234 VanDerWaalsContact C-N 3.34Å; T232-S234 PolarHBondContact O-N 3.5Å; T232-G235 WeakPolarHBondContact O-CA 3.31Å; T232-G235 PolarHBondContact O-N 3.49Å; T232-G235 VanDerWaalsContact O-N 3.09Å; T232-V236 HydrophobicContact CG2-CG2 4.35Å; T232-V236 WeakPolarHBondContact O-CG2 3.43Å; T232-V236 PolarHBondContact O-N 3.44Å; T232-P268 HydrophobicContact CG2-CB 3.42Å; T232-P268 VanDerWaalsContact CG2-CB 3.42Å; T232-P268 HydrophobicContact CG2-CG 4.22Å
233	M	92.5	Very high	88.4	Confident	0 Å²	0	15.9 Å²	15.9	0%	0	10%	0.097	C	C	.	.	H	α-helix	trans	-60.8	-42.6	179.1	-70.9	178.3	71.6	0	0	112.2	I16 F20 T136 F167 V229 S230 G235 T237	I16-M233 HydrophobicContact CG2-SD 3.48Å; I16-M233 WeakPolarHBondContact CG2-SD 3.26Å; F20-M233 HydrophobicContact CB-CE 3.79Å; F20-M233 HydrophobicContact CB-SD 4.05Å; F20-M233 HydrophobicContact CD1-CE 4.1Å; F20-M233 HydrophobicContact CD2-CB 3.56Å; F20-M233 HydrophobicContact CD2-CE 3.74Å; F20-M233 HydrophobicContact CD2-SD 4.31Å; F20-M233 HydrophobicContact CE2-CB 3.99Å; F20-M233 HydrophobicContact CE2-CE 4.31Å; F20-M233 HydrophobicContact CG-CB 4.47Å; F20-M233 HydrophobicContact CG-CE 3.6Å; F20-M233 HydrophobicContact CG-SD 4.34Å; T136-M233 HydrophobicContact CG2-CE 3.32Å; T136-M233 HydrophobicContact CG2-SD 4.16Å; F167-M233 HydrophobicContact CD1-CG 3.63Å; F167-M233 HydrophobicContact CD1-SD 4.47Å; F167-M233 HydrophobicContact CD2-CE 4.13Å; F167-M233 HydrophobicContact CE1-CB 4.39Å; F167-M233 HydrophobicContact CE1-CG 3.73Å; F167-M233 HydrophobicContact CG-CE 4.17Å; F167-M233 HydrophobicContact CG-CG 4.12Å; F167-M233 HydrophobicContact CG-SD 4.44Å; F167-M233 HydrophobicContact CZ-CG 4.32Å; V229-M233 HydrophobicContact CG1-CG 4.23Å; V229-M233 HydrophobicContact CG1-SD 3.96Å; V229-M233 WeakPolarHBondContact O-CG 3.42Å; V229-M233 PolarHBondContact O-N 3.14Å; S230-M233 PolarHBondContact O-N 3.33Å; M233-G235 VanDerWaalsContact C-N 3.31Å; M233-G235 PolarHBondContact O-N 3.13Å; M233-T237 WeakPolarHBondContact O-CB 3.35Å; M233-T237 VanDerWaalsContact O-CG2 3.25Å; M233-T237 WeakPolarHBondContact O-CG2 3.47Å; M233-T237 PolarHBondContact O-N 3.42Å; M233-T237 PolarHBondContact O-OG1 3.26Å
234	S	91.9	Very high	87.6	Confident	2 Å²	2	14.9 Å²	14.9	1%	0.014	9%	0.086	C	C	.	.	H	α-helix	trans	-60	-43.6	173.8	174.3	0	0	0	0	111.2	E27 S230 A231 T232 T237 T238 R241 R318	E27-S234 VanDerWaalsContact CD-OG 3.23Å; E27-S234 PolarHBondContact OE1-OG 3.07Å; E27-S234 PolarHBondContact OE2-OG 3.31Å; S230-S234 VanDerWaalsContact O-CB 3.31Å; S230-S234 WeakPolarHBondContact O-CB 3.48Å; S230-S234 PolarHBondContact O-N 3.01Å; A231-S234 PolarHBondContact O-N 3.42Å; T232-S234 VanDerWaalsContact C-N 3.34Å; T232-S234 PolarHBondContact O-N 3.5Å; S234-T237 PolarHBondContact O-N 3.42Å; S234-T237 PolarHBondContact O-OG1 3.38Å; S234-T238 PolarHBondContact O-N 3.34Å; S234-T238 VanDerWaalsContact O-N 3.1Å; S234-T238 PolarHBondContact O-OG1 3.49Å; S234-R241 PolarHBondContact O-NH2 2.94Å; S234-R241 PolarHBondContact OG-NH2 3.5Å; S234-R318 PolarHBondContact OG-NH1 3.15Å
235	G	90.1	Very high	86.2	Confident	0 Å²	0	20 Å²	20	0%	0	11%	0.109	C	C	.	.	H	α-helix	trans	-59.6	-52.5	176.9	0	0	0	0	0	113.8	A231 T232 M233 T237 T238 I316 T366	A231-G235 PolarHBondContact O-N 3.5Å; T232-G235 WeakPolarHBondContact O-CA 3.31Å; T232-G235 PolarHBondContact O-N 3.49Å; T232-G235 VanDerWaalsContact O-N 3.09Å; M233-G235 VanDerWaalsContact C-N 3.31Å; M233-G235 PolarHBondContact O-N 3.13Å; G235-T237 VanDerWaalsContact C-N 3.31Å; G235-T237 PolarHBondContact O-N 3.4Å; G235-T238 VanDerWaalsContact O-CB 3.24Å; G235-T238 WeakPolarHBondContact O-CB 3.43Å; G235-T238 PolarHBondContact O-N 3.23Å; G235-T238 PolarHBondContact O-OG1 3.38Å; G235-T238 VanDerWaalsContact O-OG1 3.09Å; G235-I316 WeakPolarHBondContact O-CD1 3.41Å; G235-T366 WeakPolarHBondContact CA-OG1 3.33Å
236	V	88.8	Confident	85	Confident	7 Å²	7	23.8 Å²	23.8	4%	0.042	13%	0.129	C	C	.	.	H	α-helix	trans	-59.6	-42.6	178.7	172.6	0	0	0	0	111.1	F167 F200 T232 T238 T366 I368	F167-V236 HydrophobicContact CZ-CB 4.42Å; F167-V236 HydrophobicContact CZ-CG1 4.1Å; F200-V236 HydrophobicContact CD1-CG1 4.46Å; F200-V236 HydrophobicContact CD1-CG2 4.29Å; F200-V236 HydrophobicContact CE1-CB 4.49Å; F200-V236 HydrophobicContact CE1-CG1 3.63Å; F200-V236 HydrophobicContact CE1-CG2 3.98Å; F200-V236 HydrophobicContact CE2-CG1 4.04Å; F200-V236 HydrophobicContact CZ-CG1 3.4Å; F200-V236 VanDerWaalsContact CZ-CG1 3.4Å; T232-V236 HydrophobicContact CG2-CG2 4.35Å; T232-V236 WeakPolarHBondContact O-CG2 3.43Å; T232-V236 PolarHBondContact O-N 3.44Å; V236-T238 VanDerWaalsContact C-N 3.28Å; V236-T238 PolarHBondContact O-N 3.47Å; V236-T366 HydrophobicContact CG2-CG2 4.07Å; V236-I368 HydrophobicContact CB-CD1 4.32Å; V236-I368 HydrophobicContact CG1-CD1 3.99Å; V236-I368 HydrophobicContact CG2-CD1 3.89Å; V236-I368 HydrophobicContact CG2-CG1 3.98Å
237	T	90.3	Very high	83.3	Confident	3 Å²	3	26.9 Å²	26.9	2%	0.018	15%	0.145	C	C	.	.	T	Hydrogen-bonded Turn	trans	-82.6	-1.2	-177.2	61.2	0	0	0	0	113.9	F20 Y50 M233 S234 G235 C239 L240 R241	F20-T237 HydrophobicContact CE2-CG2 4.27Å; F20-T237 HydrophobicContact CZ-CG2 4.31Å; Y50-T237 WeakPolarHBondContact OH-CG2 3.44Å; M233-T237 WeakPolarHBondContact O-CB 3.35Å; M233-T237 VanDerWaalsContact O-CG2 3.25Å; M233-T237 WeakPolarHBondContact O-CG2 3.47Å; M233-T237 PolarHBondContact O-N 3.42Å; M233-T237 PolarHBondContact O-OG1 3.26Å; S234-T237 PolarHBondContact O-N 3.42Å; S234-T237 PolarHBondContact O-OG1 3.38Å; G235-T237 VanDerWaalsContact C-N 3.31Å; G235-T237 PolarHBondContact O-N 3.4Å; T237-C239 VanDerWaalsContact C-N 3.34Å; T237-C239 PolarHBondContact O-N 3.04Å; T237-L240 HydrophobicContact CG2-CD1 4.47Å; T237-L240 WeakPolarHBondContact O-CB 3.38Å; T237-L240 PolarHBondContact O-N 3.17Å; T237-L240 VanDerWaalsContact O-N 3.1Å; T237-R241 WeakPolarHBondContact O-CG 3.23Å; T237-R241 PolarHBondContact O-N 3.07Å; T237-R241 VanDerWaalsContact O-N 3.08Å; T237-R241 PolarHBondContact OG1-NE 2.64Å; T237-R241 VanDerWaalsContact OG1-NE 3.13Å
238	T	89.1	Confident	82.1	Confident	0 Å²	0	21.8 Å²	21.8	0%	0	12%	0.124	C	C	.	.	H	α-helix	trans	-59.7	-43.1	-176.7	-65.9	0	0	0	0	111.9	S234 G235 V236 L240 R241 F242 I316 R318 C354	S234-T238 PolarHBondContact O-N 3.34Å; S234-T238 VanDerWaalsContact O-N 3.1Å; S234-T238 PolarHBondContact O-OG1 3.49Å; G235-T238 VanDerWaalsContact O-CB 3.24Å; G235-T238 WeakPolarHBondContact O-CB 3.43Å; G235-T238 PolarHBondContact O-N 3.23Å; G235-T238 PolarHBondContact O-OG1 3.38Å; G235-T238 VanDerWaalsContact O-OG1 3.09Å; V236-T238 VanDerWaalsContact C-N 3.28Å; V236-T238 PolarHBondContact O-N 3.47Å; T238-L240 PolarHBondContact O-N 3.11Å; T238-L240 VanDerWaalsContact O-N 3.17Å; T238-R241 PolarHBondContact O-N 3.25Å; T238-F242 HydrophobicContact CG2-CD2 4.1Å; T238-F242 PolarHBondContact O-N 3.2Å; T238-I316 HydrophobicContact CG2-CG2 4.38Å; T238-R318 HydrophobicContact CG2-CG 3.98Å; T238-R318 WeakPolarHBondContact OG1-CD 3.36Å; T238-R318 PolarHBondContact OG1-NE 2.94Å; T238-R318 PolarHBondContact OG1-NH1 3.39Å; T238-C354 HydrophobicContact CG2-CB 3.61Å
239	C	81.3	Confident	81.2	Confident	21 Å²	21	23 Å²	23	14%	0.142	13%	0.131	C	C	.	.	H	α-helix	trans	-63.2	-22.2	-180	-61.8	0	0	0	0	113.3	R46 T237	R46-C239 PolarHBondContact NH1-O 3.01Å; T237-C239 VanDerWaalsContact C-N 3.34Å; T237-C239 PolarHBondContact O-N 3.04Å
240	L	85.2	Confident	80.5	Confident	12 Å²	12	23.4 Å²	23.4	6%	0.063	13%	0.132	C	C	.	.	H	α-helix	trans	-86.4	-44.5	178.8	-51.9	168.2	0	0	0	110.2	I4 R46 V49 T237 T238 L250	I4-L240 HydrophobicContact CD1-CD1 3.72Å; R46-L240 WeakPolarHBondContact CD-O 3.48Å; V49-L240 HydrophobicContact CG1-CB 4.38Å; T237-L240 HydrophobicContact CG2-CD1 4.47Å; T237-L240 WeakPolarHBondContact O-CB 3.38Å; T237-L240 PolarHBondContact O-N 3.17Å; T237-L240 VanDerWaalsContact O-N 3.1Å; T238-L240 PolarHBondContact O-N 3.11Å; T238-L240 VanDerWaalsContact O-N 3.17Å; L240-L250 HydrophobicContact CD1-CD2 3.43Å; L240-L250 VanDerWaalsContact CD1-CD2 3.43Å; L240-L250 HydrophobicContact CD1-CG 4.01Å; L240-L250 HydrophobicContact CD2-CD2 4.04Å; L240-L250 HydrophobicContact CD2-CG 4.04Å; L240-L250 HydrophobicContact CG-CD2 4.35Å
241	R	88.1	Confident	80.1	Confident	0 Å²	0	29.2 Å²	29.2	0%	0	15%	0.154	C	C	.	.	H	α-helix	trans	-80.7	-26.2	-171.8	-71.3	-173.4	-57.9	105.1	-1.1	115	E27 H28 R46 Y50 S234 T237 T238	E27-R241 IonicContact OE2-CZ 3.53Å; E27-R241 VanDerWaalsContact OE2-CZ 3.24Å; E27-R241 IonicContact OE2-NH1 3.48Å; E27-R241 PolarHBondContact OE2-NH1 3.09Å; E27-R241 IonicContact OE2-NH2 3.8Å; E27-R241 PolarHBondContact OE2-NH2 3.08Å; H28-R241 PolarHBondContact NE2-NH1 3.19Å; R46-R241 WeakPolarHBondContact CB-O 3.29Å; Y50-R241 HydrophobicContact CD2-CG 3.57Å; Y50-R241 HydrophobicContact CE2-CG 3.57Å; S234-R241 PolarHBondContact O-NH2 2.94Å; S234-R241 PolarHBondContact OG-NH2 3.5Å; T237-R241 WeakPolarHBondContact O-CG 3.23Å; T237-R241 PolarHBondContact O-N 3.07Å; T237-R241 VanDerWaalsContact O-N 3.08Å; T237-R241 PolarHBondContact OG1-NE 2.64Å; T237-R241 VanDerWaalsContact OG1-NE 3.13Å; T238-R241 PolarHBondContact O-N 3.25Å
242	F	86.1	Confident	79.8	Confident	1 Å²	1	33.3 Å²	33.3	0%	0.004	17%	0.169	C	C	.	.	S	Bend	trans	-122.3	146.1	-180	-63	-64.8	0	0	0	110.9	E27 H28 T238 G244 I356	E27-F242 HydrophobicContact CB-CZ 4.21Å; H28-F242 AromaticContact CE1-CE1 3.64Å; H28-F242 AromaticContact CE1-CZ 3.9Å; H28-F242 AromaticContact ND1-CE1 3.98Å; T238-F242 HydrophobicContact CG2-CD2 4.1Å; T238-F242 PolarHBondContact O-N 3.2Å; F242-G244 PolarHBondContact O-N 3.24Å; F242-I356 HydrophobicContact CD1-CD1 3.4Å; F242-I356 VanDerWaalsContact CD1-CD1 3.4Å; F242-I356 HydrophobicContact CE1-CD1 3.61Å; F242-I356 HydrophobicContact CE1-CG2 4.33Å; F242-I356 HydrophobicContact CE2-CG2 4.3Å; F242-I356 HydrophobicContact CG-CD1 3.98Å; F242-I356 HydrophobicContact CZ-CD1 4.36Å; F242-I356 HydrophobicContact CZ-CG2 4.06Å
243	P	77.5	Confident	79.4	Confident	36 Å²	36	34.5 Å²	34.5	23%	0.234	18%	0.175	C	C	.	.			trans	-62.5	126.4	168.3	30.3	-36.5	0	0	0	108.8	L42 E45	L42-P243 HydrophobicContact CD2-CG 3.89Å; E45-P243 WeakPolarHBondContact OE2-CG 3.44Å
244	G	69.2	Low	79.1	Confident	20 Å²	20	35 Å²	35	21%	0.206	18%	0.179	C	C	.	.			trans	-131.6	159	175	0	0	0	0	0	109.8	F242 L246 N247	F242-G244 PolarHBondContact O-N 3.24Å; G244-L246 PolarHBondContact O-N 2.81Å; G244-N247 PolarHBondContact O-OD1 3.25Å
245	Q	58.4	Low	78.9	Confident	154 Å²	154	40.1 Å²	40.1	72%	0.72	21%	0.21	S	C	*	.	S	Bend	trans	-64	-30.2	178.3	-65.1	-164.6	-10.6	0	0	112	N247 M323	Q245-N247 PolarHBondContact O-N 2.95Å; Q245-M323 HydrophobicContact CG-CE 4.2Å; Q245-M323 PolarHBondContact OE1-SD 3.32Å
246	L	64	Low	78.8	Confident	83 Å²	83	43.4 Å²	43.4	44%	0.435	23%	0.228	S	C	.	.	S	Bend	trans	-90.9	88.4	167.9	-153.8	88.2	0	0	0	109.4	G244 A248 A352	G244-L246 PolarHBondContact O-N 2.81Å; L246-A248 VanDerWaalsContact C-N 3.34Å; L246-A248 PolarHBondContact O-N 3.08Å; L246-A352 HydrophobicContact CB-CB 4.19Å; L246-A352 HydrophobicContact CD2-CB 4.05Å
247	N	55.2	Low	78.8	Confident	79 Å²	79	43.2 Å²	43.2	42%	0.422	23%	0.226	S	C	.	.			trans	-69.6	88.2	173.5	-75.9	-44.9	0	0	0	110.2	R46 G244 Q245	R46-N247 PolarHBondContact NH2-OD1 3.38Å; G244-N247 PolarHBondContact O-OD1 3.25Å; Q245-N247 PolarHBondContact O-N 2.95Å
248	A	62.1	Low	78.8	Confident	12 Å²	12	44.3 Å²	44.3	10%	0.099	23%	0.233	C	C	.	.			trans	-100.5	117.2	173.4	0	0	0	0	0	109.7	L246	L246-A248 VanDerWaalsContact C-N 3.34Å; L246-A248 PolarHBondContact O-N 3.08Å
249	D	70.7	Confident	78.8	Confident	34 Å²	34	46.7 Å²	46.7	18%	0.182	25%	0.248	C	C	.	.			trans	-76.4	169.9	157.4	34.5	60.9	0	0	0	109.7	R2 R251 K252 L253	R2-D249 IonicContact CZ-OD2 3.09Å; R2-D249 IonicContact NH1-OD2 2.92Å; R2-D249 PolarHBondContact NH1-OD2 3.34Å; R2-D249 IonicContact NH2-OD2 2.74Å; R2-D249 PolarHBondContact NH2-OD2 3.46Å; D249-R251 VanDerWaalsContact C-N 3.25Å; D249-R251 PolarHBondContact O-N 3.38Å; D249-K252 PolarHBondContact O-N 3.05Å; D249-K252 WeakPolarHBondContact OD1-CA 3.18Å; D249-K252 WeakPolarHBondContact OD1-CB 3.38Å; D249-K252 PolarHBondContact OD1-N 3.42Å; D249-L253 PolarHBondContact O-N 2.85Å
250	L	76.8	Confident	79.3	Confident	8 Å²	8	47.3 Å²	47.3	4%	0.042	25%	0.249	C	C	.	.	H	α-helix	trans	-53.1	-44.4	172.4	-73.4	-178.4	0	0	0	112	I4 Q131 I163 N165 L240 K252 L253 A254	I4-L250 HydrophobicContact CD1-CD1 3.73Å; I4-L250 HydrophobicContact CD1-CG 4.15Å; I4-L250 HydrophobicContact CG1-CD1 3.94Å; Q131-L250 HydrophobicContact CB-CD1 4.22Å; I163-L250 HydrophobicContact CB-CB 4.38Å; I163-L250 HydrophobicContact CG2-CB 4.11Å; I163-L250 HydrophobicContact CG2-CD1 4.49Å; N165-L250 WeakPolarHBondContact ND2-CD2 3.46Å; L240-L250 HydrophobicContact CD1-CD2 3.43Å; L240-L250 VanDerWaalsContact CD1-CD2 3.43Å; L240-L250 HydrophobicContact CD1-CG 4.01Å; L240-L250 HydrophobicContact CD2-CD2 4.04Å; L240-L250 HydrophobicContact CD2-CG 4.04Å; L240-L250 HydrophobicContact CG-CD2 4.35Å; L250-K252 PolarHBondContact O-N 3.22Å; L250-L253 WeakPolarHBondContact O-CB 3.46Å; L250-L253 PolarHBondContact O-N 3.42Å; L250-A254 PolarHBondContact O-N 3.34Å
251	R	83.6	Confident	79.4	Confident	124 Å²	124	52 Å²	52	47%	0.468	28%	0.28	S	S	.	.	H	α-helix	trans	-63	-41	-179.5	-176.1	172	-68.5	-75.5	0.7	112.5	D161 I163 D249 L253 A254 V255	D161-R251 PolarHBondContact O-NH2 3.26Å; I163-R251 HydrophobicContact CD1-CB 4.35Å; I163-R251 HydrophobicContact CD1-CG 4.46Å; I163-R251 HydrophobicContact CG1-CB 4.11Å; D249-R251 VanDerWaalsContact C-N 3.25Å; D249-R251 PolarHBondContact O-N 3.38Å; R251-L253 VanDerWaalsContact C-N 3.35Å; R251-A254 PolarHBondContact O-N 2.86Å; R251-V255 HydrophobicContact CG-CG2 4.48Å; R251-V255 WeakPolarHBondContact O-CB 3.46Å; R251-V255 VanDerWaalsContact O-CG2 3.24Å; R251-V255 WeakPolarHBondContact O-CG2 3.31Å; R251-V255 PolarHBondContact O-N 3.3Å
252	K	84.1	Confident	79.5	Confident	103 Å²	103	55.6 Å²	55.6	45%	0.448	29%	0.293	S	S	.	.	H	α-helix	trans	-72.3	-30.8	177.8	-169.4	179.4	-159.4	179.1	0	111.3	D249 L250 N256	D249-K252 PolarHBondContact O-N 3.05Å; D249-K252 WeakPolarHBondContact OD1-CA 3.18Å; D249-K252 WeakPolarHBondContact OD1-CB 3.38Å; D249-K252 PolarHBondContact OD1-N 3.42Å; L250-K252 PolarHBondContact O-N 3.22Å; K252-N256 WeakPolarHBondContact O-CB 3.46Å; K252-N256 PolarHBondContact O-N 3.32Å; K252-N256 PolarHBondContact O-ND2 3.33Å
253	L	82	Confident	79.9	Confident	26 Å²	26	55.6 Å²	55.6	14%	0.136	29%	0.293	C	S	.	.	H	α-helix	trans	-62.5	-51.1	168.7	-174.6	65.4	0	0	0	109.7	D249 L250 R251 V255 N256 M257 A314	D249-L253 PolarHBondContact O-N 2.85Å; L250-L253 WeakPolarHBondContact O-CB 3.46Å; L250-L253 PolarHBondContact O-N 3.42Å; R251-L253 VanDerWaalsContact C-N 3.35Å; L253-V255 PolarHBondContact O-N 2.98Å; L253-N256 PolarHBondContact O-N 3.33Å; L253-N256 VanDerWaalsContact O-N 3.1Å; L253-M257 HydrophobicContact CD1-CG 3.87Å; L253-M257 HydrophobicContact CG-CG 4.24Å; L253-M257 WeakPolarHBondContact O-CB 3.45Å; L253-M257 VanDerWaalsContact O-CG 3.29Å; L253-M257 WeakPolarHBondContact O-CG 3.39Å; L253-M257 PolarHBondContact O-N 3.18Å; L253-A314 HydrophobicContact CD1-CB 4.32Å
254	A	85.9	Confident	80.7	Confident	10 Å²	10	53.9 Å²	53.9	8%	0.083	28%	0.282	C	S	.	.	H	α-helix	trans	-57	-50.5	-179.4	0	0	0	0	0	111.8	I163 E198 L250 R251 N256 M257 V258	I163-A254 HydrophobicContact CD1-CB 4.45Å; E198-A254 HydrophobicContact CG-CB 4.08Å; E198-A254 WeakPolarHBondContact OE1-CA 3.48Å; E198-A254 VanDerWaalsContact OE1-CB 3.24Å; E198-A254 WeakPolarHBondContact OE1-CB 3.39Å; E198-A254 PolarHBondContact OE1-N 3.44Å; L250-A254 PolarHBondContact O-N 3.34Å; R251-A254 PolarHBondContact O-N 2.86Å; A254-N256 PolarHBondContact O-N 3.2Å; A254-M257 PolarHBondContact O-N 3.15Å; A254-V258 WeakPolarHBondContact O-CB 3.42Å; A254-V258 PolarHBondContact O-N 3.44Å
255	V	87.8	Confident	82	Confident	110 Å²	110	52.9 Å²	52.9	67%	0.667	27%	0.272	S	S	*	.	H	α-helix	trans	-60.8	-31.5	179.5	170.8	0	0	0	0	112.8	R251 L253	R251-V255 HydrophobicContact CG-CG2 4.48Å; R251-V255 WeakPolarHBondContact O-CB 3.46Å; R251-V255 VanDerWaalsContact O-CG2 3.24Å; R251-V255 WeakPolarHBondContact O-CG2 3.31Å; R251-V255 PolarHBondContact O-N 3.3Å; L253-V255 PolarHBondContact O-N 2.98Å
256	N	88.3	Confident	83.7	Confident	69 Å²	69	45.6 Å²	45.6	37%	0.369	24%	0.238	S	C	.	.	H	α-helix	trans	-84.3	-21.6	177.3	-76.6	-64.3	0	0	0	113.2	K252 L253 A254 T312 K350	K252-N256 WeakPolarHBondContact O-CB 3.46Å; K252-N256 PolarHBondContact O-N 3.32Å; K252-N256 PolarHBondContact O-ND2 3.33Å; L253-N256 PolarHBondContact O-N 3.33Å; L253-N256 VanDerWaalsContact O-N 3.1Å; A254-N256 PolarHBondContact O-N 3.2Å; N256-T312 WeakPolarHBondContact O-CG2 3.43Å; N256-K350 HydrophobicContact CB-CG 4.47Å
257	M	88.4	Confident	85.2	Confident	2 Å²	2	41.6 Å²	41.6	1%	0.01	22%	0.217	C	C	.	.	H	α-helix	trans	-105.5	-25.4	-170.8	-69.6	-59.8	-59.7	0	0	113.6	L253 A254 P259 F266 T312 A314 I368 N370	L253-M257 HydrophobicContact CD1-CG 3.87Å; L253-M257 HydrophobicContact CG-CG 4.24Å; L253-M257 WeakPolarHBondContact O-CB 3.45Å; L253-M257 VanDerWaalsContact O-CG 3.29Å; L253-M257 WeakPolarHBondContact O-CG 3.39Å; L253-M257 PolarHBondContact O-N 3.18Å; A254-M257 PolarHBondContact O-N 3.15Å; M257-P259 WeakPolarHBondContact O-CD 3.29Å; M257-F266 HydrophobicContact CB-CE1 3.78Å; M257-F266 HydrophobicContact CB-CE2 4.33Å; M257-F266 HydrophobicContact CB-CZ 3.49Å; M257-F266 VanDerWaalsContact CB-CZ 3.49Å; M257-F266 HydrophobicContact CE-CD1 4.39Å; M257-F266 HydrophobicContact CE-CE1 4.31Å; M257-F266 HydrophobicContact CG-CZ 4.44Å; M257-T312 WeakPolarHBondContact CA-OG1 3.18Å; M257-T312 WeakPolarHBondContact CE-OG1 3.4Å; M257-T312 PolarHBondContact O-OG1 3.14Å; M257-A314 HydrophobicContact CE-CB 4.29Å; M257-A314 HydrophobicContact CG-CB 4.46Å; M257-A314 HydrophobicContact SD-CB 3.54Å; M257-A314 VanDerWaalsContact SD-CB 3.54Å; M257-I368 HydrophobicContact CE-CB 4.35Å; M257-I368 HydrophobicContact CE-CG2 3.9Å; M257-I368 WeakPolarHBondContact CE-O 3.36Å; M257-N370 HydrophobicContact CE-CB 4.38Å; M257-N370 PolarHBondContact O-ND2 3.38Å
