A0A087Y0P5_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 A0A087Y0P5, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 444 aa.

Structure Viewer

Loading PAE data...

(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	56.5	Low	90.4	Very high	151 Å²	151	34.5 Å²	34.5	74%	0.744	16%	0.157	S	C	*	.				0	135.1	0	-65.2	-171.3	-91.5	0	0	107	E3 D128 C129	M1-E3 WeakPolarHBondContact CB-OE1 3.46Å; M1-D128 HydrophobicContact CB-CB 4.41Å; M1-D128 VanDerWaalsContact SD-OD2 3.4Å; M1-C129 WeakPolarHBondContact O-CB 3.29Å
2	R	80.3	Confident	90.5	Very high	103 Å²	103	33.9 Å²	33.9	39%	0.389	16%	0.16	S	C	.	.			trans	-155.8	78.4	-161.2	-67.3	-171.9	172.7	-173.9	-16.8	109.7	C129 Q131 D249	R2-C129 WeakPolarHBondContact CA-O 3.47Å; R2-Q131 HydrophobicContact CB-CG 3.63Å; R2-Q131 HydrophobicContact CG-CG 4.35Å; R2-Q131 PolarHBondContact O-NE2 3.47Å; R2-D249 IonicContact CZ-OD2 3.96Å; R2-D249 IonicContact NH1-OD2 3.26Å; R2-D249 PolarHBondContact NH1-OD2 2.86Å; R2-D249 IonicContact NH2-OD2 3.53Å; R2-D249 PolarHBondContact NH2-OD2 3.43Å
3	E	92.4	Very high	90.8	Very high	7 Å²	7	31.3 Å²	31.3	3%	0.033	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.3	152.1	-171.6	-58.8	71.8	-148.1	0	0	112.7	M1 C127 D128 C129 Q131	M1-E3 WeakPolarHBondContact CB-OE1 3.46Å; E3-C127 HydrophobicContact CB-CB 4.03Å; E3-C127 HydrophobicContact CG-CB 4.18Å; E3-D128 PolarHBondContact OE2-N 2.99Å; E3-C129 PolarHBondContact N-O 2.96Å; E3-C129 WeakPolarHBondContact OE2-CA 3.47Å; E3-C129 PolarHBondContact OE2-N 2.89Å; E3-Q131 WeakPolarHBondContact O-CB 3.45Å; E3-Q131 PolarHBondContact O-N 3.37Å
4	I	94.9	Very high	91.1	Very high	0 Å²	0	29.1 Å²	29.1	0%	0	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	127	174.9	-63.8	168.5	0	0	0	108.5	V49 Y50 R62 Q131 Q134 L240 L250	I4-V49 HydrophobicContact CD1-CG1 3.73Å; I4-V49 HydrophobicContact CG1-CG1 4.07Å; I4-V49 PolarHBondContact N-O 3.23Å; I4-Y50 HydrophobicContact CB-CE1 4.35Å; I4-Y50 HydrophobicContact CD1-CE2 4.25Å; I4-Y50 HydrophobicContact CG2-CE1 4.15Å; I4-R62 WeakPolarHBondContact O-CD 3.44Å; I4-Q131 HydrophobicContact CG1-CB 4.19Å; I4-Q134 HydrophobicContact CG2-CB 3.95Å; I4-L240 HydrophobicContact CD1-CD1 3.73Å; I4-L250 HydrophobicContact CD1-CD1 3.7Å; I4-L250 HydrophobicContact CD1-CG 4.08Å; I4-L250 HydrophobicContact CG1-CD1 3.94Å
5	V	96.5	Very high	91.2	Very high	0 Å²	0	31.7 Å²	31.7	0%	0	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.7	118.6	171.7	176.5	0	0	0	0	108.2	I7 R62 V64 E123 L130 G132 F133 Q134	V5-I7 HydrophobicContact CG1-CG1 4.19Å; V5-R62 HydrophobicContact CG2-CG 4.07Å; V5-V64 HydrophobicContact CG1-CG2 4.5Å; V5-E123 HydrophobicContact CG1-CB 4.46Å; V5-E123 HydrophobicContact CG2-CB 4.22Å; V5-L130 HydrophobicContact CB-CD1 4.48Å; V5-L130 HydrophobicContact CG2-CD1 3.76Å; V5-G132 PolarHBondContact N-O 3.13Å; V5-F133 HydrophobicContact CB-CD1 3.82Å; V5-F133 HydrophobicContact CB-CE1 4.09Å; V5-F133 HydrophobicContact CG1-CD1 4.13Å; V5-F133 HydrophobicContact CG1-CE1 4.37Å; V5-F133 HydrophobicContact CG2-CE1 4.43Å; V5-F133 WeakPolarHBondContact O-CA 3.4Å; V5-Q134 PolarHBondContact O-N 3.49Å
6	H	97.4	Very high	91.3	Very high	0 Å²	0	30 Å²	30	0%	0	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.4	135.7	176.8	-173.3	89.1	0	0	0	110.2	Q8 F20 W21 R62 S63 V64 Q134	H6-Q8 VanDerWaalsContact CD2-CG 3.49Å; H6-Q8 WeakPolarHBondContact CD2-CG 3.46Å; H6-Q8 PolarHBondContact CD2-NE2 3.25Å; H6-Q8 VanDerWaalsContact NE2-CG 3.34Å; H6-Q8 WeakPolarHBondContact NE2-CG 3.25Å; H6-Q8 PolarHBondContact NE2-NE2 3.4Å; H6-F20 AromaticContact CE1-CD1 3.73Å; H6-F20 AromaticContact CE1-CE1 3.96Å; H6-F20 AromaticContact ND1-CE1 3.93Å; H6-W21 HydrophobicContact CB-CZ2 3.72Å; H6-W21 AromaticContact CD2-NE1 3.44Å; H6-W21 PolarHBondContact CD2-NE1 3.13Å; H6-W21 AromaticContact NE2-NE1 3.81Å; H6-R62 PolarHBondContact N-O 2.8Å; H6-S63 CarbonylContact O-C 3.58Å; H6-S63 WeakPolarHBondContact O-CA 3.38Å; H6-V64 PolarHBondContact O-N 2.92Å; H6-Q134 CarbonylContact C-O 3.55Å; H6-Q134 WeakPolarHBondContact CA-O 3.5Å
7	I	97.6	Very high	91.5	Very high	2 Å²	2	28.2 Å²	28.2	1%	0.01	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	137	-179.9	-53.7	175	0	0	0	108.5	V5 V64 V66 V120 F133 Q134 L135 T136 L151 I155	V5-I7 HydrophobicContact CG1-CG1 4.19Å; I7-V64 WeakPolarHBondContact CA-O 3.26Å; I7-V64 HydrophobicContact CG1-CB 4.46Å; I7-V66 HydrophobicContact CG2-CG2 4.48Å; I7-V120 HydrophobicContact CD1-CG2 3.94Å; I7-F133 HydrophobicContact CD1-CD1 4.12Å; I7-Q134 PolarHBondContact N-O 3.13Å; I7-L135 HydrophobicContact CB-CD1 3.82Å; I7-L135 HydrophobicContact CG2-CD1 3.66Å; I7-L135 CarbonylContact O-C 3.57Å; I7-L135 VanDerWaalsContact O-CA 3.31Å; I7-L135 WeakPolarHBondContact O-CA 3.28Å; I7-T136 PolarHBondContact O-N 3.42Å; I7-T136 PolarHBondContact O-OG1 3.08Å; I7-L151 HydrophobicContact CD1-CD2 4.15Å; I7-L151 HydrophobicContact CG2-CD2 3.62Å; I7-I155 HydrophobicContact CD1-CD1 3.46Å; I7-I155 VanDerWaalsContact CD1-CD1 3.46Å
8	Q	96.4	Very high	91.7	Very high	0 Å²	0	27.3 Å²	27.3	0%	0	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123	123.1	179.4	-53.5	179.8	10.6	0	0	108.5	H6 N14 G17 V64 V66 T136	H6-Q8 VanDerWaalsContact CD2-CG 3.49Å; H6-Q8 WeakPolarHBondContact CD2-CG 3.46Å; H6-Q8 PolarHBondContact CD2-NE2 3.25Å; H6-Q8 VanDerWaalsContact NE2-CG 3.34Å; H6-Q8 WeakPolarHBondContact NE2-CG 3.25Å; H6-Q8 PolarHBondContact NE2-NE2 3.4Å; Q8-N14 WeakPolarHBondContact CB-OD1 3.17Å; Q8-N14 PolarHBondContact OE1-O 3.3Å; Q8-G17 VanDerWaalsContact CD-CA 3.46Å; Q8-G17 VanDerWaalsContact NE2-CA 3.3Å; Q8-G17 PolarHBondContact NE2-O 3.12Å; Q8-V64 PolarHBondContact N-O 3.32Å; Q8-V66 PolarHBondContact O-N 3.05Å; Q8-T136 WeakPolarHBondContact CG-OG1 3.32Å
9	A	95.7	Very high	91.7	Very high	2 Å²	2	29.9 Å²	29.9	2%	0.017	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	127.2	-177.3	0	0	0	0	0	111.9	V66 L135 T136 H137 G144	A9-V66 WeakPolarHBondContact CA-O 3.45Å; A9-L135 HydrophobicContact CB-CD1 4.04Å; A9-T136 PolarHBondContact N-O 3.4Å; A9-T136 VanDerWaalsContact N-O 3.08Å; A9-H137 HydrophobicContact CB-CB 4.3Å; A9-G144 WeakPolarHBondContact O-CA 3.29Å
10	G	94.4	Very high	91.9	Very high	1 Å²	1	28.4 Å²	28.4	1%	0.01	13%	0.133	C	C	.	.	H	α-helix	trans	73	175.8	177.5	0	0	0	0	0	114.3	C12 G13 N14 V66	G10-C12 PolarHBondContact O-N 3.21Å; G10-G13 PolarHBondContact O-N 3.18Å; G10-N14 WeakPolarHBondContact O-CB 3.43Å; G10-N14 PolarHBondContact O-N 2.88Å; G10-N14 PolarHBondContact O-ND2 2.82Å; G10-V66 PolarHBondContact N-O 3.31Å
11	Q	92.3	Very high	92.1	Very high	113 Å²	113	27 Å²	27	53%	0.528	13%	0.127	S	C	.	.	H	α-helix	trans	-55.3	-51.1	-174.1	-173.1	-176.5	5.5	0	0	113.5	Q15 D67	Q11-Q15 VanDerWaalsContact O-CG 3.29Å; Q11-Q15 WeakPolarHBondContact O-CG 3.41Å; Q11-Q15 PolarHBondContact O-N 2.9Å; Q11-D67 PolarHBondContact N-OD2 3.32Å
12	C	92	Very high	93.8	Very high	28 Å²	28	21.3 Å²	21.3	19%	0.189	10%	0.098	C	C	.	.	H	α-helix	trans	-65.2	-44.1	-179.3	179.9	0	0	0	0	111.8	G10 N14 Q15 I16	G10-C12 PolarHBondContact O-N 3.21Å; C12-N14 PolarHBondContact O-N 3.46Å; C12-Q15 PolarHBondContact O-N 3.48Å; C12-I16 PolarHBondContact O-N 3.47Å; C12-I16 VanDerWaalsContact SG-CD1 3.54Å
13	G	93.9	Very high	94.3	Very high	0 Å²	0	17.8 Å²	17.8	0%	0	9%	0.086	C	C	.	.	H	α-helix	trans	-59.3	-46.9	177.7	0	0	0	0	0	112.4	G10 G17 T136	G10-G13 PolarHBondContact O-N 3.18Å; G13-G17 WeakPolarHBondContact O-CA 3.47Å; G13-G17 PolarHBondContact O-N 3.37Å; G13-T136 VanDerWaalsContact CA-O 3.22Å; G13-T136 WeakPolarHBondContact CA-O 3.4Å; G13-T136 PolarHBondContact O-OG1 3.1Å
14	N	94.8	Very high	94.4	Very high	0 Å²	0	17.5 Å²	17.5	0%	0	9%	0.085	C	C	.	.	H	α-helix	trans	-66	-37.2	177.9	-74.8	-63.6	0	0	0	112.8	Q8 G10 C12 T18 V66 T72 V76	Q8-N14 WeakPolarHBondContact CB-OD1 3.17Å; Q8-N14 PolarHBondContact OE1-O 3.3Å; G10-N14 WeakPolarHBondContact O-CB 3.43Å; G10-N14 PolarHBondContact O-N 2.88Å; G10-N14 PolarHBondContact O-ND2 2.82Å; C12-N14 PolarHBondContact O-N 3.46Å; N14-T18 VanDerWaalsContact O-CB 3.24Å; N14-T18 WeakPolarHBondContact O-CB 3.43Å; N14-T18 PolarHBondContact O-N 3Å; N14-T18 PolarHBondContact O-OG1 2.78Å; N14-V66 PolarHBondContact ND2-O 2.91Å; N14-T72 HydrophobicContact CB-CG2 3.57Å; N14-V76 HydrophobicContact CB-CG2 4.14Å
15	Q	92.9	Very high	94.3	Very high	68 Å²	68	17.5 Å²	17.5	32%	0.318	9%	0.085	S	C	.	.	H	α-helix	trans	-66.9	-48.1	177.2	-74.3	177.7	15.7	0	0	112.5	Q11 C12 K19	Q11-Q15 VanDerWaalsContact O-CG 3.29Å; Q11-Q15 WeakPolarHBondContact O-CG 3.41Å; Q11-Q15 PolarHBondContact O-N 2.9Å; C12-Q15 PolarHBondContact O-N 3.48Å; Q15-K19 WeakPolarHBondContact O-CG 3.31Å; Q15-K19 PolarHBondContact O-N 3.31Å; Q15-K19 VanDerWaalsContact O-N 3.1Å
16	I	93.8	Very high	94	Very high	5 Å²	5	20.2 Å²	20.2	3%	0.026	10%	0.1	C	C	.	.	H	α-helix	trans	-68.3	-43.8	179	-70.1	169.2	0	0	0	110.3	C12 T18 K19 F20 V169 N226 V229 M233	C12-I16 PolarHBondContact O-N 3.47Å; C12-I16 VanDerWaalsContact SG-CD1 3.54Å; I16-T18 VanDerWaalsContact C-N 3.34Å; I16-T18 PolarHBondContact O-N 3.28Å; I16-K19 PolarHBondContact O-N 2.82Å; I16-F20 WeakPolarHBondContact O-CB 3.49Å; I16-F20 PolarHBondContact O-N 3.12Å; I16-V169 HydrophobicContact CD1-CG2 3.38Å; I16-N226 WeakPolarHBondContact CG1-OD1 3.49Å; I16-V229 HydrophobicContact CD1-CG1 4.25Å; I16-V229 HydrophobicContact CG1-CG1 4.43Å; I16-V229 HydrophobicContact CG2-CB 4.23Å; I16-V229 HydrophobicContact CG2-CG1 3.43Å; I16-V229 VanDerWaalsContact CG2-CG1 3.43Å; I16-M233 HydrophobicContact CG2-SD 3.48Å; I16-M233 WeakPolarHBondContact CG2-SD 3.44Å
17	G	94.4	Very high	93.7	Very high	0 Å²	0	20.7 Å²	20.7	0%	0	10%	0.102	C	C	.	.	H	α-helix	trans	-61.5	-41	177.1	0	0	0	0	0	112.1	Q8 G13 F20 W21	Q8-G17 VanDerWaalsContact CD-CA 3.46Å; Q8-G17 VanDerWaalsContact NE2-CA 3.3Å; Q8-G17 PolarHBondContact NE2-O 3.12Å; G13-G17 WeakPolarHBondContact O-CA 3.47Å; G13-G17 PolarHBondContact O-N 3.37Å; G17-F20 WeakPolarHBondContact O-CB 3.5Å; G17-F20 PolarHBondContact O-N 3.27Å; G17-W21 PolarHBondContact O-N 2.84Å
18	T	93.8	Very high	93.4	Very high	12 Å²	12	20.7 Å²	20.7	7%	0.074	10%	0.102	C	C	.	.	H	α-helix	trans	-59.3	-49.8	172.3	-60.9	0	0	0	0	110.7	N14 I16 F20 W21 E22	N14-T18 VanDerWaalsContact O-CB 3.24Å; N14-T18 WeakPolarHBondContact O-CB 3.43Å; N14-T18 PolarHBondContact O-N 3Å; N14-T18 PolarHBondContact O-OG1 2.78Å; I16-T18 VanDerWaalsContact C-N 3.34Å; I16-T18 PolarHBondContact O-N 3.28Å; T18-F20 VanDerWaalsContact C-N 3.29Å; T18-F20 PolarHBondContact O-N 3.35Å; T18-W21 PolarHBondContact O-N 3.2Å; T18-W21 VanDerWaalsContact O-N 3.12Å; T18-E22 WeakPolarHBondContact O-CG 3.3Å; T18-E22 PolarHBondContact O-N 3.3Å
19	K	93.2	Very high	93.1	Very high	76 Å²	76	21.2 Å²	21.2	33%	0.33	11%	0.107	S	C	.	.	H	α-helix	trans	-61.4	-36.5	177.9	-73.6	-74.8	164	-156.1	0	113	Q15 I16 E22 E23 N226	Q15-K19 WeakPolarHBondContact O-CG 3.31Å; Q15-K19 PolarHBondContact O-N 3.31Å; Q15-K19 VanDerWaalsContact O-N 3.1Å; I16-K19 PolarHBondContact O-N 2.82Å; K19-E22 WeakPolarHBondContact CD-OE2 3.29Å; K19-E22 WeakPolarHBondContact CE-OE2 3.48Å; K19-E22 IonicContact NZ-OE1 3.99Å; K19-E22 IonicContact NZ-OE2 2.73Å; K19-E22 PolarHBondContact NZ-OE2 3.34Å; K19-E22 PolarHBondContact O-N 3.05Å; K19-E23 PolarHBondContact O-N 2.91Å; K19-N226 HydrophobicContact CG-CB 4.08Å