258	V	91.9	Very high	87	Confident	27 Å²	27	37.9 Å²	37.9	16%	0.164	20%	0.197	C	C	.	.			trans	-111.3	93.6	-175.1	-174	0	0	0	0	108.9	A254 F260 H264 F266	A254-V258 WeakPolarHBondContact O-CB 3.42Å; A254-V258 PolarHBondContact O-N 3.44Å; V258-F260 WeakPolarHBondContact CG1-O 3.43Å; V258-H264 HydrophobicContact CG1-CB 3.96Å; V258-H264 HydrophobicContact CG2-CB 3.85Å; V258-F266 HydrophobicContact CG2-CE1 4.1Å; V258-F266 HydrophobicContact CG2-CZ 3.63Å
259	P	88.8	Confident	88.5	Confident	49 Å²	49	37.3 Å²	37.3	32%	0.318	19%	0.193	S	C	.	.	S	Bend	trans	-71.4	-35.1	174.3	27.8	-32.6	0	0	0	111.7	M257 L311 I345	M257-P259 WeakPolarHBondContact O-CD 3.29Å; P259-L311 HydrophobicContact CG-CB 4.31Å; P259-L311 HydrophobicContact CG-CD1 4.26Å; P259-I345 HydrophobicContact CB-CD1 4.03Å; P259-I345 HydrophobicContact CG-CD1 4.2Å
260	F	90.8	Very high	89.5	Confident	35 Å²	35	36.3 Å²	36.3	15%	0.154	19%	0.187	C	C	.	.	S	Bend	trans	-124.3	134.8	-179.1	-57.9	-71.2	0	0	0	110.4	V258 R262 L263 W344 Y425 M433	V258-F260 WeakPolarHBondContact CG1-O 3.43Å; F260-R262 VanDerWaalsContact C-N 3.29Å; F260-R262 PolarHBondContact O-N 3.24Å; F260-R262 VanDerWaalsContact O-N 3.14Å; F260-L263 HydrophobicContact CB-CB 4.32Å; F260-L263 HydrophobicContact CB-CD1 4.34Å; F260-L263 HydrophobicContact CB-CG 4.15Å; F260-L263 HydrophobicContact CD2-CD1 3.99Å; F260-L263 PolarHBondContact O-N 3.08Å; F260-W344 AromaticContact CE2-CH2 3.54Å; F260-W344 HydrophobicContact CE2-CH2 3.54Å; F260-W344 HydrophobicContact CE2-CZ2 4.38Å; F260-W344 HydrophobicContact CE2-CZ3 4.17Å; F260-W344 AromaticContact CZ-CH2 3.91Å; F260-W344 HydrophobicContact CZ-CH2 3.91Å; F260-W344 HydrophobicContact CZ-CZ3 4.12Å; F260-Y425 HydrophobicContact CD2-CD1 4.42Å; F260-Y425 HydrophobicContact CD2-CD2 4.28Å; F260-Y425 HydrophobicContact CD2-CE1 4.05Å; F260-Y425 AromaticContact CD2-CE2 3.88Å; F260-Y425 HydrophobicContact CD2-CE2 3.88Å; F260-Y425 AromaticContact CD2-CZ 3.73Å; F260-Y425 AromaticContact CE1-CE1 3.91Å; F260-Y425 HydrophobicContact CE1-CE1 3.91Å; F260-Y425 AromaticContact CE1-CZ 3.84Å; F260-Y425 WeakPolarHBondContact CE1-OH 3.21Å; F260-Y425 AromaticContact CE2-CD1 3.58Å; F260-Y425 HydrophobicContact CE2-CD1 3.58Å; F260-Y425 HydrophobicContact CE2-CD2 4.21Å; F260-Y425 AromaticContact CE2-CE1 3.27Å; F260-Y425 HydrophobicContact CE2-CE1 3.27Å; F260-Y425 AromaticContact CE2-CE2 3.94Å; F260-Y425 HydrophobicContact CE2-CE2 3.94Å; F260-Y425 HydrophobicContact CE2-CG 4.03Å; F260-Y425 AromaticContact CE2-CZ 3.45Å; F260-Y425 VanDerWaalsContact CE2-CZ 3.45Å; F260-Y425 HydrophobicContact CG-CE2 4.28Å; F260-Y425 AromaticContact CZ-CD1 3.9Å; F260-Y425 HydrophobicContact CZ-CD1 3.9Å; F260-Y425 AromaticContact CZ-CE1 3.22Å; F260-Y425 HydrophobicContact CZ-CE1 3.22Å; F260-Y425 HydrophobicContact CZ-CE2 4.46Å; F260-Y425 AromaticContact CZ-CZ 3.54Å; F260-M433 HydrophobicContact CZ-CE 3.91Å
261	P	87.3	Confident	90.2	Very high	111 Å²	111	35.9 Å²	35.9	72%	0.721	19%	0.185	S	C	*	.	T	Hydrogen-bonded Turn	trans	-54.9	-37.1	-171.8	-28.8	35.1	0	0	0	115.1	H264	P261-H264 PolarHBondContact O-ND1 3.39Å
262	R	91.7	Very high	90.4	Very high	75 Å²	75	30.3 Å²	30.3	28%	0.283	16%	0.164	S	C	.	.	T	Hydrogen-bonded Turn	trans	-80.1	-21.6	-179.2	-68.6	169	61.4	105.7	-4.7	113.3	V193 F260 H264 N414 L418 E421	V193-R262 HydrophobicContact CG1-CB 4.25Å; V193-R262 HydrophobicContact CG1-CG 4.06Å; F260-R262 VanDerWaalsContact C-N 3.29Å; F260-R262 PolarHBondContact O-N 3.24Å; F260-R262 VanDerWaalsContact O-N 3.14Å; R262-H264 PolarHBondContact O-N 3.47Å; R262-N414 PolarHBondContact NH1-OD1 2.96Å; R262-N414 PolarHBondContact NH2-OD1 2.8Å; R262-L418 HydrophobicContact CB-CD1 4.47Å; R262-E421 WeakPolarHBondContact CB-OE2 3.45Å; R262-E421 IonicContact CZ-OE1 2.74Å; R262-E421 IonicContact NE-OE1 3.94Å; R262-E421 PolarHBondContact NE-OE1 3.05Å; R262-E421 IonicContact NE-OE2 3.96Å; R262-E421 PolarHBondContact NE-OE2 3.19Å; R262-E421 IonicContact NH2-OE1 3.31Å; R262-E421 PolarHBondContact NH2-OE1 3.27Å
263	L	93.7	Very high	90.4	Very high	0 Å²	0	25.9 Å²	25.9	0%	0	15%	0.146	C	C	.	.			trans	-95.9	58.3	-176.5	-52.6	-170.4	0	0	0	111.7	F260 L311 N370 L418 E421 Y422 Y425	F260-L263 HydrophobicContact CB-CB 4.32Å; F260-L263 HydrophobicContact CB-CD1 4.34Å; F260-L263 HydrophobicContact CB-CG 4.15Å; F260-L263 HydrophobicContact CD2-CD1 3.99Å; F260-L263 PolarHBondContact O-N 3.08Å; L263-L311 HydrophobicContact CD1-CD1 4.11Å; L263-N370 PolarHBondContact O-ND2 3.07Å; L263-L418 HydrophobicContact CD2-CD1 3.82Å; L263-E421 HydrophobicContact CD2-CB 4.08Å; L263-Y422 HydrophobicContact CB-CE1 4Å; L263-Y422 HydrophobicContact CD1-CD1 4.22Å; L263-Y422 HydrophobicContact CD1-CE1 4.22Å; L263-Y422 HydrophobicContact CD2-CD1 4Å; L263-Y422 HydrophobicContact CD2-CD2 3.99Å; L263-Y422 HydrophobicContact CD2-CE1 3.77Å; L263-Y422 HydrophobicContact CD2-CE2 3.72Å; L263-Y422 HydrophobicContact CD2-CG 4.11Å; L263-Y422 HydrophobicContact CG-CE1 4.21Å; L263-Y425 HydrophobicContact CD1-CD2 3.41Å; L263-Y425 VanDerWaalsContact CD1-CD2 3.41Å; L263-Y425 HydrophobicContact CD1-CE2 3.66Å; L263-Y425 HydrophobicContact CD1-CG 4.39Å
264	H	94.7	Very high	89.9	Confident	0 Å²	0	25.8 Å²	25.8	0%	0	15%	0.146	C	C	.	.			trans	-109.6	19.8	-177.9	60.1	-100.4	0	0	0	113.7	L192 V193 T196 D197 T199 V258 P261 R262	L192-H264 PolarHBondContact O-NE2 3.42Å; V193-H264 PolarHBondContact O-CE1 3.39Å; T196-H264 PolarHBondContact O-CE1 2.89Å; T196-H264 VanDerWaalsContact O-CE1 3.29Å; T196-H264 PolarHBondContact O-NE2 3.1Å; T196-H264 PolarHBondContact OG1-CD2 3.01Å; T196-H264 PolarHBondContact OG1-NE2 3.44Å; D197-H264 WeakPolarHBondContact O-CB 3.23Å; T199-H264 PolarHBondContact N-O 2.99Å; V258-H264 HydrophobicContact CG1-CB 3.96Å; V258-H264 HydrophobicContact CG2-CB 3.85Å; P261-H264 PolarHBondContact O-ND1 3.39Å; R262-H264 PolarHBondContact O-N 3.47Å
265	F	95.7	Very high	89.1	Confident	0 Å²	0	26.4 Å²	26.4	0%	0	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.7	111.7	177.7	-64.8	-90.7	0	0	0	110.6	V189 L192 V193 T199 I374 F378 L418	V189-F265 HydrophobicContact CG1-CZ 4.21Å; L192-F265 HydrophobicContact CB-CE1 4.33Å; L192-F265 HydrophobicContact CB-CZ 4.21Å; V193-F265 HydrophobicContact CG2-CE2 3.73Å; V193-F265 HydrophobicContact CG2-CZ 3.76Å; T199-F265 HydrophobicContact CG2-CD1 3.57Å; T199-F265 HydrophobicContact CG2-CE1 3.71Å; T199-F265 CarbonylContact O-C 3.56Å; T199-F265 WeakPolarHBondContact O-CA 3.41Å; F265-I374 HydrophobicContact CB-CG1 4.33Å; F265-F378 HydrophobicContact CB-CE2 4.33Å; F265-F378 HydrophobicContact CB-CZ 4.14Å; F265-F378 HydrophobicContact CD1-CE1 4.46Å; F265-F378 AromaticContact CD1-CZ 3.68Å; F265-F378 HydrophobicContact CD1-CZ 3.68Å; F265-F378 HydrophobicContact CD2-CE2 4.33Å; F265-F378 AromaticContact CD2-CZ 3.95Å; F265-F378 HydrophobicContact CD2-CZ 3.95Å; F265-F378 HydrophobicContact CE1-CE1 4.46Å; F265-F378 HydrophobicContact CE1-CZ 4.01Å; F265-F378 HydrophobicContact CE2-CZ 4.28Å; F265-F378 HydrophobicContact CG-CE2 4.18Å; F265-F378 AromaticContact CG-CZ 3.64Å; F265-F378 HydrophobicContact CG-CZ 3.64Å; F265-F378 HydrophobicContact CZ-CZ 4.3Å; F265-L418 HydrophobicContact CD2-CD2 4.25Å; F265-L418 HydrophobicContact CE2-CD2 3.87Å
266	F	95.3	Very high	88.1	Confident	0 Å²	0	31.6 Å²	31.6	0%	0	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95	144.3	-177.5	-55.2	-39.1	0	0	0	112.2	E198 T199 F200 S201 M257 V258 P268 I368 G369 N370	E198-F266 HydrophobicContact CB-CD2 4.4Å; E198-F266 HydrophobicContact CB-CE2 3.68Å; E198-F266 HydrophobicContact CB-CZ 4.43Å; E198-F266 HydrophobicContact CG-CE2 3.7Å; E198-F266 HydrophobicContact CG-CZ 4.14Å; T199-F266 PolarHBondContact O-N 3.07Å; F200-F266 HydrophobicContact CD1-CB 4.14Å; F200-F266 HydrophobicContact CD1-CD2 4.05Å; F200-F266 HydrophobicContact CE1-CB 4.4Å; F200-F266 AromaticContact CE1-CD2 3.67Å; F200-F266 HydrophobicContact CE1-CD2 3.67Å; F200-F266 HydrophobicContact CE1-CE2 4.48Å; F200-F266 HydrophobicContact CE1-CG 4.5Å; F200-F266 AromaticContact CZ-CD2 3.91Å; F200-F266 HydrophobicContact CZ-CD2 3.91Å; F200-F266 HydrophobicContact CZ-CE2 4.33Å; S201-F266 WeakPolarHBondContact CB-O 3.34Å; S201-F266 PolarHBondContact N-O 3.5Å; M257-F266 HydrophobicContact CB-CE1 3.78Å; M257-F266 HydrophobicContact CB-CE2 4.33Å; M257-F266 HydrophobicContact CB-CZ 3.49Å; M257-F266 VanDerWaalsContact CB-CZ 3.49Å; M257-F266 HydrophobicContact CE-CD1 4.39Å; M257-F266 HydrophobicContact CE-CE1 4.31Å; M257-F266 HydrophobicContact CG-CZ 4.44Å; V258-F266 HydrophobicContact CG2-CE1 4.1Å; V258-F266 HydrophobicContact CG2-CZ 3.63Å; F266-P268 WeakPolarHBondContact O-CD 3.44Å; F266-I368 HydrophobicContact CB-CG2 3.75Å; F266-I368 HydrophobicContact CD1-CG2 4.47Å; F266-I368 HydrophobicContact CD2-CG2 3.87Å; F266-I368 HydrophobicContact CG-CG2 3.78Å; F266-G369 WeakPolarHBondContact CA-O 3.39Å; F266-N370 HydrophobicContact CD1-CB 3.92Å; F266-N370 HydrophobicContact CE1-CB 4.04Å
267	M	93.9	Very high	86.9	Confident	0 Å²	0	31 Å²	31	0%	0	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.6	105.8	166.1	-65.8	-179.1	67.8	0	0	108.9	M299 A301 C303 P305 G369 A373 I374	M267-M299 HydrophobicContact CE-CB 4.31Å; M267-M299 HydrophobicContact CE-CG 4.28Å; M267-A301 HydrophobicContact CB-CB 4.4Å; M267-A301 HydrophobicContact CE-CB 4.09Å; M267-A301 HydrophobicContact CG-CB 4.05Å; M267-C303 HydrophobicContact CE-CB 3.61Å; M267-C303 HydrophobicContact SD-CB 4.28Å; M267-P305 HydrophobicContact CE-CG 4.36Å; M267-G369 PolarHBondContact N-O 3.14Å; M267-G369 PolarHBondContact O-N 3.19Å; M267-A373 HydrophobicContact SD-CB 4.43Å; M267-I374 HydrophobicContact CG-CB 4.38Å; M267-I374 HydrophobicContact CG-CD1 3.59Å; M267-I374 HydrophobicContact CG-CG1 4.49Å; M267-I374 HydrophobicContact SD-CB 4.49Å; M267-I374 HydrophobicContact SD-CD1 4.42Å
268	P	94.1	Very high	85.9	Confident	0 Å²	0	33.9 Å²	33.9	0%	0	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.4	151.4	173.8	16.5	-6.3	0	0	0	110.8	S201 I202 T232 F266 M300 F367	S201-P268 WeakPolarHBondContact O-CD 3.41Å; I202-P268 HydrophobicContact CG1-CG 4.34Å; T232-P268 HydrophobicContact CG2-CB 3.42Å; T232-P268 VanDerWaalsContact CG2-CB 3.42Å; T232-P268 HydrophobicContact CG2-CG 4.22Å; F266-P268 WeakPolarHBondContact O-CD 3.44Å; P268-M300 HydrophobicContact CB-CB 4.35Å; P268-M300 HydrophobicContact CG-CB 4.02Å; P268-M300 WeakPolarHBondContact O-CB 3.39Å; P268-M300 PolarHBondContact O-N 2.77Å; P268-F367 CarbonylContact C-O 3.57Å; P268-F367 WeakPolarHBondContact CA-O 3.29Å
269	G	92.6	Very high	84.7	Confident	0 Å²	0	36.8 Å²	36.8	0%	0	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.4	154.5	169.4	0	0	0	0	0	110.7	N298 F367	G269-N298 WeakPolarHBondContact CA-O 3.34Å; G269-F367 PolarHBondContact N-O 3.01Å; G269-F367 PolarHBondContact O-N 3.06Å
270	F	91.9	Very high	83.5	Confident	13 Å²	13	42.5 Å²	42.5	6%	0.057	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134	139.7	177.1	-175	-95.3	0	0	0	110.7	A231 L273 N298 M300 L361	A231-F270 HydrophobicContact CB-CD2 4.39Å; A231-F270 HydrophobicContact CB-CE1 4.39Å; A231-F270 HydrophobicContact CB-CE2 4.25Å; A231-F270 HydrophobicContact CB-CZ 4.25Å; F270-L273 HydrophobicContact CD1-CD2 4.09Å; F270-L273 WeakPolarHBondContact O-CG 3.33Å; F270-N298 PolarHBondContact O-ND2 3.02Å; F270-M300 HydrophobicContact CB-CE 3.76Å; F270-L361 HydrophobicContact CE1-CD1 4.29Å; F270-L361 HydrophobicContact CZ-CD1 4.08Å
271	A	91.1	Very high	82.3	Confident	0 Å²	0	50.2 Å²	50.2	0%	0	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.8	140.2	170.9	0	0	0	0	0	109.3	L289 Q292 M293 S364 A365	A271-L289 HydrophobicContact CB-CD2 4.04Å; A271-Q292 HydrophobicContact CB-CB 3.92Å; A271-M293 HydrophobicContact CB-CG 4.05Å; A271-S364 CarbonylContact O-C 3.57Å; A271-S364 VanDerWaalsContact O-CA 3.29Å; A271-S364 WeakPolarHBondContact O-CA 3.44Å; A271-S364 WeakPolarHBondContact O-CB 3.46Å; A271-A365 PolarHBondContact N-O 3.11Å; A271-A365 PolarHBondContact O-N 3.01Å; A271-A365 VanDerWaalsContact O-O 3.11Å
272	P	89.4	Confident	81.4	Confident	7 Å²	7	50.4 Å²	50.4	5%	0.045	24%	0.238	C	C	.	.			cis	-90.3	143.7	3.6	35.2	-35	0	0	0	113.9	T274 L284 L289 L361	P272-T274 HydrophobicContact CB-CG2 4.23Å; P272-L284 HydrophobicContact CB-CD1 4.41Å; P272-L284 HydrophobicContact CB-CD2 3.36Å; P272-L284 HydrophobicContact CB-CG 4.5Å; P272-L284 HydrophobicContact CG-CD1 3.83Å; P272-L284 HydrophobicContact CG-CD2 3.61Å; P272-L284 HydrophobicContact CG-CG 4.38Å; P272-L289 HydrophobicContact CB-CD2 4.33Å; P272-L289 HydrophobicContact CG-CD2 4.48Å; P272-L361 HydrophobicContact CG-CD1 4.29Å; P272-L361 HydrophobicContact CG-CD2 4.13Å
273	L	84	Confident	80.2	Confident	10 Å²	10	50.7 Å²	50.7	5%	0.052	26%	0.256	C	S	.	.			trans	-102.2	91.1	167.2	-63.8	172.2	0	0	0	108.2	I210 T214 L228 F270 N298 M300	I210-L273 HydrophobicContact CD1-CD1 4.11Å; I210-L273 HydrophobicContact CG1-CD1 4.39Å; I210-L273 HydrophobicContact CG2-CD1 3.84Å; I210-L273 HydrophobicContact CG2-CD2 4.41Å; T214-L273 HydrophobicContact CG2-CB 4.14Å; L228-L273 HydrophobicContact CD2-CD2 3.51Å; F270-L273 HydrophobicContact CD1-CD2 4.09Å; F270-L273 WeakPolarHBondContact O-CG 3.33Å; L273-N298 HydrophobicContact CD1-CB 4.07Å; L273-M300 HydrophobicContact CD1-CE 4.46Å; L273-M300 HydrophobicContact CD2-CE 4.26Å
274	T	70.6	Confident	79.6	Confident	24 Å²	24	52.8 Å²	52.8	15%	0.147	27%	0.267	C	S	.	.			trans	-119.1	138	180	55.8	0	0	0	0	110.8	L215 P272	L215-T274 WeakPolarHBondContact CD2-O 3.09Å; P272-T274 HydrophobicContact CB-CG2 4.23Å
275	S	69.7	Low	79.4	Confident	22 Å²	22	54.8 Å²	54.8	15%	0.154	28%	0.281	C	S	.	.			trans	-65.9	150.6	172.3	72.2	0	0	0	0	110.1	L215 G277 S278 Q279	L215-S275 WeakPolarHBondContact O-CB 3.5Å; S275-G277 PolarHBondContact O-N 3.18Å; S275-G277 VanDerWaalsContact O-N 3.08Å; S275-S278 PolarHBondContact O-N 3.06Å; S275-S278 WeakPolarHBondContact OG-CB 3.1Å; S275-S278 PolarHBondContact OG-N 2.99Å; S275-S278 PolarHBondContact OG-OG 2.91Å; S275-Q279 PolarHBondContact O-N 3Å
276	R	65.9	Low	79.1	Confident	219 Å²	219	55 Å²	55	83%	0.826	28%	0.282	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.9	-31.8	178.9	-65.1	-177.4	-178.7	178	2.1	113
277	G	62.5	Low	79	Confident	56 Å²	56	57 Å²	57	58%	0.577	30%	0.295	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.9	-27.4	178.1	0	0	0	0	0	114.6	S275 Y281	S275-G277 PolarHBondContact O-N 3.18Å; S275-G277 VanDerWaalsContact O-N 3.08Å; G277-Y281 WeakPolarHBondContact O-CD2 3.25Å
278	S	68.4	Low	78.8	Confident	63 Å²	63	59.9 Å²	59.9	44%	0.441	31%	0.309	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93.2	-14.8	-179.9	-61.3	0	0	0	0	113.4	S275 Q280 Y281 R282	S275-S278 PolarHBondContact O-N 3.06Å; S275-S278 WeakPolarHBondContact OG-CB 3.1Å; S275-S278 PolarHBondContact OG-N 2.99Å; S275-S278 PolarHBondContact OG-OG 2.91Å; S278-Q280 VanDerWaalsContact C-N 3.26Å; S278-Q280 PolarHBondContact O-N 2.93Å; S278-Y281 PolarHBondContact O-N 2.81Å; S278-Y281 VanDerWaalsContact O-N 3.14Å; S278-R282 PolarHBondContact O-N 3.41Å
279	Q	67.3	Low	78.6	Confident	88 Å²	88	59.9 Å²	59.9	41%	0.411	31%	0.309	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.9	-31.4	-176.8	-165.7	178.1	2.2	0	0	113.4	S275	S275-Q279 PolarHBondContact O-N 3Å
280	Q	62.9	Low	78.6	Confident	170 Å²	170	59.9 Å²	59.9	79%	0.794	31%	0.309	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.4	-19.9	179.7	-65.5	-176.7	2.7	0	0	113.9	S278	S278-Q280 VanDerWaalsContact C-N 3.26Å; S278-Q280 PolarHBondContact O-N 2.93Å
281	Y	65.8	Low	78.5	Confident	197 Å²	197	66.4 Å²	66.4	77%	0.773	34%	0.34	S	S	*	.	T	Hydrogen-bonded Turn	trans	-102.9	-10.8	-172.5	-61.3	-77.2	0	0	0	113.5	G277 S278	G277-Y281 WeakPolarHBondContact O-CD2 3.25Å; S278-Y281 PolarHBondContact O-N 2.81Å; S278-Y281 VanDerWaalsContact O-N 3.14Å
282	R	68.4	Low	78.4	Confident	115 Å²	115	67.1 Å²	67.1	43%	0.434	34%	0.343	S	S	.	.			trans	-103	117.2	-174.8	-157.4	173.9	-172.7	166.3	6.8	111	S278 L284 E288 Q292	S278-R282 PolarHBondContact O-N 3.41Å; R282-L284 PolarHBondContact O-N 3Å; R282-E288 IonicContact NE-OE2 2.7Å; R282-E288 PolarHBondContact NE-OE2 3Å; R282-Q292 VanDerWaalsContact CZ-NE2 3.26Å
283	A	65.8	Low	78.4	Confident	81 Å²	81	66.8 Å²	66.8	67%	0.669	34%	0.341	S	S	*	.			trans	-80.9	99.5	171.8	0	0	0	0	0	109.1	S285	A283-S285 PolarHBondContact O-N 3.38Å
284	L	81.9	Confident	78.7	Confident	44 Å²	44	67.6 Å²	67.6	23%	0.23	34%	0.344	C	S	.	.			trans	-64.3	127.1	175.6	-72.1	152.8	0	0	0	109.6	P272 R282 L289 M363	P272-L284 HydrophobicContact CB-CD1 4.41Å; P272-L284 HydrophobicContact CB-CD2 3.36Å; P272-L284 HydrophobicContact CB-CG 4.5Å; P272-L284 HydrophobicContact CG-CD1 3.83Å; P272-L284 HydrophobicContact CG-CD2 3.61Å; P272-L284 HydrophobicContact CG-CG 4.38Å; R282-L284 PolarHBondContact O-N 3Å; L284-L289 HydrophobicContact CD2-CD2 4.05Å; L284-M363 HydrophobicContact CB-CE 4.18Å; L284-M363 WeakPolarHBondContact O-CE 3.38Å
285	S	89.6	Confident	79.6	Confident	41 Å²	41	68.8 Å²	68.8	29%	0.287	35%	0.349	S	S	.	.			trans	-129.9	161.5	174.7	64.7	0	0	0	0	110	A283 E288 L289	A283-S285 PolarHBondContact O-N 3.38Å; S285-E288 PolarHBondContact O-N 3.4Å; S285-E288 WeakPolarHBondContact OG-CG 3.31Å; S285-L289 WeakPolarHBondContact O-CG 3.41Å; S285-L289 PolarHBondContact O-N 2.99Å
286	V	90.7	Very high	80.4	Confident	4 Å²	4	69 Å²	69	2%	0.024	35%	0.352	C	S	.	.	H	α-helix	trans	-57	-46.2	178.3	177.1	0	0	0	0	111.7	E288 L289 T290 F317 M321 E325 V326 Q329	V286-E288 VanDerWaalsContact C-N 3.32Å; V286-E288 PolarHBondContact O-N 3.41Å; V286-L289 PolarHBondContact O-N 3.32Å; V286-T290 PolarHBondContact O-N 3.08Å; V286-T290 PolarHBondContact O-OG1 2.8Å; V286-T290 VanDerWaalsContact O-OG1 3.07Å; V286-F317 HydrophobicContact CG1-CE1 4.39Å; V286-M321 HydrophobicContact CG2-CB 3.94Å; V286-M321 HydrophobicContact CG2-SD 4.09Å; V286-E325 HydrophobicContact CB-CG 4.14Å; V286-E325 HydrophobicContact CG1-CG 4.31Å; V286-V326 HydrophobicContact CG1-CB 4.4Å; V286-V326 HydrophobicContact CG1-CG2 3.79Å; V286-V326 HydrophobicContact CG2-CG2 4.4Å; V286-Q329 HydrophobicContact CG1-CG 4.21Å
287	P	91.8	Very high	81.4	Confident	43 Å²	43	65.2 Å²	65.2	28%	0.279	34%	0.342	S	S	.	.	H	α-helix	trans	-59.5	-38.7	176.3	-23.2	33.2	0	0	0	113.7	Q291 Q329	P287-Q291 WeakPolarHBondContact O-CB 3.45Å; P287-Q291 PolarHBondContact O-N 3.14Å; P287-Q329 HydrophobicContact CB-CG 4.22Å; P287-Q329 HydrophobicContact CG-CG 3.94Å