20	F	95	Very high	92.9	Very high	0 Å²	0	21.2 Å²	21.2	0%	0	11%	0.107	C	C	.	.	H	α-helix	trans	-59.8	-49.1	172.3	168.1	-106.6	0	0	0	111.2	H6 I16 G17 T18 E22 E23 I24 Y50 M233 T237	H6-F20 AromaticContact CE1-CD1 3.73Å; H6-F20 AromaticContact CE1-CE1 3.96Å; H6-F20 AromaticContact ND1-CE1 3.93Å; I16-F20 WeakPolarHBondContact O-CB 3.49Å; I16-F20 PolarHBondContact O-N 3.12Å; G17-F20 WeakPolarHBondContact O-CB 3.5Å; G17-F20 PolarHBondContact O-N 3.27Å; T18-F20 VanDerWaalsContact C-N 3.29Å; T18-F20 PolarHBondContact O-N 3.35Å; F20-E22 VanDerWaalsContact C-N 3.34Å; F20-E22 PolarHBondContact O-N 2.73Å; F20-E23 PolarHBondContact O-N 2.87Å; F20-I24 HydrophobicContact CD1-CD1 4.41Å; F20-I24 HydrophobicContact CD2-CG2 3.97Å; F20-I24 HydrophobicContact CE1-CD1 3.72Å; F20-I24 HydrophobicContact CE1-CG1 4.34Å; F20-I24 HydrophobicContact CE2-CD1 4.47Å; F20-I24 HydrophobicContact CE2-CG2 3.54Å; F20-I24 HydrophobicContact CZ-CD1 3.77Å; F20-I24 HydrophobicContact CZ-CG1 4.35Å; F20-I24 HydrophobicContact CZ-CG2 3.93Å; F20-I24 WeakPolarHBondContact O-CG1 3.35Å; F20-I24 PolarHBondContact O-N 3.46Å; F20-Y50 HydrophobicContact CE1-CD1 4.3Å; F20-Y50 HydrophobicContact CE1-CE1 4Å; F20-Y50 HydrophobicContact CZ-CD1 4.42Å; F20-Y50 AromaticContact CZ-CE1 3.9Å; F20-Y50 HydrophobicContact CZ-CE1 3.9Å; F20-M233 HydrophobicContact CB-CE 3.69Å; F20-M233 HydrophobicContact CB-SD 4.04Å; F20-M233 HydrophobicContact CD1-CE 4.06Å; F20-M233 HydrophobicContact CD2-CB 3.54Å; F20-M233 HydrophobicContact CD2-CE 3.74Å; F20-M233 HydrophobicContact CD2-SD 4.38Å; F20-M233 HydrophobicContact CE2-CB 4Å; F20-M233 HydrophobicContact CE2-CE 4.36Å; F20-M233 HydrophobicContact CG-CB 4.42Å; F20-M233 HydrophobicContact CG-CE 3.54Å; F20-M233 HydrophobicContact CG-SD 4.37Å; F20-T237 HydrophobicContact CE2-CG2 4.34Å; F20-T237 HydrophobicContact CZ-CG2 4.41Å
21	W	95.2	Very high	92.7	Very high	0 Å²	0	23.4 Å²	23.4	0%	0	12%	0.118	C	C	.	.	H	α-helix	trans	-63.4	-36.9	177.2	-74.8	110.9	0	0	0	113.3	H6 G17 T18 I24 S25 Y50 Y51 P61 F85	H6-W21 HydrophobicContact CB-CZ2 3.72Å; H6-W21 AromaticContact CD2-NE1 3.44Å; H6-W21 PolarHBondContact CD2-NE1 3.13Å; H6-W21 AromaticContact NE2-NE1 3.81Å; G17-W21 PolarHBondContact O-N 2.84Å; T18-W21 PolarHBondContact O-N 3.2Å; T18-W21 VanDerWaalsContact O-N 3.12Å; W21-I24 HydrophobicContact CD2-CD1 4.26Å; W21-I24 HydrophobicContact CE3-CD1 3.49Å; W21-I24 VanDerWaalsContact CE3-CD1 3.49Å; W21-I24 HydrophobicContact CE3-CG1 3.96Å; W21-I24 HydrophobicContact CH2-CD1 4.32Å; W21-I24 HydrophobicContact CZ3-CD1 3.53Å; W21-I24 HydrophobicContact CZ3-CG1 4.45Å; W21-S25 WeakPolarHBondContact O-CB 3.3Å; W21-S25 PolarHBondContact O-N 2.99Å; W21-S25 PolarHBondContact O-OG 2.91Å; W21-Y50 AromaticContact CH2-CD1 3.78Å; W21-Y50 HydrophobicContact CH2-CD1 3.78Å; W21-Y50 HydrophobicContact CH2-CG 4.24Å; W21-Y50 VanDerWaalsContact CH2-O 3.29Å; W21-Y50 WeakPolarHBondContact CH2-O 3.47Å; W21-Y50 HydrophobicContact CZ2-CD1 4.33Å; W21-Y50 HydrophobicContact CZ3-CD1 4.41Å; W21-Y51 HydrophobicContact CE3-CE1 4.18Å; W21-Y51 AromaticContact CE3-CZ 3.97Å; W21-Y51 HydrophobicContact CZ3-CD1 4.45Å; W21-Y51 AromaticContact CZ3-CE1 3.98Å; W21-Y51 HydrophobicContact CZ3-CE1 3.98Å; W21-Y51 HydrophobicContact CZ3-CE2 4.15Å; W21-Y51 AromaticContact CZ3-CZ 3.8Å; W21-P61 HydrophobicContact CD2-CB 3.89Å; W21-P61 HydrophobicContact CD2-CG 4.22Å; W21-P61 HydrophobicContact CE3-CB 3.69Å; W21-P61 HydrophobicContact CE3-CG 3.83Å; W21-P61 HydrophobicContact CH2-CB 3.68Å; W21-P61 HydrophobicContact CZ2-CB 3.86Å; W21-P61 HydrophobicContact CZ3-CB 3.58Å; W21-P61 HydrophobicContact CZ3-CG 4.05Å; W21-F85 HydrophobicContact CB-CE1 4.25Å; W21-F85 HydrophobicContact CB-CZ 3.87Å; W21-F85 AromaticContact CD1-CE1 3.44Å; W21-F85 VanDerWaalsContact CD1-CE1 3.44Å; W21-F85 AromaticContact CD1-CZ 3.55Å; W21-F85 HydrophobicContact CD2-CE1 4.25Å; W21-F85 AromaticContact CG-CE1 3.74Å; W21-F85 HydrophobicContact CG-CE1 3.74Å; W21-F85 AromaticContact CG-CZ 3.8Å; W21-F85 HydrophobicContact CG-CZ 3.8Å; W21-F85 AromaticContact NE1-CE1 3.81Å
22	E	92.9	Very high	92.6	Very high	31 Å²	31	19.9 Å²	19.9	15%	0.145	11%	0.108	C	C	.	.	H	α-helix	trans	-58.9	-50.7	172.8	-64.3	-176.4	167	0	0	110.6	T18 K19 F20 S25 D26 F81	T18-E22 WeakPolarHBondContact O-CG 3.3Å; T18-E22 PolarHBondContact O-N 3.3Å; K19-E22 WeakPolarHBondContact CD-OE2 3.29Å; K19-E22 WeakPolarHBondContact CE-OE2 3.48Å; K19-E22 IonicContact NZ-OE1 3.99Å; K19-E22 IonicContact NZ-OE2 2.73Å; K19-E22 PolarHBondContact NZ-OE2 3.34Å; K19-E22 PolarHBondContact O-N 3.05Å; F20-E22 VanDerWaalsContact C-N 3.34Å; F20-E22 PolarHBondContact O-N 2.73Å; E22-S25 PolarHBondContact O-N 3.42Å; E22-D26 WeakPolarHBondContact O-CB 3.38Å; E22-D26 PolarHBondContact O-N 3.5Å; E22-F81 HydrophobicContact CB-CD2 4.13Å; E22-F81 HydrophobicContact CB-CE2 4.32Å; E22-F81 HydrophobicContact CG-CB 4.28Å; E22-F81 HydrophobicContact CG-CD2 3.61Å; E22-F81 HydrophobicContact CG-CE2 4.26Å; E22-F81 HydrophobicContact CG-CG 4.2Å
23	E	91.6	Very high	92.3	Very high	29 Å²	29	21.3 Å²	21.3	14%	0.136	12%	0.122	C	C	.	.	H	α-helix	trans	-64.2	-46.9	-178	-167.8	69.1	-156	0	0	111.9	K19 F20 D26 E27	K19-E23 PolarHBondContact O-N 2.91Å; F20-E23 PolarHBondContact O-N 2.87Å; E23-D26 PolarHBondContact O-N 2.77Å; E23-E27 WeakPolarHBondContact O-CG 3.34Å; E23-E27 PolarHBondContact O-N 2.92Å
24	I	93.3	Very high	92	Very high	0 Å²	0	21.4 Å²	21.4	0%	0	12%	0.123	C	C	.	.	H	α-helix	trans	-73.7	-29.6	180	66.4	158.2	0	0	0	112.5	F20 W21 E27 H28 Y50 Y51	F20-I24 HydrophobicContact CD1-CD1 4.41Å; F20-I24 HydrophobicContact CD2-CG2 3.97Å; F20-I24 HydrophobicContact CE1-CD1 3.72Å; F20-I24 HydrophobicContact CE1-CG1 4.34Å; F20-I24 HydrophobicContact CE2-CD1 4.47Å; F20-I24 HydrophobicContact CE2-CG2 3.54Å; F20-I24 HydrophobicContact CZ-CD1 3.77Å; F20-I24 HydrophobicContact CZ-CG1 4.35Å; F20-I24 HydrophobicContact CZ-CG2 3.93Å; F20-I24 WeakPolarHBondContact O-CG1 3.35Å; F20-I24 PolarHBondContact O-N 3.46Å; W21-I24 HydrophobicContact CD2-CD1 4.26Å; W21-I24 HydrophobicContact CE3-CD1 3.49Å; W21-I24 VanDerWaalsContact CE3-CD1 3.49Å; W21-I24 HydrophobicContact CE3-CG1 3.96Å; W21-I24 HydrophobicContact CH2-CD1 4.32Å; W21-I24 HydrophobicContact CZ3-CD1 3.53Å; W21-I24 HydrophobicContact CZ3-CG1 4.45Å; I24-E27 PolarHBondContact O-N 3.12Å; I24-H28 WeakPolarHBondContact O-CB 3.24Å; I24-H28 PolarHBondContact O-CD2 3.31Å; I24-H28 PolarHBondContact O-N 3.46Å; I24-Y50 HydrophobicContact CD1-CD1 4.38Å; I24-Y50 HydrophobicContact CD1-CG 4.14Å; I24-Y51 HydrophobicContact CD1-CE2 4.28Å
25	S	92.9	Very high	91.9	Very high	0 Å²	0	23.4 Å²	23.4	0%	0	14%	0.137	C	C	.	.	H	α-helix	trans	-61.8	-49.7	171.8	-64.5	0	0	0	0	109.4	W21 E22 E27 H28 G29 V30 Y51	W21-S25 WeakPolarHBondContact O-CB 3.3Å; W21-S25 PolarHBondContact O-N 2.99Å; W21-S25 PolarHBondContact O-OG 2.91Å; E22-S25 PolarHBondContact O-N 3.42Å; S25-E27 VanDerWaalsContact C-N 3.31Å; S25-E27 PolarHBondContact O-N 3.28Å; S25-H28 CarbonylContact O-C 3.48Å; S25-H28 PolarHBondContact O-N 3.5Å; S25-H28 VanDerWaalsContact O-N 3.11Å; S25-G29 PolarHBondContact O-N 3.03Å; S25-V30 VanDerWaalsContact O-CA 3.29Å; S25-V30 WeakPolarHBondContact O-CA 3.25Å; S25-V30 PolarHBondContact O-N 3.11Å; S25-Y51 VanDerWaalsContact CA-OH 3.25Å; S25-Y51 WeakPolarHBondContact CA-OH 3.47Å; S25-Y51 PolarHBondContact N-OH 3.21Å; S25-Y51 PolarHBondContact OG-OH 3.11Å
26	D	90.6	Very high	91.8	Very high	58 Å²	58	23.2 Å²	23.2	31%	0.31	13%	0.134	S	C	.	.	H	α-helix	trans	-57.8	-42.2	177.3	-80.5	-20.7	0	0	0	112.4	E22 E23 H28 G29 R359	E22-D26 WeakPolarHBondContact O-CB 3.38Å; E22-D26 PolarHBondContact O-N 3.5Å; E23-D26 PolarHBondContact O-N 2.77Å; D26-H28 VanDerWaalsContact C-N 3.34Å; D26-H28 PolarHBondContact O-N 2.82Å; D26-G29 PolarHBondContact O-N 3.25Å; D26-R359 IonicContact OD1-NH1 3.24Å; D26-R359 PolarHBondContact OD1-NH1 3.01Å; D26-R359 VanDerWaalsContact OD1-NH1 3.11Å; D26-R359 IonicContact OD2-CZ 2.77Å; D26-R359 IonicContact OD2-NH1 3.2Å; D26-R359 PolarHBondContact OD2-NH1 3.07Å
27	E	90.6	Very high	91.6	Very high	10 Å²	10	27.9 Å²	27.9	5%	0.047	16%	0.162	C	C	.	.	H	α-helix	trans	-65.7	-33.6	176.9	-73.4	-172.8	-176.6	0	0	113.6	E23 I24 S25 Q43 S234 R241 F242 R318	E23-E27 WeakPolarHBondContact O-CG 3.34Å; E23-E27 PolarHBondContact O-N 2.92Å; I24-E27 PolarHBondContact O-N 3.12Å; S25-E27 VanDerWaalsContact C-N 3.31Å; S25-E27 PolarHBondContact O-N 3.28Å; E27-Q43 WeakPolarHBondContact O-CG 3.35Å; E27-Q43 PolarHBondContact O-NE2 3.19Å; E27-S234 VanDerWaalsContact CD-OG 3.23Å; E27-S234 PolarHBondContact OE1-OG 3.33Å; E27-S234 PolarHBondContact OE2-OG 2.97Å; E27-R241 IonicContact OE1-NH2 3.52Å; E27-R241 IonicContact OE2-CZ 2.9Å; E27-R241 IonicContact OE2-NH1 3.06Å; E27-R241 PolarHBondContact OE2-NH1 3.04Å; E27-R241 IonicContact OE2-NH2 2.68Å; E27-R241 PolarHBondContact OE2-NH2 2.76Å; E27-F242 HydrophobicContact CB-CZ 4.14Å; E27-F242 WeakPolarHBondContact OE2-CE2 3.29Å; E27-R318 IonicContact OE1-CZ 2.77Å; E27-R318 IonicContact OE1-NH1 2.7Å; E27-R318 PolarHBondContact OE1-NH1 2.8Å; E27-R318 IonicContact OE1-NH2 2.82Å; E27-R318 PolarHBondContact OE1-NH2 2.84Å; E27-R318 IonicContact OE2-CZ 2.95Å; E27-R318 IonicContact OE2-NH1 3.9Å; E27-R318 PolarHBondContact OE2-NH1 3.41Å; E27-R318 IonicContact OE2-NH2 3.38Å; E27-R318 PolarHBondContact OE2-NH2 3.32Å
28	H	90.9	Very high	91.1	Very high	2 Å²	2	29 Å²	29	1%	0.009	17%	0.174	C	C	.	.	T	Hydrogen-bonded Turn	trans	-88.9	2	178.1	-76.9	-74.3	0	0	0	113.7	I24 S25 D26 V30 Y36 Q43 I47 R241 F242	I24-H28 WeakPolarHBondContact O-CB 3.24Å; I24-H28 PolarHBondContact O-CD2 3.31Å; I24-H28 PolarHBondContact O-N 3.46Å; S25-H28 CarbonylContact O-C 3.48Å; S25-H28 PolarHBondContact O-N 3.5Å; S25-H28 VanDerWaalsContact O-N 3.11Å; D26-H28 VanDerWaalsContact C-N 3.34Å; D26-H28 PolarHBondContact O-N 2.82Å; H28-V30 PolarHBondContact O-N 3.03Å; H28-Y36 VanDerWaalsContact O-CD2 3.29Å; H28-Y36 WeakPolarHBondContact O-CD2 3.42Å; H28-Y36 WeakPolarHBondContact O-CE2 3.42Å; H28-Q43 PolarHBondContact ND1-O 3.14Å; H28-I47 HydrophobicContact CB-CD1 4.31Å; H28-R241 PolarHBondContact CE1-O 2.98Å; H28-R241 PolarHBondContact NE2-NH1 2.82Å; H28-F242 AromaticContact CE1-CE1 3.69Å; H28-F242 AromaticContact CE1-CZ 3.94Å; H28-F242 AromaticContact ND1-CE1 3.97Å
29	G	90.4	Very high	90.7	Very high	10 Å²	10	35.8 Å²	35.8	10%	0.103	21%	0.21	C	C	.	.	T	Hydrogen-bonded Turn	trans	68.2	24.4	-174.4	0	0	0	0	0	113.4	S25 D26 Y36 V37	S25-G29 PolarHBondContact O-N 3.03Å; D26-G29 PolarHBondContact O-N 3.25Å; G29-Y36 WeakPolarHBondContact O-CA 3.45Å; G29-V37 WeakPolarHBondContact O-CG2 3.37Å; G29-V37 PolarHBondContact O-N 3.33Å
30	V	92	Very high	90.2	Very high	3 Å²	3	34 Å²	34	2%	0.018	21%	0.207	C	C	.	.	B	Isolated β-bridge	trans	-59.9	99.2	168.3	-150.8	0	0	0	0	116.1	S25 H28 Y36 I47 Y59 F81 L84	S25-V30 VanDerWaalsContact O-CA 3.29Å; S25-V30 WeakPolarHBondContact O-CA 3.25Å; S25-V30 PolarHBondContact O-N 3.11Å; H28-V30 PolarHBondContact O-N 3.03Å; V30-Y36 HydrophobicContact CG2-CD2 4.46Å; V30-I47 HydrophobicContact CG2-CD1 3.99Å; V30-Y59 HydrophobicContact CG2-CD2 4.05Å; V30-Y59 HydrophobicContact CG2-CG 4.39Å; V30-F81 WeakPolarHBondContact O-CE1 3.32Å; V30-L84 HydrophobicContact CG1-CD1 4.43Å
31	D	91.1	Very high	89.7	Confident	46 Å²	46	38 Å²	38	25%	0.246	24%	0.24	C	C	.	.			trans	-77.3	164.6	170	85.2	6.3	0	0	0	112.9	A33 G34 S35 V37	D31-A33 PolarHBondContact O-N 3.38Å; D31-A33 VanDerWaalsContact O-N 3.09Å; D31-A33 VanDerWaalsContact OD1-C 3.29Å; D31-A33 VanDerWaalsContact OD1-CA 3.26Å; D31-A33 WeakPolarHBondContact OD1-CA 3.29Å; D31-A33 WeakPolarHBondContact OD1-CB 3.44Å; D31-A33 PolarHBondContact OD1-N 3.31Å; D31-G34 PolarHBondContact O-N 2.81Å; D31-G34 PolarHBondContact OD1-N 3.32Å; D31-S35 PolarHBondContact N-O 2.77Å; D31-S35 PolarHBondContact OD1-N 3.24Å; D31-V37 HydrophobicContact CB-CG1 4.35Å; D31-V37 HydrophobicContact CB-CG2 4.09Å
32	A	88.7	Confident	89.2	Confident	39 Å²	39	41.7 Å²	41.7	32%	0.322	26%	0.26	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.8	-12.7	179.5	0	0	0	0	0	114.4	A80 F81	A32-A80 WeakPolarHBondContact CB-O 3.11Å; A32-F81 HydrophobicContact CB-CD1 4.22Å; A32-F81 HydrophobicContact CB-CE1 4.39Å
33	A	86.9	Confident	88.9	Confident	58 Å²	58	41.2 Å²	41.2	48%	0.479	26%	0.257	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.1	-1.9	173.9	0	0	0	0	0	112.8	D31	D31-A33 PolarHBondContact O-N 3.38Å; D31-A33 VanDerWaalsContact O-N 3.09Å; D31-A33 VanDerWaalsContact OD1-C 3.29Å; D31-A33 VanDerWaalsContact OD1-CA 3.26Å; D31-A33 WeakPolarHBondContact OD1-CA 3.29Å; D31-A33 WeakPolarHBondContact OD1-CB 3.44Å; D31-A33 PolarHBondContact OD1-N 3.31Å
34	G	87.8	Confident	88.8	Confident	2 Å²	2	42.6 Å²	42.6	2%	0.021	27%	0.265	C	S	.	.	S	Bend	trans	83.8	9.4	-177.6	0	0	0	0	0	114.1	D31 K58 Y59	D31-G34 PolarHBondContact O-N 2.81Å; D31-G34 PolarHBondContact OD1-N 3.32Å; G34-K58 CarbonylContact O-C 3.58Å; G34-K58 VanDerWaalsContact O-CA 3.25Å; G34-K58 WeakPolarHBondContact O-CA 3.29Å; G34-Y59 PolarHBondContact O-N 3.41Å
35	S	91	Very high	88.4	Confident	43 Å²	43	47.3 Å²	47.3	30%	0.301	29%	0.29	S	S	.	.	B	Isolated β-bridge	trans	-88.7	141.1	179.8	-45	0	0	0	0	110.4	D31 V37	D31-S35 PolarHBondContact N-O 2.77Å; D31-S35 PolarHBondContact OD1-N 3.24Å; S35-V37 PolarHBondContact O-N 3.13Å
36	Y	91.9	Very high	88.1	Confident	64 Å²	64	49.9 Å²	49.9	25%	0.251	30%	0.3	S	S	.	.	B	Isolated β-bridge	trans	-77.9	120.7	173.8	176.8	-101.6	0	0	0	110.7	H28 G29 V30 G38 S40 Q43 L44	H28-Y36 VanDerWaalsContact O-CD2 3.29Å; H28-Y36 WeakPolarHBondContact O-CD2 3.42Å; H28-Y36 WeakPolarHBondContact O-CE2 3.42Å; G29-Y36 WeakPolarHBondContact O-CA 3.45Å; V30-Y36 HydrophobicContact CG2-CD2 4.46Å; Y36-G38 WeakPolarHBondContact CE1-O 3.48Å; Y36-G38 VanDerWaalsContact CZ-CA 3.41Å; Y36-G38 VanDerWaalsContact OH-C 3.25Å; Y36-G38 WeakPolarHBondContact OH-CA 3.43Å; Y36-S40 PolarHBondContact OH-N 3.35Å; Y36-S40 PolarHBondContact OH-O 2.95Å; Y36-Q43 HydrophobicContact CE2-CB 4.03Å; Y36-Q43 PolarHBondContact OH-OE1 3.21Å; Y36-L44 HydrophobicContact CD1-CD1 4Å; Y36-L44 HydrophobicContact CD1-CD2 4.38Å; Y36-L44 HydrophobicContact CD1-CG 4.47Å; Y36-L44 HydrophobicContact CD2-CD1 4.45Å; Y36-L44 HydrophobicContact CD2-CD2 3.5Å; Y36-L44 HydrophobicContact CD2-CG 4.06Å; Y36-L44 HydrophobicContact CE1-CD1 3.79Å; Y36-L44 HydrophobicContact CE1-CG 4.21Å; Y36-L44 HydrophobicContact CE2-CD1 4.27Å; Y36-L44 HydrophobicContact CE2-CD2 3.71Å; Y36-L44 HydrophobicContact CE2-CG 3.77Å; Y36-L44 HydrophobicContact CG-CD1 4.31Å; Y36-L44 HydrophobicContact CG-CD2 3.86Å; Y36-L44 HydrophobicContact CG-CG 4.39Å
37	V	89.6	Confident	88.1	Confident	102 Å²	102	47.6 Å²	47.6	62%	0.618	29%	0.288	S	S	*	.			trans	-121.1	15.4	176.3	-63.9	0	0	0	0	111.9	G29 D31 S35	G29-V37 WeakPolarHBondContact O-CG2 3.37Å; G29-V37 PolarHBondContact O-N 3.33Å; D31-V37 HydrophobicContact CB-CG1 4.35Å; D31-V37 HydrophobicContact CB-CG2 4.09Å; S35-V37 PolarHBondContact O-N 3.13Å
38	G	84.3	Confident	88.2	Confident	24 Å²	24	49.3 Å²	49.3	25%	0.247	30%	0.297	C	S	.	.			trans	-73.7	169.6	-179.9	0	0	0	0	0	113.9	Y36	Y36-G38 WeakPolarHBondContact CE1-O 3.48Å; Y36-G38 VanDerWaalsContact CZ-CA 3.41Å; Y36-G38 VanDerWaalsContact OH-C 3.25Å; Y36-G38 WeakPolarHBondContact OH-CA 3.43Å
39	D	84.4	Confident	88.2	Confident	154 Å²	154	49.5 Å²	49.5	82%	0.824	30%	0.298	S	S	*	.	S	Bend	trans	-113.2	-11.9	-173.6	59.3	-18.1	0	0	0	113.5	Q43	D39-Q43 PolarHBondContact OD1-NE2 3.48Å
40	S	84	Confident	88.4	Confident	38 Å²	38	49.1 Å²	49.1	27%	0.266	29%	0.294	S	S	.	.			trans	-122.8	127	-173.9	179.4	0	0	0	0	112.9	Y36 L42 Q43	Y36-S40 PolarHBondContact OH-N 3.35Å; Y36-S40 PolarHBondContact OH-O 2.95Å; S40-L42 PolarHBondContact O-N 3.31Å; S40-L42 VanDerWaalsContact O-N 3.13Å; S40-L42 PolarHBondContact OG-N 2.84Å; S40-Q43 VanDerWaalsContact O-CB 3.28Å; S40-Q43 WeakPolarHBondContact O-CB 3.45Å; S40-Q43 PolarHBondContact O-N 3.39Å; S40-Q43 PolarHBondContact O-OE1 3.42Å
41	A	84.1	Confident	88.5	Confident	84 Å²	84	49.1 Å²	49.1	69%	0.694	29%	0.294	S	S	*	.	G	3₁₀ helix	trans	-59	-26.8	176	0	0	0	0	0	113.3	Q43 L44 D45	A41-Q43 PolarHBondContact O-N 2.77Å; A41-L44 PolarHBondContact O-N 2.74Å; A41-L44 VanDerWaalsContact O-N 3.08Å; A41-D45 PolarHBondContact O-N 3.31Å
42	L	84.9	Confident	88.5	Confident	79 Å²	79	47.9 Å²	47.9	41%	0.414	29%	0.287	S	S	.	.	G	3₁₀ helix	trans	-65.5	-21.6	177.2	-63.6	174.6	0	0	0	112.8	S40 L44 P243 I356	S40-L42 PolarHBondContact O-N 3.31Å; S40-L42 VanDerWaalsContact O-N 3.13Å; S40-L42 PolarHBondContact OG-N 2.84Å; L42-L44 VanDerWaalsContact C-N 3.26Å; L42-L44 PolarHBondContact O-N 2.96Å; L42-P243 HydrophobicContact CD2-CG 3.9Å; L42-I356 HydrophobicContact CB-CD1 3.71Å; L42-I356 HydrophobicContact CD1-CD1 4.28Å
43	Q	86.8	Confident	88.5	Confident	20 Å²	20	52 Å²	52	9%	0.093	30%	0.299	C	S	.	.	G	3₁₀ helix	trans	-68.9	-27	174.3	-67.1	165.4	-27.5	0	0	112.1	E27 H28 Y36 D39 S40 A41	E27-Q43 WeakPolarHBondContact O-CG 3.35Å; E27-Q43 PolarHBondContact O-NE2 3.19Å; H28-Q43 PolarHBondContact ND1-O 3.14Å; Y36-Q43 HydrophobicContact CE2-CB 4.03Å; Y36-Q43 PolarHBondContact OH-OE1 3.21Å; D39-Q43 PolarHBondContact OD1-NE2 3.48Å; S40-Q43 VanDerWaalsContact O-CB 3.28Å; S40-Q43 WeakPolarHBondContact O-CB 3.45Å; S40-Q43 PolarHBondContact O-N 3.39Å; S40-Q43 PolarHBondContact O-OE1 3.42Å; A41-Q43 PolarHBondContact O-N 2.77Å
44	L	88.1	Confident	88.3	Confident	58 Å²	58	51.1 Å²	51.1	30%	0.304	29%	0.292	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93.4	-19.6	-178.2	-67.2	178.7	0	0	0	113.3	Y36 A41 L42 R46 I47 Y59	Y36-L44 HydrophobicContact CD1-CD1 4Å; Y36-L44 HydrophobicContact CD1-CD2 4.38Å; Y36-L44 HydrophobicContact CD1-CG 4.47Å; Y36-L44 HydrophobicContact CD2-CD1 4.45Å; Y36-L44 HydrophobicContact CD2-CD2 3.5Å; Y36-L44 HydrophobicContact CD2-CG 4.06Å; Y36-L44 HydrophobicContact CE1-CD1 3.79Å; Y36-L44 HydrophobicContact CE1-CG 4.21Å; Y36-L44 HydrophobicContact CE2-CD1 4.27Å; Y36-L44 HydrophobicContact CE2-CD2 3.71Å; Y36-L44 HydrophobicContact CE2-CG 3.77Å; Y36-L44 HydrophobicContact CG-CD1 4.31Å; Y36-L44 HydrophobicContact CG-CD2 3.86Å; Y36-L44 HydrophobicContact CG-CG 4.39Å; A41-L44 PolarHBondContact O-N 2.74Å; A41-L44 VanDerWaalsContact O-N 3.08Å; L42-L44 VanDerWaalsContact C-N 3.26Å; L42-L44 PolarHBondContact O-N 2.96Å; L44-R46 VanDerWaalsContact C-N 3.28Å; L44-R46 PolarHBondContact O-N 3.48Å; L44-I47 HydrophobicContact CD2-CD1 3.78Å; L44-I47 HydrophobicContact CD2-CG2 4.41Å; L44-I47 WeakPolarHBondContact O-CG2 3.22Å; L44-I47 PolarHBondContact O-N 2.96Å; L44-Y59 HydrophobicContact CD2-CE2 4.14Å
45	D	85.2	Confident	87.7	Confident	99 Å²	99	57.5 Å²	57.5	53%	0.529	34%	0.337	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58	-36.7	-171.1	-169.4	54.1	0	0	0	113.7	A41 P243	A41-D45 PolarHBondContact O-N 3.31Å; D45-P243 HydrophobicContact CB-CG 4.36Å; D45-P243 WeakPolarHBondContact OD2-CG 3.43Å
46	R	87.8	Confident	87	Confident	54 Å²	54	58.7 Å²	58.7	20%	0.204	35%	0.345	C	S	.	.	T	Hydrogen-bonded Turn	trans	-128.2	27	178.2	-64.3	-172.2	-178.9	179.9	1.3	113.7	L44 N48 V49 S239 L240 R241 N247	L44-R46 VanDerWaalsContact C-N 3.28Å; L44-R46 PolarHBondContact O-N 3.48Å; R46-N48 PolarHBondContact O-N 2.85Å; R46-V49 HydrophobicContact CB-CG2 4.09Å; R46-V49 WeakPolarHBondContact O-CB 3.25Å; R46-V49 WeakPolarHBondContact O-CG2 2.93Å; R46-V49 PolarHBondContact O-N 3.18Å; R46-S239 PolarHBondContact NH1-O 3.01Å; R46-L240 VanDerWaalsContact CD-O 3.31Å; R46-L240 WeakPolarHBondContact CD-O 3.34Å; R46-R241 WeakPolarHBondContact CB-O 3.45Å; R46-N247 PolarHBondContact NH2-OD1 3.2Å
47	I	90.4	Very high	86.5	Confident	10 Å²	10	62.3 Å²	62.3	5%	0.051	36%	0.364	C	S	.	.	G	3₁₀ helix	trans	-61.4	-28.8	178.5	-162.9	163.4	0	0	0	112.1	H28 V30 L44 V49 Y50 Y51 Y59	H28-I47 HydrophobicContact CB-CD1 4.31Å; V30-I47 HydrophobicContact CG2-CD1 3.99Å; L44-I47 HydrophobicContact CD2-CD1 3.78Å; L44-I47 HydrophobicContact CD2-CG2 4.41Å; L44-I47 WeakPolarHBondContact O-CG2 3.22Å; L44-I47 PolarHBondContact O-N 2.96Å; I47-V49 PolarHBondContact O-N 3.42Å; I47-V49 VanDerWaalsContact O-N 3.13Å; I47-Y50 PolarHBondContact O-N 3.44Å; I47-Y51 HydrophobicContact CD1-CD2 4.42Å; I47-Y51 HydrophobicContact CG1-CD2 3.61Å; I47-Y51 HydrophobicContact CG1-CE2 4.37Å; I47-Y51 HydrophobicContact CG1-CG 4.08Å; I47-Y51 WeakPolarHBondContact O-CB 3.46Å; I47-Y51 WeakPolarHBondContact O-CD2 3.37Å; I47-Y51 PolarHBondContact O-N 3.37Å; I47-Y59 HydrophobicContact CD1-CD1 3.66Å; I47-Y59 HydrophobicContact CD1-CD2 4.06Å; I47-Y59 HydrophobicContact CD1-CE1 3.81Å; I47-Y59 HydrophobicContact CD1-CE2 4.2Å; I47-Y59 HydrophobicContact CD1-CG 3.78Å; I47-Y59 HydrophobicContact CG1-CD1 4Å; I47-Y59 HydrophobicContact CG1-CE1 4.22Å; I47-Y59 HydrophobicContact CG1-CG 4.48Å; I47-Y59 HydrophobicContact CG2-CD1 4.1Å; I47-Y59 HydrophobicContact CG2-CE1 3.56Å
48	N	91.1	Very high	86.4	Confident	47 Å²	47	61.8 Å²	61.8	25%	0.251	35%	0.353	S	S	.	.	G	3₁₀ helix	trans	-63.6	-15.9	178.9	66	-48.4	0	0	0	114.3	R46 Y50 Y51	R46-N48 PolarHBondContact O-N 2.85Å; N48-Y50 VanDerWaalsContact C-N 3.3Å; N48-Y50 PolarHBondContact O-N 3.09Å; N48-Y51 WeakPolarHBondContact CA-O 3.28Å
49	V	91.9	Very high	86.8	Confident	5 Å²	5	61.6 Å²	61.6	3%	0.03	35%	0.346	C	S	.	.	G	3₁₀ helix	trans	-60.5	-42.6	177.2	175.9	0	0	0	0	110.9	I4 R46 I47 L240	I4-V49 HydrophobicContact CD1-CG1 3.73Å; I4-V49 HydrophobicContact CG1-CG1 4.07Å; I4-V49 PolarHBondContact N-O 3.23Å; R46-V49 HydrophobicContact CB-CG2 4.09Å; R46-V49 WeakPolarHBondContact O-CB 3.25Å; R46-V49 WeakPolarHBondContact O-CG2 2.93Å; R46-V49 PolarHBondContact O-N 3.18Å; I47-V49 PolarHBondContact O-N 3.42Å; I47-V49 VanDerWaalsContact O-N 3.13Å; V49-L240 HydrophobicContact CG1-CB 4.36Å
50	Y	94.4	Very high	87.3	Confident	2 Å²	2	55.6 Å²	55.6	1%	0.008	31%	0.314	C	S	.	.	T	Hydrogen-bonded Turn	trans	-114.6	-20.1	-177.8	-79.9	-80.9	0	0	0	113.8	I4 F20 W21 I24 I47 N48 R62 Q134 T237 R241	I4-Y50 HydrophobicContact CB-CE1 4.35Å; I4-Y50 HydrophobicContact CD1-CE2 4.25Å; I4-Y50 HydrophobicContact CG2-CE1 4.15Å; F20-Y50 HydrophobicContact CE1-CD1 4.3Å; F20-Y50 HydrophobicContact CE1-CE1 4Å; F20-Y50 HydrophobicContact CZ-CD1 4.42Å; F20-Y50 AromaticContact CZ-CE1 3.9Å; F20-Y50 HydrophobicContact CZ-CE1 3.9Å; W21-Y50 AromaticContact CH2-CD1 3.78Å; W21-Y50 HydrophobicContact CH2-CD1 3.78Å; W21-Y50 HydrophobicContact CH2-CG 4.24Å; W21-Y50 VanDerWaalsContact CH2-O 3.29Å; W21-Y50 WeakPolarHBondContact CH2-O 3.47Å; W21-Y50 HydrophobicContact CZ2-CD1 4.33Å; W21-Y50 HydrophobicContact CZ3-CD1 4.41Å; I24-Y50 HydrophobicContact CD1-CD1 4.38Å; I24-Y50 HydrophobicContact CD1-CG 4.14Å; I47-Y50 PolarHBondContact O-N 3.44Å; N48-Y50 VanDerWaalsContact C-N 3.3Å; N48-Y50 PolarHBondContact O-N 3.09Å; Y50-R62 VanDerWaalsContact O-CB 3.32Å; Y50-R62 WeakPolarHBondContact O-CB 3.47Å; Y50-R62 PolarHBondContact O-N 3.26Å; Y50-Q134 PolarHBondContact OH-OE1 2.97Å; Y50-T237 WeakPolarHBondContact OH-CG2 3.32Å; Y50-R241 HydrophobicContact CD2-CG 3.58Å; Y50-R241 HydrophobicContact CE2-CG 3.6Å
51	Y	94.4	Very high	87.8	Confident	4 Å²	4	53.8 Å²	53.8	2%	0.016	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	138.8	-176.6	-63.5	-92.3	0	0	0	112.4	W21 I24 S25 I47 N48 V60 P61 L84	W21-Y51 HydrophobicContact CE3-CE1 4.18Å; W21-Y51 AromaticContact CE3-CZ 3.97Å; W21-Y51 HydrophobicContact CZ3-CD1 4.45Å; W21-Y51 AromaticContact CZ3-CE1 3.98Å; W21-Y51 HydrophobicContact CZ3-CE1 3.98Å; W21-Y51 HydrophobicContact CZ3-CE2 4.15Å; W21-Y51 AromaticContact CZ3-CZ 3.8Å; I24-Y51 HydrophobicContact CD1-CE2 4.28Å; S25-Y51 VanDerWaalsContact CA-OH 3.25Å; S25-Y51 WeakPolarHBondContact CA-OH 3.47Å; S25-Y51 PolarHBondContact N-OH 3.21Å; S25-Y51 PolarHBondContact OG-OH 3.11Å; I47-Y51 HydrophobicContact CD1-CD2 4.42Å; I47-Y51 HydrophobicContact CG1-CD2 3.61Å; I47-Y51 HydrophobicContact CG1-CE2 4.37Å; I47-Y51 HydrophobicContact CG1-CG 4.08Å; I47-Y51 WeakPolarHBondContact O-CB 3.46Å; I47-Y51 WeakPolarHBondContact O-CD2 3.37Å; I47-Y51 PolarHBondContact O-N 3.37Å; N48-Y51 WeakPolarHBondContact CA-O 3.28Å; Y51-V60 CarbonylContact C-O 3.54Å; Y51-V60 WeakPolarHBondContact CA-O 3.46Å; Y51-P61 HydrophobicContact CD1-CG 4.28Å; Y51-P61 HydrophobicContact CE1-CG 3.95Å; Y51-L84 HydrophobicContact CE1-CD2 4.38Å
52	N	91.5	Very high	88.3	Confident	20 Å²	20	50 Å²	50	11%	0.107	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.8	130.9	164.5	-71.4	-35.3	0	0	0	109.9	A54 Y59 V60 R62 E123	N52-A54 PolarHBondContact O-N 2.94Å; N52-Y59 WeakPolarHBondContact O-CA 3.42Å; N52-V60 PolarHBondContact N-O 3.09Å; N52-V60 PolarHBondContact O-N 3.46Å; N52-R62 PolarHBondContact OD1-NE 2.78Å; N52-R62 PolarHBondContact OD1-NH1 2.79Å; N52-R62 PolarHBondContact OD1-NH2 2.82Å; N52-E123 PolarHBondContact ND2-OE2 2.73Å
53	Q	87.5	Confident	88.8	Confident	124 Å²	124	46.2 Å²	46.2	58%	0.579	25%	0.25	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-86.7	110.3	172.4	-171.7	176.1	1.2	0	0	109.9	Y59	Q53-Y59 HydrophobicContact CB-CE1 4.33Å; Q53-Y59 HydrophobicContact CG-CE1 4.25Å