288	E	89.8	Confident	82.5	Confident	60 Å²	60	62.9 Å²	62.9	28%	0.28	32%	0.316	S	S	.	.	H	α-helix	trans	-68	-38.4	177.1	-76.7	-170.9	-161.6	0	0	112.6	R282 S285 V286 Q292	R282-E288 IonicContact NE-OE2 2.7Å; R282-E288 PolarHBondContact NE-OE2 3Å; S285-E288 PolarHBondContact O-N 3.4Å; S285-E288 WeakPolarHBondContact OG-CG 3.31Å; V286-E288 VanDerWaalsContact C-N 3.32Å; V286-E288 PolarHBondContact O-N 3.41Å; E288-Q292 WeakPolarHBondContact O-CB 3.12Å; E288-Q292 WeakPolarHBondContact O-CG 3.48Å; E288-Q292 PolarHBondContact O-N 3.35Å
289	L	91.4	Very high	83.5	Confident	0 Å²	0	60 Å²	60	0%	0	30%	0.296	C	S	.	.	H	α-helix	trans	-63.7	-49.9	174.7	-71.9	173.9	0	0	0	110	A271 P272 L284 S285 V286 Q291 Q292 M293 F317 M363 A365	A271-L289 HydrophobicContact CB-CD2 4.04Å; P272-L289 HydrophobicContact CB-CD2 4.33Å; P272-L289 HydrophobicContact CG-CD2 4.48Å; L284-L289 HydrophobicContact CD2-CD2 4.05Å; S285-L289 WeakPolarHBondContact O-CG 3.41Å; S285-L289 PolarHBondContact O-N 2.99Å; V286-L289 PolarHBondContact O-N 3.32Å; L289-Q291 VanDerWaalsContact C-N 3.32Å; L289-Q291 PolarHBondContact O-N 3.41Å; L289-Q292 PolarHBondContact O-N 3.36Å; L289-M293 VanDerWaalsContact O-CG 3.25Å; L289-M293 WeakPolarHBondContact O-CG 3.42Å; L289-M293 PolarHBondContact O-N 3.21Å; L289-F317 HydrophobicContact CB-CE1 4.27Å; L289-M363 HydrophobicContact CD1-CB 3.86Å; L289-A365 HydrophobicContact CB-CB 4.21Å
290	T	91.8	Very high	84.5	Confident	1 Å²	1	55.9 Å²	55.9	1%	0.006	28%	0.277	C	S	.	.	H	α-helix	trans	-58.5	-44.2	178.1	-56	0	0	0	0	111.4	V286 Q292 M293 F294 Q329 M330 V333	V286-T290 PolarHBondContact O-N 3.08Å; V286-T290 PolarHBondContact O-OG1 2.8Å; V286-T290 VanDerWaalsContact O-OG1 3.07Å; T290-Q292 PolarHBondContact O-N 2.92Å; T290-M293 PolarHBondContact O-N 3.2Å; T290-F294 HydrophobicContact CG2-CD2 4.49Å; T290-F294 HydrophobicContact CG2-CE2 4.46Å; T290-F294 WeakPolarHBondContact O-CD2 3.03Å; T290-F294 PolarHBondContact O-N 3.05Å; T290-Q329 HydrophobicContact CG2-CB 4.18Å; T290-M330 HydrophobicContact CG2-SD 3.7Å; T290-V333 HydrophobicContact CG2-CG2 3.63Å
291	Q	89.6	Confident	85.8	Confident	150 Å²	150	47.9 Å²	47.9	70%	0.701	24%	0.239	S	C	*	.	H	α-helix	trans	-64.9	-40.3	178.1	-171.5	178.7	11.7	0	0	112.5	P287 L289 D295	P287-Q291 WeakPolarHBondContact O-CB 3.45Å; P287-Q291 PolarHBondContact O-N 3.14Å; L289-Q291 VanDerWaalsContact C-N 3.32Å; L289-Q291 PolarHBondContact O-N 3.41Å; Q291-D295 PolarHBondContact O-N 3.01Å
292	Q	89.4	Confident	86.8	Confident	15 Å²	15	40.1 Å²	40.1	7%	0.07	22%	0.216	C	C	.	.	H	α-helix	trans	-68.6	-35.6	177.7	-81.7	-179.1	52.6	0	0	112.7	A271 R282 E288 L289 T290 F294 D295 N298	A271-Q292 HydrophobicContact CB-CB 3.92Å; R282-Q292 VanDerWaalsContact CZ-NE2 3.26Å; E288-Q292 WeakPolarHBondContact O-CB 3.12Å; E288-Q292 WeakPolarHBondContact O-CG 3.48Å; E288-Q292 PolarHBondContact O-N 3.35Å; L289-Q292 PolarHBondContact O-N 3.36Å; T290-Q292 PolarHBondContact O-N 2.92Å; Q292-F294 VanDerWaalsContact C-N 3.27Å; Q292-F294 PolarHBondContact O-N 2.95Å; Q292-D295 WeakPolarHBondContact O-CB 3.37Å; Q292-D295 PolarHBondContact O-N 2.98Å; Q292-D295 VanDerWaalsContact O-N 3.14Å; Q292-N298 WeakPolarHBondContact O-CB 3.31Å
293	M	89.9	Confident	87.7	Confident	0 Å²	0	35 Å²	35	0%	0	20%	0.198	C	C	.	.	H	α-helix	trans	-59.9	-37.3	178.5	-74.9	171.8	72.5	0	0	112.9	A271 L289 T290 M299 A315 F317 A365 T366 F367	A271-M293 HydrophobicContact CB-CG 4.05Å; L289-M293 VanDerWaalsContact O-CG 3.25Å; L289-M293 WeakPolarHBondContact O-CG 3.42Å; L289-M293 PolarHBondContact O-N 3.21Å; T290-M293 PolarHBondContact O-N 3.2Å; M293-M299 WeakPolarHBondContact O-CE 3.29Å; M293-A315 HydrophobicContact CE-CB 3.53Å; M293-F317 HydrophobicContact SD-CE1 4.14Å; M293-F317 HydrophobicContact SD-CE2 4.39Å; M293-F317 HydrophobicContact SD-CZ 3.81Å; M293-A365 HydrophobicContact CE-CB 4.19Å; M293-A365 HydrophobicContact CG-CB 3.9Å; M293-A365 HydrophobicContact SD-CB 3.21Å; M293-A365 WeakPolarHBondContact SD-CB 3.32Å; M293-T366 WeakPolarHBondContact CE-O 3.39Å; M293-F367 HydrophobicContact CB-CB 4.3Å; M293-F367 HydrophobicContact CB-CD2 4.43Å; M293-F367 HydrophobicContact CE-CB 3.77Å; M293-F367 HydrophobicContact CE-CD2 4Å; M293-F367 HydrophobicContact CE-CG 4.41Å; M293-F367 HydrophobicContact CG-CB 4.45Å
294	F	89.4	Confident	88.7	Confident	27 Å²	27	33.3 Å²	33.3	12%	0.118	18%	0.178	C	C	.	.	T	Hydrogen-bonded Turn	trans	-92.7	7.1	178.8	-72	-85.4	0	0	0	113.3	T290 Q292 Y310 V313 M330 V333 F341 F367	T290-F294 HydrophobicContact CG2-CD2 4.49Å; T290-F294 HydrophobicContact CG2-CE2 4.46Å; T290-F294 WeakPolarHBondContact O-CD2 3.03Å; T290-F294 PolarHBondContact O-N 3.05Å; Q292-F294 VanDerWaalsContact C-N 3.27Å; Q292-F294 PolarHBondContact O-N 2.95Å; F294-Y310 HydrophobicContact CD1-CE2 4.02Å; F294-Y310 HydrophobicContact CE1-CE2 4.12Å; F294-V313 HydrophobicContact CZ-CG1 4.26Å; F294-M330 HydrophobicContact CE2-CE 3.83Å; F294-M330 HydrophobicContact CE2-SD 4.11Å; F294-M330 HydrophobicContact CZ-CE 3.93Å; F294-V333 HydrophobicContact CD1-CG1 4.28Å; F294-V333 HydrophobicContact CD2-CG1 3.78Å; F294-V333 HydrophobicContact CD2-CG2 4.48Å; F294-V333 HydrophobicContact CE1-CG1 4.31Å; F294-V333 HydrophobicContact CE2-CB 4.44Å; F294-V333 HydrophobicContact CE2-CG1 3.82Å; F294-V333 HydrophobicContact CG-CG1 4.02Å; F294-V333 HydrophobicContact CZ-CG1 4.08Å; F294-F341 HydrophobicContact CE1-CE1 4.24Å; F294-F341 AromaticContact CE1-CZ 3.75Å; F294-F341 HydrophobicContact CE1-CZ 3.75Å; F294-F341 HydrophobicContact CZ-CZ 4.18Å; F294-F367 HydrophobicContact CD1-CE2 4.1Å; F294-F367 AromaticContact CE1-CE2 3.69Å; F294-F367 HydrophobicContact CE1-CE2 3.69Å; F294-F367 HydrophobicContact CE1-CZ 4.34Å; F294-F367 AromaticContact CZ-CE2 3.97Å; F294-F367 HydrophobicContact CZ-CE2 3.97Å
295	D	89.6	Confident	89	Confident	48 Å²	48	31.6 Å²	31.6	26%	0.257	17%	0.169	S	C	.	.			trans	-80.7	131.5	172.6	-165.5	0.2	0	0	0	109.7	Q291 Q292 K297 N298	Q291-D295 PolarHBondContact O-N 3.01Å; Q292-D295 WeakPolarHBondContact O-CB 3.37Å; Q292-D295 PolarHBondContact O-N 2.98Å; Q292-D295 VanDerWaalsContact O-N 3.14Å; D295-K297 PolarHBondContact O-N 3.15Å; D295-K297 VanDerWaalsContact O-N 3.08Å; D295-N298 PolarHBondContact O-N 3.14Å
296	A	86.8	Confident	88.9	Confident	27 Å²	27	36.8 Å²	36.8	22%	0.223	18%	0.182	C	C	.	.	G	3₁₀ helix	trans	-57	-28.1	178	0	0	0	0	0	112	N298 M299	A296-N298 PolarHBondContact O-N 3.06Å; A296-M299 PolarHBondContact O-N 3.28Å
297	K	85.9	Confident	88.9	Confident	140 Å²	140	42 Å²	42	61%	0.609	21%	0.206	S	C	*	.	G	3₁₀ helix	trans	-70.8	-15.7	178.9	-62.6	175.7	-172.6	165.3	0	114.5	I210 D295	I210-K297 VanDerWaalsContact CG1-O 3.31Å; I210-K297 WeakPolarHBondContact CG1-O 3.28Å; D295-K297 PolarHBondContact O-N 3.15Å; D295-K297 VanDerWaalsContact O-N 3.08Å
298	N	86	Confident	88.9	Confident	7 Å²	7	40.2 Å²	40.2	4%	0.037	20%	0.195	C	C	.	.	G	3₁₀ helix	trans	-102.8	-0.8	-178.2	-77.3	45.5	0	0	0	112.5	G269 F270 L273 Q292 D295 A296	G269-N298 WeakPolarHBondContact CA-O 3.34Å; F270-N298 PolarHBondContact O-ND2 3.02Å; L273-N298 HydrophobicContact CD1-CB 4.07Å; Q292-N298 WeakPolarHBondContact O-CB 3.31Å; D295-N298 PolarHBondContact O-N 3.14Å; A296-N298 PolarHBondContact O-N 3.06Å
299	M	89.3	Confident	89	Confident	3 Å²	3	41 Å²	41	2%	0.015	20%	0.196	C	C	.	.	B	Isolated β-bridge	trans	-75.1	135.9	175.1	-62.6	-61.3	165.3	0	0	110	I210 M267 M293 A296 P305 F367	I210-M299 WeakPolarHBondContact CD1-O 3.41Å; M267-M299 HydrophobicContact CE-CB 4.31Å; M267-M299 HydrophobicContact CE-CG 4.28Å; M293-M299 WeakPolarHBondContact O-CE 3.29Å; A296-M299 PolarHBondContact O-N 3.28Å; M299-P305 HydrophobicContact CE-CG 3.9Å; M299-P305 HydrophobicContact CG-CG 3.87Å; M299-P305 HydrophobicContact SD-CG 4.41Å; M299-F367 HydrophobicContact CE-CD1 3.73Å; M299-F367 HydrophobicContact CE-CE1 3.57Å; M299-F367 HydrophobicContact CE-CG 4.43Å; M299-F367 HydrophobicContact CE-CZ 4.14Å; M299-F367 HydrophobicContact SD-CD1 3.74Å; M299-F367 HydrophobicContact SD-CE1 3.81Å
300	M	89.3	Confident	89.1	Confident	1 Å²	1	41.4 Å²	41.4	1%	0.005	20%	0.197	C	C	.	.	S	Bend	trans	-85.6	-0.7	176.3	-58.5	-64.2	178.9	0	0	112	D203 L207 I210 L228 P268 F270 L273	D203-M300 PolarHBondContact N-O 3.48Å; L207-M300 HydrophobicContact CD2-SD 3.39Å; L207-M300 WeakPolarHBondContact CD2-SD 3.48Å; I210-M300 HydrophobicContact CD1-CE 4.37Å; I210-M300 HydrophobicContact CD1-SD 3.7Å; L228-M300 HydrophobicContact CB-CE 4.15Å; L228-M300 HydrophobicContact CB-SD 4.38Å; L228-M300 HydrophobicContact CD2-CE 4.38Å; P268-M300 HydrophobicContact CB-CB 4.35Å; P268-M300 HydrophobicContact CG-CB 4.02Å; P268-M300 WeakPolarHBondContact O-CB 3.39Å; P268-M300 PolarHBondContact O-N 2.77Å; F270-M300 HydrophobicContact CB-CE 3.76Å; L273-M300 HydrophobicContact CD1-CE 4.46Å; L273-M300 HydrophobicContact CD2-CE 4.26Å
301	A	89.2	Confident	89.2	Confident	1 Å²	1	41.3 Å²	41.3	1%	0.008	20%	0.197	C	C	.	.	S	Bend	trans	-111.9	136.6	168.9	0	0	0	0	0	108.9	M267 C303 I374 L377	M267-A301 HydrophobicContact CB-CB 4.4Å; M267-A301 HydrophobicContact CE-CB 4.09Å; M267-A301 HydrophobicContact CG-CB 4.05Å; A301-C303 PolarHBondContact O-N 2.74Å; A301-I374 HydrophobicContact CB-CD1 4.2Å; A301-L377 HydrophobicContact CB-CD1 4.42Å
302	A	87.9	Confident	89.4	Confident	34 Å²	34	34.4 Å²	34.4	28%	0.281	17%	0.165	S	C	.	.	S	Bend	trans	-81.5	63.4	-175.8	0	0	0	0	0	111.4	D203 E205 A206	D203-A302 WeakPolarHBondContact OD2-CB 3.43Å; D203-A302 PolarHBondContact OD2-N 3.19Å; E205-A302 HydrophobicContact CB-CB 4.05Å; E205-A302 HydrophobicContact CG-CB 4.06Å; A206-A302 HydrophobicContact CB-CB 4.01Å
303	C	87.1	Confident	89.6	Confident	7 Å²	7	33.7 Å²	33.7	5%	0.047	16%	0.162	C	C	.	.	S	Bend	trans	-130.1	145.2	174.2	-42.2	0	0	0	0	108.8	M267 A301 P305 A373 E376	M267-C303 HydrophobicContact CE-CB 3.61Å; M267-C303 HydrophobicContact SD-CB 4.28Å; A301-C303 PolarHBondContact O-N 2.74Å; C303-P305 VanDerWaalsContact O-CD 3.32Å; C303-P305 WeakPolarHBondContact O-CD 3.45Å; C303-A373 HydrophobicContact CB-CB 4.35Å; C303-A373 WeakPolarHBondContact CB-O 3.14Å; C303-E376 WeakPolarHBondContact CA-OE2 3.47Å; C303-E376 HydrophobicContact CB-CB 4.31Å
304	D	87.6	Confident	89.6	Confident	47 Å²	47	34 Å²	34	25%	0.251	16%	0.164	S	C	.	.			trans	-85.5	113.6	171	-167.2	-24.1	0	0	0	109.2	R306 H307 A373 E376	D304-R306 PolarHBondContact O-N 3.19Å; D304-R306 VanDerWaalsContact OD1-CB 3.29Å; D304-R306 WeakPolarHBondContact OD1-CB 3.44Å; D304-R306 WeakPolarHBondContact OD1-CG 3.49Å; D304-R306 PolarHBondContact OD1-N 3.1Å; D304-H307 PolarHBondContact O-N 2.87Å; D304-A373 WeakPolarHBondContact O-CB 3.44Å; D304-E376 PolarHBondContact N-OE2 3.08Å; D304-E376 VanDerWaalsContact N-OE2 3.14Å
305	P	87.4	Confident	89.7	Confident	7 Å²	7	32.8 Å²	32.8	5%	0.045	16%	0.159	C	C	.	.	G	3₁₀ helix	trans	-61	-17.1	179.9	-18.8	31	0	0	0	113.7	M267 M299 C303 H307 G308 Y310	M267-P305 HydrophobicContact CE-CG 4.36Å; M299-P305 HydrophobicContact CE-CG 3.9Å; M299-P305 HydrophobicContact CG-CG 3.87Å; M299-P305 HydrophobicContact SD-CG 4.41Å; C303-P305 VanDerWaalsContact O-CD 3.32Å; C303-P305 WeakPolarHBondContact O-CD 3.45Å; P305-H307 VanDerWaalsContact C-N 3.29Å; P305-G308 PolarHBondContact O-N 2.94Å; P305-Y310 HydrophobicContact CB-CE1 4.33Å; P305-Y310 HydrophobicContact CB-CE2 4.23Å; P305-Y310 WeakPolarHBondContact CB-OH 3.42Å
306	R	88.3	Confident	89.8	Confident	150 Å²	150	30.8 Å²	30.8	57%	0.566	15%	0.148	S	C	*	.	G	3₁₀ helix	trans	-75.3	-16.9	177.5	-59.9	173.2	-177.9	-176.1	2.9	113.4	D304 G308 Y340	D304-R306 PolarHBondContact O-N 3.19Å; D304-R306 VanDerWaalsContact OD1-CB 3.29Å; D304-R306 WeakPolarHBondContact OD1-CB 3.44Å; D304-R306 WeakPolarHBondContact OD1-CG 3.49Å; D304-R306 PolarHBondContact OD1-N 3.1Å; R306-G308 VanDerWaalsContact C-N 3.26Å; R306-Y340 HydrophobicContact CB-CE1 4.01Å; R306-Y340 HydrophobicContact CG-CE1 4.44Å; R306-Y340 WeakPolarHBondContact O-CE1 3.4Å
307	H	90.2	Very high	90.1	Very high	114 Å²	114	29.5 Å²	29.5	53%	0.528	14%	0.138	S	C	.	.	G	3₁₀ helix	trans	-82.6	-7.1	175.6	-65.6	165.7	0	0	0	112.9	D304 P305 E376 Q426	D304-H307 PolarHBondContact O-N 2.87Å; P305-H307 VanDerWaalsContact C-N 3.29Å; H307-E376 IonicContact CE1-OE1 3.77Å; H307-E376 IonicContact CG-OE1 3.55Å; H307-E376 IonicContact ND1-OE1 2.72Å; H307-E376 PolarHBondContact ND1-OE1 3.48Å; H307-Q426 PolarHBondContact O-NE2 3.21Å
308	G	90.4	Very high	90.3	Very high	5 Å²	5	23 Å²	23	5%	0.052	11%	0.109	C	C	.	.	S	Bend	trans	-132.2	-165.4	177.2	0	0	0	0	0	112.8	P305 R306 T372	P305-G308 PolarHBondContact O-N 2.94Å; R306-G308 VanDerWaalsContact C-N 3.26Å; G308-T372 VanDerWaalsContact CA-OG1 3.3Å; G308-T372 WeakPolarHBondContact CA-OG1 3.49Å
309	R	93.1	Very high	90.4	Very high	77 Å²	77	22.6 Å²	22.6	29%	0.291	11%	0.107	S	C	.	.			trans	-122.1	150.1	173.2	-62.9	-177.2	178.9	178.5	1.6	109.7	Y340 V342 S371 T372	R309-Y340 CarbonylContact C-O 3.56Å; R309-Y340 VanDerWaalsContact CA-O 3.29Å; R309-Y340 WeakPolarHBondContact CA-O 3.45Å; R309-V342 HydrophobicContact CB-CG1 3.93Å; R309-S371 VanDerWaalsContact O-CA 3.31Å; R309-S371 WeakPolarHBondContact O-CA 3.48Å; R309-S371 PolarHBondContact O-OG 3.06Å; R309-S371 VanDerWaalsContact O-OG 3.06Å; R309-T372 PolarHBondContact N-OG1 3.43Å; R309-T372 PolarHBondContact O-N 3.36Å; R309-T372 PolarHBondContact O-OG1 3.23Å
310	Y	94	Very high	90.3	Very high	8 Å²	8	33.2 Å²	33.2	3%	0.031	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83	120.4	170.9	-71.2	-66.7	0	0	0	109.3	F294 P305 V313 Y340 F341 V342 N348 F367	F294-Y310 HydrophobicContact CD1-CE2 4.02Å; F294-Y310 HydrophobicContact CE1-CE2 4.12Å; P305-Y310 HydrophobicContact CB-CE1 4.33Å; P305-Y310 HydrophobicContact CB-CE2 4.23Å; P305-Y310 WeakPolarHBondContact CB-OH 3.42Å; Y310-V313 HydrophobicContact CD1-CG2 3.75Å; Y310-V313 HydrophobicContact CD2-CG2 4.43Å; Y310-V313 HydrophobicContact CE1-CG2 4.41Å; Y310-V313 HydrophobicContact CG-CG2 3.75Å; Y310-Y340 PolarHBondContact N-O 3.17Å; Y310-F341 HydrophobicContact CD2-CD1 4.3Å; Y310-F341 AromaticContact CD2-CE1 3.96Å; Y310-F341 HydrophobicContact CD2-CE1 3.96Å; Y310-F341 HydrophobicContact CD2-CZ 4.22Å; Y310-F341 HydrophobicContact CG-CD1 4.48Å; Y310-F341 HydrophobicContact CG-CE1 4.33Å; Y310-V342 WeakPolarHBondContact O-CG2 3.49Å; Y310-V342 PolarHBondContact O-N 3.21Å; Y310-V342 VanDerWaalsContact O-N 3.08Å; Y310-N348 PolarHBondContact O-ND2 2.66Å; Y310-F367 HydrophobicContact CD1-CZ 4.24Å; Y310-F367 HydrophobicContact CE1-CE1 4.02Å; Y310-F367 AromaticContact CE1-CZ 3.47Å; Y310-F367 HydrophobicContact CE1-CZ 3.47Å; Y310-F367 VanDerWaalsContact CE1-CZ 3.47Å; Y310-F367 AromaticContact CZ-CZ 3.71Å
311	L	93.3	Very high	90.2	Very high	0 Å²	0	34.6 Å²	34.6	0%	0	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.7	-57.3	167.8	-62.4	178.8	0	0	0	108.7	P259 L263 V342 W344 N348 N370 T372	P259-L311 HydrophobicContact CG-CB 4.31Å; P259-L311 HydrophobicContact CG-CD1 4.26Å; L263-L311 HydrophobicContact CD1-CD1 4.11Å; L311-V342 HydrophobicContact CD2-CG1 3.88Å; L311-V342 HydrophobicContact CD2-CG2 4.45Å; L311-W344 HydrophobicContact CD2-CH2 4.11Å; L311-W344 HydrophobicContact CD2-CZ2 3.73Å; L311-N348 WeakPolarHBondContact O-CB 3.44Å; L311-N348 PolarHBondContact O-ND2 3.17Å; L311-N370 HydrophobicContact CB-CB 4.36Å; L311-N370 PolarHBondContact N-O 3.07Å; L311-T372 HydrophobicContact CD2-CG2 4.31Å; L311-T372 HydrophobicContact CG-CG2 4.33Å
312	T	93.4	Very high	90.2	Very high	5 Å²	5	37.4 Å²	37.4	3%	0.031	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.6	152.6	-179.8	63.2	0	0	0	0	110.4	N256 M257 I345 N348 N370	N256-T312 WeakPolarHBondContact O-CG2 3.43Å; M257-T312 WeakPolarHBondContact CA-OG1 3.18Å; M257-T312 WeakPolarHBondContact CE-OG1 3.4Å; M257-T312 PolarHBondContact O-OG1 3.14Å; T312-I345 HydrophobicContact CG2-CD1 4.34Å; T312-N348 WeakPolarHBondContact CA-O 3.32Å; T312-N370 PolarHBondContact N-O 2.94Å; T312-N370 PolarHBondContact O-N 2.97Å; T312-N370 WeakPolarHBondContact OG1-CB 3.23Å
313	V	93.4	Very high	90.1	Very high	0 Å²	0	39.1 Å²	39.1	0%	0	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.3	131.7	178.5	173.8	0	0	0	0	110	F294 Y310 F341 N348 V349 K350 F367 I368	F294-V313 HydrophobicContact CZ-CG1 4.26Å; Y310-V313 HydrophobicContact CD1-CG2 3.75Å; Y310-V313 HydrophobicContact CD2-CG2 4.43Å; Y310-V313 HydrophobicContact CE1-CG2 4.41Å; Y310-V313 HydrophobicContact CG-CG2 3.75Å; V313-F341 HydrophobicContact CG2-CE1 4.06Å; V313-N348 PolarHBondContact N-O 3.11Å; V313-V349 HydrophobicContact CB-CB 4.45Å; V313-V349 HydrophobicContact CB-CG1 4.2Å; V313-V349 HydrophobicContact CB-CG2 4.15Å; V313-V349 HydrophobicContact CG1-CG1 4.13Å; V313-V349 CarbonylContact O-C 3.58Å; V313-V349 WeakPolarHBondContact O-CA 3.34Å; V313-K350 PolarHBondContact O-N 2.87Å; V313-F367 HydrophobicContact CB-CE2 4.39Å; V313-F367 HydrophobicContact CG1-CD2 3.96Å; V313-F367 HydrophobicContact CG1-CE2 3.33Å; V313-F367 HydrophobicContact CG1-CZ 4.05Å; V313-F367 HydrophobicContact CG2-CE2 4.17Å; V313-F367 HydrophobicContact CG2-CZ 4.16Å; V313-I368 CarbonylContact C-O 3.48Å; V313-I368 WeakPolarHBondContact CA-O 3.48Å
314	A	91	Very high	90.2	Very high	7 Å²	7	45.6 Å²	45.6	6%	0.058	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	130.3	164.9	0	0	0	0	0	110.6	L253 M257 K350 I368	L253-A314 HydrophobicContact CD1-CB 4.32Å; M257-A314 HydrophobicContact CE-CB 4.29Å; M257-A314 HydrophobicContact CG-CB 4.46Å; M257-A314 HydrophobicContact SD-CB 3.54Å; M257-A314 VanDerWaalsContact SD-CB 3.54Å; A314-K350 CarbonylContact C-O 3.48Å; A314-K350 WeakPolarHBondContact CA-O 3.29Å; A314-I368 HydrophobicContact CB-CB 4.25Å; A314-I368 HydrophobicContact CB-CD1 4.45Å; A314-I368 PolarHBondContact N-O 3.41Å; A314-I368 PolarHBondContact O-N 3Å
315	A	91.6	Very high	90.5	Very high	1 Å²	1	46.8 Å²	46.8	1%	0.008	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120	112.8	179.2	0	0	0	0	0	109.6	M293 F317 M330 K350 T351 A352 T366	M293-A315 HydrophobicContact CE-CB 3.53Å; A315-F317 HydrophobicContact CB-CD2 4.4Å; A315-F317 HydrophobicContact CB-CE2 3.86Å; A315-M330 HydrophobicContact CB-CE 3.84Å; A315-M330 HydrophobicContact CB-SD 4.33Å; A315-K350 PolarHBondContact N-O 2.68Å; A315-T351 HydrophobicContact CB-CG2 4.33Å; A315-T351 CarbonylContact O-C 3.21Å; A315-T351 WeakPolarHBondContact O-CA 3.33Å; A315-A352 PolarHBondContact O-N 2.94Å; A315-T366 WeakPolarHBondContact CA-O 3.42Å
316	I	91.4	Very high	90.6	Very high	6 Å²	6	46.5 Å²	46.5	3%	0.031	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	103	-178.8	-53.8	168.9	0	0	0	108.8	G235 T238 A352 A365 T366 I368	G235-I316 WeakPolarHBondContact O-CD1 3.41Å; T238-I316 HydrophobicContact CG2-CG2 4.38Å; I316-A352 CarbonylContact C-O 3.48Å; I316-A352 WeakPolarHBondContact CA-O 3.34Å; I316-A352 HydrophobicContact CG1-CB 4.43Å; I316-A365 CarbonylContact O-C 3.49Å; I316-A365 VanDerWaalsContact O-CA 3.3Å; I316-A365 WeakPolarHBondContact O-CA 3.49Å; I316-T366 PolarHBondContact N-O 3.06Å; I316-T366 PolarHBondContact O-N 3.47Å; I316-I368 HydrophobicContact CD1-CD1 4.08Å
317	F	92	Very high	90.7	Very high	0 Å²	0	43.3 Å²	43.3	0%	0	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.7	137.8	174.9	-71.2	-92.9	0	0	0	110.8	V286 L289 M293 A315 M321 V326 M330 A352 V353 C354 A365	V286-F317 HydrophobicContact CG1-CE1 4.39Å; L289-F317 HydrophobicContact CB-CE1 4.27Å; M293-F317 HydrophobicContact SD-CE1 4.14Å; M293-F317 HydrophobicContact SD-CE2 4.39Å; M293-F317 HydrophobicContact SD-CZ 3.81Å; A315-F317 HydrophobicContact CB-CD2 4.4Å; A315-F317 HydrophobicContact CB-CE2 3.86Å; F317-M321 HydrophobicContact CB-CE 3.71Å; F317-M321 HydrophobicContact CB-SD 3.52Å; F317-M321 VanDerWaalsContact CB-SD 3.52Å; F317-M321 HydrophobicContact CD1-CE 4.36Å; F317-M321 HydrophobicContact CD1-SD 3.74Å; F317-M321 HydrophobicContact CG-SD 3.92Å; F317-V326 HydrophobicContact CD1-CG2 4.41Å; F317-V326 HydrophobicContact CD2-CG1 3.57Å; F317-V326 HydrophobicContact CE2-CG1 3.5Å; F317-V326 HydrophobicContact CG-CG1 4.16Å; F317-V326 HydrophobicContact CG-CG2 4.35Å; F317-V326 HydrophobicContact CZ-CG1 4.05Å; F317-M330 HydrophobicContact CE2-CG 4.31Å; F317-M330 HydrophobicContact CE2-SD 4.13Å; F317-M330 HydrophobicContact CZ-SD 4.11Å; F317-A352 PolarHBondContact N-O 3.02Å; F317-V353 HydrophobicContact CB-CG2 4.32Å; F317-V353 CarbonylContact O-C 3.6Å; F317-V353 WeakPolarHBondContact O-CA 3.48Å; F317-C354 PolarHBondContact O-N 3.43Å; F317-A365 HydrophobicContact CD1-CB 3.65Å; F317-A365 HydrophobicContact CE1-CB 3.73Å; F317-A365 HydrophobicContact CG-CB 4.23Å; F317-A365 HydrophobicContact CZ-CB 4.37Å
318	R	90.4	Very high	90.8	Very high	2 Å²	2	42.7 Å²	42.7	1%	0.008	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	138.8	178.9	-55.7	-176.8	64	178.8	-2.4	111.1	E27 S234 T238 M321 C354 I356 M363 S364	E27-R318 VanDerWaalsContact CD-NH2 3.26Å; E27-R318 IonicContact OE1-CZ 2.64Å; E27-R318 IonicContact OE1-NH1 2.83Å; E27-R318 PolarHBondContact OE1-NH1 3.42Å; E27-R318 IonicContact OE1-NH2 3.24Å; E27-R318 PolarHBondContact OE1-NH2 2.98Å; E27-R318 IonicContact OE2-CZ 3.76Å; E27-R318 IonicContact OE2-NH1 2.74Å; E27-R318 PolarHBondContact OE2-NH1 2.75Å; E27-R318 IonicContact OE2-NH2 3.46Å; E27-R318 PolarHBondContact OE2-NH2 3.43Å; S234-R318 PolarHBondContact OG-NH1 3.15Å; T238-R318 HydrophobicContact CG2-CG 3.98Å; T238-R318 WeakPolarHBondContact OG1-CD 3.36Å; T238-R318 PolarHBondContact OG1-NE 2.94Å; T238-R318 PolarHBondContact OG1-NH1 3.39Å; R318-M321 VanDerWaalsContact C-CE 3.44Å; R318-M321 WeakPolarHBondContact O-CE 3.23Å; R318-C354 CarbonylContact C-O 3.58Å; R318-C354 VanDerWaalsContact CA-O 3.29Å; R318-C354 WeakPolarHBondContact CA-O 3.45Å; R318-C354 HydrophobicContact CG-CB 4.43Å; R318-I356 PolarHBondContact NE-O 3.49Å; R318-I356 VanDerWaalsContact NE-O 3.11Å; R318-I356 PolarHBondContact NH2-O 3.31Å; R318-M363 VanDerWaalsContact O-CA 3.23Å; R318-M363 WeakPolarHBondContact O-CA 3.47Å; R318-S364 PolarHBondContact N-O 3.45Å; R318-S364 PolarHBondContact O-N 2.75Å
319	G	88.7	Confident	90.9	Very high	0 Å²	0	44.4 Å²	44.4	0%	0	21%	0.205	C	C	.	.	S	Bend	trans	106.5	169.5	-178.5	0	0	0	0	0	112.9	M321 C354	G319-M321 VanDerWaalsContact O-CE 3.3Å; G319-M321 WeakPolarHBondContact O-CE 3.45Å; G319-M321 PolarHBondContact O-N 3.24Å; G319-M321 VanDerWaalsContact O-N 3.13Å; G319-C354 PolarHBondContact N-O 3.24Å
320	R	86.1	Confident	90.9	Very high	226 Å²	226	40.9 Å²	40.9	85%	0.853	19%	0.191	S	C	*	.	S	Bend	trans	-72.8	106.5	-176.9	-63.6	-177.1	-175.7	-178.1	1.2	110.7
321	M	87.9	Confident	90.7	Very high	29 Å²	29	45 Å²	45	14%	0.143	21%	0.213	C	C	.	.			trans	-143.8	162	178.9	66.1	-169.2	85.5	0	0	112.2	V286 F317 R318 G319 V326 V353 M363	V286-M321 HydrophobicContact CG2-CB 3.94Å; V286-M321 HydrophobicContact CG2-SD 4.09Å; F317-M321 HydrophobicContact CB-CE 3.71Å; F317-M321 HydrophobicContact CB-SD 3.52Å; F317-M321 VanDerWaalsContact CB-SD 3.52Å; F317-M321 HydrophobicContact CD1-CE 4.36Å; F317-M321 HydrophobicContact CD1-SD 3.74Å; F317-M321 HydrophobicContact CG-SD 3.92Å; R318-M321 VanDerWaalsContact C-CE 3.44Å; R318-M321 WeakPolarHBondContact O-CE 3.23Å; G319-M321 VanDerWaalsContact O-CE 3.3Å; G319-M321 WeakPolarHBondContact O-CE 3.45Å; G319-M321 PolarHBondContact O-N 3.24Å; G319-M321 VanDerWaalsContact O-N 3.13Å; M321-V326 HydrophobicContact CG-CG2 3.91Å; M321-V326 HydrophobicContact SD-CG2 3.57Å; M321-V326 VanDerWaalsContact SD-CG2 3.57Å; M321-V353 HydrophobicContact CG-CG1 4Å; M321-M363 HydrophobicContact CB-SD 4.5Å
322	S	88.6	Confident	90.7	Very high	61 Å²	61	47.6 Å²	47.6	43%	0.427	23%	0.227	S	C	.	.			trans	-79.9	119.4	177	-180	0	0	0	0	110.2	K324 E325 V326	S322-K324 PolarHBondContact O-N 3.46Å; S322-E325 WeakPolarHBondContact O-CB 3.21Å; S322-E325 PolarHBondContact O-N 3.13Å; S322-V326 PolarHBondContact O-N 3.31Å; S322-V326 VanDerWaalsContact O-N 3.11Å
323	M	86.2	Confident	90.6	Very high	69 Å²	69	48.3 Å²	48.3	34%	0.34	23%	0.231	S	C	.	.	H	α-helix	trans	-58.3	-39.1	176.8	-67.7	167.8	-163.8	0	0	112.1	Q245 E325 V326 D327 V353	Q245-M323 HydrophobicContact CG-CE 4.2Å; Q245-M323 PolarHBondContact OE1-SD 3.32Å; M323-E325 PolarHBondContact O-N 3.24Å; M323-V326 WeakPolarHBondContact O-CB 3.47Å; M323-V326 PolarHBondContact O-N 3.02Å; M323-V326 VanDerWaalsContact O-N 3.11Å; M323-D327 PolarHBondContact O-N 3.36Å; M323-V353 HydrophobicContact CG-CG2 4.27Å
324	K	90.3	Very high	90.4	Very high	143 Å²	143	50.3 Å²	50.3	62%	0.622	24%	0.241	S	C	*	.	H	α-helix	trans	-57	-41.1	176.3	-178.2	-179.4	170.2	-178.2	0	111.6	S322 E328	S322-K324 PolarHBondContact O-N 3.46Å; K324-E328 WeakPolarHBondContact CE-OE1 3.5Å; K324-E328 IonicContact NZ-OE1 3.47Å; K324-E328 WeakPolarHBondContact O-CB 3.42Å; K324-E328 VanDerWaalsContact O-CG 3.25Å; K324-E328 WeakPolarHBondContact O-CG 3.28Å; K324-E328 PolarHBondContact O-N 3.05Å
325	E	92.1	Very high	90.4	Very high	73 Å²	73	55.3 Å²	55.3	34%	0.341	27%	0.267	S	S	.	.	H	α-helix	trans	-69.7	-40.2	178.8	-170.8	179.2	-179.1	0	0	111.1	V286 S322 M323 E328 Q329	V286-E325 HydrophobicContact CB-CG 4.14Å; V286-E325 HydrophobicContact CG1-CG 4.31Å; S322-E325 WeakPolarHBondContact O-CB 3.21Å; S322-E325 PolarHBondContact O-N 3.13Å; M323-E325 PolarHBondContact O-N 3.24Å; E325-E328 PolarHBondContact O-N 3.33Å; E325-Q329 VanDerWaalsContact O-CG 3.31Å; E325-Q329 WeakPolarHBondContact O-CG 3.37Å; E325-Q329 PolarHBondContact O-N 3.42Å
326	V	90.8	Very high	90.3	Very high	0 Å²	0	62.2 Å²	62.2	0%	0	30%	0.297	C	S	.	.	H	α-helix	trans	-59.2	-50.1	174.7	174.5	0	0	0	0	110.7	V286 F317 M321 S322 M323 E328 Q329 M330 T351 V353	V286-V326 HydrophobicContact CG1-CB 4.4Å; V286-V326 HydrophobicContact CG1-CG2 3.79Å; V286-V326 HydrophobicContact CG2-CG2 4.4Å; F317-V326 HydrophobicContact CD1-CG2 4.41Å; F317-V326 HydrophobicContact CD2-CG1 3.57Å; F317-V326 HydrophobicContact CE2-CG1 3.5Å; F317-V326 HydrophobicContact CG-CG1 4.16Å; F317-V326 HydrophobicContact CG-CG2 4.35Å; F317-V326 HydrophobicContact CZ-CG1 4.05Å; M321-V326 HydrophobicContact CG-CG2 3.91Å; M321-V326 HydrophobicContact SD-CG2 3.57Å; M321-V326 VanDerWaalsContact SD-CG2 3.57Å; S322-V326 PolarHBondContact O-N 3.31Å; S322-V326 VanDerWaalsContact O-N 3.11Å; M323-V326 WeakPolarHBondContact O-CB 3.47Å; M323-V326 PolarHBondContact O-N 3.02Å; M323-V326 VanDerWaalsContact O-N 3.11Å; V326-E328 PolarHBondContact O-N 3.49Å; V326-Q329 PolarHBondContact O-N 3.4Å; V326-M330 HydrophobicContact CG1-CG 4.38Å; V326-M330 WeakPolarHBondContact O-CB 3.3Å; V326-M330 VanDerWaalsContact O-CG 3.26Å; V326-M330 WeakPolarHBondContact O-CG 3.49Å; V326-M330 PolarHBondContact O-N 2.96Å; V326-T351 HydrophobicContact CG1-CG2 4.38Å; V326-V353 HydrophobicContact CG1-CG2 4.49Å; V326-V353 HydrophobicContact CG2-CG2 4.46Å
327	D	89.7	Confident	90.3	Very high	84 Å²	84	64.8 Å²	64.8	45%	0.449	31%	0.31	S	S	.	.	H	α-helix	trans	-64.4	-42.2	-178.9	-66.3	-24.6	0	0	0	111.6	M323 Q329 M330 L331 T351	M323-D327 PolarHBondContact O-N 3.36Å; D327-Q329 PolarHBondContact O-N 3.42Å; D327-M330 PolarHBondContact O-N 3.45Å; D327-L331 VanDerWaalsContact O-CB 3.3Å; D327-L331 WeakPolarHBondContact O-CB 3.25Å; D327-L331 PolarHBondContact O-N 3.2Å; D327-T351 PolarHBondContact OD1-OG1 3.42Å
328	E	92.6	Very high	90.1	Very high	100 Å²	100	68 Å²	68	47%	0.467	33%	0.333	S	S	.	.	H	α-helix	trans	-61.1	-42.5	175	-78.2	176.4	-177.9	0	0	112.1	K324 E325 V326 N332	K324-E328 WeakPolarHBondContact CE-OE1 3.5Å; K324-E328 IonicContact NZ-OE1 3.47Å; K324-E328 WeakPolarHBondContact O-CB 3.42Å; K324-E328 VanDerWaalsContact O-CG 3.25Å; K324-E328 WeakPolarHBondContact O-CG 3.28Å; K324-E328 PolarHBondContact O-N 3.05Å; E325-E328 PolarHBondContact O-N 3.33Å; V326-E328 PolarHBondContact O-N 3.49Å; E328-N332 VanDerWaalsContact O-CB 3.24Å; E328-N332 WeakPolarHBondContact O-CB 3.27Å; E328-N332 PolarHBondContact O-N 2.92Å
329	Q	93.2	Very high	90	Very high	42 Å²	42	71.2 Å²	71.2	20%	0.196	36%	0.356	C	S	.	.	H	α-helix	trans	-70	-39.1	178.7	-68.7	-47.7	-52.4	0	0	112.5	V286 P287 T290 E325 V326 D327 N332 V333	V286-Q329 HydrophobicContact CG1-CG 4.21Å; P287-Q329 HydrophobicContact CB-CG 4.22Å; P287-Q329 HydrophobicContact CG-CG 3.94Å; T290-Q329 HydrophobicContact CG2-CB 4.18Å; E325-Q329 VanDerWaalsContact O-CG 3.31Å; E325-Q329 WeakPolarHBondContact O-CG 3.37Å; E325-Q329 PolarHBondContact O-N 3.42Å; V326-Q329 PolarHBondContact O-N 3.4Å; D327-Q329 PolarHBondContact O-N 3.42Å; Q329-N332 WeakPolarHBondContact O-CB 3.29Å; Q329-N332 PolarHBondContact O-N 2.97Å; Q329-V333 PolarHBondContact O-N 2.99Å
330	M	91.4	Very high	90.1	Very high	3 Å²	3	75.1 Å²	75.1	2%	0.015	37%	0.371	C	S	.	.	H	α-helix	trans	-68	-40.2	178.3	-68.4	-63.5	-58.7	0	0	111.5	T290 F294 A315 F317 V326 D327 V333 Q334 V349 T351	T290-M330 HydrophobicContact CG2-SD 3.7Å; F294-M330 HydrophobicContact CE2-CE 3.83Å; F294-M330 HydrophobicContact CE2-SD 4.11Å; F294-M330 HydrophobicContact CZ-CE 3.93Å; A315-M330 HydrophobicContact CB-CE 3.84Å; A315-M330 HydrophobicContact CB-SD 4.33Å; F317-M330 HydrophobicContact CE2-CG 4.31Å; F317-M330 HydrophobicContact CE2-SD 4.13Å; F317-M330 HydrophobicContact CZ-SD 4.11Å; V326-M330 HydrophobicContact CG1-CG 4.38Å; V326-M330 WeakPolarHBondContact O-CB 3.3Å; V326-M330 VanDerWaalsContact O-CG 3.26Å; V326-M330 WeakPolarHBondContact O-CG 3.49Å; V326-M330 PolarHBondContact O-N 2.96Å; D327-M330 PolarHBondContact O-N 3.45Å; M330-V333 PolarHBondContact O-N 3.42Å; M330-Q334 WeakPolarHBondContact O-CG 3.41Å; M330-Q334 PolarHBondContact O-N 2.89Å; M330-V349 HydrophobicContact CE-CG1 3.38Å; M330-T351 HydrophobicContact CB-CG2 4.11Å; M330-T351 HydrophobicContact CE-CG2 4.23Å; M330-T351 HydrophobicContact CG-CG2 3.61Å
331	L	90.9	Very high	90.4	Very high	94 Å²	94	65 Å²	65	49%	0.492	33%	0.333	S	S	.	.	H	α-helix	trans	-64.5	-39.5	172.8	-174.8	64.8	0	0	0	111.8	D327 V333 Q334 N335	D327-L331 VanDerWaalsContact O-CB 3.3Å; D327-L331 WeakPolarHBondContact O-CB 3.25Å; D327-L331 PolarHBondContact O-N 3.2Å; L331-V333 VanDerWaalsContact C-N 3.35Å; L331-V333 PolarHBondContact O-N 2.82Å; L331-Q334 PolarHBondContact O-N 2.54Å; L331-N335 WeakPolarHBondContact O-CB 3.27Å; L331-N335 VanDerWaalsContact O-CG 3.28Å; L331-N335 PolarHBondContact O-N 3.28Å; L331-N335 PolarHBondContact O-ND2 2.94Å
332	N	93.1	Very high	90.5	Very high	55 Å²	55	63.9 Å²	63.9	29%	0.294	33%	0.328	S	S	.	.	H	α-helix	trans	-62.2	-40.9	176.3	-174.2	24.1	0	0	0	112.1	E328 Q329 K336	E328-N332 VanDerWaalsContact O-CB 3.24Å; E328-N332 WeakPolarHBondContact O-CB 3.27Å; E328-N332 PolarHBondContact O-N 2.92Å; Q329-N332 WeakPolarHBondContact O-CB 3.29Å; Q329-N332 PolarHBondContact O-N 2.97Å; N332-K336 PolarHBondContact ND2-NZ 2.84Å; N332-K336 WeakPolarHBondContact O-CB 3.5Å; N332-K336 VanDerWaalsContact O-CG 3.31Å; N332-K336 WeakPolarHBondContact O-CG 3.32Å; N332-K336 PolarHBondContact O-N 3.44Å; N332-K336 WeakPolarHBondContact OD1-CE 3.31Å; N332-K336 PolarHBondContact OD1-NZ 2.77Å
333	V	91.2	Very high	90.4	Very high	19 Å²	19	67.9 Å²	67.9	12%	0.115	34%	0.34	C	S	.	.	H	α-helix	trans	-65.4	-47.1	175.2	170.2	0	0	0	0	111	T290 F294 Q329 M330 L331 N335 K336 N337	T290-V333 HydrophobicContact CG2-CG2 3.63Å; F294-V333 HydrophobicContact CD1-CG1 4.28Å; F294-V333 HydrophobicContact CD2-CG1 3.78Å; F294-V333 HydrophobicContact CD2-CG2 4.48Å; F294-V333 HydrophobicContact CE1-CG1 4.31Å; F294-V333 HydrophobicContact CE2-CB 4.44Å; F294-V333 HydrophobicContact CE2-CG1 3.82Å; F294-V333 HydrophobicContact CG-CG1 4.02Å; F294-V333 HydrophobicContact CZ-CG1 4.08Å; Q329-V333 PolarHBondContact O-N 2.99Å; M330-V333 PolarHBondContact O-N 3.42Å; L331-V333 VanDerWaalsContact C-N 3.35Å; L331-V333 PolarHBondContact O-N 2.82Å; V333-N335 VanDerWaalsContact C-N 3.34Å; V333-N335 PolarHBondContact O-N 3.33Å; V333-K336 PolarHBondContact O-N 2.86Å; V333-N337 VanDerWaalsContact O-CB 3.27Å; V333-N337 WeakPolarHBondContact O-CB 3.49Å; V333-N337 PolarHBondContact O-N 3.3Å
334	Q	89.3	Confident	90.3	Very high	42 Å²	42	67 Å²	67	20%	0.196	33%	0.333	C	S	.	.	H	α-helix	trans	-57.6	-46.2	177.6	-73.4	170.2	41.6	0	0	111.9	M330 L331 K336 N337 S338 F341 V349	M330-Q334 WeakPolarHBondContact O-CG 3.41Å; M330-Q334 PolarHBondContact O-N 2.89Å; L331-Q334 PolarHBondContact O-N 2.54Å; Q334-K336 PolarHBondContact O-N 2.71Å; Q334-N337 CarbonylContact O-C 3.59Å; Q334-N337 PolarHBondContact O-N 3.22Å; Q334-S338 WeakPolarHBondContact O-CA 3.32Å; Q334-S338 WeakPolarHBondContact O-CB 3.48Å; Q334-S338 PolarHBondContact O-N 3.21Å; Q334-F341 HydrophobicContact CG-CE1 4.41Å; Q334-F341 HydrophobicContact CG-CE2 4.22Å; Q334-F341 HydrophobicContact CG-CZ 4.13Å; Q334-V349 HydrophobicContact CG-CG2 3.84Å; Q334-V349 VanDerWaalsContact NE2-CG2 3.33Å
335	N	90.1	Very high	90.1	Very high	113 Å²	113	61.8 Å²	61.8	60%	0.604	31%	0.311	S	S	*	.	H	α-helix	trans	-66.9	-35.8	-179.4	-72.2	-22.8	0	0	0	113.2	L331 V333	L331-N335 WeakPolarHBondContact O-CB 3.27Å; L331-N335 VanDerWaalsContact O-CG 3.28Å; L331-N335 PolarHBondContact O-N 3.28Å; L331-N335 PolarHBondContact O-ND2 2.94Å; V333-N335 VanDerWaalsContact C-N 3.34Å; V333-N335 PolarHBondContact O-N 3.33Å
336	K	91	Very high	89.7	Confident	146 Å²	146	63.1 Å²	63.1	64%	0.635	33%	0.326	S	S	*	.	H	α-helix	trans	-73.6	-32.7	177.8	-77.9	175.5	176.1	168.6	0	112.8	N332 V333 Q334	N332-K336 PolarHBondContact ND2-NZ 2.84Å; N332-K336 WeakPolarHBondContact O-CB 3.5Å; N332-K336 VanDerWaalsContact O-CG 3.31Å; N332-K336 WeakPolarHBondContact O-CG 3.32Å; N332-K336 PolarHBondContact O-N 3.44Å; N332-K336 WeakPolarHBondContact OD1-CE 3.31Å; N332-K336 PolarHBondContact OD1-NZ 2.77Å; V333-K336 PolarHBondContact O-N 2.86Å; Q334-K336 PolarHBondContact O-N 2.71Å
337	N	89.8	Confident	89.4	Confident	59 Å²	59	69.1 Å²	69.1	32%	0.316	36%	0.359	S	S	.	.	T	Hydrogen-bonded Turn	trans	-116.5	27.8	-170.1	-67.9	-9.3	0	0	0	111.2	V333 Q334 S339 Y340 F341	V333-N337 VanDerWaalsContact O-CB 3.27Å; V333-N337 WeakPolarHBondContact O-CB 3.49Å; V333-N337 PolarHBondContact O-N 3.3Å; Q334-N337 CarbonylContact O-C 3.59Å; Q334-N337 PolarHBondContact O-N 3.22Å; N337-S339 PolarHBondContact O-N 2.93Å; N337-S339 VanDerWaalsContact O-N 3.1Å; N337-Y340 HydrophobicContact CB-CD2 3.81Å; N337-Y340 WeakPolarHBondContact O-CB 3.26Å; N337-Y340 PolarHBondContact O-N 2.75Å; N337-F341 HydrophobicContact CB-CE2 4.11Å; N337-F341 VanDerWaalsContact O-CD2 3.3Å; N337-F341 WeakPolarHBondContact O-CD2 3.33Å
338	S	87.8	Confident	89.3	Confident	68 Å²	68	65.7 Å²	65.7	48%	0.476	34%	0.34	S	S	.	.	G	3₁₀ helix	trans	-56.6	-33.3	-170.2	62	0	0	0	0	112.9	Q334 Y340 F341	Q334-S338 WeakPolarHBondContact O-CA 3.32Å; Q334-S338 WeakPolarHBondContact O-CB 3.48Å; Q334-S338 PolarHBondContact O-N 3.21Å; S338-Y340 PolarHBondContact O-N 3.43Å; S338-F341 PolarHBondContact O-N 2.78Å; S338-F341 VanDerWaalsContact O-N 3.08Å; S338-F341 VanDerWaalsContact O-O 3.07Å
339	S	89.2	Confident	89.1	Confident	70 Å²	70	61.8 Å²	61.8	49%	0.49	32%	0.323	S	S	.	.	G	3₁₀ helix	trans	-62.6	-19.9	175.6	58.6	0	0	0	0	114.9	N337	N337-S339 PolarHBondContact O-N 2.93Å; N337-S339 VanDerWaalsContact O-N 3.1Å
340	Y	91.2	Very high	88.9	Confident	82 Å²	82	63.5 Å²	63.5	32%	0.322	33%	0.33	S	S	.	.	G	3₁₀ helix	trans	-93.5	-3.3	178.1	-60.7	-67.8	0	0	0	112.6	R306 R309 Y310 N337 S338	R306-Y340 HydrophobicContact CB-CE1 4.01Å; R306-Y340 HydrophobicContact CG-CE1 4.44Å; R306-Y340 WeakPolarHBondContact O-CE1 3.4Å; R309-Y340 CarbonylContact C-O 3.56Å; R309-Y340 VanDerWaalsContact CA-O 3.29Å; R309-Y340 WeakPolarHBondContact CA-O 3.45Å; Y310-Y340 PolarHBondContact N-O 3.17Å; N337-Y340 HydrophobicContact CB-CD2 3.81Å; N337-Y340 WeakPolarHBondContact O-CB 3.26Å; N337-Y340 PolarHBondContact O-N 2.75Å; S338-Y340 PolarHBondContact O-N 3.43Å
341	F	91.6	Very high	88.8	Confident	13 Å²	13	65.1 Å²	65.1	6%	0.057	34%	0.34	C	S	.	.	B	Isolated β-bridge	trans	-107.9	141.1	172.3	-64.2	-89.3	0	0	0	108.4	F294 Y310 V313 Q334 N337 S338 V349	F294-F341 HydrophobicContact CE1-CE1 4.24Å; F294-F341 AromaticContact CE1-CZ 3.75Å; F294-F341 HydrophobicContact CE1-CZ 3.75Å; F294-F341 HydrophobicContact CZ-CZ 4.18Å; Y310-F341 HydrophobicContact CD2-CD1 4.3Å; Y310-F341 AromaticContact CD2-CE1 3.96Å; Y310-F341 HydrophobicContact CD2-CE1 3.96Å; Y310-F341 HydrophobicContact CD2-CZ 4.22Å; Y310-F341 HydrophobicContact CG-CD1 4.48Å; Y310-F341 HydrophobicContact CG-CE1 4.33Å; V313-F341 HydrophobicContact CG2-CE1 4.06Å; Q334-F341 HydrophobicContact CG-CE1 4.41Å; Q334-F341 HydrophobicContact CG-CE2 4.22Å; Q334-F341 HydrophobicContact CG-CZ 4.13Å; N337-F341 HydrophobicContact CB-CE2 4.11Å; N337-F341 VanDerWaalsContact O-CD2 3.3Å; N337-F341 WeakPolarHBondContact O-CD2 3.33Å; S338-F341 PolarHBondContact O-N 2.78Å; S338-F341 VanDerWaalsContact O-N 3.08Å; S338-F341 VanDerWaalsContact O-O 3.07Å; F341-V349 HydrophobicContact CD1-CG2 3.98Å; F341-V349 HydrophobicContact CE1-CG2 3.62Å; F341-V349 HydrophobicContact CZ-CG2 4.45Å