54	A	84.1	Confident	89.3	Confident	40 Å²	40	45.3 Å²	45.3	33%	0.331	25%	0.245	S	C	.	.			trans	-82.6	165.3	175.5	0	0	0	0	0	112	N52 S56 H57 K58 V60	N52-A54 PolarHBondContact O-N 2.94Å; A54-S56 PolarHBondContact O-N 3.33Å; A54-H57 PolarHBondContact O-N 3.5Å; A54-K58 HydrophobicContact CB-CB 4.42Å; A54-K58 PolarHBondContact N-O 3.2Å; A54-V60 HydrophobicContact CB-CG2 4.48Å
55	S	74.4	Confident	89.6	Confident	136 Å²	136	42.5 Å²	42.5	95%	0.951	23%	0.231	S	C	*	.	T	Hydrogen-bonded Turn	trans	-60.4	-4.8	-173.9	50.9	0	0	0	0	116.2
56	S	75.8	Confident	90.1	Very high	69 Å²	69	37.9 Å²	37.9	48%	0.483	21%	0.206	S	C	.	.	T	Hydrogen-bonded Turn	trans	-116.4	27.9	178.9	68.7	0	0	0	0	113.7	A54 K58	A54-S56 PolarHBondContact O-N 3.33Å; S56-K58 PolarHBondContact O-N 3.05Å; S56-K58 VanDerWaalsContact O-N 3.1Å; S56-K58 WeakPolarHBondContact OG-CD 3.45Å; S56-K58 VanDerWaalsContact OG-CG 3.24Å; S56-K58 WeakPolarHBondContact OG-CG 3.33Å
57	H	80.8	Confident	90.5	Very high	140 Å²	140	35.4 Å²	35.4	65%	0.648	20%	0.197	S	C	*	.	S	Bend	trans	53.2	29.5	-171.3	-63.7	-79.8	0	0	0	113.3	A54	A54-H57 PolarHBondContact O-N 3.5Å
58	K	89.4	Confident	90.6	Very high	90 Å²	90	35 Å²	35	39%	0.391	20%	0.195	S	C	.	.	B	Isolated β-bridge	trans	-96.1	135.6	174.1	-74.9	-176.4	-178.6	-164.8	0	109.7	G34 A54 S56	G34-K58 CarbonylContact O-C 3.58Å; G34-K58 VanDerWaalsContact O-CA 3.25Å; G34-K58 WeakPolarHBondContact O-CA 3.29Å; A54-K58 HydrophobicContact CB-CB 4.42Å; A54-K58 PolarHBondContact N-O 3.2Å; S56-K58 PolarHBondContact O-N 3.05Å; S56-K58 VanDerWaalsContact O-N 3.1Å; S56-K58 WeakPolarHBondContact OG-CD 3.45Å; S56-K58 VanDerWaalsContact OG-CG 3.24Å; S56-K58 WeakPolarHBondContact OG-CG 3.33Å
59	Y	92.5	Very high	90.4	Very high	21 Å²	21	36.6 Å²	36.6	8%	0.082	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.2	122	175.1	-63.6	-78.3	0	0	0	108.7	V30 G34 L44 I47 N52 Q53 L84	V30-Y59 HydrophobicContact CG2-CD2 4.05Å; V30-Y59 HydrophobicContact CG2-CG 4.39Å; G34-Y59 PolarHBondContact O-N 3.41Å; L44-Y59 HydrophobicContact CD2-CE2 4.14Å; I47-Y59 HydrophobicContact CD1-CD1 3.66Å; I47-Y59 HydrophobicContact CD1-CD2 4.06Å; I47-Y59 HydrophobicContact CD1-CE1 3.81Å; I47-Y59 HydrophobicContact CD1-CE2 4.2Å; I47-Y59 HydrophobicContact CD1-CG 3.78Å; I47-Y59 HydrophobicContact CG1-CD1 4Å; I47-Y59 HydrophobicContact CG1-CE1 4.22Å; I47-Y59 HydrophobicContact CG1-CG 4.48Å; I47-Y59 HydrophobicContact CG2-CD1 4.1Å; I47-Y59 HydrophobicContact CG2-CE1 3.56Å; N52-Y59 WeakPolarHBondContact O-CA 3.42Å; Q53-Y59 HydrophobicContact CB-CE1 4.33Å; Q53-Y59 HydrophobicContact CG-CE1 4.25Å; Y59-L84 WeakPolarHBondContact O-CD1 3.3Å
60	V	93.3	Very high	90.2	Very high	27 Å²	27	39.1 Å²	39.1	16%	0.164	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115	125.9	179.5	-179.7	0	0	0	0	108.3	Y51 N52 A54 R62 R86	Y51-V60 CarbonylContact C-O 3.54Å; Y51-V60 WeakPolarHBondContact CA-O 3.46Å; N52-V60 PolarHBondContact N-O 3.09Å; N52-V60 PolarHBondContact O-N 3.46Å; A54-V60 HydrophobicContact CB-CG2 4.48Å; V60-R62 PolarHBondContact O-N 3.25Å; V60-R86 HydrophobicContact CG1-CB 4.19Å
61	P	94.8	Very high	89.9	Confident	0 Å²	0	41 Å²	41	0%	0	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-50.8	131.5	174.8	-32	37.4	0	0	0	112.4	W21 Y51 S63 L84 F85	W21-P61 HydrophobicContact CD2-CB 3.89Å; W21-P61 HydrophobicContact CD2-CG 4.22Å; W21-P61 HydrophobicContact CE3-CB 3.69Å; W21-P61 HydrophobicContact CE3-CG 3.83Å; W21-P61 HydrophobicContact CH2-CB 3.68Å; W21-P61 HydrophobicContact CZ2-CB 3.86Å; W21-P61 HydrophobicContact CZ3-CB 3.58Å; W21-P61 HydrophobicContact CZ3-CG 4.05Å; Y51-P61 HydrophobicContact CD1-CG 4.28Å; Y51-P61 HydrophobicContact CE1-CG 3.95Å; P61-S63 PolarHBondContact O-N 3.05Å; P61-L84 VanDerWaalsContact CD-CG 3.44Å; P61-L84 WeakPolarHBondContact CD-O 3.42Å; P61-L84 HydrophobicContact CG-CD2 3.58Å; P61-L84 HydrophobicContact CG-CG 3.65Å; P61-F85 HydrophobicContact CB-CD1 4.01Å; P61-F85 HydrophobicContact CB-CE1 4.04Å; P61-F85 HydrophobicContact CG-CD1 4.12Å; P61-F85 HydrophobicContact CG-CE1 4.14Å
62	R	95.2	Very high	89.5	Confident	5 Å²	5	41.5 Å²	41.5	2%	0.019	24%	0.241	C	C	.	.			trans	-80.8	70.7	167.9	-170.2	-179	-68.8	-86.8	21.9	108.9	I4 V5 H6 Y50 N52 V60 E123 H126 C127	I4-R62 WeakPolarHBondContact O-CD 3.44Å; V5-R62 HydrophobicContact CG2-CG 4.07Å; H6-R62 PolarHBondContact N-O 2.8Å; Y50-R62 VanDerWaalsContact O-CB 3.32Å; Y50-R62 WeakPolarHBondContact O-CB 3.47Å; Y50-R62 PolarHBondContact O-N 3.26Å; N52-R62 PolarHBondContact OD1-NE 2.78Å; N52-R62 PolarHBondContact OD1-NH1 2.79Å; N52-R62 PolarHBondContact OD1-NH2 2.82Å; V60-R62 PolarHBondContact O-N 3.25Å; R62-E123 PolarHBondContact NH1-O 3.21Å; R62-E123 IonicContact NH1-OE2 2.95Å; R62-E123 PolarHBondContact NH1-OE2 3.34Å; R62-H126 PolarHBondContact NH2-O 3.29Å; R62-C127 PolarHBondContact NH1-SG 2.88Å; R62-C127 PolarHBondContact NH2-SG 2.84Å; R62-C127 VanDerWaalsContact NH2-SG 3.42Å
63	S	95.2	Very high	89.4	Confident	0 Å²	0	40.7 Å²	40.7	0%	0	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	143.7	-176.7	61.4	0	0	0	0	112.3	H6 P61 F85 N89	H6-S63 CarbonylContact O-C 3.58Å; H6-S63 WeakPolarHBondContact O-CA 3.38Å; P61-S63 PolarHBondContact O-N 3.05Å; S63-F85 WeakPolarHBondContact OG-CD1 3.33Å; S63-F85 WeakPolarHBondContact OG-CE1 3.26Å; S63-N89 VanDerWaalsContact O-CB 3.28Å; S63-N89 WeakPolarHBondContact O-CB 3.46Å; S63-N89 PolarHBondContact O-ND2 3.31Å
64	V	96.6	Very high	89.4	Confident	0 Å²	0	39.8 Å²	39.8	0%	0	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	124.8	168.6	-173.7	0	0	0	0	108.3	V5 H6 I7 Q8 V66 I91 V116 V119 V120 E123	V5-V64 HydrophobicContact CG1-CG2 4.5Å; H6-V64 PolarHBondContact O-N 2.92Å; I7-V64 WeakPolarHBondContact CA-O 3.26Å; I7-V64 HydrophobicContact CG1-CB 4.46Å; Q8-V64 PolarHBondContact N-O 3.32Å; V64-V66 HydrophobicContact CG1-CG2 3.94Å; V64-I91 HydrophobicContact CG1-CD1 3.78Å; V64-V116 HydrophobicContact CG1-CG1 4.44Å; V64-V119 HydrophobicContact CG1-CG1 4.13Å; V64-V119 HydrophobicContact CG2-CG1 3.96Å; V64-V120 HydrophobicContact CG1-CG2 4.48Å; V64-V120 HydrophobicContact CG2-CG2 4.09Å; V64-E123 HydrophobicContact CG2-CG 4.38Å
65	L	96.4	Very high	89.6	Confident	0 Å²	0	41.8 Å²	41.8	0%	0	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	122.3	-178.2	-66	89.5	0	0	0	108.8	M73 V76 F85 N89 F90 I91	L65-M73 HydrophobicContact CB-CE 4.38Å; L65-M73 HydrophobicContact CB-SD 4.15Å; L65-V76 HydrophobicContact CD2-CB 4.46Å; L65-V76 HydrophobicContact CD2-CG1 3.68Å; L65-V76 HydrophobicContact CD2-CG2 4.46Å; L65-F85 HydrophobicContact CD1-CB 4.43Å; L65-F85 HydrophobicContact CD1-CD1 3.94Å; L65-F85 HydrophobicContact CD1-CE1 4.41Å; L65-F85 HydrophobicContact CD1-CG 4.18Å; L65-N89 PolarHBondContact N-O 2.91Å; L65-F90 HydrophobicContact CB-CD1 4.38Å; L65-F90 HydrophobicContact CD2-CD1 4.47Å; L65-F90 HydrophobicContact CD2-CE1 3.94Å; L65-F90 HydrophobicContact CD2-CZ 4.4Å; L65-I91 PolarHBondContact O-N 3Å
66	V	95.6	Very high	90.3	Very high	1 Å²	1	35.7 Å²	35.7	1%	0.006	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	128.5	-172.2	-171.5	0	0	0	0	109.6	I7 Q8 A9 G10 N14 V64 I91 V116 M147	I7-V66 HydrophobicContact CG2-CG2 4.48Å; Q8-V66 PolarHBondContact O-N 3.05Å; A9-V66 WeakPolarHBondContact CA-O 3.45Å; G10-V66 PolarHBondContact N-O 3.31Å; N14-V66 PolarHBondContact ND2-O 2.91Å; V64-V66 HydrophobicContact CG1-CG2 3.94Å; V66-I91 WeakPolarHBondContact CA-O 3.11Å; V66-V116 HydrophobicContact CB-CG2 4.45Å; V66-V116 HydrophobicContact CG1-CG2 3.7Å; V66-V116 HydrophobicContact CG2-CB 4.48Å; V66-V116 HydrophobicContact CG2-CG1 3.73Å; V66-V116 HydrophobicContact CG2-CG2 3.83Å; V66-M147 HydrophobicContact CG1-CE 3.47Å; V66-M147 VanDerWaalsContact CG1-CE 3.47Å; V66-M147 HydrophobicContact CG1-SD 3.69Å
67	D	95.2	Very high	90.9	Very high	3 Å²	3	37.7 Å²	37.7	2%	0.016	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153	147.2	167	-155.2	-17.7	0	0	0	110.5	Q11 E69 T72 M73 I91 F92 G93	Q11-D67 PolarHBondContact N-OD2 3.32Å; D67-E69 PolarHBondContact O-N 2.71Å; D67-E69 PolarHBondContact OD1-N 2.67Å; D67-T72 WeakPolarHBondContact OD2-CB 3.45Å; D67-T72 WeakPolarHBondContact OD2-CG2 3.39Å; D67-T72 PolarHBondContact OD2-OG1 2.94Å; D67-M73 HydrophobicContact CB-CE 3.3Å; D67-I91 PolarHBondContact N-O 3.41Å; D67-F92 CarbonylContact O-C 3.21Å; D67-F92 WeakPolarHBondContact O-CA 3.4Å; D67-F92 WeakPolarHBondContact O-CB 3.29Å; D67-G93 PolarHBondContact O-N 2.63Å
68	L	92.2	Very high	91.3	Very high	2 Å²	2	35.8 Å²	35.8	1%	0.01	20%	0.203	C	C	.	.	S	Bend	trans	-78.6	-14.4	173.6	-70.9	171.7	0	0	0	111.2	G93 T95 A97 E108 L112 T143 M147	L68-G93 CarbonylContact O-C 3.42Å; L68-G93 VanDerWaalsContact O-C 3.26Å; L68-G93 WeakPolarHBondContact O-CA 3.32Å; L68-T95 WeakPolarHBondContact CB-O 3.34Å; L68-T95 CarbonylContact O-C 3.54Å; L68-A97 HydrophobicContact CD1-CB 3.96Å; L68-E108 HydrophobicContact CD1-CB 4.19Å; L68-E108 HydrophobicContact CD2-CB 4.23Å; L68-L112 HydrophobicContact CD2-CB 4.24Å; L68-L112 HydrophobicContact CD2-CD2 3.82Å; L68-T143 HydrophobicContact CB-CG2 4.07Å; L68-T143 HydrophobicContact CD1-CG2 3.97Å; L68-T143 HydrophobicContact CG-CG2 3.77Å; L68-M147 HydrophobicContact CD1-SD 4.47Å; L68-M147 HydrophobicContact CD2-SD 4.19Å; L68-M147 HydrophobicContact CG-SD 4.1Å
69	E	87.8	Confident	91.1	Very high	79 Å²	79	32.8 Å²	32.8	37%	0.369	20%	0.198	S	C	.	.	S	Bend	trans	-105.1	129.8	176.9	-64.7	-175.9	177.5	0	0	112.4	D67 G71 G96	D67-E69 PolarHBondContact O-N 2.71Å; D67-E69 PolarHBondContact OD1-N 2.67Å; E69-G71 VanDerWaalsContact C-N 3.33Å; E69-G71 PolarHBondContact O-N 3.27Å; E69-G96 VanDerWaalsContact CG-CA 3.41Å
70	P	87.1	Confident	90.7	Very high	59 Å²	59	35.3 Å²	35.3	38%	0.383	22%	0.223	S	C	.	.	H	α-helix	trans	-70.1	-28.7	-178.9	26.8	-33.8	0	0	0	113.1	T72 M73 D74 F92	P70-T72 VanDerWaalsContact C-N 3.28Å; P70-T72 PolarHBondContact O-N 3.32Å; P70-M73 WeakPolarHBondContact O-CB 2.96Å; P70-M73 PolarHBondContact O-N 3.34Å; P70-D74 PolarHBondContact O-N 3.44Å; P70-F92 HydrophobicContact CB-CD2 4Å; P70-F92 HydrophobicContact CB-CE2 4.39Å
71	G	88.1	Confident	90.5	Very high	42 Å²	42	35 Å²	35	43%	0.433	22%	0.22	S	C	.	.	H	α-helix	trans	-63.9	-28.5	-173.6	0	0	0	0	0	114.5	E69 M73 S75	E69-G71 VanDerWaalsContact C-N 3.33Å; E69-G71 PolarHBondContact O-N 3.27Å; G71-M73 VanDerWaalsContact C-N 3.31Å; G71-M73 PolarHBondContact O-N 2.77Å; G71-S75 PolarHBondContact O-N 2.93Å; G71-S75 PolarHBondContact O-OG 3.03Å
72	T	86.4	Confident	90	Very high	13 Å²	13	35.2 Å²	35.2	8%	0.08	22%	0.221	C	C	.	.	H	α-helix	trans	-65.6	-37.4	174.7	-59.2	0	0	0	0	110.6	N14 D67 P70 S75 V76	N14-T72 HydrophobicContact CB-CG2 3.57Å; D67-T72 WeakPolarHBondContact OD2-CB 3.45Å; D67-T72 WeakPolarHBondContact OD2-CG2 3.39Å; D67-T72 PolarHBondContact OD2-OG1 2.94Å; P70-T72 VanDerWaalsContact C-N 3.28Å; P70-T72 PolarHBondContact O-N 3.32Å; T72-S75 WeakPolarHBondContact O-CB 3.41Å; T72-S75 PolarHBondContact O-N 3.35Å; T72-V76 WeakPolarHBondContact O-CG2 3.31Å; T72-V76 PolarHBondContact O-N 3.17Å
73	M	88.1	Confident	89.6	Confident	3 Å²	3	46 Å²	46	2%	0.015	26%	0.262	C	S	.	.	H	α-helix	trans	-68.6	-37.6	-178.4	-60.6	-58.5	145.1	0	0	112.5	L65 D67 P70 G71 S75 V76 R77 F90 F92	L65-M73 HydrophobicContact CB-CE 4.38Å; L65-M73 HydrophobicContact CB-SD 4.15Å; D67-M73 HydrophobicContact CB-CE 3.3Å; P70-M73 WeakPolarHBondContact O-CB 2.96Å; P70-M73 PolarHBondContact O-N 3.34Å; G71-M73 VanDerWaalsContact C-N 3.31Å; G71-M73 PolarHBondContact O-N 2.77Å; M73-S75 VanDerWaalsContact C-N 3.29Å; M73-S75 PolarHBondContact O-N 3.1Å; M73-V76 PolarHBondContact O-N 2.75Å; M73-R77 VanDerWaalsContact O-CB 3.31Å; M73-R77 WeakPolarHBondContact O-CB 3.45Å; M73-R77 PolarHBondContact O-N 3.25Å; M73-F90 HydrophobicContact CB-CD1 4.31Å; M73-F90 HydrophobicContact CG-CD1 4.4Å; M73-F90 HydrophobicContact SD-CD1 3.61Å; M73-F90 HydrophobicContact SD-CE1 4.29Å; M73-F92 HydrophobicContact CB-CD1 4.5Å; M73-F92 HydrophobicContact CG-CB 3.9Å; M73-F92 HydrophobicContact CG-CD1 3.94Å; M73-F92 HydrophobicContact CG-CG 4.09Å
74	D	87.7	Confident	89.4	Confident	106 Å²	106	46.3 Å²	46.3	57%	0.567	26%	0.264	S	S	*	.	H	α-helix	trans	-64.3	-37.9	174.1	-70.9	-29	0	0	0	111.6	P70 R77 S78	P70-D74 PolarHBondContact O-N 3.44Å; D74-R77 PolarHBondContact O-N 3.32Å; D74-S78 WeakPolarHBondContact O-CB 3.46Å; D74-S78 PolarHBondContact O-N 3.37Å; D74-S78 PolarHBondContact O-OG 3.32Å
75	S	88.6	Confident	89.1	Confident	81 Å²	81	46.6 Å²	46.6	57%	0.566	27%	0.265	S	S	*	.	H	α-helix	trans	-65.5	-42.8	176.1	-58.3	0	0	0	0	111.7	G71 T72 M73 S78 G79	G71-S75 PolarHBondContact O-N 2.93Å; G71-S75 PolarHBondContact O-OG 3.03Å; T72-S75 WeakPolarHBondContact O-CB 3.41Å; T72-S75 PolarHBondContact O-N 3.35Å; M73-S75 VanDerWaalsContact C-N 3.29Å; M73-S75 PolarHBondContact O-N 3.1Å; S75-S78 PolarHBondContact O-OG 2.84Å; S75-S78 VanDerWaalsContact O-OG 3.04Å; S75-G79 PolarHBondContact O-N 3.09Å
76	V	89.3	Confident	88.9	Confident	8 Å²	8	49.4 Å²	49.4	5%	0.048	28%	0.276	C	S	.	.	H	α-helix	trans	-66.6	-44.4	176.1	175.9	0	0	0	0	111.1	N14 L65 T72 M73 S78 G79 G82 F85 F90	N14-V76 HydrophobicContact CB-CG2 4.14Å; L65-V76 HydrophobicContact CD2-CB 4.46Å; L65-V76 HydrophobicContact CD2-CG1 3.68Å; L65-V76 HydrophobicContact CD2-CG2 4.46Å; T72-V76 WeakPolarHBondContact O-CG2 3.31Å; T72-V76 PolarHBondContact O-N 3.17Å; M73-V76 PolarHBondContact O-N 2.75Å; V76-S78 VanDerWaalsContact C-N 3.3Å; V76-S78 PolarHBondContact O-N 2.91Å; V76-G79 PolarHBondContact O-N 2.94Å; V76-G79 VanDerWaalsContact O-N 3.07Å; V76-G82 WeakPolarHBondContact O-CA 3.4Å; V76-F85 HydrophobicContact CG1-CD2 4.13Å; V76-F85 HydrophobicContact CG1-CE2 3.98Å; V76-F90 HydrophobicContact CG1-CE1 4.22Å
77	R	88.3	Confident	88.6	Confident	112 Å²	112	53.4 Å²	53.4	42%	0.423	30%	0.302	S	S	.	.	H	α-helix	trans	-65.7	-32.5	-178.6	-167.9	-176.3	-60.1	-103.8	-2.7	113	M73 D74 G79	M73-R77 VanDerWaalsContact O-CB 3.31Å; M73-R77 WeakPolarHBondContact O-CB 3.45Å; M73-R77 PolarHBondContact O-N 3.25Å; D74-R77 PolarHBondContact O-N 3.32Å; R77-G79 VanDerWaalsContact C-N 3.31Å
78	S	88.6	Confident	88.4	Confident	100 Å²	100	58.2 Å²	58.2	70%	0.699	33%	0.327	S	S	*	.	H	α-helix	trans	-79.9	-11.5	175	59	0	0	0	0	113.7	D74 S75 V76	D74-S78 WeakPolarHBondContact O-CB 3.46Å; D74-S78 PolarHBondContact O-N 3.37Å; D74-S78 PolarHBondContact O-OG 3.32Å; S75-S78 PolarHBondContact O-OG 2.84Å; S75-S78 VanDerWaalsContact O-OG 3.04Å; V76-S78 VanDerWaalsContact C-N 3.3Å; V76-S78 PolarHBondContact O-N 2.91Å
79	G	86.8	Confident	88.5	Confident	27 Å²	27	58.2 Å²	58.2	28%	0.278	33%	0.327	S	S	.	.	S	Bend	trans	-64.1	165.6	174	0	0	0	0	0	113.5	S75 V76 R77 F81 G82	S75-G79 PolarHBondContact O-N 3.09Å; V76-G79 PolarHBondContact O-N 2.94Å; V76-G79 VanDerWaalsContact O-N 3.07Å; R77-G79 VanDerWaalsContact C-N 3.31Å; G79-F81 VanDerWaalsContact C-N 3.27Å; G79-F81 PolarHBondContact O-N 2.77Å; G79-G82 PolarHBondContact O-N 2.94Å
80	A	84	Confident	88.8	Confident	73 Å²	73	55.2 Å²	55.2	60%	0.603	31%	0.313	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.8	-39.4	-174.6	0	0	0	0	0	112.9	A32	A32-A80 WeakPolarHBondContact CB-O 3.11Å
81	F	87.8	Confident	89.1	Confident	22 Å²	22	53 Å²	53	10%	0.096	30%	0.298	C	S	.	.	T	Hydrogen-bonded Turn	trans	-103.6	12.5	178.8	-73.7	-98.1	0	0	0	113.2	E22 V30 A32 G79 R83 L84	E22-F81 HydrophobicContact CB-CD2 4.13Å; E22-F81 HydrophobicContact CB-CE2 4.32Å; E22-F81 HydrophobicContact CG-CB 4.28Å; E22-F81 HydrophobicContact CG-CD2 3.61Å; E22-F81 HydrophobicContact CG-CE2 4.26Å; E22-F81 HydrophobicContact CG-CG 4.2Å; V30-F81 WeakPolarHBondContact O-CE1 3.32Å; A32-F81 HydrophobicContact CB-CD1 4.22Å; A32-F81 HydrophobicContact CB-CE1 4.39Å; G79-F81 VanDerWaalsContact C-N 3.27Å; G79-F81 PolarHBondContact O-N 2.77Å; F81-R83 PolarHBondContact O-N 3.11Å; F81-R83 VanDerWaalsContact O-N 3.1Å; F81-L84 HydrophobicContact CB-CB 4.49Å; F81-L84 HydrophobicContact CD1-CD2 3.91Å; F81-L84 WeakPolarHBondContact O-CB 3.47Å; F81-L84 PolarHBondContact O-N 2.67Å
82	G	85.8	Confident	89.3	Confident	3 Å²	3	55.9 Å²	55.9	3%	0.031	30%	0.298	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59.9	-27.6	-176.1	0	0	0	0	0	114.5	V76 G79 L84	V76-G82 WeakPolarHBondContact O-CA 3.4Å; G79-G82 PolarHBondContact O-N 2.94Å; G82-L84 VanDerWaalsContact C-N 3.32Å
83	R	87	Confident	89.5	Confident	231 Å²	231	55.9 Å²	55.9	87%	0.872	30%	0.301	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.5	-11.4	177.9	-62.5	-178.6	-176.9	176.8	1	114	F81	F81-R83 PolarHBondContact O-N 3.11Å; F81-R83 VanDerWaalsContact O-N 3.1Å
84	L	89.4	Confident	89.4	Confident	8 Å²	8	64.7 Å²	64.7	4%	0.042	34%	0.342	C	S	.	.	T	Hydrogen-bonded Turn	trans	-74.4	-32.8	-179.9	-175.3	64.7	0	0	0	111	V30 Y51 Y59 P61 F81 G82	V30-L84 HydrophobicContact CG1-CD1 4.43Å; Y51-L84 HydrophobicContact CE1-CD2 4.38Å; Y59-L84 WeakPolarHBondContact O-CD1 3.3Å; P61-L84 VanDerWaalsContact CD-CG 3.44Å; P61-L84 WeakPolarHBondContact CD-O 3.42Å; P61-L84 HydrophobicContact CG-CD2 3.58Å; P61-L84 HydrophobicContact CG-CG 3.65Å; F81-L84 HydrophobicContact CB-CB 4.49Å; F81-L84 HydrophobicContact CD1-CD2 3.91Å; F81-L84 WeakPolarHBondContact O-CB 3.47Å; F81-L84 PolarHBondContact O-N 2.67Å; G82-L84 VanDerWaalsContact C-N 3.32Å
85	F	91.9	Very high	89.3	Confident	6 Å²	6	62.9 Å²	62.9	3%	0.026	34%	0.335	C	S	.	.	S	Bend	trans	-69.9	143.5	179.8	-61.8	-65.8	0	0	0	112.6	W21 P61 S63 L65 V76 P87 F90	W21-F85 HydrophobicContact CB-CE1 4.25Å; W21-F85 HydrophobicContact CB-CZ 3.87Å; W21-F85 AromaticContact CD1-CE1 3.44Å; W21-F85 VanDerWaalsContact CD1-CE1 3.44Å; W21-F85 AromaticContact CD1-CZ 3.55Å; W21-F85 HydrophobicContact CD2-CE1 4.25Å; W21-F85 AromaticContact CG-CE1 3.74Å; W21-F85 HydrophobicContact CG-CE1 3.74Å; W21-F85 AromaticContact CG-CZ 3.8Å; W21-F85 HydrophobicContact CG-CZ 3.8Å; W21-F85 AromaticContact NE1-CE1 3.81Å; P61-F85 HydrophobicContact CB-CD1 4.01Å; P61-F85 HydrophobicContact CB-CE1 4.04Å; P61-F85 HydrophobicContact CG-CD1 4.12Å; P61-F85 HydrophobicContact CG-CE1 4.14Å; S63-F85 WeakPolarHBondContact OG-CD1 3.33Å; S63-F85 WeakPolarHBondContact OG-CE1 3.26Å; L65-F85 HydrophobicContact CD1-CB 4.43Å; L65-F85 HydrophobicContact CD1-CD1 3.94Å; L65-F85 HydrophobicContact CD1-CE1 4.41Å; L65-F85 HydrophobicContact CD1-CG 4.18Å; V76-F85 HydrophobicContact CG1-CD2 4.13Å; V76-F85 HydrophobicContact CG1-CE2 3.98Å; F85-P87 WeakPolarHBondContact O-CD 3.45Å; F85-F90 HydrophobicContact CB-CE2 3.51Å; F85-F90 HydrophobicContact CB-CZ 3.58Å; F85-F90 HydrophobicContact CD2-CZ 4.25Å; F85-F90 HydrophobicContact CG-CZ 4.2Å
86	R	90.9	Very high	89.1	Confident	59 Å²	59	60 Å²	60	22%	0.223	32%	0.318	C	S	.	.			trans	-67.6	124.9	175.4	-175.6	176.7	-72.1	166.5	-5.8	109.6	V60 D88 N89 F90 E123	V60-R86 HydrophobicContact CG1-CB 4.19Å; R86-D88 HydrophobicContact CG-CB 4.13Å; R86-D88 PolarHBondContact O-N 3.44Å; R86-N89 HydrophobicContact CB-CB 4.28Å; R86-N89 WeakPolarHBondContact CD-OD1 3.25Å; R86-N89 PolarHBondContact O-N 3.48Å; R86-F90 VanDerWaalsContact O-CD2 3.26Å; R86-F90 WeakPolarHBondContact O-CD2 3.32Å; R86-F90 WeakPolarHBondContact O-CE2 3.36Å; R86-E123 IonicContact CZ-OE1 2.74Å; R86-E123 IonicContact NH1-OE1 3.31Å; R86-E123 PolarHBondContact NH1-OE1 3.2Å
87	P	90.2	Very high	89	Confident	85 Å²	85	59.7 Å²	59.7	55%	0.552	32%	0.317	S	S	*	.	G	3₁₀ helix	trans	-56.7	-35.1	179.6	-28.2	36.4	0	0	0	114.1	F85 N89 F90	F85-P87 WeakPolarHBondContact O-CD 3.45Å; P87-N89 PolarHBondContact O-N 3.29Å; P87-F90 PolarHBondContact O-N 2.89Å
88	D	91	Very high	89	Confident	104 Å²	104	56.8 Å²	56.8	56%	0.556	32%	0.321	S	S	*	.	G	3₁₀ helix	trans	-66.3	-18.7	178.3	-56.8	-9	0	0	0	113.2	R86 F90 K122	R86-D88 HydrophobicContact CG-CB 4.13Å; R86-D88 PolarHBondContact O-N 3.44Å; D88-F90 VanDerWaalsContact C-N 3.34Å; D88-K122 IonicContact OD2-NZ 2.84Å
89	N	93.5	Very high	89.1	Confident	1 Å²	1	55.2 Å²	55.2	1%	0.005	31%	0.305	C	S	.	.	G	3₁₀ helix	trans	-93.7	5.9	-177.4	-64.4	14.4	0	0	0	112.7	S63 L65 R86 P87 V119 E123	S63-N89 VanDerWaalsContact O-CB 3.28Å; S63-N89 WeakPolarHBondContact O-CB 3.46Å; S63-N89 PolarHBondContact O-ND2 3.31Å; L65-N89 PolarHBondContact N-O 2.91Å; R86-N89 HydrophobicContact CB-CB 4.28Å; R86-N89 WeakPolarHBondContact CD-OD1 3.25Å; R86-N89 PolarHBondContact O-N 3.48Å; P87-N89 PolarHBondContact O-N 3.29Å; N89-V119 HydrophobicContact CB-CG1 4.3Å; N89-E123 PolarHBondContact ND2-OE1 2.96Å
90	F	93.8	Very high	89.5	Confident	17 Å²	17	54.2 Å²	54.2	8%	0.075	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.2	111.6	171	-71.5	-98.7	0	0	0	109	L65 M73 V76 F85 R86 P87 D88	L65-F90 HydrophobicContact CB-CD1 4.38Å; L65-F90 HydrophobicContact CD2-CD1 4.47Å; L65-F90 HydrophobicContact CD2-CE1 3.94Å; L65-F90 HydrophobicContact CD2-CZ 4.4Å; M73-F90 HydrophobicContact CB-CD1 4.31Å; M73-F90 HydrophobicContact CG-CD1 4.4Å; M73-F90 HydrophobicContact SD-CD1 3.61Å; M73-F90 HydrophobicContact SD-CE1 4.29Å; V76-F90 HydrophobicContact CG1-CE1 4.22Å; F85-F90 HydrophobicContact CB-CE2 3.51Å; F85-F90 HydrophobicContact CB-CZ 3.58Å; F85-F90 HydrophobicContact CD2-CZ 4.25Å; F85-F90 HydrophobicContact CG-CZ 4.2Å; R86-F90 VanDerWaalsContact O-CD2 3.26Å; R86-F90 WeakPolarHBondContact O-CD2 3.32Å; R86-F90 WeakPolarHBondContact O-CE2 3.36Å; P87-F90 PolarHBondContact O-N 2.89Å; D88-F90 VanDerWaalsContact C-N 3.34Å
91	I	94	Very high	90.1	Very high	13 Å²	13	51 Å²	51	7%	0.067	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	116.3	-176.4	-52.6	170.9	0	0	0	106.8	V64 L65 V66 D67 L112 V116 V119	V64-I91 HydrophobicContact CG1-CD1 3.78Å; L65-I91 PolarHBondContact O-N 3Å; V66-I91 WeakPolarHBondContact CA-O 3.11Å; D67-I91 PolarHBondContact N-O 3.41Å; I91-L112 HydrophobicContact CG2-CD1 3.75Å; I91-L112 HydrophobicContact CG2-CD2 4.24Å; I91-L112 HydrophobicContact CG2-CG 3.97Å; I91-V116 HydrophobicContact CB-CG2 4.22Å; I91-V116 HydrophobicContact CD1-CB 4.24Å; I91-V116 HydrophobicContact CD1-CG1 4.5Å; I91-V116 HydrophobicContact CD1-CG2 4.03Å; I91-V116 HydrophobicContact CG2-CG2 3.68Å; I91-V119 HydrophobicContact CD1-CB 3.64Å; I91-V119 HydrophobicContact CD1-CG1 4.15Å; I91-V119 HydrophobicContact CD1-CG2 3.51Å; I91-V119 HydrophobicContact CG1-CG2 4.22Å
92	F	92.6	Very high	90.4	Very high	101 Å²	101	49.9 Å²	49.9	44%	0.443	26%	0.261	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.7	144.6	-176.3	58.3	-87.2	0	0	0	113.9	D67 P70 M73	D67-F92 CarbonylContact O-C 3.21Å; D67-F92 WeakPolarHBondContact O-CA 3.4Å; D67-F92 WeakPolarHBondContact O-CB 3.29Å; P70-F92 HydrophobicContact CB-CD2 4Å; P70-F92 HydrophobicContact CB-CE2 4.39Å; M73-F92 HydrophobicContact CB-CD1 4.5Å; M73-F92 HydrophobicContact CG-CB 3.9Å; M73-F92 HydrophobicContact CG-CD1 3.94Å; M73-F92 HydrophobicContact CG-CG 4.09Å
93	G	89.6	Confident	90.8	Very high	13 Å²	13	52.7 Å²	52.7	13%	0.134	27%	0.272	C	S	.	.			trans	-81.6	178.1	172.7	0	0	0	0	0	112.6	D67 L68	D67-G93 PolarHBondContact O-N 2.63Å; L68-G93 CarbonylContact O-C 3.42Å; L68-G93 VanDerWaalsContact O-C 3.26Å; L68-G93 WeakPolarHBondContact O-CA 3.32Å
94	Q	86.3	Confident	91.1	Very high	189 Å²	189	41.7 Å²	41.7	88%	0.883	23%	0.231	S	C	*	.	S	Bend	trans	-102.1	-22.1	169.5	-62.4	-166.3	-0.3	0	0	112.4
95	T	85.2	Confident	91.4	Very high	67 Å²	67	42.1 Å²	42.1	41%	0.411	23%	0.232	S	C	.	.	S	Bend	trans	-116.4	120.5	-174.2	-44.2	0	0	0	0	109.4	L68 E108	L68-T95 WeakPolarHBondContact CB-O 3.34Å; L68-T95 CarbonylContact O-C 3.54Å; T95-E108 WeakPolarHBondContact CB-OE2 3.43Å; T95-E108 HydrophobicContact CG2-CG 4.5Å
96	G	86.1	Confident	91.5	Very high	21 Å²	21	46.4 Å²	46.4	22%	0.216	25%	0.249	C	C	.	.			trans	-71.8	155	175.6	0	0	0	0	0	113.4	E69 G98	E69-G96 VanDerWaalsContact CG-CA 3.41Å; G96-G98 PolarHBondContact O-N 3.34Å
97	A	86.6	Confident	91.5	Very high	2 Å²	2	45.4 Å²	45.4	2%	0.017	25%	0.249	C	C	.	.			trans	-71.9	-15	176	0	0	0	0	0	113.8	L68 N99 N100 K103	L68-A97 HydrophobicContact CD1-CB 3.96Å; A97-N99 PolarHBondContact O-N 3.15Å; A97-N100 WeakPolarHBondContact O-CB 3.32Å; A97-N100 PolarHBondContact O-N 3.41Å; A97-K103 HydrophobicContact CB-CB 4.37Å
98	G	88.3	Confident	91.6	Very high	50 Å²	50	44 Å²	44	52%	0.515	24%	0.235	S	C	.	.	T	Hydrogen-bonded Turn	trans	57.8	40.9	176.4	0	0	0	0	0	114.4	G96 N100	G96-G98 PolarHBondContact O-N 3.34Å; G98-N100 PolarHBondContact O-N 2.87Å