342	V	90.6	Very high	88.6	Confident	5 Å²	5	61.1 Å²	61.1	3%	0.03	32%	0.32	C	S	.	.			trans	-67	135.9	174.6	-64.2	0	0	0	0	110.8	R309 Y310 L311 W344 I345	R309-V342 HydrophobicContact CB-CG1 3.93Å; Y310-V342 WeakPolarHBondContact O-CG2 3.49Å; Y310-V342 PolarHBondContact O-N 3.21Å; Y310-V342 VanDerWaalsContact O-N 3.08Å; L311-V342 HydrophobicContact CD2-CG1 3.88Å; L311-V342 HydrophobicContact CD2-CG2 4.45Å; V342-W344 HydrophobicContact CB-CD2 4.5Å; V342-W344 HydrophobicContact CB-CZ2 4.25Å; V342-W344 HydrophobicContact CG1-CZ2 4.24Å; V342-W344 HydrophobicContact CG2-CD2 4.47Å; V342-W344 HydrophobicContact CG2-CZ2 4.14Å; V342-I345 HydrophobicContact CG2-CB 3.9Å; V342-I345 HydrophobicContact CG2-CD1 3.97Å; V342-I345 HydrophobicContact CG2-CG1 3.77Å
343	E	85.5	Confident	88.4	Confident	145 Å²	145	59.6 Å²	59.6	68%	0.678	31%	0.313	S	S	*	.	S	Bend	trans	-80.4	-27.2	-175.3	-61.7	-177.2	169.7	0	0	112.5
344	W	85.8	Confident	88.2	Confident	50 Å²	50	59 Å²	59	19%	0.189	31%	0.31	C	S	.	.	S	Bend	trans	-80.1	-15.4	-175.9	54	-97.1	0	0	0	113.9	F260 L311 V342 P346 Y425 A430 M433	F260-W344 AromaticContact CE2-CH2 3.54Å; F260-W344 HydrophobicContact CE2-CH2 3.54Å; F260-W344 HydrophobicContact CE2-CZ2 4.38Å; F260-W344 HydrophobicContact CE2-CZ3 4.17Å; F260-W344 AromaticContact CZ-CH2 3.91Å; F260-W344 HydrophobicContact CZ-CH2 3.91Å; F260-W344 HydrophobicContact CZ-CZ3 4.12Å; L311-W344 HydrophobicContact CD2-CH2 4.11Å; L311-W344 HydrophobicContact CD2-CZ2 3.73Å; V342-W344 HydrophobicContact CB-CD2 4.5Å; V342-W344 HydrophobicContact CB-CZ2 4.25Å; V342-W344 HydrophobicContact CG1-CZ2 4.24Å; V342-W344 HydrophobicContact CG2-CD2 4.47Å; V342-W344 HydrophobicContact CG2-CZ2 4.14Å; W344-P346 WeakPolarHBondContact O-CD 3.37Å; W344-Y425 HydrophobicContact CZ2-CD1 4.39Å; W344-A430 HydrophobicContact CB-CB 4.33Å; W344-M433 HydrophobicContact CD2-CG 4.18Å; W344-M433 HydrophobicContact CE3-CE 4.34Å; W344-M433 HydrophobicContact CG-CG 4.07Å; W344-M433 HydrophobicContact CZ3-CE 4.33Å
345	I	85.9	Confident	88	Confident	34 Å²	34	61.8 Å²	61.8	17%	0.174	33%	0.326	C	S	.	.	S	Bend	trans	-99.3	97.3	167.1	-52.4	-176.4	0	0	0	109.2	P259 T312 V342 N348	P259-I345 HydrophobicContact CB-CD1 4.03Å; P259-I345 HydrophobicContact CG-CD1 4.2Å; T312-I345 HydrophobicContact CG2-CD1 4.34Å; V342-I345 HydrophobicContact CG2-CB 3.9Å; V342-I345 HydrophobicContact CG2-CD1 3.97Å; V342-I345 HydrophobicContact CG2-CG1 3.77Å; I345-N348 HydrophobicContact CB-CB 4.04Å; I345-N348 HydrophobicContact CG2-CB 3.68Å
346	P	83.5	Confident	87.8	Confident	101 Å²	101	57.7 Å²	57.7	66%	0.656	30%	0.304	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67	140	177.1	28	-34.6	0	0	0	111	W344 N348	W344-P346 WeakPolarHBondContact O-CD 3.37Å; P346-N348 VanDerWaalsContact C-N 3.33Å; P346-N348 PolarHBondContact O-N 2.99Å
347	N	83.5	Confident	87.6	Confident	127 Å²	127	53.1 Å²	53.1	68%	0.679	29%	0.289	S	S	*	.	T	Hydrogen-bonded Turn	trans	54.3	44.4	176.9	-55	-53.3	0	0	0	113.9	V349 K350	N347-V349 PolarHBondContact O-N 3.4Å; N347-K350 PolarHBondContact O-NZ 3.13Å
348	N	87.5	Confident	87.4	Confident	12 Å²	12	50.9 Å²	50.9	6%	0.064	28%	0.278	C	S	.	.			trans	-72.4	-3.3	-177.5	66.5	-14.6	0	0	0	115.5	Y310 L311 T312 V313 I345 P346	Y310-N348 PolarHBondContact O-ND2 2.66Å; L311-N348 WeakPolarHBondContact O-CB 3.44Å; L311-N348 PolarHBondContact O-ND2 3.17Å; T312-N348 WeakPolarHBondContact CA-O 3.32Å; V313-N348 PolarHBondContact N-O 3.11Å; I345-N348 HydrophobicContact CB-CB 4.04Å; I345-N348 HydrophobicContact CG2-CB 3.68Å; P346-N348 VanDerWaalsContact C-N 3.33Å; P346-N348 PolarHBondContact O-N 2.99Å
349	V	89.3	Confident	87	Confident	17 Å²	17	56.5 Å²	56.5	10%	0.103	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	122.7	176.8	-174.8	0	0	0	0	110.4	V313 M330 Q334 F341 N347	V313-V349 HydrophobicContact CB-CB 4.45Å; V313-V349 HydrophobicContact CB-CG1 4.2Å; V313-V349 HydrophobicContact CB-CG2 4.15Å; V313-V349 HydrophobicContact CG1-CG1 4.13Å; V313-V349 CarbonylContact O-C 3.58Å; V313-V349 WeakPolarHBondContact O-CA 3.34Å; M330-V349 HydrophobicContact CE-CG1 3.38Å; Q334-V349 HydrophobicContact CG-CG2 3.84Å; Q334-V349 VanDerWaalsContact NE2-CG2 3.33Å; F341-V349 HydrophobicContact CD1-CG2 3.98Å; F341-V349 HydrophobicContact CE1-CG2 3.62Å; F341-V349 HydrophobicContact CZ-CG2 4.45Å; N347-V349 PolarHBondContact O-N 3.4Å
350	K	88.4	Confident	86.5	Confident	78 Å²	78	56.2 Å²	56.2	34%	0.339	30%	0.297	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	134.8	175.2	-57.6	-53.4	-177.2	-151.6	0	110.8	N256 V313 A314 A315 N347	N256-K350 HydrophobicContact CB-CG 4.47Å; V313-K350 PolarHBondContact O-N 2.87Å; A314-K350 CarbonylContact C-O 3.48Å; A314-K350 WeakPolarHBondContact CA-O 3.29Å; A315-K350 PolarHBondContact N-O 2.68Å; N347-K350 PolarHBondContact O-NZ 3.13Å
351	T	88.8	Confident	86.2	Confident	37 Å²	37	54 Å²	54	23%	0.227	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	137.7	177	52.2	0	0	0	0	109.7	A315 V326 D327 M330	A315-T351 HydrophobicContact CB-CG2 4.33Å; A315-T351 CarbonylContact O-C 3.21Å; A315-T351 WeakPolarHBondContact O-CA 3.33Å; V326-T351 HydrophobicContact CG1-CG2 4.38Å; D327-T351 PolarHBondContact OD1-OG1 3.42Å; M330-T351 HydrophobicContact CB-CG2 4.11Å; M330-T351 HydrophobicContact CE-CG2 4.23Å; M330-T351 HydrophobicContact CG-CG2 3.61Å
352	A	87.4	Confident	86	Confident	10 Å²	10	61.9 Å²	61.9	8%	0.083	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	139.5	171.2	0	0	0	0	0	108.8	L246 A315 I316 F317	L246-A352 HydrophobicContact CB-CB 4.19Å; L246-A352 HydrophobicContact CD2-CB 4.05Å; A315-A352 PolarHBondContact O-N 2.94Å; I316-A352 CarbonylContact C-O 3.48Å; I316-A352 WeakPolarHBondContact CA-O 3.34Å; I316-A352 HydrophobicContact CG1-CB 4.43Å; F317-A352 PolarHBondContact N-O 3.02Å
353	V	88.3	Confident	86	Confident	23 Å²	23	63.2 Å²	63.2	14%	0.139	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	127.8	176.9	-174.9	0	0	0	0	108.7	F317 M321 M323 V326	F317-V353 HydrophobicContact CB-CG2 4.32Å; F317-V353 CarbonylContact O-C 3.6Å; F317-V353 WeakPolarHBondContact O-CA 3.48Å; M321-V353 HydrophobicContact CG-CG1 4Å; M323-V353 HydrophobicContact CG-CG2 4.27Å; V326-V353 HydrophobicContact CG1-CG2 4.49Å; V326-V353 HydrophobicContact CG2-CG2 4.46Å
354	C	87.4	Confident	86.3	Confident	7 Å²	7	56.3 Å²	56.3	5%	0.047	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117	131.6	173.1	-178.5	0	0	0	0	109.5	T238 F317 R318 G319 I356	T238-C354 HydrophobicContact CG2-CB 3.61Å; F317-C354 PolarHBondContact O-N 3.43Å; R318-C354 CarbonylContact C-O 3.58Å; R318-C354 VanDerWaalsContact CA-O 3.29Å; R318-C354 WeakPolarHBondContact CA-O 3.45Å; R318-C354 HydrophobicContact CG-CB 4.43Å; G319-C354 PolarHBondContact N-O 3.24Å; C354-I356 PolarHBondContact O-N 3.44Å
355	D	84.9	Confident	86.6	Confident	101 Å²	101	54 Å²	54	54%	0.54	29%	0.29	S	S	.	.	S	Bend	trans	-72	-18.8	-177.4	-71.2	-30.1	0	0	0	113.4	P357	D355-P357 VanDerWaalsContact O-CD 3.26Å; D355-P357 WeakPolarHBondContact O-CD 3.42Å
356	I	85.6	Confident	86.9	Confident	27 Å²	27	52.3 Å²	52.3	14%	0.138	28%	0.282	C	S	.	.			trans	-91	107.6	-176.5	-59	176.7	0	0	0	109.7	L42 F242 R318 C354	L42-I356 HydrophobicContact CB-CD1 3.68Å; L42-I356 HydrophobicContact CD1-CD1 4.17Å; L42-I356 HydrophobicContact CD1-CG1 4.47Å; F242-I356 HydrophobicContact CD1-CD1 3.4Å; F242-I356 VanDerWaalsContact CD1-CD1 3.4Å; F242-I356 HydrophobicContact CE1-CD1 3.61Å; F242-I356 HydrophobicContact CE1-CG2 4.33Å; F242-I356 HydrophobicContact CE2-CG2 4.3Å; F242-I356 HydrophobicContact CG-CD1 3.98Å; F242-I356 HydrophobicContact CZ-CD1 4.36Å; F242-I356 HydrophobicContact CZ-CG2 4.06Å; R318-I356 PolarHBondContact NE-O 3.49Å; R318-I356 VanDerWaalsContact NE-O 3.11Å; R318-I356 PolarHBondContact NH2-O 3.31Å; C354-I356 PolarHBondContact O-N 3.44Å
357	P	87.1	Confident	87.4	Confident	49 Å²	49	47.5 Å²	47.5	32%	0.318	25%	0.25	S	S	.	.	P	Polyproline II helix	trans	-73.8	158.1	176.8	34.3	-35.8	0	0	0	111.1	D355 L361 K362	D355-P357 VanDerWaalsContact O-CD 3.26Å; D355-P357 WeakPolarHBondContact O-CD 3.42Å; P357-L361 WeakPolarHBondContact CB-O 3.23Å; P357-K362 WeakPolarHBondContact CB-O 3.19Å
358	P	85.9	Confident	87.9	Confident	13 Å²	13	41.5 Å²	41.5	8%	0.084	22%	0.218	C	C	.	.	P	Polyproline II helix	trans	-69.4	160.5	171.8	29.6	-33.4	0	0	0	111.5	G360 L361 S364	P358-G360 PolarHBondContact O-N 3.29Å; P358-L361 HydrophobicContact CG-CB 4.2Å; P358-L361 HydrophobicContact CG-CD1 4.19Å; P358-L361 PolarHBondContact O-N 2.87Å; P358-L361 VanDerWaalsContact O-O 3.11Å; P358-S364 VanDerWaalsContact CD-OG 3.25Å; P358-S364 WeakPolarHBondContact CD-OG 3.37Å; P358-S364 VanDerWaalsContact CG-OG 3.27Å; P358-S364 WeakPolarHBondContact CG-OG 3.3Å
359	R	79.2	Confident	88.2	Confident	185 Å²	185	40.9 Å²	40.9	70%	0.698	22%	0.215	S	C	*	.	T	Hydrogen-bonded Turn	trans	-58.2	131	-178.5	-171.5	178.3	-178.8	-173.2	5.3	111.6	D26 L361	D26-R359 IonicContact OD1-NH1 3.36Å; D26-R359 PolarHBondContact OD1-NH1 3.42Å; D26-R359 IonicContact OD2-CZ 2.86Å; D26-R359 IonicContact OD2-NH1 2.82Å; D26-R359 PolarHBondContact OD2-NH1 2.94Å; R359-L361 VanDerWaalsContact C-N 3.29Å; R359-L361 PolarHBondContact O-N 3.13Å
360	G	79.8	Confident	88.4	Confident	65 Å²	65	40.1 Å²	40.1	67%	0.67	21%	0.21	S	C	*	.	T	Hydrogen-bonded Turn	trans	82	-1.6	175.6	0	0	0	0	0	115.3	P358	P358-G360 PolarHBondContact O-N 3.29Å
361	L	84.8	Confident	88.7	Confident	36 Å²	36	36.4 Å²	36.4	19%	0.188	19%	0.194	C	C	.	.			trans	-124.9	148.7	175.4	-62.6	171.5	0	0	0	110	F270 P272 P357 P358 R359	F270-L361 HydrophobicContact CE1-CD1 4.29Å; F270-L361 HydrophobicContact CZ-CD1 4.08Å; P272-L361 HydrophobicContact CG-CD1 4.29Å; P272-L361 HydrophobicContact CG-CD2 4.13Å; P357-L361 WeakPolarHBondContact CB-O 3.23Å; P358-L361 HydrophobicContact CG-CB 4.2Å; P358-L361 HydrophobicContact CG-CD1 4.19Å; P358-L361 PolarHBondContact O-N 2.87Å; P358-L361 VanDerWaalsContact O-O 3.11Å; R359-L361 VanDerWaalsContact C-N 3.29Å; R359-L361 PolarHBondContact O-N 3.13Å
362	K	86.8	Confident	89	Confident	178 Å²	178	34.6 Å²	34.6	77%	0.774	18%	0.183	S	C	*	.	S	Bend	trans	-87.7	-32	173.6	-68.6	-174.1	179.3	-179.6	0	112.4	P357	P357-K362 WeakPolarHBondContact CB-O 3.19Å
363	M	89.8	Confident	89.3	Confident	33 Å²	33	34.2 Å²	34.2	16%	0.163	18%	0.179	C	C	.	.			trans	-144.3	143.2	178.5	-61.8	-177	-65.4	0	0	109	L284 L289 R318 M321	L284-M363 HydrophobicContact CB-CE 4.18Å; L284-M363 WeakPolarHBondContact O-CE 3.38Å; L289-M363 HydrophobicContact CD1-CB 3.86Å; R318-M363 VanDerWaalsContact O-CA 3.23Å; R318-M363 WeakPolarHBondContact O-CA 3.47Å; M321-M363 HydrophobicContact CB-SD 4.5Å
364	S	91.9	Very high	89.6	Confident	0 Å²	0	33.1 Å²	33.1	0%	0	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.4	164.8	171	67.2	0	0	0	0	109.6	A271 R318 P358	A271-S364 CarbonylContact O-C 3.57Å; A271-S364 VanDerWaalsContact O-CA 3.29Å; A271-S364 WeakPolarHBondContact O-CA 3.44Å; A271-S364 WeakPolarHBondContact O-CB 3.46Å; R318-S364 PolarHBondContact N-O 3.45Å; R318-S364 PolarHBondContact O-N 2.75Å; P358-S364 VanDerWaalsContact CD-OG 3.25Å; P358-S364 WeakPolarHBondContact CD-OG 3.37Å; P358-S364 VanDerWaalsContact CG-OG 3.27Å; P358-S364 WeakPolarHBondContact CG-OG 3.3Å
365	A	92.5	Very high	89.8	Confident	0 Å²	0	33.1 Å²	33.1	0%	0	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.9	134.4	172.2	0	0	0	0	0	109.6	A271 L289 M293 I316 F317	A271-A365 PolarHBondContact N-O 3.11Å; A271-A365 PolarHBondContact O-N 3.01Å; A271-A365 VanDerWaalsContact O-O 3.11Å; L289-A365 HydrophobicContact CB-CB 4.21Å; M293-A365 HydrophobicContact CE-CB 4.19Å; M293-A365 HydrophobicContact CG-CB 3.9Å; M293-A365 HydrophobicContact SD-CB 3.21Å; M293-A365 WeakPolarHBondContact SD-CB 3.32Å; I316-A365 CarbonylContact O-C 3.49Å; I316-A365 VanDerWaalsContact O-CA 3.3Å; I316-A365 WeakPolarHBondContact O-CA 3.49Å; F317-A365 HydrophobicContact CD1-CB 3.65Å; F317-A365 HydrophobicContact CE1-CB 3.73Å; F317-A365 HydrophobicContact CG-CB 4.23Å; F317-A365 HydrophobicContact CZ-CB 4.37Å
366	T	93.3	Very high	90.1	Very high	0 Å²	0	31.1 Å²	31.1	0%	0	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	131.5	177.1	-51.3	0	0	0	0	108.1	G235 V236 M293 A315 I316	G235-T366 WeakPolarHBondContact CA-OG1 3.33Å; V236-T366 HydrophobicContact CG2-CG2 4.07Å; M293-T366 WeakPolarHBondContact CE-O 3.39Å; A315-T366 WeakPolarHBondContact CA-O 3.42Å; I316-T366 PolarHBondContact N-O 3.06Å; I316-T366 PolarHBondContact O-N 3.47Å
367	F	93.5	Very high	90.4	Very high	0 Å²	0	29.9 Å²	29.9	0%	0	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	134.9	-180	178.8	-96.7	0	0	0	108.8	P268 G269 M293 F294 M299 Y310 V313 G369	P268-F367 CarbonylContact C-O 3.57Å; P268-F367 WeakPolarHBondContact CA-O 3.29Å; G269-F367 PolarHBondContact N-O 3.01Å; G269-F367 PolarHBondContact O-N 3.06Å; M293-F367 HydrophobicContact CB-CB 4.3Å; M293-F367 HydrophobicContact CB-CD2 4.43Å; M293-F367 HydrophobicContact CE-CB 3.77Å; M293-F367 HydrophobicContact CE-CD2 4Å; M293-F367 HydrophobicContact CE-CG 4.41Å; M293-F367 HydrophobicContact CG-CB 4.45Å; F294-F367 HydrophobicContact CD1-CE2 4.1Å; F294-F367 AromaticContact CE1-CE2 3.69Å; F294-F367 HydrophobicContact CE1-CE2 3.69Å; F294-F367 HydrophobicContact CE1-CZ 4.34Å; F294-F367 AromaticContact CZ-CE2 3.97Å; F294-F367 HydrophobicContact CZ-CE2 3.97Å; M299-F367 HydrophobicContact CE-CD1 3.73Å; M299-F367 HydrophobicContact CE-CE1 3.57Å; M299-F367 HydrophobicContact CE-CG 4.43Å; M299-F367 HydrophobicContact CE-CZ 4.14Å; M299-F367 HydrophobicContact SD-CD1 3.74Å; M299-F367 HydrophobicContact SD-CE1 3.81Å; Y310-F367 HydrophobicContact CD1-CZ 4.24Å; Y310-F367 HydrophobicContact CE1-CE1 4.02Å; Y310-F367 AromaticContact CE1-CZ 3.47Å; Y310-F367 HydrophobicContact CE1-CZ 3.47Å; Y310-F367 VanDerWaalsContact CE1-CZ 3.47Å; Y310-F367 AromaticContact CZ-CZ 3.71Å; V313-F367 HydrophobicContact CB-CE2 4.39Å; V313-F367 HydrophobicContact CG1-CD2 3.96Å; V313-F367 HydrophobicContact CG1-CE2 3.33Å; V313-F367 HydrophobicContact CG1-CZ 4.05Å; V313-F367 HydrophobicContact CG2-CE2 4.17Å; V313-F367 HydrophobicContact CG2-CZ 4.16Å; F367-G369 VanDerWaalsContact CE1-CA 3.49Å
368	I	93.8	Very high	90.7	Very high	0 Å²	0	27.6 Å²	27.6	0%	0	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	109.2	169.4	-51.5	168.6	0	0	0	105.2	F200 V236 M257 F266 V313 A314 I316	F200-I368 HydrophobicContact CD1-CG2 4.44Å; F200-I368 HydrophobicContact CE1-CD1 4.09Å; F200-I368 HydrophobicContact CE1-CG1 4.26Å; F200-I368 HydrophobicContact CE1-CG2 3.78Å; V236-I368 HydrophobicContact CB-CD1 4.32Å; V236-I368 HydrophobicContact CG1-CD1 3.99Å; V236-I368 HydrophobicContact CG2-CD1 3.89Å; V236-I368 HydrophobicContact CG2-CG1 3.98Å; M257-I368 HydrophobicContact CE-CB 4.35Å; M257-I368 HydrophobicContact CE-CG2 3.9Å; M257-I368 WeakPolarHBondContact CE-O 3.36Å; F266-I368 HydrophobicContact CB-CG2 3.75Å; F266-I368 HydrophobicContact CD1-CG2 4.47Å; F266-I368 HydrophobicContact CD2-CG2 3.87Å; F266-I368 HydrophobicContact CG-CG2 3.78Å; V313-I368 CarbonylContact C-O 3.48Å; V313-I368 WeakPolarHBondContact CA-O 3.48Å; A314-I368 HydrophobicContact CB-CB 4.25Å; A314-I368 HydrophobicContact CB-CD1 4.45Å; A314-I368 PolarHBondContact N-O 3.41Å; A314-I368 PolarHBondContact O-N 3Å; I316-I368 HydrophobicContact CD1-CD1 4.08Å
369	G	93.3	Very high	91	Very high	0 Å²	0	32.3 Å²	32.3	0%	0	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	128.2	178.3	0	0	0	0	0	110.8	F266 M267 F367	F266-G369 WeakPolarHBondContact CA-O 3.39Å; M267-G369 PolarHBondContact N-O 3.14Å; M267-G369 PolarHBondContact O-N 3.19Å; F367-G369 VanDerWaalsContact CE1-CA 3.49Å
370	N	94.9	Very high	91.5	Very high	0 Å²	0	25.6 Å²	25.6	0%	0	13%	0.129	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.3	105.6	159.3	-166.6	-14.2	0	0	0	107.3	M257 L263 F266 L311 T312	M257-N370 HydrophobicContact CE-CB 4.38Å; M257-N370 PolarHBondContact O-ND2 3.38Å; L263-N370 PolarHBondContact O-ND2 3.07Å; F266-N370 HydrophobicContact CD1-CB 3.92Å; F266-N370 HydrophobicContact CE1-CB 4.04Å; L311-N370 HydrophobicContact CB-CB 4.36Å; L311-N370 PolarHBondContact N-O 3.07Å; T312-N370 PolarHBondContact N-O 2.94Å; T312-N370 PolarHBondContact O-N 2.97Å; T312-N370 WeakPolarHBondContact OG1-CB 3.23Å
371	S	94.4	Very high	92	Very high	0 Å²	0	22.5 Å²	22.5	0%	0	10%	0.097	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130	140.6	-175.2	-176.7	0	0	0	0	110.8	R309 A373 I374	R309-S371 VanDerWaalsContact O-CA 3.31Å; R309-S371 WeakPolarHBondContact O-CA 3.48Å; R309-S371 PolarHBondContact O-OG 3.06Å; R309-S371 VanDerWaalsContact O-OG 3.06Å; S371-A373 PolarHBondContact O-N 3.46Å; S371-A373 VanDerWaalsContact O-N 3.14Å; S371-A373 PolarHBondContact OG-N 3.37Å; S371-I374 WeakPolarHBondContact O-CB 3Å; S371-I374 VanDerWaalsContact O-CG2 3.25Å; S371-I374 WeakPolarHBondContact O-CG2 2.9Å; S371-I374 PolarHBondContact O-N 2.96Å; S371-I374 VanDerWaalsContact O-N 3.15Å
372	T	94.6	Very high	92.3	Very high	0 Å²	0	21.2 Å²	21.2	0%	0	9%	0.092	C	C	.	.	G	3₁₀ helix	trans	-63.2	-18	173.7	66.7	0	0	0	0	112.7	G308 R309 L311 I374 Q375 Y422 Q426	G308-T372 VanDerWaalsContact CA-OG1 3.3Å; G308-T372 WeakPolarHBondContact CA-OG1 3.49Å; R309-T372 PolarHBondContact N-OG1 3.43Å; R309-T372 PolarHBondContact O-N 3.36Å; R309-T372 PolarHBondContact O-OG1 3.23Å; L311-T372 HydrophobicContact CD2-CG2 4.31Å; L311-T372 HydrophobicContact CG-CG2 4.33Å; T372-I374 PolarHBondContact O-N 3.2Å; T372-Q375 WeakPolarHBondContact O-CB 3.3Å; T372-Q375 WeakPolarHBondContact O-CG 3.34Å; T372-Q375 PolarHBondContact O-N 3Å; T372-Y422 HydrophobicContact CG2-CD1 4.41Å; T372-Y422 WeakPolarHBondContact CG2-O 3.4Å; T372-Q426 HydrophobicContact CG2-CB 3.97Å; T372-Q426 PolarHBondContact OG1-OE1 3.38Å