99	N	91.1	Very high	91.5	Very high	67 Å²	67	39 Å²	39	36%	0.358	21%	0.209	S	C	.	.	T	Hydrogen-bonded Turn	trans	57.6	26.1	-174.7	-63.4	-35.2	0	0	0	115	A97 T178 V180 N184	A97-N99 PolarHBondContact O-N 3.15Å; N99-T178 HydrophobicContact CB-CG2 3.97Å; N99-T178 PolarHBondContact ND2-OG1 3.43Å; N99-V180 HydrophobicContact CB-CG2 4.27Å; N99-V180 WeakPolarHBondContact O-CG2 3.27Å; N99-N184 PolarHBondContact O-ND2 3.07Å
100	N	94.1	Very high	91.5	Very high	7 Å²	7	40.7 Å²	40.7	4%	0.037	22%	0.223	C	C	.	.			trans	-108.3	115	175	-173.1	-20.2	0	0	0	110.5	A97 G98 A102 K103 G104 G142 W397 F398	A97-N100 WeakPolarHBondContact O-CB 3.32Å; A97-N100 PolarHBondContact O-N 3.41Å; G98-N100 PolarHBondContact O-N 2.87Å; N100-A102 WeakPolarHBondContact OD1-CB 3.33Å; N100-A102 PolarHBondContact OD1-N 3.3Å; N100-K103 HydrophobicContact CB-CB 4.17Å; N100-K103 HydrophobicContact CB-CD 4.24Å; N100-K103 HydrophobicContact CB-CG 4.06Å; N100-K103 PolarHBondContact O-N 2.92Å; N100-K103 PolarHBondContact OD1-N 3.4Å; N100-G104 PolarHBondContact O-N 3.12Å; N100-G142 WeakPolarHBondContact O-CA 3.25Å; N100-W397 PolarHBondContact ND2-O 3.02Å; N100-F398 WeakPolarHBondContact OD1-CD1 3.35Å
101	W	96.2	Very high	91.4	Very high	4 Å²	4	47 Å²	47	2%	0.015	25%	0.253	C	S	.	.	H	α-helix	trans	-60.8	-41.6	176.9	-176.4	98	0	0	0	112.5	K103 G104 H105 Y106 G146 N184 L187 S188 Q191 F398 M403	W101-K103 VanDerWaalsContact C-N 3.28Å; W101-K103 PolarHBondContact O-N 2.83Å; W101-G104 CarbonylContact O-C 3.55Å; W101-G104 PolarHBondContact O-N 2.63Å; W101-G104 VanDerWaalsContact O-N 3.08Å; W101-H105 HydrophobicContact CD2-CB 4.12Å; W101-H105 HydrophobicContact CE3-CB 3.87Å; W101-H105 HydrophobicContact CH2-CB 3.74Å; W101-H105 AromaticContact CH2-CD2 3.44Å; W101-H105 VanDerWaalsContact CH2-CD2 3.44Å; W101-H105 WeakPolarHBondContact CH2-CD2 3.24Å; W101-H105 AromaticContact CH2-CE1 3.91Å; W101-H105 AromaticContact CH2-CG 3.3Å; W101-H105 AromaticContact CH2-ND1 3.62Å; W101-H105 AromaticContact CH2-NE2 3.83Å; W101-H105 HydrophobicContact CZ2-CB 4Å; W101-H105 AromaticContact CZ2-CE1 3.87Å; W101-H105 AromaticContact CZ2-CG 3.57Å; W101-H105 AromaticContact CZ2-ND1 3.43Å; W101-H105 WeakPolarHBondContact CZ2-ND1 3.29Å; W101-H105 HydrophobicContact CZ3-CB 3.68Å; W101-H105 AromaticContact CZ3-CD2 3.94Å; W101-H105 AromaticContact CZ3-CG 3.76Å; W101-H105 WeakPolarHBondContact O-CB 3.41Å; W101-H105 PolarHBondContact O-N 3.08Å; W101-Y106 HydrophobicContact CZ3-CD2 4.43Å; W101-Y106 AromaticContact CZ3-CE2 3.85Å; W101-Y106 HydrophobicContact CZ3-CE2 3.85Å; W101-G146 VanDerWaalsContact CD1-N 3.31Å; W101-N184 HydrophobicContact CB-CB 4.13Å; W101-N184 VanDerWaalsContact CB-OD1 3.22Å; W101-N184 WeakPolarHBondContact CB-OD1 3.31Å; W101-N184 PolarHBondContact N-OD1 2.73Å; W101-N184 VanDerWaalsContact N-OD1 3.14Å; W101-L187 HydrophobicContact CB-CD1 4.31Å; W101-L187 HydrophobicContact CD2-CB 3.84Å; W101-L187 HydrophobicContact CD2-CD1 3.89Å; W101-L187 HydrophobicContact CE3-CB 4.22Å; W101-L187 HydrophobicContact CE3-CD1 3.69Å; W101-L187 HydrophobicContact CG-CB 4.18Å; W101-L187 HydrophobicContact CG-CD1 4.16Å; W101-L187 HydrophobicContact CZ2-CB 4.16Å; W101-L187 HydrophobicContact CZ3-CD1 4.32Å; W101-S188 VanDerWaalsContact CD1-OG 3.26Å; W101-S188 PolarHBondContact NE1-OG 3.03Å; W101-S188 VanDerWaalsContact NE1-OG 3.14Å; W101-Q191 HydrophobicContact CZ2-CG 4.22Å; W101-F398 HydrophobicContact CB-CE1 4.05Å; W101-M403 HydrophobicContact CE3-SD 4.33Å; W101-M403 HydrophobicContact CZ3-CE 4.29Å; W101-M403 HydrophobicContact CZ3-SD 4.26Å
102	A	95.1	Very high	91.4	Very high	0 Å²	0	47.5 Å²	47.5	0%	0	26%	0.256	C	S	.	.	H	α-helix	trans	-63.6	-34.8	-178.4	0	0	0	0	0	111.8	N100 H105 Y106 F398 E401 M403	N100-A102 WeakPolarHBondContact OD1-CB 3.33Å; N100-A102 PolarHBondContact OD1-N 3.3Å; A102-H105 PolarHBondContact O-N 2.79Å; A102-Y106 HydrophobicContact CB-CD2 4.33Å; A102-Y106 WeakPolarHBondContact O-CB 3.31Å; A102-Y106 PolarHBondContact O-N 2.76Å; A102-F398 HydrophobicContact CB-CB 4.26Å; A102-F398 HydrophobicContact CB-CD1 3.97Å; A102-E401 HydrophobicContact CB-CB 3.88Å; A102-E401 HydrophobicContact CB-CG 4.3Å; A102-M403 HydrophobicContact CB-CB 4.45Å; A102-M403 HydrophobicContact CB-SD 4.24Å
103	K	94.2	Very high	91.4	Very high	62 Å²	62	43 Å²	43	27%	0.27	24%	0.236	S	C	.	.	H	α-helix	trans	-63.2	-44.5	172.2	-75.3	-168.9	168.7	-167.4	0	113	A97 N100 W101 H105 T107 E108 G109 E401	A97-K103 HydrophobicContact CB-CB 4.37Å; N100-K103 HydrophobicContact CB-CB 4.17Å; N100-K103 HydrophobicContact CB-CD 4.24Å; N100-K103 HydrophobicContact CB-CG 4.06Å; N100-K103 PolarHBondContact O-N 2.92Å; N100-K103 PolarHBondContact OD1-N 3.4Å; W101-K103 VanDerWaalsContact C-N 3.28Å; W101-K103 PolarHBondContact O-N 2.83Å; K103-H105 VanDerWaalsContact C-N 3.28Å; K103-H105 PolarHBondContact O-N 3.01Å; K103-T107 VanDerWaalsContact CA-OG1 3.31Å; K103-T107 WeakPolarHBondContact CA-OG1 3.12Å; K103-T107 CarbonylContact O-C 3.58Å; K103-T107 PolarHBondContact O-N 2.95Å; K103-T107 PolarHBondContact O-OG1 2.91Å; K103-E108 PolarHBondContact O-N 3.4Å; K103-G109 PolarHBondContact O-N 3.49Å; K103-E401 VanDerWaalsContact CE-CD 3.43Å; K103-E401 WeakPolarHBondContact CE-OE1 3.24Å; K103-E401 VanDerWaalsContact CG-CD 3.44Å; K103-E401 HydrophobicContact CG-CG 3.71Å; K103-E401 WeakPolarHBondContact CG-OE2 3.43Å; K103-E401 IonicContact NZ-OE1 2.89Å
104	G	93.9	Very high	91.6	Very high	0 Å²	0	47.6 Å²	47.6	0%	0	26%	0.257	C	S	.	.	H	α-helix	trans	-66.4	-31.4	176.5	0	0	0	0	0	112.8	N100 W101 G109 G146 M147	N100-G104 PolarHBondContact O-N 3.12Å; W101-G104 CarbonylContact O-C 3.55Å; W101-G104 PolarHBondContact O-N 2.63Å; W101-G104 VanDerWaalsContact O-N 3.08Å; G104-G109 VanDerWaalsContact O-CA 3.23Å; G104-G109 WeakPolarHBondContact O-CA 3.39Å; G104-G146 CarbonylContact O-C 3.51Å; G104-M147 WeakPolarHBondContact O-CA 3.26Å; G104-M147 WeakPolarHBondContact O-CB 3.17Å; G104-M147 PolarHBondContact O-N 3.41Å
105	H	94.9	Very high	92	Very high	16 Å²	16	41.7 Å²	41.7	7%	0.074	24%	0.237	C	C	.	.	H	α-helix	trans	-94.9	-38.3	-172.5	-159.4	82.5	0	0	0	114.1	W101 A102 K103 G146 T149 L150	W101-H105 HydrophobicContact CD2-CB 4.12Å; W101-H105 HydrophobicContact CE3-CB 3.87Å; W101-H105 HydrophobicContact CH2-CB 3.74Å; W101-H105 AromaticContact CH2-CD2 3.44Å; W101-H105 VanDerWaalsContact CH2-CD2 3.44Å; W101-H105 WeakPolarHBondContact CH2-CD2 3.24Å; W101-H105 AromaticContact CH2-CE1 3.91Å; W101-H105 AromaticContact CH2-CG 3.3Å; W101-H105 AromaticContact CH2-ND1 3.62Å; W101-H105 AromaticContact CH2-NE2 3.83Å; W101-H105 HydrophobicContact CZ2-CB 4Å; W101-H105 AromaticContact CZ2-CE1 3.87Å; W101-H105 AromaticContact CZ2-CG 3.57Å; W101-H105 AromaticContact CZ2-ND1 3.43Å; W101-H105 WeakPolarHBondContact CZ2-ND1 3.29Å; W101-H105 HydrophobicContact CZ3-CB 3.68Å; W101-H105 AromaticContact CZ3-CD2 3.94Å; W101-H105 AromaticContact CZ3-CG 3.76Å; W101-H105 WeakPolarHBondContact O-CB 3.41Å; W101-H105 PolarHBondContact O-N 3.08Å; A102-H105 PolarHBondContact O-N 2.79Å; K103-H105 VanDerWaalsContact C-N 3.28Å; K103-H105 PolarHBondContact O-N 3.01Å; H105-G146 PolarHBondContact ND1-O 2.95Å; H105-T149 PolarHBondContact ND1-OG1 3.23Å; H105-L150 WeakPolarHBondContact O-CD2 3.38Å
106	Y	93.2	Very high	92.5	Very high	97 Å²	97	38.5 Å²	38.5	38%	0.38	22%	0.217	S	C	.	.	H	α-helix	trans	-112.3	-27.7	-171.2	-67.2	-60	0	0	0	114.5	W101 A102 M403 E407	W101-Y106 HydrophobicContact CZ3-CD2 4.43Å; W101-Y106 AromaticContact CZ3-CE2 3.85Å; W101-Y106 HydrophobicContact CZ3-CE2 3.85Å; A102-Y106 HydrophobicContact CB-CD2 4.33Å; A102-Y106 WeakPolarHBondContact O-CB 3.31Å; A102-Y106 PolarHBondContact O-N 2.76Å; Y106-M403 HydrophobicContact CE2-CB 4.31Å; Y106-M403 HydrophobicContact CE2-CG 4.1Å; Y106-M403 HydrophobicContact CE2-SD 4.5Å; Y106-E407 PolarHBondContact OH-OE2 2.98Å
107	T	92.3	Very high	92.9	Very high	37 Å²	37	37.9 Å²	37.9	23%	0.227	21%	0.209	C	C	.	.	S	Bend	trans	-112.4	-100.6	-174.8	62.4	0	0	0	0	111.8	K103 G109 A110 E111 E401	K103-T107 VanDerWaalsContact CA-OG1 3.31Å; K103-T107 WeakPolarHBondContact CA-OG1 3.12Å; K103-T107 CarbonylContact O-C 3.58Å; K103-T107 PolarHBondContact O-N 2.95Å; K103-T107 PolarHBondContact O-OG1 2.91Å; T107-G109 VanDerWaalsContact C-N 3.3Å; T107-G109 PolarHBondContact O-N 3.31Å; T107-A110 WeakPolarHBondContact O-CB 3.37Å; T107-A110 PolarHBondContact O-N 3.15Å; T107-E111 PolarHBondContact O-N 3.35Å; T107-E111 VanDerWaalsContact O-N 3.16Å; T107-E401 HydrophobicContact CG2-CB 4.26Å; T107-E401 VanDerWaalsContact CG2-OE2 3.24Å; T107-E401 WeakPolarHBondContact CG2-OE2 3.33Å; T107-E401 PolarHBondContact OG1-OE2 2.67Å
108	E	91.2	Very high	93.3	Very high	55 Å²	55	42.2 Å²	42.2	26%	0.257	23%	0.232	S	C	.	.	H	α-helix	trans	-56	-40.8	-172.7	-60.1	-71.2	159.8	0	0	113.1	L68 T95 K103 E111 L112	L68-E108 HydrophobicContact CD1-CB 4.19Å; L68-E108 HydrophobicContact CD2-CB 4.23Å; T95-E108 WeakPolarHBondContact CB-OE2 3.43Å; T95-E108 HydrophobicContact CG2-CG 4.5Å; K103-E108 PolarHBondContact O-N 3.4Å; E108-E111 PolarHBondContact O-N 3.36Å; E108-L112 PolarHBondContact O-N 2.73Å
109	G	90.4	Very high	93.7	Very high	0 Å²	0	40.9 Å²	40.9	0%	0	21%	0.214	C	C	.	.	H	α-helix	trans	-73.9	-26.4	179.2	0	0	0	0	0	113.9	K103 G104 T107 M113	K103-G109 PolarHBondContact O-N 3.49Å; G104-G109 VanDerWaalsContact O-CA 3.23Å; G104-G109 WeakPolarHBondContact O-CA 3.39Å; T107-G109 VanDerWaalsContact C-N 3.3Å; T107-G109 PolarHBondContact O-N 3.31Å; G109-M113 WeakPolarHBondContact O-CB 3.44Å; G109-M113 PolarHBondContact O-N 3.5Å; G109-M113 VanDerWaalsContact O-N 3.13Å
110	A	92.3	Very high	93.9	Very high	37 Å²	37	37.8 Å²	37.8	31%	0.306	20%	0.197	S	C	.	.	H	α-helix	trans	-71.1	-38	173.7	0	0	0	0	0	111.2	T107 L112 M113 L150	T107-A110 WeakPolarHBondContact O-CB 3.37Å; T107-A110 PolarHBondContact O-N 3.15Å; A110-L112 VanDerWaalsContact C-N 3.34Å; A110-L112 PolarHBondContact O-N 3.46Å; A110-M113 WeakPolarHBondContact O-CB 3.41Å; A110-M113 PolarHBondContact O-N 3.38Å; A110-L150 HydrophobicContact CB-CD2 4.13Å
111	E	92.4	Very high	94	Very high	149 Å²	149	41.4 Å²	41.4	70%	0.696	21%	0.21	S	C	*	.	H	α-helix	trans	-63.8	-37.8	175.6	-65.2	-172.3	177.2	0	0	112.6	T107 E108	T107-E111 PolarHBondContact O-N 3.35Å; T107-E111 VanDerWaalsContact O-N 3.16Å; E108-E111 PolarHBondContact O-N 3.36Å
112	L	93.6	Very high	93.9	Very high	24 Å²	24	45.3 Å²	45.3	13%	0.126	23%	0.227	C	C	.	.	H	α-helix	trans	-81.1	-16	178.9	-167.6	61.6	0	0	0	113.2	L68 I91 E108 A110 D114 S115 V116 M147	L68-L112 HydrophobicContact CD2-CB 4.24Å; L68-L112 HydrophobicContact CD2-CD2 3.82Å; I91-L112 HydrophobicContact CG2-CD1 3.75Å; I91-L112 HydrophobicContact CG2-CD2 4.24Å; I91-L112 HydrophobicContact CG2-CG 3.97Å; E108-L112 PolarHBondContact O-N 2.73Å; A110-L112 VanDerWaalsContact C-N 3.34Å; A110-L112 PolarHBondContact O-N 3.46Å; L112-D114 PolarHBondContact O-N 3.23Å; L112-S115 PolarHBondContact O-N 2.64Å; L112-V116 HydrophobicContact CG-CG2 4.39Å; L112-V116 PolarHBondContact O-N 3.21Å; L112-M147 HydrophobicContact CB-CE 3.83Å; L112-M147 HydrophobicContact CD2-CE 3.93Å; L112-M147 HydrophobicContact CD2-SD 4.44Å; L112-M147 HydrophobicContact CG-CE 3.93Å
113	M	92.9	Very high	93.8	Very high	6 Å²	6	45.3 Å²	45.3	3%	0.03	23%	0.227	C	C	.	.	H	α-helix	trans	-58.7	-44.6	-170.9	-172.7	51.1	60.5	0	0	113.1	G109 A110 S115 V116 L117 M147 L150 L151 K154	G109-M113 WeakPolarHBondContact O-CB 3.44Å; G109-M113 PolarHBondContact O-N 3.5Å; G109-M113 VanDerWaalsContact O-N 3.13Å; A110-M113 WeakPolarHBondContact O-CB 3.41Å; A110-M113 PolarHBondContact O-N 3.38Å; M113-S115 VanDerWaalsContact C-N 3.28Å; M113-S115 PolarHBondContact O-N 3.08Å; M113-V116 WeakPolarHBondContact O-CB 3.46Å; M113-V116 PolarHBondContact O-N 3.16Å; M113-L117 HydrophobicContact CG-CD1 3.95Å; M113-L117 HydrophobicContact CG-CG 4.28Å; M113-L117 WeakPolarHBondContact O-CG 3.5Å; M113-L117 PolarHBondContact O-N 3.4Å; M113-L117 HydrophobicContact SD-CD1 4.35Å; M113-L117 HydrophobicContact SD-CG 4.12Å; M113-M147 HydrophobicContact CE-CE 4.18Å; M113-M147 HydrophobicContact CE-CG 3.84Å; M113-L150 HydrophobicContact CB-CD2 4.28Å; M113-L150 HydrophobicContact CE-CB 3.88Å; M113-L150 HydrophobicContact CE-CD2 3.6Å; M113-L150 HydrophobicContact CE-CG 3.69Å; M113-L150 HydrophobicContact CG-CD2 4.2Å; M113-L150 HydrophobicContact CG-CG 4.47Å; M113-L151 HydrophobicContact CE-CB 3.76Å; M113-L151 HydrophobicContact CE-CD1 4.35Å; M113-L151 HydrophobicContact SD-CB 4.01Å; M113-L151 HydrophobicContact SD-CD1 3.5Å; M113-L151 VanDerWaalsContact SD-CD1 3.5Å; M113-L151 HydrophobicContact SD-CG 4.35Å; M113-K154 HydrophobicContact CG-CG 4.33Å
114	D	93.3	Very high	93.8	Very high	110 Å²	110	43 Å²	43	59%	0.588	22%	0.219	S	C	*	.	H	α-helix	trans	-60.9	-40.2	-177.9	-72	-24.3	0	0	0	111.6	L112 V116 L117 D118	L112-D114 PolarHBondContact O-N 3.23Å; D114-V116 VanDerWaalsContact C-N 3.32Å; D114-V116 PolarHBondContact O-N 2.77Å; D114-L117 PolarHBondContact O-N 3.09Å; D114-D118 PolarHBondContact O-N 3.33Å
115	S	94.6	Very high	93.7	Very high	64 Å²	64	50.7 Å²	50.7	45%	0.448	26%	0.255	S	S	.	.	H	α-helix	trans	-64.4	-38.1	176.1	-62.9	0	0	0	0	111.8	L112 M113 V119	L112-S115 PolarHBondContact O-N 2.64Å; M113-S115 VanDerWaalsContact C-N 3.28Å; M113-S115 PolarHBondContact O-N 3.08Å; S115-V119 PolarHBondContact O-N 3.49Å
116	V	95.1	Very high	93.4	Very high	0 Å²	0	54.8 Å²	54.8	0%	0	27%	0.274	C	S	.	.	H	α-helix	trans	-65.9	-47.7	175.5	179.5	0	0	0	0	111.2	V64 V66 I91 L112 M113 D114 D118 V119 V120 M147 L151	V64-V116 HydrophobicContact CG1-CG1 4.44Å; V66-V116 HydrophobicContact CB-CG2 4.45Å; V66-V116 HydrophobicContact CG1-CG2 3.7Å; V66-V116 HydrophobicContact CG2-CB 4.48Å; V66-V116 HydrophobicContact CG2-CG1 3.73Å; V66-V116 HydrophobicContact CG2-CG2 3.83Å; I91-V116 HydrophobicContact CB-CG2 4.22Å; I91-V116 HydrophobicContact CD1-CB 4.24Å; I91-V116 HydrophobicContact CD1-CG1 4.5Å; I91-V116 HydrophobicContact CD1-CG2 4.03Å; I91-V116 HydrophobicContact CG2-CG2 3.68Å; L112-V116 HydrophobicContact CG-CG2 4.39Å; L112-V116 PolarHBondContact O-N 3.21Å; M113-V116 WeakPolarHBondContact O-CB 3.46Å; M113-V116 PolarHBondContact O-N 3.16Å; D114-V116 VanDerWaalsContact C-N 3.32Å; D114-V116 PolarHBondContact O-N 2.77Å; V116-D118 VanDerWaalsContact C-N 3.3Å; V116-D118 PolarHBondContact O-N 2.89Å; V116-V119 PolarHBondContact O-N 2.84Å; V116-V120 HydrophobicContact CG1-CG2 4.23Å; V116-V120 WeakPolarHBondContact O-CG2 3.32Å; V116-V120 PolarHBondContact O-N 3.42Å; V116-M147 HydrophobicContact CG2-CE 3.67Å; V116-L151 HydrophobicContact CG1-CD1 3.75Å; V116-L151 HydrophobicContact CG1-CD2 3.96Å
117	L	95.2	Very high	93.4	Very high	8 Å²	8	51 Å²	51	4%	0.042	26%	0.261	C	S	.	.	H	α-helix	trans	-61.7	-37.8	-179.9	-71.3	173.3	0	0	0	111.9	M113 D114 V119 V120 R121 L151 K154 I155	M113-L117 HydrophobicContact CG-CD1 3.95Å; M113-L117 HydrophobicContact CG-CG 4.28Å; M113-L117 WeakPolarHBondContact O-CG 3.5Å; M113-L117 PolarHBondContact O-N 3.4Å; M113-L117 HydrophobicContact SD-CD1 4.35Å; M113-L117 HydrophobicContact SD-CG 4.12Å; D114-L117 PolarHBondContact O-N 3.09Å; L117-V119 PolarHBondContact O-N 2.91Å; L117-V120 PolarHBondContact O-N 2.92Å; L117-R121 WeakPolarHBondContact O-CB 3.41Å; L117-R121 VanDerWaalsContact O-CG 3.25Å; L117-R121 WeakPolarHBondContact O-CG 3.4Å; L117-R121 PolarHBondContact O-N 3.04Å; L117-L151 HydrophobicContact CD2-CD1 3.84Å; L117-L151 HydrophobicContact CG-CD1 4.43Å; L117-K154 HydrophobicContact CD1-CB 3.91Å; L117-K154 HydrophobicContact CD1-CG 4.26Å; L117-K154 HydrophobicContact CD2-CB 4.03Å; L117-I155 HydrophobicContact CD2-CG1 4.19Å
118	D	95.8	Very high	93.3	Very high	93 Å²	93	55 Å²	55	50%	0.497	28%	0.282	S	S	.	.	H	α-helix	trans	-63.5	-39.4	177	-76.3	-12.3	0	0	0	112.8	D114 V116 R121 K122	D114-D118 PolarHBondContact O-N 3.33Å; V116-D118 VanDerWaalsContact C-N 3.3Å; V116-D118 PolarHBondContact O-N 2.89Å; D118-R121 IonicContact OD1-NH1 3.48Å; D118-R121 PolarHBondContact OD1-NH1 3.17Å; D118-K122 WeakPolarHBondContact O-CB 3.5Å; D118-K122 PolarHBondContact O-N 3.11Å
119	V	95.8	Very high	93.2	Very high	23 Å²	23	55.6 Å²	55.6	14%	0.139	29%	0.291	C	S	.	.	H	α-helix	trans	-71	-40.3	174.8	176.2	0	0	0	0	111.2	V64 N89 I91 S115 V116 L117 K122 E123	V64-V119 HydrophobicContact CG1-CG1 4.13Å; V64-V119 HydrophobicContact CG2-CG1 3.96Å; N89-V119 HydrophobicContact CB-CG1 4.3Å; I91-V119 HydrophobicContact CD1-CB 3.64Å; I91-V119 HydrophobicContact CD1-CG1 4.15Å; I91-V119 HydrophobicContact CD1-CG2 3.51Å; I91-V119 HydrophobicContact CG1-CG2 4.22Å; S115-V119 PolarHBondContact O-N 3.49Å; V116-V119 PolarHBondContact O-N 2.84Å; L117-V119 PolarHBondContact O-N 2.91Å; V119-K122 WeakPolarHBondContact O-CB 3.1Å; V119-K122 PolarHBondContact O-N 3.21Å; V119-E123 PolarHBondContact O-N 2.83Å
120	V	95.4	Very high	93.4	Very high	1 Å²	1	56.1 Å²	56.1	1%	0.006	29%	0.294	C	S	.	.	H	α-helix	trans	-60.5	-46.3	175.4	172.3	0	0	0	0	110.5	I7 V64 V116 L117 K122 E123 C124 F133 I155	I7-V120 HydrophobicContact CD1-CG2 3.94Å; V64-V120 HydrophobicContact CG1-CG2 4.48Å; V64-V120 HydrophobicContact CG2-CG2 4.09Å; V116-V120 HydrophobicContact CG1-CG2 4.23Å; V116-V120 WeakPolarHBondContact O-CG2 3.32Å; V116-V120 PolarHBondContact O-N 3.42Å; L117-V120 PolarHBondContact O-N 2.92Å; V120-K122 PolarHBondContact O-N 3.19Å; V120-E123 PolarHBondContact O-N 3.48Å; V120-C124 PolarHBondContact O-N 3.39Å; V120-C124 PolarHBondContact O-SG 3.22Å; V120-F133 HydrophobicContact CG1-CD1 4.31Å; V120-F133 HydrophobicContact CG1-CE1 3.58Å; V120-F133 HydrophobicContact CG1-CZ 4.37Å; V120-I155 HydrophobicContact CG1-CD1 4.33Å
121	R	95.6	Very high	93.3	Very high	83 Å²	83	55.5 Å²	55.5	31%	0.313	28%	0.284	S	S	.	.	H	α-helix	trans	-55	-49.8	173.4	-78.6	170.7	-170.2	143.5	5.1	111.5	L117 D118 E123 C124 E125 E158	L117-R121 WeakPolarHBondContact O-CB 3.41Å; L117-R121 VanDerWaalsContact O-CG 3.25Å; L117-R121 WeakPolarHBondContact O-CG 3.4Å; L117-R121 PolarHBondContact O-N 3.04Å; D118-R121 IonicContact OD1-NH1 3.48Å; D118-R121 PolarHBondContact OD1-NH1 3.17Å; R121-E123 VanDerWaalsContact C-N 3.32Å; R121-E123 PolarHBondContact O-N 3.36Å; R121-C124 WeakPolarHBondContact O-CB 3.26Å; R121-C124 PolarHBondContact O-N 3.12Å; R121-C124 VanDerWaalsContact O-N 3.11Å; R121-E125 WeakPolarHBondContact O-CG 3.22Å; R121-E125 PolarHBondContact O-N 2.67Å; R121-E158 WeakPolarHBondContact CD-OE1 3.01Å; R121-E158 WeakPolarHBondContact CG-OE1 3.31Å; R121-E158 IonicContact CZ-OE1 2.73Å; R121-E158 IonicContact CZ-OE2 2.67Å; R121-E158 VanDerWaalsContact CZ-OE2 3.27Å; R121-E158 VanDerWaalsContact NE-CD 3.3Å; R121-E158 IonicContact NE-OE1 2.85Å; R121-E158 PolarHBondContact NE-OE1 2.83Å; R121-E158 IonicContact NE-OE2 2.73Å; R121-E158 PolarHBondContact NE-OE2 2.88Å; R121-E158 IonicContact NH2-OE2 3.69Å; R121-E158 PolarHBondContact NH2-OE2 2.88Å
122	K	94.8	Very high	93.4	Very high	86 Å²	86	48.4 Å²	48.4	37%	0.374	25%	0.251	S	S	.	.	H	α-helix	trans	-56.5	-47.3	177.5	-173.2	180	178.8	-175.4	0	110.7	D88 D118 V119 V120 C124 E125 H126	D88-K122 IonicContact OD2-NZ 2.84Å; D118-K122 WeakPolarHBondContact O-CB 3.5Å; D118-K122 PolarHBondContact O-N 3.11Å; V119-K122 WeakPolarHBondContact O-CB 3.1Å; V119-K122 PolarHBondContact O-N 3.21Å; V120-K122 PolarHBondContact O-N 3.19Å; K122-C124 PolarHBondContact O-N 2.79Å; K122-E125 PolarHBondContact O-N 2.82Å; K122-H126 PolarHBondContact O-N 2.84Å; K122-H126 PolarHBondContact O-ND1 2.85Å
123	E	93.4	Very high	93.5	Very high	0 Å²	0	47.3 Å²	47.3	0%	0	25%	0.245	C	C	.	.	H	α-helix	trans	-63.7	-41	176.9	-70	-61.6	153.1	0	0	112.2	V5 N52 R62 V64 R86 N89 V119 V120 R121 E125 H126 C127	V5-E123 HydrophobicContact CG1-CB 4.46Å; V5-E123 HydrophobicContact CG2-CB 4.22Å; N52-E123 PolarHBondContact ND2-OE2 2.73Å; R62-E123 PolarHBondContact NH1-O 3.21Å; R62-E123 IonicContact NH1-OE2 2.95Å; R62-E123 PolarHBondContact NH1-OE2 3.34Å; V64-E123 HydrophobicContact CG2-CG 4.38Å; R86-E123 IonicContact CZ-OE1 2.74Å; R86-E123 IonicContact NH1-OE1 3.31Å; R86-E123 PolarHBondContact NH1-OE1 3.2Å; N89-E123 PolarHBondContact ND2-OE1 2.96Å; V119-E123 PolarHBondContact O-N 2.83Å; V120-E123 PolarHBondContact O-N 3.48Å; R121-E123 VanDerWaalsContact C-N 3.32Å; R121-E123 PolarHBondContact O-N 3.36Å; E123-E125 PolarHBondContact O-N 2.89Å; E123-H126 PolarHBondContact O-N 3.2Å; E123-H126 VanDerWaalsContact O-N 3.15Å; E123-C127 PolarHBondContact O-N 2.82Å; E123-C127 PolarHBondContact O-SG 3.46Å; E123-C127 VanDerWaalsContact O-SG 3.38Å
124	C	93	Very high	93.7	Very high	13 Å²	13	47.3 Å²	47.3	9%	0.088	25%	0.245	C	C	.	.	H	α-helix	trans	-60.3	-41.3	176.1	-69.6	0	0	0	0	112.9	V120 R121 K122 H126 C127 L130 F133 Y159	V120-C124 PolarHBondContact O-N 3.39Å; V120-C124 PolarHBondContact O-SG 3.22Å; R121-C124 WeakPolarHBondContact O-CB 3.26Å; R121-C124 PolarHBondContact O-N 3.12Å; R121-C124 VanDerWaalsContact O-N 3.11Å; K122-C124 PolarHBondContact O-N 2.79Å; C124-H126 PolarHBondContact O-N 3.26Å; C124-C127 VanDerWaalsContact O-CB 3.29Å; C124-C127 WeakPolarHBondContact O-CB 3.31Å; C124-C127 PolarHBondContact O-N 3.12Å; C124-L130 HydrophobicContact CB-CD2 4.26Å; C124-F133 VanDerWaalsContact SG-CE1 3.51Å; C124-F133 VanDerWaalsContact SG-CZ 3.57Å; C124-Y159 HydrophobicContact CB-CE1 4.28Å
125	E	92.8	Very high	93.9	Very high	162 Å²	162	42.2 Å²	42.2	76%	0.757	22%	0.218	S	C	*	.	H	α-helix	trans	-66.1	-24.8	176.7	-71.9	-177.8	167.1	0	0	112.9	R121 K122 E123 C127	R121-E125 WeakPolarHBondContact O-CG 3.22Å; R121-E125 PolarHBondContact O-N 2.67Å; K122-E125 PolarHBondContact O-N 2.82Å; E123-E125 PolarHBondContact O-N 2.89Å; E125-C127 VanDerWaalsContact C-N 3.26Å; E125-C127 PolarHBondContact O-N 2.86Å
126	H	89.4	Confident	94	Very high	102 Å²	102	39.2 Å²	39.2	47%	0.472	20%	0.197	S	C	.	.	T	Hydrogen-bonded Turn	trans	-84.1	4.1	173.5	-69.3	75.9	0	0	0	112.9	R62 K122 E123 C124	R62-H126 PolarHBondContact NH2-O 3.29Å; K122-H126 PolarHBondContact O-N 2.84Å; K122-H126 PolarHBondContact O-ND1 2.85Å; E123-H126 PolarHBondContact O-N 3.2Å; E123-H126 VanDerWaalsContact O-N 3.15Å; C124-H126 PolarHBondContact O-N 3.26Å
127	C	91.4	Very high	94.1	Very high	18 Å²	18	39.3 Å²	39.3	12%	0.122	20%	0.197	C	C	.	.			trans	-94.3	137.8	174.2	-62.8	0	0	0	0	110.7	E3 R62 E123 C124 E125 L130	E3-C127 HydrophobicContact CB-CB 4.03Å; E3-C127 HydrophobicContact CG-CB 4.18Å; R62-C127 PolarHBondContact NH1-SG 2.88Å; R62-C127 PolarHBondContact NH2-SG 2.84Å; R62-C127 VanDerWaalsContact NH2-SG 3.42Å; E123-C127 PolarHBondContact O-N 2.82Å; E123-C127 PolarHBondContact O-SG 3.46Å; E123-C127 VanDerWaalsContact O-SG 3.38Å; C124-C127 VanDerWaalsContact O-CB 3.29Å; C124-C127 WeakPolarHBondContact O-CB 3.31Å; C124-C127 PolarHBondContact O-N 3.12Å; E125-C127 VanDerWaalsContact C-N 3.26Å; E125-C127 PolarHBondContact O-N 2.86Å; C127-L130 HydrophobicContact CB-CB 4.15Å
128	D	90.6	Very high	94.1	Very high	122 Å²	122	39.7 Å²	39.7	65%	0.652	20%	0.201	S	C	*	.	S	Bend	trans	-72.7	-42.7	170.7	-68.3	-25.4	0	0	0	111.2	M1 E3	M1-D128 HydrophobicContact CB-CB 4.41Å; M1-D128 VanDerWaalsContact SD-OD2 3.4Å; E3-D128 PolarHBondContact OE2-N 2.99Å
129	C	90.6	Very high	94	Very high	67 Å²	67	35.3 Å²	35.3	45%	0.453	18%	0.177	S	C	.	.	S	Bend	trans	-151.4	85.7	178.4	-171.3	0	0	0	0	111.2	M1 R2 E3 Q131	M1-C129 WeakPolarHBondContact O-CB 3.29Å; R2-C129 WeakPolarHBondContact CA-O 3.47Å; E3-C129 PolarHBondContact N-O 2.96Å; E3-C129 WeakPolarHBondContact OE2-CA 3.47Å; E3-C129 PolarHBondContact OE2-N 2.89Å; C129-Q131 PolarHBondContact O-N 3.43Å
130	L	93.1	Very high	93.8	Very high	11 Å²	11	34.4 Å²	34.4	6%	0.058	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-56.7	121.5	177.3	-179.1	67.6	0	0	0	111.7	V5 C124 C127 G132 F133 Y159 R162	V5-L130 HydrophobicContact CB-CD1 4.48Å; V5-L130 HydrophobicContact CG2-CD1 3.76Å; C124-L130 HydrophobicContact CB-CD2 4.26Å; C127-L130 HydrophobicContact CB-CB 4.15Å; L130-G132 WeakPolarHBondContact CD1-O 3.29Å; L130-F133 HydrophobicContact CD2-CE1 4.41Å; L130-F133 HydrophobicContact CD2-CE2 4.08Å; L130-F133 HydrophobicContact CD2-CZ 3.76Å; L130-Y159 HydrophobicContact CD2-CD1 4.49Å; L130-R162 HydrophobicContact CD2-CG 4.17Å; L130-R162 WeakPolarHBondContact O-CD 3.44Å; L130-R162 PolarHBondContact O-NH1 3Å