373	A	94.1	Very high	92.6	Very high	1 Å²	1	18.8 Å²	18.8	1%	0.008	8%	0.083	C	C	.	.	G	3₁₀ helix	trans	-62.2	-19.5	174.8	0	0	0	0	0	113.3	M267 C303 D304 S371 Q375 E376	M267-A373 HydrophobicContact SD-CB 4.43Å; C303-A373 HydrophobicContact CB-CB 4.35Å; C303-A373 WeakPolarHBondContact CB-O 3.14Å; D304-A373 WeakPolarHBondContact O-CB 3.44Å; S371-A373 PolarHBondContact O-N 3.46Å; S371-A373 VanDerWaalsContact O-N 3.14Å; S371-A373 PolarHBondContact OG-N 3.37Å; A373-Q375 PolarHBondContact O-N 3.1Å; A373-E376 PolarHBondContact O-N 3.4Å
374	I	94	Very high	92.6	Very high	0 Å²	0	20 Å²	20	0%	0	9%	0.088	C	C	.	.	G	3₁₀ helix	trans	-58.7	-21.1	175.7	-162	70.6	0	0	0	112.3	F265 M267 A301 S371 T372 E376 L377 F378 Y422	F265-I374 HydrophobicContact CB-CG1 4.33Å; M267-I374 HydrophobicContact CG-CB 4.38Å; M267-I374 HydrophobicContact CG-CD1 3.59Å; M267-I374 HydrophobicContact CG-CG1 4.49Å; M267-I374 HydrophobicContact SD-CB 4.49Å; M267-I374 HydrophobicContact SD-CD1 4.42Å; A301-I374 HydrophobicContact CB-CD1 4.2Å; S371-I374 WeakPolarHBondContact O-CB 3Å; S371-I374 VanDerWaalsContact O-CG2 3.25Å; S371-I374 WeakPolarHBondContact O-CG2 2.9Å; S371-I374 PolarHBondContact O-N 2.96Å; S371-I374 VanDerWaalsContact O-N 3.15Å; T372-I374 PolarHBondContact O-N 3.2Å; I374-E376 PolarHBondContact O-N 3.17Å; I374-E376 VanDerWaalsContact O-N 3.11Å; I374-L377 HydrophobicContact CD1-CB 4.42Å; I374-L377 HydrophobicContact CD1-CD1 4.39Å; I374-L377 WeakPolarHBondContact O-CB 3.28Å; I374-L377 PolarHBondContact O-N 3.43Å; I374-F378 HydrophobicContact CG1-CD2 4.47Å; I374-F378 HydrophobicContact CG1-CE2 3.89Å; I374-F378 HydrophobicContact CG1-CZ 4.49Å; I374-F378 HydrophobicContact CG2-CD2 4.45Å; I374-F378 HydrophobicContact CG2-CE2 4.05Å; I374-F378 PolarHBondContact O-N 2.88Å; I374-Y422 HydrophobicContact CG2-CD1 4.03Å; I374-Y422 HydrophobicContact CG2-CD2 4Å; I374-Y422 HydrophobicContact CG2-CE1 3.59Å; I374-Y422 HydrophobicContact CG2-CE2 3.59Å; I374-Y422 HydrophobicContact CG2-CG 4.21Å
375	Q	92.3	Very high	92.7	Very high	8 Å²	8	20 Å²	20	4%	0.037	9%	0.088	C	C	.	.	H	α-helix	trans	-54.9	-28.3	173.9	75.2	170.9	-71.3	0	0	113.3	T372 A373 L377 F378 R379 V419 Q423	T372-Q375 WeakPolarHBondContact O-CB 3.3Å; T372-Q375 WeakPolarHBondContact O-CG 3.34Å; T372-Q375 PolarHBondContact O-N 3Å; A373-Q375 PolarHBondContact O-N 3.1Å; Q375-L377 VanDerWaalsContact C-N 3.29Å; Q375-L377 PolarHBondContact O-N 3.13Å; Q375-F378 PolarHBondContact O-N 2.85Å; Q375-R379 VanDerWaalsContact O-CB 3.3Å; Q375-R379 WeakPolarHBondContact O-CB 3.4Å; Q375-R379 PolarHBondContact O-N 3.2Å; Q375-V419 HydrophobicContact CB-CG1 4.36Å; Q375-Q423 VanDerWaalsContact OE1-OE1 3.09Å
376	E	91.5	Very high	92.7	Very high	59 Å²	59	21.1 Å²	21.1	28%	0.276	10%	0.095	S	C	.	.	H	α-helix	trans	-62.8	-38.4	177.1	-66.3	-172.2	150.9	0	0	111.6	C303 D304 H307 A373 I374 R380	C303-E376 WeakPolarHBondContact CA-OE2 3.47Å; C303-E376 HydrophobicContact CB-CB 4.31Å; D304-E376 PolarHBondContact N-OE2 3.08Å; D304-E376 VanDerWaalsContact N-OE2 3.14Å; H307-E376 IonicContact CE1-OE1 3.77Å; H307-E376 IonicContact CG-OE1 3.55Å; H307-E376 IonicContact ND1-OE1 2.72Å; H307-E376 PolarHBondContact ND1-OE1 3.48Å; A373-E376 PolarHBondContact O-N 3.4Å; I374-E376 PolarHBondContact O-N 3.17Å; I374-E376 VanDerWaalsContact O-N 3.11Å; E376-R380 WeakPolarHBondContact O-CB 3.37Å; E376-R380 PolarHBondContact O-N 2.85Å
377	L	91.4	Very high	92.7	Very high	1 Å²	1	23.7 Å²	23.7	1%	0.005	12%	0.116	C	C	.	.	H	α-helix	trans	-64.7	-46.6	177.5	-174	145.6	0	0	0	110.7	M170 D203 A301 I374 Q375 R380 L381	M170-L377 HydrophobicContact CB-CD1 4.35Å; M170-L377 HydrophobicContact CE-CD2 4.08Å; M170-L377 HydrophobicContact CG-CD1 3.93Å; M170-L377 HydrophobicContact CG-CD2 3.95Å; M170-L377 HydrophobicContact CG-CG 4.49Å; M170-L377 HydrophobicContact SD-CD2 3.92Å; D203-L377 HydrophobicContact CB-CD1 4.12Å; A301-L377 HydrophobicContact CB-CD1 4.42Å; I374-L377 HydrophobicContact CD1-CB 4.42Å; I374-L377 HydrophobicContact CD1-CD1 4.39Å; I374-L377 WeakPolarHBondContact O-CB 3.28Å; I374-L377 PolarHBondContact O-N 3.43Å; Q375-L377 VanDerWaalsContact C-N 3.29Å; Q375-L377 PolarHBondContact O-N 3.13Å; L377-R380 PolarHBondContact O-N 3.18Å; L377-L381 HydrophobicContact CD2-CD1 3.85Å; L377-L381 WeakPolarHBondContact O-CG 3.13Å; L377-L381 PolarHBondContact O-N 3.29Å; L377-L381 VanDerWaalsContact O-N 3.13Å
378	F	92.7	Very high	92.6	Very high	0 Å²	0	25.1 Å²	25.1	0%	0	12%	0.123	C	C	.	.	H	α-helix	trans	-68.3	-39.2	178.6	-64.5	-55.6	0	0	0	112.3	V189 F265 I374 Q375 R380 L381 S382 M415 L418 V419 Y422	V189-F378 HydrophobicContact CG1-CD1 4.29Å; V189-F378 HydrophobicContact CG1-CE1 3.8Å; V189-F378 HydrophobicContact CG2-CE1 4.1Å; F265-F378 HydrophobicContact CB-CE2 4.33Å; F265-F378 HydrophobicContact CB-CZ 4.14Å; F265-F378 HydrophobicContact CD1-CE1 4.46Å; F265-F378 AromaticContact CD1-CZ 3.68Å; F265-F378 HydrophobicContact CD1-CZ 3.68Å; F265-F378 HydrophobicContact CD2-CE2 4.33Å; F265-F378 AromaticContact CD2-CZ 3.95Å; F265-F378 HydrophobicContact CD2-CZ 3.95Å; F265-F378 HydrophobicContact CE1-CE1 4.46Å; F265-F378 HydrophobicContact CE1-CZ 4.01Å; F265-F378 HydrophobicContact CE2-CZ 4.28Å; F265-F378 HydrophobicContact CG-CE2 4.18Å; F265-F378 AromaticContact CG-CZ 3.64Å; F265-F378 HydrophobicContact CG-CZ 3.64Å; F265-F378 HydrophobicContact CZ-CZ 4.3Å; I374-F378 HydrophobicContact CG1-CD2 4.47Å; I374-F378 HydrophobicContact CG1-CE2 3.89Å; I374-F378 HydrophobicContact CG1-CZ 4.49Å; I374-F378 HydrophobicContact CG2-CD2 4.45Å; I374-F378 HydrophobicContact CG2-CE2 4.05Å; I374-F378 PolarHBondContact O-N 2.88Å; Q375-F378 PolarHBondContact O-N 2.85Å; F378-R380 VanDerWaalsContact C-N 3.34Å; F378-R380 PolarHBondContact O-N 3.18Å; F378-L381 PolarHBondContact O-N 3.11Å; F378-S382 WeakPolarHBondContact O-CB 3.32Å; F378-S382 PolarHBondContact O-N 3.34Å; F378-M415 HydrophobicContact CB-SD 3.83Å; F378-M415 HydrophobicContact CD1-CE 4.32Å; F378-M415 HydrophobicContact CD1-SD 3.4Å; F378-M415 WeakPolarHBondContact CD1-SD 3.44Å; F378-M415 HydrophobicContact CE1-SD 4.21Å; F378-M415 HydrophobicContact CG-SD 3.87Å; F378-L418 HydrophobicContact CD2-CD2 4.13Å; F378-L418 HydrophobicContact CE1-CD2 4.32Å; F378-L418 HydrophobicContact CE2-CD2 3.83Å; F378-L418 HydrophobicContact CG-CD2 4.5Å; F378-L418 HydrophobicContact CZ-CD2 3.93Å; F378-V419 HydrophobicContact CB-CG2 3.54Å; F378-Y422 HydrophobicContact CD2-CE2 4.39Å; F378-Y422 AromaticContact CE2-CE2 4Å; F378-Y422 HydrophobicContact CE2-CE2 4Å
379	R	92.1	Very high	92.6	Very high	112 Å²	112	26.5 Å²	26.5	42%	0.423	13%	0.129	S	C	.	.	H	α-helix	trans	-61.1	-42.6	174.6	-171.9	177	-70.3	149.4	4.2	111.3	Q375 L381 S382 E383	Q375-R379 VanDerWaalsContact O-CB 3.3Å; Q375-R379 WeakPolarHBondContact O-CB 3.4Å; Q375-R379 PolarHBondContact O-N 3.2Å; R379-L381 PolarHBondContact O-N 2.95Å; R379-S382 PolarHBondContact O-N 3.27Å; R379-E383 WeakPolarHBondContact O-CB 3.18Å; R379-E383 WeakPolarHBondContact O-CG 3.48Å; R379-E383 PolarHBondContact O-N 3.29Å
380	R	90.7	Very high	92.5	Very high	44 Å²	44	36.5 Å²	36.5	17%	0.166	17%	0.167	C	C	.	.	H	α-helix	trans	-61.1	-43.9	175.4	-174.6	-174.7	65.4	-158.2	-12.7	112.1	D203 E205 E376 L377 F378 Q384	D203-R380 IonicContact OD1-NH2 3.88Å; D203-R380 PolarHBondContact OD1-NH2 3.45Å; D203-R380 IonicContact OD2-CZ 2.77Å; D203-R380 IonicContact OD2-NH1 2.85Å; D203-R380 PolarHBondContact OD2-NH1 3.07Å; D203-R380 IonicContact OD2-NH2 3.81Å; D203-R380 PolarHBondContact OD2-NH2 2.72Å; E205-R380 IonicContact OE2-CZ 3.49Å; E205-R380 IonicContact OE2-NE 3.85Å; E205-R380 IonicContact OE2-NH1 3.24Å; E205-R380 PolarHBondContact OE2-NH1 3.31Å; E376-R380 WeakPolarHBondContact O-CB 3.37Å; E376-R380 PolarHBondContact O-N 2.85Å; L377-R380 PolarHBondContact O-N 3.18Å; F378-R380 VanDerWaalsContact C-N 3.34Å; F378-R380 PolarHBondContact O-N 3.18Å; R380-Q384 WeakPolarHBondContact O-CG 3.47Å; R380-Q384 PolarHBondContact O-N 2.95Å
381	L	89.9	Confident	92.5	Very high	0 Å²	0	46.4 Å²	46.4	0%	0	20%	0.204	C	C	.	.	H	α-helix	trans	-65.6	-44.8	176.6	-70.5	175.1	0	0	0	111.5	M170 P171 A185 L377 F378 R379 Q384 F385	M170-L381 HydrophobicContact SD-CD1 4.43Å; P171-L381 HydrophobicContact CG-CD2 3.93Å; A185-L381 HydrophobicContact CB-CD1 4.33Å; A185-L381 HydrophobicContact CB-CD2 4.23Å; L377-L381 HydrophobicContact CD2-CD1 3.85Å; L377-L381 WeakPolarHBondContact O-CG 3.13Å; L377-L381 PolarHBondContact O-N 3.29Å; L377-L381 VanDerWaalsContact O-N 3.13Å; F378-L381 PolarHBondContact O-N 3.11Å; R379-L381 PolarHBondContact O-N 2.95Å; L381-Q384 PolarHBondContact O-N 2.92Å; L381-F385 WeakPolarHBondContact O-CB 3.44Å; L381-F385 PolarHBondContact O-N 3.06Å
382	S	91.7	Very high	92.3	Very high	10 Å²	10	51.7 Å²	51.7	7%	0.07	23%	0.227	C	C	.	.	H	α-helix	trans	-59.5	-47.4	177.5	-176.4	0	0	0	0	111.3	F378 R379 Q384 F385 T386 N416	F378-S382 WeakPolarHBondContact O-CB 3.32Å; F378-S382 PolarHBondContact O-N 3.34Å; R379-S382 PolarHBondContact O-N 3.27Å; S382-Q384 VanDerWaalsContact C-N 3.34Å; S382-Q384 PolarHBondContact O-N 3.4Å; S382-F385 WeakPolarHBondContact O-CB 3.33Å; S382-F385 PolarHBondContact O-N 3.31Å; S382-T386 WeakPolarHBondContact O-CB 3.43Å; S382-T386 PolarHBondContact O-N 3.14Å; S382-T386 PolarHBondContact O-OG1 3.46Å; S382-N416 PolarHBondContact OG-OD1 3.32Å
383	E	91.9	Very high	92.1	Very high	127 Å²	127	53.1 Å²	53.1	59%	0.593	24%	0.239	S	C	*	.	H	α-helix	trans	-58.5	-42.7	177.6	-76.3	176.9	-170.1	0	0	113	R379 A387	R379-E383 WeakPolarHBondContact O-CB 3.18Å; R379-E383 WeakPolarHBondContact O-CG 3.48Å; R379-E383 PolarHBondContact O-N 3.29Å; E383-A387 VanDerWaalsContact O-CB 3.31Å; E383-A387 WeakPolarHBondContact O-CB 3.43Å; E383-A387 PolarHBondContact O-N 2.54Å
384	Q	90.6	Very high	92	Very high	59 Å²	59	56.9 Å²	56.9	28%	0.276	26%	0.255	S	S	.	.	H	α-helix	trans	-68.6	-42.2	177.4	-69	176	8.5	0	0	111.7	P182 R380 L381 S382 A387 M388	P182-Q384 HydrophobicContact CB-CB 3.95Å; P182-Q384 HydrophobicContact CG-CB 3.75Å; R380-Q384 WeakPolarHBondContact O-CG 3.47Å; R380-Q384 PolarHBondContact O-N 2.95Å; L381-Q384 PolarHBondContact O-N 2.92Å; S382-Q384 VanDerWaalsContact C-N 3.34Å; S382-Q384 PolarHBondContact O-N 3.4Å; Q384-A387 PolarHBondContact O-N 3.28Å; Q384-M388 WeakPolarHBondContact O-CG 3.27Å; Q384-M388 PolarHBondContact O-N 3.47Å
385	F	93.1	Very high	91.9	Very high	0 Å²	0	57.1 Å²	57.1	0%	0	26%	0.257	C	S	.	.	H	α-helix	trans	-58.7	-54.3	174.7	176.6	-82.1	0	0	0	110.9	P182 Y183 T186 L381 S382 A387 M388 F389 F408 E412	P182-F385 HydrophobicContact CB-CB 4.36Å; Y183-F385 AromaticContact CD1-CD2 3.57Å; Y183-F385 HydrophobicContact CD1-CD2 3.57Å; Y183-F385 AromaticContact CD1-CE2 3.42Å; Y183-F385 HydrophobicContact CD1-CE2 3.42Å; Y183-F385 VanDerWaalsContact CD1-CE2 3.42Å; Y183-F385 HydrophobicContact CD1-CZ 4.19Å; Y183-F385 HydrophobicContact CE1-CD2 4.07Å; Y183-F385 AromaticContact CE1-CE2 3.91Å; Y183-F385 HydrophobicContact CE1-CE2 3.91Å; Y183-F385 HydrophobicContact CE1-CZ 4.28Å; T186-F385 VanDerWaalsContact CB-CD2 3.49Å; T186-F385 HydrophobicContact CG2-CD2 3.81Å; T186-F385 HydrophobicContact CG2-CE2 3.78Å; T186-F385 HydrophobicContact CG2-CG 4.26Å; T186-F385 HydrophobicContact CG2-CZ 4.29Å; T186-F385 WeakPolarHBondContact OG1-CD2 3.32Å; L381-F385 WeakPolarHBondContact O-CB 3.44Å; L381-F385 PolarHBondContact O-N 3.06Å; S382-F385 WeakPolarHBondContact O-CB 3.33Å; S382-F385 PolarHBondContact O-N 3.31Å; F385-A387 VanDerWaalsContact C-N 3.29Å; F385-A387 PolarHBondContact O-N 2.89Å; F385-M388 PolarHBondContact O-N 2.85Å; F385-M388 VanDerWaalsContact O-N 3.07Å; F385-F389 HydrophobicContact CD1-CB 4.23Å; F385-F389 HydrophobicContact CE1-CB 3.92Å; F385-F389 HydrophobicContact CE1-CD1 4.17Å; F385-F389 HydrophobicContact CE1-CG 4.02Å; F385-F389 HydrophobicContact CZ-CB 4.49Å; F385-F389 HydrophobicContact CZ-CG 4.39Å; F385-F389 WeakPolarHBondContact O-CB 3.34Å; F385-F389 PolarHBondContact O-N 3.2Å; F385-F408 AromaticContact CE2-CD1 3.92Å; F385-F408 HydrophobicContact CE2-CD1 3.92Å; F385-F408 HydrophobicContact CZ-CB 4.08Å; F385-F408 AromaticContact CZ-CD1 3.89Å; F385-F408 HydrophobicContact CZ-CD1 3.89Å; F385-F408 WeakPolarHBondContact CZ-O 3.31Å; F385-E412 HydrophobicContact CD1-CB 4.19Å; F385-E412 HydrophobicContact CD1-CG 3.99Å; F385-E412 HydrophobicContact CE1-CB 3.61Å; F385-E412 HydrophobicContact CE1-CG 3.84Å; F385-E412 HydrophobicContact CZ-CB 4.2Å
386	T	93.6	Very high	91.9	Very high	23 Å²	23	62.6 Å²	62.6	14%	0.141	28%	0.282	C	S	.	.	H	α-helix	trans	-59.3	-40.6	-179.3	-55.8	0	0	0	0	111.1	S382 M388 F389 R390 E412	S382-T386 WeakPolarHBondContact O-CB 3.43Å; S382-T386 PolarHBondContact O-N 3.14Å; S382-T386 PolarHBondContact O-OG1 3.46Å; T386-M388 VanDerWaalsContact C-N 3.28Å; T386-M388 PolarHBondContact O-N 3.3Å; T386-F389 PolarHBondContact O-N 2.97Å; T386-R390 HydrophobicContact CG2-CG 4.14Å; T386-R390 VanDerWaalsContact CG2-NE 3.28Å; T386-R390 WeakPolarHBondContact O-CB 3.36Å; T386-R390 VanDerWaalsContact O-CG 3.24Å; T386-R390 WeakPolarHBondContact O-CG 3.45Å; T386-R390 PolarHBondContact O-N 3.04Å; T386-E412 WeakPolarHBondContact CB-OE1 3.32Å; T386-E412 PolarHBondContact OG1-OE1 2.88Å
387	A	92.1	Very high	91.9	Very high	53 Å²	53	65 Å²	65	44%	0.438	29%	0.289	S	S	.	.	H	α-helix	trans	-61	-36.8	177.9	0	0	0	0	0	112.7	E383 Q384 F385	E383-A387 VanDerWaalsContact O-CB 3.31Å; E383-A387 WeakPolarHBondContact O-CB 3.43Å; E383-A387 PolarHBondContact O-N 2.54Å; Q384-A387 PolarHBondContact O-N 3.28Å; F385-A387 VanDerWaalsContact C-N 3.29Å; F385-A387 PolarHBondContact O-N 2.89Å
388	M	91.9	Very high	92	Very high	31 Å²	31	65 Å²	65	15%	0.153	29%	0.289	C	S	.	.	H	α-helix	trans	-78.6	-46.1	175.8	-67.7	-125.8	-64.8	0	0	112.4	V179 Y183 Q384 F385 T386 R390 R391 K392 A393	V179-M388 HydrophobicContact CB-SD 4.48Å; V179-M388 WeakPolarHBondContact O-CE 3.17Å; V179-M388 VanDerWaalsContact O-SD 3.37Å; Y183-M388 HydrophobicContact CD2-CE 3.5Å; Y183-M388 VanDerWaalsContact CD2-CE 3.5Å; Y183-M388 HydrophobicContact CE1-CB 4.43Å; Y183-M388 HydrophobicContact CE2-CB 4.07Å; Y183-M388 HydrophobicContact CE2-CE 3.39Å; Y183-M388 HydrophobicContact CG-CE 4.32Å; Y183-M388 WeakPolarHBondContact OH-CB 3.31Å; Y183-M388 PolarHBondContact OH-O 3.14Å; Q384-M388 WeakPolarHBondContact O-CG 3.27Å; Q384-M388 PolarHBondContact O-N 3.47Å; F385-M388 PolarHBondContact O-N 2.85Å; F385-M388 VanDerWaalsContact O-N 3.07Å; T386-M388 VanDerWaalsContact C-N 3.28Å; T386-M388 PolarHBondContact O-N 3.3Å; M388-R390 PolarHBondContact O-N 3.07Å; M388-R391 CarbonylContact O-C 3.58Å; M388-R391 PolarHBondContact O-N 3.03Å; M388-K392 PolarHBondContact O-N 2.98Å; M388-A393 PolarHBondContact O-N 3.26Å
389	F	93.1	Very high	92	Very high	29 Å²	29	67.7 Å²	67.7	13%	0.127	31%	0.305	C	S	.	.	H	α-helix	trans	-63.6	-39.7	-176.2	-168.9	-122.2	0	0	0	112.4	Y183 F385 T386 R391 K392 L395 F408	Y183-F389 HydrophobicContact CE1-CB 4.04Å; Y183-F389 HydrophobicContact CE1-CD2 4.14Å; Y183-F389 WeakPolarHBondContact OH-CA 3.44Å; Y183-F389 PolarHBondContact OH-N 2.81Å; F385-F389 HydrophobicContact CD1-CB 4.23Å; F385-F389 HydrophobicContact CE1-CB 3.92Å; F385-F389 HydrophobicContact CE1-CD1 4.17Å; F385-F389 HydrophobicContact CE1-CG 4.02Å; F385-F389 HydrophobicContact CZ-CB 4.49Å; F385-F389 HydrophobicContact CZ-CG 4.39Å; F385-F389 WeakPolarHBondContact O-CB 3.34Å; F385-F389 PolarHBondContact O-N 3.2Å; T386-F389 PolarHBondContact O-N 2.97Å; F389-R391 PolarHBondContact O-N 2.86Å; F389-R391 VanDerWaalsContact O-N 3.11Å; F389-K392 PolarHBondContact O-N 3.02Å; F389-L395 HydrophobicContact CD2-CD1 4.36Å; F389-L395 HydrophobicContact CE2-CD1 4.1Å; F389-L395 HydrophobicContact CE2-CD2 4.25Å; F389-F408 HydrophobicContact CD2-CB 4.21Å; F389-F408 HydrophobicContact CD2-CD1 4.5Å; F389-F408 HydrophobicContact CD2-CG 4.47Å; F389-F408 HydrophobicContact CE2-CB 3.56Å; F389-F408 HydrophobicContact CE2-CD1 4.47Å; F389-F408 HydrophobicContact CE2-CG 4.01Å; F389-F408 HydrophobicContact CZ-CB 3.79Å
390	R	92.6	Very high	92	Very high	209 Å²	209	65.2 Å²	65.2	79%	0.789	32%	0.315	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.4	-28.2	172.9	-76.1	179.7	-175.8	173.9	8.3	113.7	T386 M388	T386-R390 HydrophobicContact CG2-CG 4.14Å; T386-R390 VanDerWaalsContact CG2-NE 3.28Å; T386-R390 WeakPolarHBondContact O-CB 3.36Å; T386-R390 VanDerWaalsContact O-CG 3.24Å; T386-R390 WeakPolarHBondContact O-CG 3.45Å; T386-R390 PolarHBondContact O-N 3.04Å; M388-R390 PolarHBondContact O-N 3.07Å
391	R	93.4	Very high	92.1	Very high	209 Å²	209	65.7 Å²	65.7	79%	0.789	32%	0.319	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.3	-3.8	177.9	-62.6	178.3	-177.3	175	3.4	112.8	M388 F389 A393	M388-R391 CarbonylContact O-C 3.58Å; M388-R391 PolarHBondContact O-N 3.03Å; F389-R391 PolarHBondContact O-N 2.86Å; F389-R391 VanDerWaalsContact O-N 3.11Å; R391-A393 PolarHBondContact O-N 3.36Å; R391-A393 VanDerWaalsContact O-N 3.14Å
392	K	91.6	Very high	92	Very high	111 Å²	111	68.8 Å²	68.8	48%	0.483	35%	0.351	S	S	.	.	T	Hydrogen-bonded Turn	trans	49.3	34.2	-172.1	-59	-169.1	166.1	-148.3	0	112.7	M388 F389 L395 E405	M388-K392 PolarHBondContact O-N 2.98Å; F389-K392 PolarHBondContact O-N 3.02Å; K392-L395 HydrophobicContact CB-CD2 4.14Å; K392-L395 HydrophobicContact CD-CD2 4.34Å; K392-L395 HydrophobicContact CG-CD2 4.18Å; K392-E405 IonicContact NZ-OE1 2.83Å; K392-E405 PolarHBondContact NZ-OE1 2.98Å; K392-E405 IonicContact NZ-OE2 2.65Å; K392-E405 PolarHBondContact NZ-OE2 3.42Å
393	A	90.3	Very high	92.1	Very high	30 Å²	30	68.6 Å²	68.6	25%	0.248	35%	0.349	C	S	.	.	T	Hydrogen-bonded Turn	trans	-69.7	133.7	-178.2	0	0	0	0	0	109.8	Y183 M388 R391 L395	Y183-A393 VanDerWaalsContact CE2-O 3.31Å; Y183-A393 WeakPolarHBondContact CE2-O 3.49Å; Y183-A393 PolarHBondContact OH-O 3.3Å; M388-A393 PolarHBondContact O-N 3.26Å; R391-A393 PolarHBondContact O-N 3.36Å; R391-A393 VanDerWaalsContact O-N 3.14Å; A393-L395 PolarHBondContact O-N 3.36Å
394	F	92.3	Very high	92.1	Very high	79 Å²	79	67.3 Å²	67.3	35%	0.346	35%	0.346	S	S	.	.	T	Hydrogen-bonded Turn	trans	58.1	7.2	178.5	-55.2	-77.9	0	0	0	116.6	V179 V180 H396 W397	V179-F394 HydrophobicContact CG2-CD2 4.03Å; V179-F394 HydrophobicContact CG2-CE2 3.53Å; V179-F394 HydrophobicContact CG2-CZ 4.02Å; V180-F394 HydrophobicContact CG1-CB 3.81Å; V180-F394 HydrophobicContact CG1-CD2 4.13Å; V180-F394 HydrophobicContact CG1-CG 3.94Å; F394-H396 VanDerWaalsContact C-N 3.26Å; F394-H396 PolarHBondContact O-N 2.7Å; F394-W397 HydrophobicContact CD1-CD2 4.29Å; F394-W397 AromaticContact CD1-CE2 3.99Å; F394-W397 HydrophobicContact CD1-CE3 4.41Å; F394-W397 AromaticContact CD1-CH2 3.98Å; F394-W397 HydrophobicContact CD1-CH2 3.98Å; F394-W397 AromaticContact CD1-CZ2 3.83Å; F394-W397 HydrophobicContact CD1-CZ2 3.83Å; F394-W397 HydrophobicContact CD1-CZ3 4.27Å; F394-W397 HydrophobicContact CE1-CH2 4.19Å; F394-W397 HydrophobicContact CE1-CZ2 4.12Å; F394-W397 WeakPolarHBondContact O-CB 3.36Å; F394-W397 PolarHBondContact O-N 2.86Å
395	L	91.8	Very high	92.1	Very high	6 Å²	6	68 Å²	68	3%	0.031	35%	0.349	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61	-34.5	-176.9	-166.7	62.6	0	0	0	113	F389 K392 A393 W397 Y398 T399 E405 F408	F389-L395 HydrophobicContact CD2-CD1 4.36Å; F389-L395 HydrophobicContact CE2-CD1 4.1Å; F389-L395 HydrophobicContact CE2-CD2 4.25Å; K392-L395 HydrophobicContact CB-CD2 4.14Å; K392-L395 HydrophobicContact CD-CD2 4.34Å; K392-L395 HydrophobicContact CG-CD2 4.18Å; A393-L395 PolarHBondContact O-N 3.36Å; L395-W397 PolarHBondContact O-N 3.49Å; L395-W397 VanDerWaalsContact O-N 3.11Å; L395-Y398 PolarHBondContact O-N 3.24Å; L395-T399 HydrophobicContact CG-CG2 4.2Å; L395-T399 PolarHBondContact O-N 3.09Å; L395-T399 PolarHBondContact O-OG1 2.89Å; L395-E405 HydrophobicContact CD2-CG 3.8Å; L395-E405 VanDerWaalsContact CD2-OE1 3.26Å; L395-E405 WeakPolarHBondContact CD2-OE1 3.04Å; L395-F408 HydrophobicContact CD1-CD1 4.29Å; L395-F408 HydrophobicContact CD1-CD2 3.84Å; L395-F408 HydrophobicContact CD1-CE1 4.12Å; L395-F408 HydrophobicContact CD1-CE2 3.64Å; L395-F408 HydrophobicContact CD1-CG 4.17Å; L395-F408 HydrophobicContact CD1-CZ 3.8Å
396	H	91.5	Very high	92.1	Very high	123 Å²	123	73.6 Å²	73.6	57%	0.569	38%	0.377	S	S	*	.	H	α-helix	trans	-59.2	-20.1	176.2	70.2	-72.5	0	0	0	114.7	F394 Y398 T399 G400	F394-H396 VanDerWaalsContact C-N 3.26Å; F394-H396 PolarHBondContact O-N 2.7Å; H396-Y398 VanDerWaalsContact C-N 3.32Å; H396-T399 WeakPolarHBondContact CA-OG1 3.38Å; H396-G400 PolarHBondContact O-N 3.36Å; H396-G400 VanDerWaalsContact O-N 3.09Å
397	W	92	Very high	92	Very high	110 Å²	110	74.9 Å²	74.9	42%	0.417	38%	0.381	S	S	.	.	H	α-helix	trans	-72.2	-29.7	174	-67.8	2.3	0	0	0	111.9	N100 F394 L395 E401	N100-W397 PolarHBondContact ND2-O 2.71Å; F394-W397 HydrophobicContact CD1-CD2 4.29Å; F394-W397 AromaticContact CD1-CE2 3.99Å; F394-W397 HydrophobicContact CD1-CE3 4.41Å; F394-W397 AromaticContact CD1-CH2 3.98Å; F394-W397 HydrophobicContact CD1-CH2 3.98Å; F394-W397 AromaticContact CD1-CZ2 3.83Å; F394-W397 HydrophobicContact CD1-CZ2 3.83Å; F394-W397 HydrophobicContact CD1-CZ3 4.27Å; F394-W397 HydrophobicContact CE1-CH2 4.19Å; F394-W397 HydrophobicContact CE1-CZ2 4.12Å; F394-W397 WeakPolarHBondContact O-CB 3.36Å; F394-W397 PolarHBondContact O-N 2.86Å; L395-W397 PolarHBondContact O-N 3.49Å; L395-W397 VanDerWaalsContact O-N 3.11Å; W397-E401 WeakPolarHBondContact O-CG 3.49Å
398	Y	94.1	Very high	92.1	Very high	0 Å²	0	72.4 Å²	72.4	0%	0	36%	0.361	C	S	.	.	H	α-helix	trans	-89.9	-45.2	-179.7	-60.9	-99.1	0	0	0	110.5	N100 W101 A102 Y183 N184 L187 L395 H396 G400 E401 M403 F408	N100-Y398 WeakPolarHBondContact OD1-CD1 3.4Å; W101-Y398 HydrophobicContact CB-CE1 4.1Å; A102-Y398 HydrophobicContact CB-CD1 3.95Å; Y183-Y398 WeakPolarHBondContact CB-OH 3.48Å; Y183-Y398 HydrophobicContact CD2-CE2 4.01Å; Y183-Y398 HydrophobicContact CG-CE2 4.42Å; N184-Y398 WeakPolarHBondContact OD1-CE1 3.5Å; N184-Y398 PolarHBondContact OD1-OH 3.42Å; L187-Y398 HydrophobicContact CD1-CD1 4.39Å; L187-Y398 HydrophobicContact CD1-CE1 4.36Å; L395-Y398 PolarHBondContact O-N 3.24Å; H396-Y398 VanDerWaalsContact C-N 3.32Å; Y398-G400 PolarHBondContact O-N 3.01Å; Y398-E401 PolarHBondContact O-N 3.31Å; Y398-M403 HydrophobicContact CD1-SD 4.32Å; Y398-M403 WeakPolarHBondContact O-CB 3.32Å; Y398-M403 PolarHBondContact O-N 3Å; Y398-F408 HydrophobicContact CD1-CE1 4.46Å; Y398-F408 AromaticContact CD1-CZ 3.76Å; Y398-F408 HydrophobicContact CD1-CZ 3.76Å; Y398-F408 AromaticContact CD2-CZ 4Å; Y398-F408 HydrophobicContact CD2-CZ 4Å; Y398-F408 HydrophobicContact CE1-CZ 4.45Å; Y398-F408 HydrophobicContact CG-CE1 4.39Å; Y398-F408 HydrophobicContact CG-CE2 4.34Å; Y398-F408 AromaticContact CG-CZ 3.51Å; Y398-F408 HydrophobicContact CG-CZ 3.51Å
399	T	92.9	Very high	92.1	Very high	56 Å²	56	74.2 Å²	74.2	34%	0.344	37%	0.374	S	S	.	.	H	α-helix	trans	-68.3	-26.3	178.2	63.8	0	0	0	0	112.9	L395 H396 E401 G402 M403 E405	L395-T399 HydrophobicContact CG-CG2 4.2Å; L395-T399 PolarHBondContact O-N 3.09Å; L395-T399 PolarHBondContact O-OG1 2.89Å; H396-T399 WeakPolarHBondContact CA-OG1 3.38Å; T399-E401 PolarHBondContact O-N 3.03Å; T399-G402 PolarHBondContact O-N 3Å; T399-M403 VanDerWaalsContact CA-O 3.29Å; T399-M403 WeakPolarHBondContact CA-O 3.3Å; T399-M403 WeakPolarHBondContact CG2-O 3.46Å; T399-E405 HydrophobicContact CG2-CG 4.34Å
400	G	91.8	Very high	92.2	Very high	61 Å²	61	77.5 Å²	77.5	63%	0.629	39%	0.389	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.4	-21.6	171.3	0	0	0	0	0	114.1	H396 Y398	H396-G400 PolarHBondContact O-N 3.36Å; H396-G400 VanDerWaalsContact O-N 3.09Å; Y398-G400 PolarHBondContact O-N 3.01Å
401	E	91.6	Very high	92.2	Very high	53 Å²	53	67.5 Å²	67.5	25%	0.248	35%	0.352	C	S	.	.	T	Hydrogen-bonded Turn	trans	-96.9	7.4	178.3	-55.9	-66.8	146.2	0	0	112.2	A102 K103 T107 W397 Y398 T399	A102-E401 HydrophobicContact CB-CB 3.89Å; A102-E401 HydrophobicContact CB-CG 4.36Å; K103-E401 VanDerWaalsContact CE-CD 3.44Å; K103-E401 WeakPolarHBondContact CE-OE1 3.47Å; K103-E401 VanDerWaalsContact CG-CD 3.46Å; K103-E401 HydrophobicContact CG-CG 3.72Å; K103-E401 WeakPolarHBondContact CG-OE2 3.46Å; K103-E401 IonicContact NZ-OE1 3.96Å; T107-E401 HydrophobicContact CG2-CB 4.22Å; T107-E401 VanDerWaalsContact CG2-OE2 3.23Å; T107-E401 WeakPolarHBondContact CG2-OE2 3.39Å; T107-E401 PolarHBondContact OG1-OE2 2.71Å; W397-E401 WeakPolarHBondContact O-CG 3.49Å; Y398-E401 PolarHBondContact O-N 3.31Å; T399-E401 PolarHBondContact O-N 3.03Å
402	G	88.5	Confident	92.2	Very high	66 Å²	66	59.1 Å²	59.1	68%	0.68	32%	0.321	S	S	*	.	T	Hydrogen-bonded Turn	trans	101.2	1.8	174.5	0	0	0	0	0	115.7	T399	T399-G402 PolarHBondContact O-N 3Å
403	M	93.1	Very high	92.3	Very high	6 Å²	6	56.7 Å²	56.7	3%	0.03	32%	0.318	C	S	.	.			trans	-78.7	141.5	179.4	-163.6	179.6	165.6	0	0	112.2	W101 A102 Y106 L187 Y398 T399 E407 F408	W101-M403 HydrophobicContact CE3-SD 4.34Å; W101-M403 HydrophobicContact CZ3-SD 4.26Å; A102-M403 HydrophobicContact CB-CB 4.45Å; A102-M403 HydrophobicContact CB-SD 4.28Å; Y106-M403 HydrophobicContact CE2-CB 4.34Å; Y106-M403 HydrophobicContact CE2-CG 4.12Å; L187-M403 HydrophobicContact CD1-CE 3.64Å; L187-M403 HydrophobicContact CD1-SD 4.08Å; L187-M403 HydrophobicContact CD2-CE 3.37Å; L187-M403 HydrophobicContact CG-CE 4.14Å; Y398-M403 HydrophobicContact CD1-SD 4.32Å; Y398-M403 WeakPolarHBondContact O-CB 3.32Å; Y398-M403 PolarHBondContact O-N 3Å; T399-M403 VanDerWaalsContact CA-O 3.29Å; T399-M403 WeakPolarHBondContact CA-O 3.3Å; T399-M403 WeakPolarHBondContact CG2-O 3.46Å; M403-E407 HydrophobicContact CE-CB 3.52Å; M403-E407 HydrophobicContact CG-CB 4.27Å; M403-E407 VanDerWaalsContact CG-OE2 3.31Å; M403-E407 WeakPolarHBondContact CG-OE2 3.41Å; M403-F408 HydrophobicContact CE-CD2 3.54Å; M403-F408 HydrophobicContact CE-CE1 4.31Å; M403-F408 HydrophobicContact CE-CE2 3.29Å; M403-F408 HydrophobicContact CE-CG 4.15Å; M403-F408 HydrophobicContact CE-CZ 3.7Å; M403-F408 HydrophobicContact CG-CE2 4.13Å; M403-F408 HydrophobicContact SD-CD2 4.26Å; M403-F408 HydrophobicContact SD-CE2 3.43Å; M403-F408 WeakPolarHBondContact SD-CE2 3.4Å; M403-F408 HydrophobicContact SD-CZ 3.72Å
404	D	92.3	Very high	92.5	Very high	100 Å²	100	56 Å²	56	54%	0.535	31%	0.311	S	S	.	.			trans	-88.1	151.7	174.4	-157.7	-17	0	0	0	112	M406 E407	D404-M406 HydrophobicContact CB-CB 4.37Å; D404-M406 PolarHBondContact O-N 3.07Å; D404-E407 PolarHBondContact N-OE1 2.98Å; D404-E407 PolarHBondContact O-N 2.82Å
405	E	90.6	Very high	92.5	Very high	73 Å²	73	52.4 Å²	52.4	34%	0.341	30%	0.295	S	S	.	.	H	α-helix	trans	-60.7	-23.4	169.3	-60	-165	165.6	0	0	111.7	K392 L395 T399 F408 T409	K392-E405 IonicContact NZ-OE1 2.83Å; K392-E405 PolarHBondContact NZ-OE1 2.98Å; K392-E405 IonicContact NZ-OE2 2.65Å; K392-E405 PolarHBondContact NZ-OE2 3.42Å; L395-E405 HydrophobicContact CD2-CG 3.8Å; L395-E405 VanDerWaalsContact CD2-OE1 3.26Å; L395-E405 WeakPolarHBondContact CD2-OE1 3.04Å; T399-E405 HydrophobicContact CG2-CG 4.34Å; E405-F408 WeakPolarHBondContact O-CB 3.43Å; E405-F408 PolarHBondContact O-N 3.45Å; E405-T409 PolarHBondContact O-N 3.34Å; E405-T409 PolarHBondContact O-OG1 3.45Å
406	M	92.4	Very high	92.6	Very high	118 Å²	118	55 Å²	55	58%	0.581	31%	0.309	S	S	*	.	H	α-helix	trans	-64.5	-40.3	177.1	-163.7	161.2	-162.9	0	0	112.1	D404 F408 T409 E410	D404-M406 HydrophobicContact CB-CB 4.37Å; D404-M406 PolarHBondContact O-N 3.07Å; M406-F408 VanDerWaalsContact C-N 3.25Å; M406-F408 PolarHBondContact O-N 2.82Å; M406-T409 WeakPolarHBondContact O-CA 3.14Å; M406-T409 WeakPolarHBondContact O-CB 3.45Å; M406-T409 PolarHBondContact O-N 3.13Å; M406-E410 WeakPolarHBondContact O-CG 3.29Å; M406-E410 PolarHBondContact O-N 3.41Å
407	E	92.6	Very high	92.7	Very high	50 Å²	50	52.8 Å²	52.8	23%	0.234	30%	0.301	C	S	.	.	H	α-helix	trans	-60.6	-34.9	177.4	-70.6	176.4	-128.6	0	0	112.1	Y106 M403 D404 T409 A411	Y106-E407 PolarHBondContact OH-OE2 3.23Å; M403-E407 HydrophobicContact CE-CB 3.52Å; M403-E407 HydrophobicContact CG-CB 4.27Å; M403-E407 VanDerWaalsContact CG-OE2 3.31Å; M403-E407 WeakPolarHBondContact CG-OE2 3.41Å; D404-E407 PolarHBondContact N-OE1 2.98Å; D404-E407 PolarHBondContact O-N 2.82Å; E407-T409 VanDerWaalsContact C-N 3.33Å; E407-A411 WeakPolarHBondContact O-CB 3.45Å; E407-A411 PolarHBondContact O-N 3.25Å
408	F	93.1	Very high	92.7	Very high	0 Å²	0	47.5 Å²	47.5	0%	0	28%	0.281	C	S	.	.	H	α-helix	trans	-64.2	-40.4	173.3	-75.8	-91.3	0	0	0	112.1	Y183 L187 F385 F389 L395 Y398 M403 E405 M406 E412	Y183-F408 AromaticContact CD1-CD1 3.78Å; Y183-F408 HydrophobicContact CD1-CD1 3.78Å; Y183-F408 AromaticContact CD1-CE1 3.59Å; Y183-F408 HydrophobicContact CD1-CE1 3.59Å; Y183-F408 HydrophobicContact CE1-CD1 4.07Å; Y183-F408 HydrophobicContact CE1-CE1 4.12Å; Y183-F408 HydrophobicContact CG-CE1 4.02Å; L187-F408 HydrophobicContact CD1-CE1 3.94Å; L187-F408 HydrophobicContact CD1-CZ 4.13Å; L187-F408 HydrophobicContact CD2-CD1 4.46Å; F385-F408 AromaticContact CE2-CD1 3.92Å; F385-F408 HydrophobicContact CE2-CD1 3.92Å; F385-F408 HydrophobicContact CZ-CB 4.08Å; F385-F408 AromaticContact CZ-CD1 3.89Å; F385-F408 HydrophobicContact CZ-CD1 3.89Å; F385-F408 WeakPolarHBondContact CZ-O 3.31Å; F389-F408 HydrophobicContact CD2-CB 4.21Å; F389-F408 HydrophobicContact CD2-CD1 4.5Å; F389-F408 HydrophobicContact CD2-CG 4.47Å; F389-F408 HydrophobicContact CE2-CB 3.56Å; F389-F408 HydrophobicContact CE2-CD1 4.47Å; F389-F408 HydrophobicContact CE2-CG 4.01Å; F389-F408 HydrophobicContact CZ-CB 3.79Å; L395-F408 HydrophobicContact CD1-CD1 4.29Å; L395-F408 HydrophobicContact CD1-CD2 3.84Å; L395-F408 HydrophobicContact CD1-CE1 4.12Å; L395-F408 HydrophobicContact CD1-CE2 3.64Å; L395-F408 HydrophobicContact CD1-CG 4.17Å; L395-F408 HydrophobicContact CD1-CZ 3.8Å; Y398-F408 HydrophobicContact CD1-CE1 4.46Å; Y398-F408 AromaticContact CD1-CZ 3.76Å; Y398-F408 HydrophobicContact CD1-CZ 3.76Å; Y398-F408 AromaticContact CD2-CZ 4Å; Y398-F408 HydrophobicContact CD2-CZ 4Å; Y398-F408 HydrophobicContact CE1-CZ 4.45Å; Y398-F408 HydrophobicContact CG-CE1 4.39Å; Y398-F408 HydrophobicContact CG-CE2 4.34Å; Y398-F408 AromaticContact CG-CZ 3.51Å; Y398-F408 HydrophobicContact CG-CZ 3.51Å; M403-F408 HydrophobicContact CE-CD2 3.54Å; M403-F408 HydrophobicContact CE-CE1 4.31Å; M403-F408 HydrophobicContact CE-CE2 3.29Å; M403-F408 HydrophobicContact CE-CG 4.15Å; M403-F408 HydrophobicContact CE-CZ 3.7Å; M403-F408 HydrophobicContact CG-CE2 4.13Å; M403-F408 HydrophobicContact SD-CD2 4.26Å; M403-F408 HydrophobicContact SD-CE2 3.43Å; M403-F408 WeakPolarHBondContact SD-CE2 3.4Å; M403-F408 HydrophobicContact SD-CZ 3.72Å; E405-F408 WeakPolarHBondContact O-CB 3.43Å; E405-F408 PolarHBondContact O-N 3.45Å; M406-F408 VanDerWaalsContact C-N 3.25Å; M406-F408 PolarHBondContact O-N 2.82Å; F408-E412 WeakPolarHBondContact O-CB 2.85Å; F408-E412 PolarHBondContact O-N 3Å
409	T	93.6	Very high	92.7	Very high	70 Å²	70	48.1 Å²	48.1	43%	0.429	29%	0.285	S	S	.	.	H	α-helix	trans	-70.5	-39.3	-179.3	-51.3	0	0	0	0	110.7	E405 M406 E407 E412 S413	E405-T409 PolarHBondContact O-N 3.34Å; E405-T409 PolarHBondContact O-OG1 3.45Å; M406-T409 WeakPolarHBondContact O-CA 3.14Å; M406-T409 WeakPolarHBondContact O-CB 3.45Å; M406-T409 PolarHBondContact O-N 3.13Å; E407-T409 VanDerWaalsContact C-N 3.33Å; T409-E412 PolarHBondContact O-N 2.72Å; T409-S413 WeakPolarHBondContact O-CB 3.37Å; T409-S413 PolarHBondContact O-N 2.83Å
410	E	93.8	Very high	92.7	Very high	97 Å²	97	48.9 Å²	48.9	45%	0.453	29%	0.293	S	S	.	.	H	α-helix	trans	-63.4	-46.3	174.9	-71.1	174	-176.8	0	0	111.4	M406 E412 S413 N414	M406-E410 WeakPolarHBondContact O-CG 3.29Å; M406-E410 PolarHBondContact O-N 3.41Å; E410-E412 PolarHBondContact O-N 2.91Å; E410-S413 PolarHBondContact O-N 2.95Å; E410-N414 WeakPolarHBondContact O-CB 3.46Å; E410-N414 PolarHBondContact O-N 3.02Å
411	A	93.7	Very high	92.7	Very high	0 Å²	0	48 Å²	48	0%	0	27%	0.272	C	S	.	.	H	α-helix	trans	-64.5	-38	176.8	0	0	0	0	0	112.6	T186 L187 H190 E407 M415	T186-A411 HydrophobicContact CG2-CB 4.08Å; L187-A411 HydrophobicContact CD2-CB 3.74Å; H190-A411 HydrophobicContact CB-CB 3.92Å; E407-A411 WeakPolarHBondContact O-CB 3.45Å; E407-A411 PolarHBondContact O-N 3.25Å; A411-M415 WeakPolarHBondContact O-CB 3.32Å; A411-M415 PolarHBondContact O-N 3.43Å; A411-M415 VanDerWaalsContact O-N 3.07Å
412	E	93.3	Very high	92.8	Very high	32 Å²	32	45.5 Å²	45.5	15%	0.15	26%	0.26	C	S	.	.	H	α-helix	trans	-63.9	-43.6	173.1	-172.9	176	-144	0	0	111.5	F385 T386 F408 T409 E410 M415 N416	F385-E412 HydrophobicContact CD1-CB 4.19Å; F385-E412 HydrophobicContact CD1-CG 3.99Å; F385-E412 HydrophobicContact CE1-CB 3.61Å; F385-E412 HydrophobicContact CE1-CG 3.84Å; F385-E412 HydrophobicContact CZ-CB 4.2Å; T386-E412 WeakPolarHBondContact CB-OE1 3.32Å; T386-E412 PolarHBondContact OG1-OE1 2.88Å; F408-E412 WeakPolarHBondContact O-CB 2.85Å; F408-E412 PolarHBondContact O-N 3Å; T409-E412 PolarHBondContact O-N 2.72Å; E410-E412 PolarHBondContact O-N 2.91Å; E412-M415 PolarHBondContact O-N 2.95Å; E412-N416 VanDerWaalsContact O-CG 3.26Å; E412-N416 PolarHBondContact O-N 3.24Å; E412-N416 VanDerWaalsContact O-N 3.09Å; E412-N416 PolarHBondContact O-ND2 3.49Å
413	S	93.7	Very high	93	Very high	60 Å²	60	45 Å²	45	42%	0.42	24%	0.24	S	C	.	.	H	α-helix	trans	-61.3	-53	176.9	-165.3	0	0	0	0	110.8	T409 E410 M415 N416 D417	T409-S413 WeakPolarHBondContact O-CB 3.37Å; T409-S413 PolarHBondContact O-N 2.83Å; E410-S413 PolarHBondContact O-N 2.95Å; S413-M415 VanDerWaalsContact C-N 3.25Å; S413-M415 PolarHBondContact O-N 2.79Å; S413-N416 CarbonylContact O-C 3.54Å; S413-N416 WeakPolarHBondContact O-CA 3.43Å; S413-N416 WeakPolarHBondContact O-CB 3.4Å; S413-N416 PolarHBondContact O-N 3.24Å; S413-D417 PolarHBondContact O-N 2.9Å
414	N	93.6	Very high	92.9	Very high	16 Å²	16	48.9 Å²	48.9	9%	0.086	26%	0.258	C	S	.	.	H	α-helix	trans	-60.9	-35.9	-177.7	-168.1	41.8	0	0	0	112.4	H190 R262 E410 D417 L418	H190-N414 PolarHBondContact ND1-ND2 3.44Å; R262-N414 PolarHBondContact NH1-OD1 2.96Å; R262-N414 PolarHBondContact NH2-OD1 2.8Å; E410-N414 WeakPolarHBondContact O-CB 3.46Å; E410-N414 PolarHBondContact O-N 3.02Å; N414-D417 PolarHBondContact O-N 3.09Å; N414-L418 WeakPolarHBondContact O-CB 3.35Å; N414-L418 PolarHBondContact O-N 3.45Å
415	M	92.4	Very high	92.8	Very high	4 Å²	4	45.6 Å²	45.6	2%	0.02	24%	0.239	C	C	.	.	H	α-helix	trans	-62.9	-43.4	173	-176.6	72.4	71.6	0	0	111.9	T186 V189 F378 A411 E412 S413 L418 V419	T186-M415 HydrophobicContact CG2-CE 4.16Å; V189-M415 HydrophobicContact CB-CE 3.37Å; V189-M415 HydrophobicContact CB-SD 4.37Å; V189-M415 HydrophobicContact CG1-CE 3.4Å; V189-M415 HydrophobicContact CG1-SD 3.73Å; V189-M415 HydrophobicContact CG2-CE 3.87Å; F378-M415 HydrophobicContact CB-SD 3.83Å; F378-M415 HydrophobicContact CD1-CE 4.32Å; F378-M415 HydrophobicContact CD1-SD 3.4Å; F378-M415 WeakPolarHBondContact CD1-SD 3.44Å; F378-M415 HydrophobicContact CE1-SD 4.21Å; F378-M415 HydrophobicContact CG-SD 3.87Å; A411-M415 WeakPolarHBondContact O-CB 3.32Å; A411-M415 PolarHBondContact O-N 3.43Å; A411-M415 VanDerWaalsContact O-N 3.07Å; E412-M415 PolarHBondContact O-N 2.95Å; S413-M415 VanDerWaalsContact C-N 3.25Å; S413-M415 PolarHBondContact O-N 2.79Å; M415-L418 PolarHBondContact O-N 3.35Å; M415-V419 WeakPolarHBondContact O-CG2 3.47Å; M415-V419 PolarHBondContact O-N 3.33Å
416	N	93.3	Very high	92.7	Very high	61 Å²	61	43.6 Å²	43.6	33%	0.326	23%	0.229	S	C	.	.	H	α-helix	trans	-70.9	-33.7	179	-67.9	-35.8	0	0	0	112	S382 E412 S413 V419 S420	S382-N416 PolarHBondContact OG-OD1 3.32Å; E412-N416 VanDerWaalsContact O-CG 3.26Å; E412-N416 PolarHBondContact O-N 3.24Å; E412-N416 VanDerWaalsContact O-N 3.09Å; E412-N416 PolarHBondContact O-ND2 3.49Å; S413-N416 CarbonylContact O-C 3.54Å; S413-N416 WeakPolarHBondContact O-CA 3.43Å; S413-N416 WeakPolarHBondContact O-CB 3.4Å; S413-N416 PolarHBondContact O-N 3.24Å; N416-V419 PolarHBondContact O-N 3.05Å; N416-S420 WeakPolarHBondContact O-CB 3.43Å; N416-S420 PolarHBondContact O-N 2.78Å; N416-S420 PolarHBondContact O-OG 3.26Å
417	D	94.3	Very high	92.4	Very high	75 Å²	75	42.8 Å²	42.8	40%	0.401	23%	0.227	S	C	.	.	H	α-helix	trans	-63.7	-46.3	173	-62.5	-28.7	0	0	0	110.1	S413 N414 V419 S420 E421	S413-D417 PolarHBondContact O-N 2.9Å; N414-D417 PolarHBondContact O-N 3.09Å; D417-V419 VanDerWaalsContact C-N 3.34Å; D417-V419 PolarHBondContact O-N 3.46Å; D417-S420 CarbonylContact O-C 3.53Å; D417-S420 WeakPolarHBondContact O-CA 3.45Å; D417-S420 WeakPolarHBondContact O-CB 3.45Å; D417-S420 PolarHBondContact O-N 3.38Å; D417-E421 WeakPolarHBondContact O-CG 3.47Å; D417-E421 PolarHBondContact O-N 3.29Å
418	L	92.9	Very high	92	Very high	0 Å²	0	40.8 Å²	40.8	0%	0	22%	0.219	C	C	.	.	H	α-helix	trans	-57.8	-43.3	173.8	-177.8	70.6	0	0	0	112.4	V189 V193 R262 L263 F265 F378 N414 M415 S420 E421 Y422	V189-L418 HydrophobicContact CG1-CD2 4.43Å; V193-L418 HydrophobicContact CG2-CD1 4.44Å; V193-L418 HydrophobicContact CG2-CD2 3.83Å; R262-L418 HydrophobicContact CB-CD1 4.47Å; L263-L418 HydrophobicContact CD2-CD1 3.82Å; F265-L418 HydrophobicContact CD2-CD2 4.25Å; F265-L418 HydrophobicContact CE2-CD2 3.87Å; F378-L418 HydrophobicContact CD2-CD2 4.13Å; F378-L418 HydrophobicContact CE1-CD2 4.32Å; F378-L418 HydrophobicContact CE2-CD2 3.83Å; F378-L418 HydrophobicContact CG-CD2 4.5Å; F378-L418 HydrophobicContact CZ-CD2 3.93Å; N414-L418 WeakPolarHBondContact O-CB 3.35Å; N414-L418 PolarHBondContact O-N 3.45Å; M415-L418 PolarHBondContact O-N 3.35Å; L418-S420 VanDerWaalsContact C-N 3.26Å; L418-S420 PolarHBondContact O-N 3.31Å; L418-E421 PolarHBondContact O-N 3.04Å; L418-Y422 HydrophobicContact CD1-CD2 4.37Å; L418-Y422 HydrophobicContact CD1-CE2 3.86Å; L418-Y422 HydrophobicContact CD2-CE2 4.32Å; L418-Y422 HydrophobicContact CG-CD2 4.13Å; L418-Y422 HydrophobicContact CG-CE2 3.85Å; L418-Y422 VanDerWaalsContact O-CD2 3.23Å; L418-Y422 WeakPolarHBondContact O-CD2 3.31Å; L418-Y422 PolarHBondContact O-N 3.09Å; L418-Y422 VanDerWaalsContact O-N 3.1Å
419	V	93.4	Very high	91.2	Very high	13 Å²	13	43.6 Å²	43.6	8%	0.079	24%	0.237	C	C	.	.	H	α-helix	trans	-61.6	-38.5	175	167.4	0	0	0	0	111	Q375 F378 M415 N416 D417 Y422 Q423	Q375-V419 HydrophobicContact CB-CG1 4.36Å; F378-V419 HydrophobicContact CB-CG2 3.54Å; M415-V419 WeakPolarHBondContact O-CG2 3.47Å; M415-V419 PolarHBondContact O-N 3.33Å; N416-V419 PolarHBondContact O-N 3.05Å; D417-V419 VanDerWaalsContact C-N 3.34Å; D417-V419 PolarHBondContact O-N 3.46Å; V419-Y422 PolarHBondContact O-N 3.32Å; V419-Q423 PolarHBondContact O-N 3.29Å
420	S	92.9	Very high	89.9	Confident	72 Å²	72	42.5 Å²	42.5	50%	0.503	24%	0.235	S	C	.	.	H	α-helix	trans	-70.5	-39	179.9	-57.1	0	0	0	0	111.5	N416 D417 L418 Q423 Q424	N416-S420 WeakPolarHBondContact O-CB 3.43Å; N416-S420 PolarHBondContact O-N 2.78Å; N416-S420 PolarHBondContact O-OG 3.26Å; D417-S420 CarbonylContact O-C 3.53Å; D417-S420 WeakPolarHBondContact O-CA 3.45Å; D417-S420 WeakPolarHBondContact O-CB 3.45Å; D417-S420 PolarHBondContact O-N 3.38Å; L418-S420 VanDerWaalsContact C-N 3.26Å; L418-S420 PolarHBondContact O-N 3.31Å; S420-Q423 WeakPolarHBondContact O-CB 3.49Å; S420-Q423 PolarHBondContact O-N 2.96Å; S420-Q424 PolarHBondContact O-N 3.07Å
421	E	92.5	Very high	88.3	Confident	42 Å²	42	44.8 Å²	44.8	20%	0.196	25%	0.25	C	S	.	.	H	α-helix	trans	-58.5	-49.2	171.8	-71.5	167.3	-142.9	0	0	111	R262 L263 D417 L418 Q423 Q424 Y425	R262-E421 WeakPolarHBondContact CB-OE2 3.45Å; R262-E421 IonicContact CZ-OE1 2.74Å; R262-E421 IonicContact NE-OE1 3.94Å; R262-E421 PolarHBondContact NE-OE1 3.05Å; R262-E421 IonicContact NE-OE2 3.96Å; R262-E421 PolarHBondContact NE-OE2 3.19Å; R262-E421 IonicContact NH2-OE1 3.31Å; R262-E421 PolarHBondContact NH2-OE1 3.27Å; L263-E421 HydrophobicContact CD2-CB 4.08Å; D417-E421 WeakPolarHBondContact O-CG 3.47Å; D417-E421 PolarHBondContact O-N 3.29Å; L418-E421 PolarHBondContact O-N 3.04Å; E421-Q423 VanDerWaalsContact C-N 3.26Å; E421-Q423 PolarHBondContact O-N 2.75Å; E421-Q424 WeakPolarHBondContact O-CB 3.39Å; E421-Q424 PolarHBondContact O-N 3.34Å; E421-Y425 WeakPolarHBondContact O-CD2 3.26Å; E421-Y425 PolarHBondContact O-N 2.88Å; E421-Y425 VanDerWaalsContact O-N 3.13Å
422	Y	93.3	Very high	86.6	Confident	0 Å²	0	49.1 Å²	49.1	0%	0	27%	0.27	C	S	.	.	H	α-helix	trans	-59.5	-37	175.6	-81.3	-64.9	0	0	0	112.7	L263 T372 I374 F378 L418 V419 Q426	L263-Y422 HydrophobicContact CB-CE1 4Å; L263-Y422 HydrophobicContact CD1-CD1 4.22Å; L263-Y422 HydrophobicContact CD1-CE1 4.22Å; L263-Y422 HydrophobicContact CD2-CD1 4Å; L263-Y422 HydrophobicContact CD2-CD2 3.99Å; L263-Y422 HydrophobicContact CD2-CE1 3.77Å; L263-Y422 HydrophobicContact CD2-CE2 3.72Å; L263-Y422 HydrophobicContact CD2-CG 4.11Å; L263-Y422 HydrophobicContact CG-CE1 4.21Å; T372-Y422 HydrophobicContact CG2-CD1 4.41Å; T372-Y422 WeakPolarHBondContact CG2-O 3.4Å; I374-Y422 HydrophobicContact CG2-CD1 4.03Å; I374-Y422 HydrophobicContact CG2-CD2 4Å; I374-Y422 HydrophobicContact CG2-CE1 3.59Å; I374-Y422 HydrophobicContact CG2-CE2 3.59Å; I374-Y422 HydrophobicContact CG2-CG 4.21Å; F378-Y422 HydrophobicContact CD2-CE2 4.39Å; F378-Y422 AromaticContact CE2-CE2 4Å; F378-Y422 HydrophobicContact CE2-CE2 4Å; L418-Y422 HydrophobicContact CD1-CD2 4.37Å; L418-Y422 HydrophobicContact CD1-CE2 3.86Å; L418-Y422 HydrophobicContact CD2-CE2 4.32Å; L418-Y422 HydrophobicContact CG-CD2 4.13Å; L418-Y422 HydrophobicContact CG-CE2 3.85Å; L418-Y422 VanDerWaalsContact O-CD2 3.23Å; L418-Y422 WeakPolarHBondContact O-CD2 3.31Å; L418-Y422 PolarHBondContact O-N 3.09Å; L418-Y422 VanDerWaalsContact O-N 3.1Å; V419-Y422 PolarHBondContact O-N 3.32Å; Y422-Q426 VanDerWaalsContact O-CB 3.32Å; Y422-Q426 WeakPolarHBondContact O-CB 3.17Å; Y422-Q426 PolarHBondContact O-N 3.22Å; Y422-Q426 VanDerWaalsContact O-N 3.11Å
423	Q	91.8	Very high	84.7	Confident	56 Å²	56	48.5 Å²	48.5	26%	0.262	27%	0.268	S	S	.	.	H	α-helix	trans	-68.6	-41.1	177	-173	60.8	53.5	0	0	111.7	Q375 V419 S420 E421 Q426 D427	Q375-Q423 VanDerWaalsContact OE1-OE1 3.09Å; V419-Q423 PolarHBondContact O-N 3.29Å; S420-Q423 WeakPolarHBondContact O-CB 3.49Å; S420-Q423 PolarHBondContact O-N 2.96Å; E421-Q423 VanDerWaalsContact C-N 3.26Å; E421-Q423 PolarHBondContact O-N 2.75Å; Q423-Q426 WeakPolarHBondContact O-CB 3.48Å; Q423-Q426 PolarHBondContact O-N 3.38Å; Q423-D427 VanDerWaalsContact NE2-CG 3.34Å; Q423-D427 PolarHBondContact NE2-OD1 3.31Å; Q423-D427 PolarHBondContact NE2-OD2 3.27Å; Q423-D427 PolarHBondContact O-N 3.28Å; Q423-D427 VanDerWaalsContact O-N 3.14Å
424	Q	91.4	Very high	82.6	Confident	88 Å²	88	47.5 Å²	47.5	41%	0.411	27%	0.266	S	S	.	.	H	α-helix	trans	-57.6	-51.6	176.9	-178.9	-179.1	-4.1	0	0	111.1	S420 E421 Q426 D427 A428	S420-Q424 PolarHBondContact O-N 3.07Å; E421-Q424 WeakPolarHBondContact O-CB 3.39Å; E421-Q424 PolarHBondContact O-N 3.34Å; Q424-Q426 VanDerWaalsContact C-N 3.26Å; Q424-Q426 PolarHBondContact O-N 2.96Å; Q424-D427 PolarHBondContact O-N 3.23Å; Q424-A428 WeakPolarHBondContact O-CB 3.37Å; Q424-A428 PolarHBondContact O-N 2.6Å
425	Y	89.7	Confident	80.3	Confident	30 Å²	30	53.1 Å²	53.1	12%	0.118	29%	0.292	C	S	.	.	H	α-helix	trans	-72.8	-18	179.5	-64.1	-67.3	0	0	0	114.1	F260 L263 W344 E421 M433	F260-Y425 HydrophobicContact CD2-CD1 4.42Å; F260-Y425 HydrophobicContact CD2-CD2 4.28Å; F260-Y425 HydrophobicContact CD2-CE1 4.05Å; F260-Y425 AromaticContact CD2-CE2 3.88Å; F260-Y425 HydrophobicContact CD2-CE2 3.88Å; F260-Y425 AromaticContact CD2-CZ 3.73Å; F260-Y425 AromaticContact CE1-CE1 3.91Å; F260-Y425 HydrophobicContact CE1-CE1 3.91Å; F260-Y425 AromaticContact CE1-CZ 3.84Å; F260-Y425 WeakPolarHBondContact CE1-OH 3.21Å; F260-Y425 AromaticContact CE2-CD1 3.58Å; F260-Y425 HydrophobicContact CE2-CD1 3.58Å; F260-Y425 HydrophobicContact CE2-CD2 4.21Å; F260-Y425 AromaticContact CE2-CE1 3.27Å; F260-Y425 HydrophobicContact CE2-CE1 3.27Å; F260-Y425 AromaticContact CE2-CE2 3.94Å; F260-Y425 HydrophobicContact CE2-CE2 3.94Å; F260-Y425 HydrophobicContact CE2-CG 4.03Å; F260-Y425 AromaticContact CE2-CZ 3.45Å; F260-Y425 VanDerWaalsContact CE2-CZ 3.45Å; F260-Y425 HydrophobicContact CG-CE2 4.28Å; F260-Y425 AromaticContact CZ-CD1 3.9Å; F260-Y425 HydrophobicContact CZ-CD1 3.9Å; F260-Y425 AromaticContact CZ-CE1 3.22Å; F260-Y425 HydrophobicContact CZ-CE1 3.22Å; F260-Y425 HydrophobicContact CZ-CE2 4.46Å; F260-Y425 AromaticContact CZ-CZ 3.54Å; L263-Y425 HydrophobicContact CD1-CD2 3.41Å; L263-Y425 VanDerWaalsContact CD1-CD2 3.41Å; L263-Y425 HydrophobicContact CD1-CE2 3.66Å; L263-Y425 HydrophobicContact CD1-CG 4.39Å; W344-Y425 HydrophobicContact CZ2-CD1 4.39Å; E421-Y425 WeakPolarHBondContact O-CD2 3.26Å; E421-Y425 PolarHBondContact O-N 2.88Å; E421-Y425 VanDerWaalsContact O-N 3.13Å; Y425-M433 HydrophobicContact CD1-CE 4.3Å; Y425-M433 HydrophobicContact CD1-SD 4.13Å; Y425-M433 HydrophobicContact CE1-CE 3.95Å; Y425-M433 HydrophobicContact CE1-SD 4.12Å
426	Q	88.6	Confident	78.4	Confident	31 Å²	31	58.2 Å²	58.2	15%	0.145	31%	0.312	C	S	.	.	H	α-helix	trans	-70.3	-40.8	172.2	-178.4	168.2	-51.8	0	0	111.7	H307 T372 Y422 Q423 Q424	H307-Q426 PolarHBondContact O-NE2 3.21Å; T372-Q426 HydrophobicContact CG2-CB 3.97Å; T372-Q426 PolarHBondContact OG1-OE1 3.38Å; Y422-Q426 VanDerWaalsContact O-CB 3.32Å; Y422-Q426 WeakPolarHBondContact O-CB 3.17Å; Y422-Q426 PolarHBondContact O-N 3.22Å; Y422-Q426 VanDerWaalsContact O-N 3.11Å; Q423-Q426 WeakPolarHBondContact O-CB 3.48Å; Q423-Q426 PolarHBondContact O-N 3.38Å; Q424-Q426 VanDerWaalsContact C-N 3.26Å; Q424-Q426 PolarHBondContact O-N 2.96Å
427	D	87.4	Confident	76.3	Confident	101 Å²	101	61.6 Å²	61.6	54%	0.54	33%	0.326	S	S	.	.	H	α-helix	trans	-86.8	-20.8	-178.4	-64.6	-29.7	0	0	0	112.4	Q423 Q424	Q423-D427 VanDerWaalsContact NE2-CG 3.34Å; Q423-D427 PolarHBondContact NE2-OD1 3.31Å; Q423-D427 PolarHBondContact NE2-OD2 3.27Å; Q423-D427 PolarHBondContact O-N 3.28Å; Q423-D427 VanDerWaalsContact O-N 3.14Å; Q424-D427 PolarHBondContact O-N 3.23Å
428	A	82.9	Confident	73.9	Confident	8 Å²	8	64.6 Å²	64.6	7%	0.066	34%	0.338	C	S	.	.			trans	-54.4	135.6	179.3	0	0	0	0	0	113.2	Q424 M433	Q424-A428 WeakPolarHBondContact O-CB 3.37Å; Q424-A428 PolarHBondContact O-N 2.6Å; A428-M433 HydrophobicContact CB-CG 4.16Å; A428-M433 HydrophobicContact CB-SD 4.04Å
429	T	76	Confident	71.7	Confident	60 Å²	60	68.8 Å²	68.8	37%	0.368	36%	0.36	S	S	.	.			trans	-108.5	161.3	173.7	59.4	0	0	0	0	111.4	D431 E432 M433	T429-D431 PolarHBondContact O-N 2.98Å; T429-E432 PolarHBondContact N-OE2 2.93Å; T429-E432 VanDerWaalsContact N-OE2 3.14Å; T429-E432 PolarHBondContact O-N 2.8Å; T429-E432 VanDerWaalsContact O-N 3.17Å; T429-E432 VanDerWaalsContact OG1-CD 3.3Å; T429-E432 PolarHBondContact OG1-OE2 3.35Å; T429-M433 PolarHBondContact O-N 2.88Å
430	A	67	Low	69.5	Low	47 Å²	47	73.8 Å²	73.8	39%	0.388	38%	0.383	S	S	.	.	H	α-helix	trans	-61.5	-27.4	-177.7	0	0	0	0	0	113.5	W344	W344-A430 HydrophobicContact CB-CB 4.33Å
431	D	60.3	Low	67.4	Low	145 Å²	145	75.2 Å²	75.2	78%	0.775	38%	0.383	S	S	*	.	H	α-helix	trans	-75.1	-32	178.2	-64.5	-28	0	0	0	112.1	T429	T429-D431 PolarHBondContact O-N 2.98Å
432	E	59.1	Low	65.1	Low	91 Å²	91	79.7 Å²	79.7	43%	0.425	40%	0.404	S	S	.	.	H	α-helix	trans	-80.1	-35.3	-179.9	-69.1	165	156.2	0	0	111.9	T429 G434 E435 Y436	T429-E432 PolarHBondContact N-OE2 2.93Å; T429-E432 VanDerWaalsContact N-OE2 3.14Å; T429-E432 PolarHBondContact O-N 2.8Å; T429-E432 VanDerWaalsContact O-N 3.17Å; T429-E432 VanDerWaalsContact OG1-CD 3.3Å; T429-E432 PolarHBondContact OG1-OE2 3.35Å; E432-G434 VanDerWaalsContact C-N 3.3Å; E432-G434 PolarHBondContact O-N 3.06Å; E432-E435 PolarHBondContact O-N 3.23Å; E432-Y436 HydrophobicContact CB-CE2 4.29Å; E432-Y436 WeakPolarHBondContact O-CD2 3.44Å; E432-Y436 PolarHBondContact O-N 3.48Å
433	M	51.8	Low	62.9	Low	19 Å²	19	85.1 Å²	85.1	9%	0.094	43%	0.433	C	S	.	.	H	α-helix	trans	-67.8	-25	178.6	-70.6	-62.1	-59	0	0	114.1	F260 W344 Y425 A428 T429 E435 Y436 E437	F260-M433 HydrophobicContact CZ-CE 3.91Å; W344-M433 HydrophobicContact CD2-CG 4.18Å; W344-M433 HydrophobicContact CE3-CE 4.34Å; W344-M433 HydrophobicContact CG-CG 4.07Å; W344-M433 HydrophobicContact CZ3-CE 4.33Å; Y425-M433 HydrophobicContact CD1-CE 4.3Å; Y425-M433 HydrophobicContact CD1-SD 4.13Å; Y425-M433 HydrophobicContact CE1-CE 3.95Å; Y425-M433 HydrophobicContact CE1-SD 4.12Å; A428-M433 HydrophobicContact CB-CG 4.16Å; A428-M433 HydrophobicContact CB-SD 4.04Å; T429-M433 PolarHBondContact O-N 2.88Å; M433-E435 VanDerWaalsContact C-N 3.29Å; M433-E435 PolarHBondContact O-N 3.49Å; M433-Y436 PolarHBondContact O-N 3.11Å; M433-Y436 HydrophobicContact SD-CD2 4.17Å; M433-E437 PolarHBondContact O-N 2.8Å; M433-E437 VanDerWaalsContact O-N 3.13Å
434	G	49.8	Very low	60.7	Low	38 Å²	38	89 Å²	89	39%	0.392	45%	0.452	S	S	.	.	H	α-helix	trans	-68.6	-26.6	174.5	0	0	0	0	0	113.6	E432	E432-G434 VanDerWaalsContact C-N 3.3Å; E432-G434 PolarHBondContact O-N 3.06Å
435	E	46.6	Very low	58.5	Low	134 Å²	134	91.4 Å²	91.4	63%	0.626	46%	0.463	S	S	*	.	H	α-helix	trans	-79.9	-37.7	173.3	-67.9	-178	165.6	0	0	111	E432 M433 E437 E438 D439	E432-E435 PolarHBondContact O-N 3.23Å; M433-E435 VanDerWaalsContact C-N 3.29Å; M433-E435 PolarHBondContact O-N 3.49Å; E435-E437 PolarHBondContact O-N 3.06Å; E435-E438 PolarHBondContact O-N 3.44Å; E435-D439 PolarHBondContact O-N 3.25Å
436	Y	51.7	Low	56.4	Low	111 Å²	111	96.1 Å²	96.1	44%	0.435	49%	0.49	S	S	.	.	H	α-helix	trans	-66.7	-34.3	176.5	-69.5	-72.1	0	0	0	114	E432 M433 E438 D439 E440	E432-Y436 HydrophobicContact CB-CE2 4.29Å; E432-Y436 WeakPolarHBondContact O-CD2 3.44Å; E432-Y436 PolarHBondContact O-N 3.48Å; M433-Y436 PolarHBondContact O-N 3.11Å; M433-Y436 HydrophobicContact SD-CD2 4.17Å; Y436-E438 VanDerWaalsContact C-N 3.31Å; Y436-D439 PolarHBondContact O-N 2.93Å; Y436-E440 PolarHBondContact O-N 3.34Å
437	E	48	Very low	54.5	Low	132 Å²	132	100.7 Å²	100.7	62%	0.617	52%	0.52	S	S	*	.	H	α-helix	trans	-66.8	-31.7	172.2	-80.8	-173.3	175.1	0	0	111.9	M433 E435 I441	M433-E437 PolarHBondContact O-N 2.8Å; M433-E437 VanDerWaalsContact O-N 3.13Å; E435-E437 PolarHBondContact O-N 3.06Å; E437-I441 WeakPolarHBondContact O-CD1 3.24Å; E437-I441 WeakPolarHBondContact O-CG1 3.31Å; E437-I441 PolarHBondContact O-N 3.03Å
438	E	44.9	Very low	52.4	Low	139 Å²	139	106 Å²	106	65%	0.65	53%	0.532	S	S	*	.	H	α-helix	trans	-70.9	-39.9	173.7	-76.2	-174.7	166.3	0	0	111.4	E435 Y436 I441 E442	E435-E438 PolarHBondContact O-N 3.44Å; Y436-E438 VanDerWaalsContact C-N 3.31Å; E438-I441 PolarHBondContact O-N 3.44Å; E438-E442 PolarHBondContact O-N 3.18Å; E438-E442 VanDerWaalsContact O-N 3.15Å
439	D	46.2	Very low	50.2	Low	88 Å²	88	116.7 Å²	116.7	47%	0.471	58%	0.58	S	S	.	*	H	α-helix	trans	-68.6	-41.4	178.5	-71.4	-24.3	0	0	0	113	E435 Y436 I441 E442 D443	E435-D439 PolarHBondContact O-N 3.25Å; Y436-D439 PolarHBondContact O-N 2.93Å; D439-I441 VanDerWaalsContact C-N 3.3Å; D439-I441 PolarHBondContact O-N 3.38Å; D439-E442 PolarHBondContact O-N 3.3Å; D439-D443 PolarHBondContact O-N 3.07Å; D439-D443 VanDerWaalsContact O-N 3.07Å
440	E	47.2	Very low	48.9	Very low	118 Å²	118	119.6 Å²	119.6	55%	0.551	59%	0.591	S	S	*	*	H	α-helix	trans	-65.5	-31.3	176	-83.2	-171.3	171.3	0	0	112.6	Y436 E444	Y436-E440 PolarHBondContact O-N 3.34Å; E440-E444 PolarHBondContact O-N 3.2Å; E440-E444 VanDerWaalsContact O-N 3.1Å
441	I	48.4	Very low	47.9	Very low	102 Å²	102	123.4 Å²	123.4	52%	0.523	60%	0.602	S	S	.	*	H	α-helix	trans	-72.4	-38.1	176.2	-67.2	167.8	0	0	0	110.9	E437 E438 D439 E444 E445	E437-I441 WeakPolarHBondContact O-CD1 3.24Å; E437-I441 WeakPolarHBondContact O-CG1 3.31Å; E437-I441 PolarHBondContact O-N 3.03Å; E438-I441 PolarHBondContact O-N 3.44Å; D439-I441 VanDerWaalsContact C-N 3.3Å; D439-I441 PolarHBondContact O-N 3.38Å; I441-E444 PolarHBondContact O-N 3.37Å; I441-E445 PolarHBondContact O-N 2.65Å; I441-E445 VanDerWaalsContact O-N 3.13Å
442	E	45.1	Very low	47.2	Very low	135 Å²	135	122.2 Å²	122.2	63%	0.631	59%	0.592	S	S	*	*	H	α-helix	trans	-64.5	-41.2	174.2	-77	-166.6	162.2	0	0	111.6	E438 D439 E444 E445 D446	E438-E442 PolarHBondContact O-N 3.18Å; E438-E442 VanDerWaalsContact O-N 3.15Å; D439-E442 PolarHBondContact O-N 3.3Å; E442-E444 PolarHBondContact O-N 3.45Å; E442-E445 PolarHBondContact O-N 2.83Å; E442-D446 PolarHBondContact O-N 3.05Å; E442-D446 VanDerWaalsContact O-N 3.15Å
443	D	48.1	Very low	46.5	Very low	114 Å²	114	124 Å²	124	61%	0.61	60%	0.602	S	S	*	*	H	α-helix	trans	-66.5	-35	176.6	-81	-24.8	0	0	0	112.8	D439 V447	D439-D443 PolarHBondContact O-N 3.07Å; D439-D443 VanDerWaalsContact O-N 3.07Å; D443-V447 WeakPolarHBondContact O-CG2 3.34Å; D443-V447 PolarHBondContact O-N 3.14Å
444	E	43.6	Very low	46.2	Very low	139 Å²	139	130.6 Å²	130.6	65%	0.65	63%	0.634	S	S	*	*	H	α-helix	trans	-72.1	-30.1	174.4	-81.5	-159.6	162.9	0	0	113.7	E440 I441 E442	E440-E444 PolarHBondContact O-N 3.2Å; E440-E444 VanDerWaalsContact O-N 3.1Å; I441-E444 PolarHBondContact O-N 3.37Å; E442-E444 PolarHBondContact O-N 3.45Å
445	E	45.7	Very low	45.9	Very low	137 Å²	137	136.7 Å²	136.7	64%	0.64	65%	0.65	S	S	*	*	H	α-helix	trans	-73.8	-35.1	175.9	-76	-162	159.2	0	0	112.2	I441 E442 V447 R448	I441-E445 PolarHBondContact O-N 2.65Å; I441-E445 VanDerWaalsContact O-N 3.13Å; E442-E445 PolarHBondContact O-N 2.83Å; E445-V447 VanDerWaalsContact C-N 3.33Å; E445-V447 PolarHBondContact O-N 2.98Å; E445-R448 PolarHBondContact O-N 2.89Å
446	D	46.7	Very low	45.9	Very low	129 Å²	129	136.9 Å²	136.9	69%	0.69	65%	0.651	S	S	*	*	H	α-helix	trans	-71.9	-23	178.3	-100.4	-11.1	0	0	0	113.6	E442 R448	E442-D446 PolarHBondContact O-N 3.05Å; E442-D446 VanDerWaalsContact O-N 3.15Å; D446-R448 VanDerWaalsContact C-N 3.29Å; D446-R448 PolarHBondContact O-N 3.11Å
447	V	48.8	Very low	45.4	Very low	128 Å²	128	138.9 Å²	138.9	78%	0.776	67%	0.668	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.2	-13.7	174	178.7	0	0	0	0	112.3	D443 E445	D443-V447 WeakPolarHBondContact O-CG2 3.34Å; D443-V447 PolarHBondContact O-N 3.14Å; E445-V447 VanDerWaalsContact C-N 3.33Å; E445-V447 PolarHBondContact O-N 2.98Å
448	R	41.7	Very low	45.2	Very low	213 Å²	213	139.5 Å²	139.5	80%	0.804	67%	0.672	S	S	*	*	T	Hydrogen-bonded Turn	trans	-98	6.4	-179.4	-75.4	-173.2	178.8	175.3	7.9	114.9	E445 D446	E445-R448 PolarHBondContact O-N 2.89Å; D446-R448 VanDerWaalsContact C-N 3.29Å; D446-R448 PolarHBondContact O-N 3.11Å
449	H	36.6	Very low	45.3	Very low	232 Å²	232	139.5 Å²	139.5	100%	1.074	67%	0.674	S	S	*	*			trans	-109.8	0	178.8	-93.3	-39.2	0	0	0	116.3

Retrieved 449 of 449 residues in 265.8 ms (Link to these results)

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