131	Q	90.8	Very high	93.6	Very high	23 Å²	23	34.9 Å²	34.9	11%	0.107	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.6	-43.9	170.7	-67.8	-167.9	67.4	0	0	111.7	R2 E3 I4 C129 I163 L250	R2-Q131 HydrophobicContact CB-CG 3.63Å; R2-Q131 HydrophobicContact CG-CG 4.35Å; R2-Q131 PolarHBondContact O-NE2 3.47Å; E3-Q131 WeakPolarHBondContact O-CB 3.45Å; E3-Q131 PolarHBondContact O-N 3.37Å; I4-Q131 HydrophobicContact CG1-CB 4.19Å; C129-Q131 PolarHBondContact O-N 3.43Å; Q131-I163 PolarHBondContact O-N 3.45Å; Q131-L250 HydrophobicContact CB-CD1 4.29Å
132	G	94	Very high	93.4	Very high	0 Å²	0	31.1 Å²	31.1	0%	0	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	165.5	-170.7	-166.6	0	0	0	0	0	113.8	V5 L130 I163	V5-G132 PolarHBondContact N-O 3.13Å; L130-G132 WeakPolarHBondContact CD1-O 3.29Å; G132-I163 CarbonylContact C-O 3.59Å; G132-I163 WeakPolarHBondContact CA-O 3.47Å
133	F	96.7	Very high	93.3	Very high	2 Å²	2	27.5 Å²	27.5	1%	0.009	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117	144.5	-176.6	-57.2	-88.7	0	0	0	110	V5 I7 V120 C124 L130 I155 Y159 R162 I163 M164 N165	V5-F133 HydrophobicContact CB-CD1 3.82Å; V5-F133 HydrophobicContact CB-CE1 4.09Å; V5-F133 HydrophobicContact CG1-CD1 4.13Å; V5-F133 HydrophobicContact CG1-CE1 4.37Å; V5-F133 HydrophobicContact CG2-CE1 4.43Å; V5-F133 WeakPolarHBondContact O-CA 3.4Å; I7-F133 HydrophobicContact CD1-CD1 4.12Å; V120-F133 HydrophobicContact CG1-CD1 4.31Å; V120-F133 HydrophobicContact CG1-CE1 3.58Å; V120-F133 HydrophobicContact CG1-CZ 4.37Å; C124-F133 VanDerWaalsContact SG-CE1 3.51Å; C124-F133 VanDerWaalsContact SG-CZ 3.57Å; L130-F133 HydrophobicContact CD2-CE1 4.41Å; L130-F133 HydrophobicContact CD2-CE2 4.08Å; L130-F133 HydrophobicContact CD2-CZ 3.76Å; F133-I155 HydrophobicContact CD1-CD1 4.21Å; F133-I155 HydrophobicContact CD1-CG2 4.22Å; F133-I155 HydrophobicContact CD2-CG2 3.34Å; F133-I155 HydrophobicContact CE1-CD1 4.48Å; F133-I155 HydrophobicContact CE1-CG2 4.16Å; F133-I155 HydrophobicContact CE2-CG2 3.26Å; F133-I155 HydrophobicContact CG-CD1 4.45Å; F133-I155 HydrophobicContact CG-CG2 3.83Å; F133-I155 HydrophobicContact CZ-CG2 3.69Å; F133-Y159 HydrophobicContact CE2-CD2 4.02Å; F133-Y159 AromaticContact CE2-CG 3.92Å; F133-Y159 HydrophobicContact CE2-CG 3.92Å; F133-Y159 HydrophobicContact CZ-CD1 4.41Å; F133-Y159 AromaticContact CZ-CD2 3.7Å; F133-Y159 HydrophobicContact CZ-CD2 3.7Å; F133-Y159 HydrophobicContact CZ-CE2 4.13Å; F133-Y159 AromaticContact CZ-CG 3.88Å; F133-Y159 HydrophobicContact CZ-CG 3.88Å; F133-R162 HydrophobicContact CD2-CB 4.46Å; F133-R162 HydrophobicContact CE2-CB 4.11Å; F133-I163 PolarHBondContact N-O 3.5Å; F133-M164 HydrophobicContact CB-CE 3.75Å; F133-M164 HydrophobicContact CB-SD 3.91Å; F133-M164 HydrophobicContact CD2-CE 4.05Å; F133-M164 HydrophobicContact CG-CE 4.1Å; F133-N165 PolarHBondContact O-N 3.06Å
134	Q	96.3	Very high	93.3	Very high	5 Å²	5	27.6 Å²	27.6	2%	0.023	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	107.7	173.4	-179.2	-176.5	-14.5	0	0	109.2	I4 V5 H6 I7 Y50 N165 F167	I4-Q134 HydrophobicContact CG2-CB 3.95Å; V5-Q134 PolarHBondContact O-N 3.49Å; H6-Q134 CarbonylContact C-O 3.55Å; H6-Q134 WeakPolarHBondContact CA-O 3.5Å; I7-Q134 PolarHBondContact N-O 3.13Å; Y50-Q134 PolarHBondContact OH-OE1 2.97Å; Q134-N165 CarbonylContact C-O 3.48Å; Q134-N165 WeakPolarHBondContact CA-O 3.27Å; Q134-F167 VanDerWaalsContact CD-CE2 3.5Å; Q134-F167 HydrophobicContact CG-CD2 3.77Å; Q134-F167 HydrophobicContact CG-CE2 3.64Å
135	L	97.3	Very high	93.4	Very high	3 Å²	3	27 Å²	27	2%	0.016	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.9	133.3	176.3	-177.1	68.4	0	0	0	111	I7 A9 H137 I152 N165 T166 F167	I7-L135 HydrophobicContact CB-CD1 3.82Å; I7-L135 HydrophobicContact CG2-CD1 3.66Å; I7-L135 CarbonylContact O-C 3.57Å; I7-L135 VanDerWaalsContact O-CA 3.31Å; I7-L135 WeakPolarHBondContact O-CA 3.28Å; A9-L135 HydrophobicContact CB-CD1 4.04Å; L135-H137 HydrophobicContact CD2-CB 4.4Å; L135-H137 WeakPolarHBondContact CD2-ND1 3.46Å; L135-H137 HydrophobicContact CG-CB 4.32Å; L135-I152 HydrophobicContact CD2-CD1 3.61Å; L135-I152 HydrophobicContact CD2-CG1 3.65Å; L135-N165 PolarHBondContact N-O 3.07Å; L135-T166 HydrophobicContact CB-CG2 4.25Å; L135-T166 CarbonylContact O-C 3.59Å; L135-T166 WeakPolarHBondContact O-CA 3.48Å; L135-F167 PolarHBondContact O-N 2.87Å
136	T	97.2	Very high	93.5	Very high	1 Å²	1	19.3 Å²	19.3	1%	0.006	11%	0.111	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	123.1	165	54.4	0	0	0	0	109.7	I7 Q8 A9 G13 F167 M233	I7-T136 PolarHBondContact O-N 3.42Å; I7-T136 PolarHBondContact O-OG1 3.08Å; Q8-T136 WeakPolarHBondContact CG-OG1 3.32Å; A9-T136 PolarHBondContact N-O 3.4Å; A9-T136 VanDerWaalsContact N-O 3.08Å; G13-T136 VanDerWaalsContact CA-O 3.22Å; G13-T136 WeakPolarHBondContact CA-O 3.4Å; G13-T136 PolarHBondContact O-OG1 3.1Å; T136-F167 HydrophobicContact CG2-CB 4.04Å; T136-F167 HydrophobicContact CG2-CD2 4.42Å; T136-M233 HydrophobicContact CG2-CE 3.3Å; T136-M233 HydrophobicContact CG2-SD 4.19Å
137	H	96.9	Very high	93.8	Very high	2 Å²	2	14.6 Å²	14.6	1%	0.009	9%	0.089	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-156.5	170.3	-177.8	69	172.1	0	0	0	112.2	A9 L135 L139 G144 F167 S168 V169	A9-H137 HydrophobicContact CB-CB 4.3Å; L135-H137 HydrophobicContact CD2-CB 4.4Å; L135-H137 WeakPolarHBondContact CD2-ND1 3.46Å; L135-H137 HydrophobicContact CG-CB 4.32Å; H137-L139 WeakPolarHBondContact NE2-CD2 3.27Å; H137-G144 WeakPolarHBondContact CB-O 3.4Å; H137-G144 PolarHBondContact ND1-O 3.24Å; H137-F167 PolarHBondContact N-O 3.22Å; H137-F167 VanDerWaalsContact N-O 3.15Å; H137-S168 PolarHBondContact CD2-OG 3.42Å; H137-S168 PolarHBondContact NE2-OG 2.9Å; H137-V169 PolarHBondContact O-N 3.43Å
138	S	95	Very high	93.9	Very high	17 Å²	17	13.8 Å²	13.8	12%	0.119	8%	0.084	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112	139.7	171.5	58.6	0	0	0	0	110.7	G144 S145	S138-G144 CarbonylContact O-C 3.59Å; S138-S145 PolarHBondContact O-N 3.1Å
139	L	94.6	Very high	94.2	Very high	0 Å²	0	8 Å²	8	0%	0	5%	0.053	C	C	.	.	S	Bend	trans	-83.3	-18.4	178.4	-50.7	-167.1	0	0	0	113.1	H137 S145 V169 M170 N184 A185 V189 L192	H137-L139 WeakPolarHBondContact NE2-CD2 3.27Å; L139-S145 WeakPolarHBondContact O-CB 3.47Å; L139-V169 PolarHBondContact N-O 3.43Å; L139-M170 HydrophobicContact CD1-CE 3.87Å; L139-M170 HydrophobicContact CD1-SD 3.5Å; L139-M170 WeakPolarHBondContact CD1-SD 3.35Å; L139-M170 HydrophobicContact CG-SD 4.28Å; L139-N184 CarbonylContact O-C 3.45Å; L139-N184 VanDerWaalsContact O-CB 3.31Å; L139-N184 WeakPolarHBondContact O-CB 3.18Å; L139-A185 HydrophobicContact CB-CB 4.12Å; L139-A185 PolarHBondContact O-N 2.97Å; L139-V189 HydrophobicContact CD1-CG2 3.8Å; L139-L192 HydrophobicContact CD1-CD1 3.81Å; L139-L192 HydrophobicContact CD2-CD1 3.82Å; L139-L192 HydrophobicContact CG-CD1 4.5Å
140	G	90.4	Very high	94.4	Very high	4 Å²	4	5.8 Å²	5.8	4%	0.041	4%	0.037	C	C	.	.	S	Bend	trans	-80.4	-24.3	-179.6	0	0	0	0	0	115.2	N184	G140-N184 PolarHBondContact O-ND2 3.4Å
141	G	91.4	Very high	94.6	Very high	12 Å²	12	5.5 Å²	5.5	12%	0.124	4%	0.035	C	C	.	.	S	Bend	trans	-74.8	-167	-178.4	0	0	0	0	0	113.4	S145 N184	G141-S145 VanDerWaalsContact C-OG 3.24Å; G141-S145 WeakPolarHBondContact O-CB 3.43Å; G141-S145 PolarHBondContact O-OG 2.88Å; G141-N184 WeakPolarHBondContact O-CB 3.48Å; G141-N184 VanDerWaalsContact O-CG 3.3Å; G141-N184 PolarHBondContact O-ND2 3.15Å
142	G	91.8	Very high	94.8	Very high	3 Å²	3	4.5 Å²	4.5	3%	0.031	3%	0.03	C	C	.	.	S	Bend	trans	-104.8	-48	170.4	0	0	0	0	0	113	N100 S145 G146	N100-G142 WeakPolarHBondContact O-CA 3.25Å; G142-S145 PolarHBondContact O-OG 3.22Å; G142-G146 PolarHBondContact O-N 2.99Å
143	T	93.8	Very high	94.9	Very high	11 Å²	11	5.7 Å²	5.7	7%	0.067	4%	0.039	C	C	.	.	I	π-helix	trans	-68.8	-58.3	179.4	-48.8	0	0	0	0	111.7	L68 S145 M147 G148	L68-T143 HydrophobicContact CB-CG2 4.07Å; L68-T143 HydrophobicContact CD1-CG2 3.97Å; L68-T143 HydrophobicContact CG-CG2 3.77Å; T143-S145 PolarHBondContact O-N 3.24Å; T143-M147 HydrophobicContact CG2-CB 4.4Å; T143-M147 HydrophobicContact CG2-SD 4.26Å; T143-M147 WeakPolarHBondContact O-CA 3.49Å; T143-M147 WeakPolarHBondContact O-CB 3.46Å; T143-M147 PolarHBondContact O-N 3.12Å; T143-G148 PolarHBondContact O-N 2.74Å
144	G	93.1	Very high	94.8	Very high	2 Å²	2	9 Å²	9	2%	0.021	5%	0.053	C	C	.	.	I	π-helix	trans	-61.8	-32	-176.3	0	0	0	0	0	112.7	A9 H137 S138 G148	A9-G144 WeakPolarHBondContact O-CA 3.29Å; H137-G144 WeakPolarHBondContact CB-O 3.4Å; H137-G144 PolarHBondContact ND1-O 3.24Å; S138-G144 CarbonylContact O-C 3.59Å; G144-G148 WeakPolarHBondContact O-CA 3.37Å
145	S	94.4	Very high	94.8	Very high	0 Å²	0	9 Å²	9	0%	0	5%	0.053	C	C	.	.	I	π-helix	trans	-82.1	-66.2	-179.5	64.7	0	0	0	0	110.8	S138 L139 G141 G142 T143 T149 S188	S138-S145 PolarHBondContact O-N 3.1Å; L139-S145 WeakPolarHBondContact O-CB 3.47Å; G141-S145 VanDerWaalsContact C-OG 3.24Å; G141-S145 WeakPolarHBondContact O-CB 3.43Å; G141-S145 PolarHBondContact O-OG 2.88Å; G142-S145 PolarHBondContact O-OG 3.22Å; T143-S145 PolarHBondContact O-N 3.24Å; S145-T149 WeakPolarHBondContact O-CB 3.13Å; S145-T149 WeakPolarHBondContact O-CG2 3.44Å; S145-T149 PolarHBondContact O-N 3.07Å; S145-T149 PolarHBondContact O-OG1 3.2Å; S145-S188 VanDerWaalsContact CB-OG 3.29Å; S145-S188 WeakPolarHBondContact CB-OG 3.37Å
146	G	94.7	Very high	94.7	Very high	0 Å²	0	12 Å²	12	0%	0	6%	0.064	C	C	.	.	I	π-helix	trans	-69.5	-51.7	-173.6	0	0	0	0	0	113.7	W101 G104 H105 G142 G148 T149 L150	W101-G146 VanDerWaalsContact CD1-N 3.31Å; G104-G146 CarbonylContact O-C 3.51Å; H105-G146 PolarHBondContact ND1-O 2.95Å; G142-G146 PolarHBondContact O-N 2.99Å; G146-G148 VanDerWaalsContact C-N 3.34Å; G146-T149 PolarHBondContact O-OG1 3.45Å; G146-T149 VanDerWaalsContact O-OG1 3.05Å; G146-L150 WeakPolarHBondContact O-CB 3.45Å; G146-L150 PolarHBondContact O-N 3.04Å
147	M	95.1	Very high	94.6	Very high	4 Å²	4	17.9 Å²	17.9	2%	0.02	9%	0.091	C	C	.	.	I	π-helix	trans	-70.6	-35.6	177.5	-169.6	-171.1	179	0	0	110.8	V66 L68 G104 L112 M113 V116 T143 L150 L151	V66-M147 HydrophobicContact CG1-CE 3.47Å; V66-M147 VanDerWaalsContact CG1-CE 3.47Å; V66-M147 HydrophobicContact CG1-SD 3.69Å; L68-M147 HydrophobicContact CD1-SD 4.47Å; L68-M147 HydrophobicContact CD2-SD 4.19Å; L68-M147 HydrophobicContact CG-SD 4.1Å; G104-M147 WeakPolarHBondContact O-CA 3.26Å; G104-M147 WeakPolarHBondContact O-CB 3.17Å; G104-M147 PolarHBondContact O-N 3.41Å; L112-M147 HydrophobicContact CB-CE 3.83Å; L112-M147 HydrophobicContact CD2-CE 3.93Å; L112-M147 HydrophobicContact CD2-SD 4.44Å; L112-M147 HydrophobicContact CG-CE 3.93Å; M113-M147 HydrophobicContact CE-CE 4.18Å; M113-M147 HydrophobicContact CE-CG 3.84Å; V116-M147 HydrophobicContact CG2-CE 3.67Å; T143-M147 HydrophobicContact CG2-CB 4.4Å; T143-M147 HydrophobicContact CG2-SD 4.26Å; T143-M147 WeakPolarHBondContact O-CA 3.49Å; T143-M147 WeakPolarHBondContact O-CB 3.46Å; T143-M147 PolarHBondContact O-N 3.12Å; M147-L150 PolarHBondContact O-N 3.35Å; M147-L151 WeakPolarHBondContact O-CB 3.28Å; M147-L151 PolarHBondContact O-N 3.25Å
148	G	95.2	Very high	94.5	Very high	0 Å²	0	21 Å²	21	0%	0	11%	0.106	C	C	.	.	H	α-helix	trans	-60	-47.3	175.4	0	0	0	0	0	112.3	T143 G144 G146 L151 I152	T143-G148 PolarHBondContact O-N 2.74Å; G144-G148 WeakPolarHBondContact O-CA 3.37Å; G146-G148 VanDerWaalsContact C-N 3.34Å; G148-L151 WeakPolarHBondContact O-CB 3.2Å; G148-L151 PolarHBondContact O-N 3.25Å; G148-I152 VanDerWaalsContact O-CG1 3.29Å; G148-I152 WeakPolarHBondContact O-CG1 3.46Å; G148-I152 PolarHBondContact O-N 2.99Å
149	T	95.6	Very high	94.5	Very high	1 Å²	1	22.4 Å²	22.4	1%	0.006	11%	0.109	C	C	.	.	H	α-helix	trans	-69.8	-35.7	178	56.7	0	0	0	0	112.9	H105 S145 G146 L151 I152 S153 Q191	H105-T149 PolarHBondContact ND1-OG1 3.23Å; S145-T149 WeakPolarHBondContact O-CB 3.13Å; S145-T149 WeakPolarHBondContact O-CG2 3.44Å; S145-T149 PolarHBondContact O-N 3.07Å; S145-T149 PolarHBondContact O-OG1 3.2Å; G146-T149 PolarHBondContact O-OG1 3.45Å; G146-T149 VanDerWaalsContact O-OG1 3.05Å; T149-L151 VanDerWaalsContact C-N 3.3Å; T149-L151 PolarHBondContact O-N 2.87Å; T149-I152 PolarHBondContact O-N 3.31Å; T149-S153 PolarHBondContact O-N 3.37Å; T149-Q191 HydrophobicContact CG2-CB 3.85Å; T149-Q191 HydrophobicContact CG2-CG 4.47Å
150	L	95.8	Very high	94.4	Very high	21 Å²	21	25.9 Å²	25.9	11%	0.11	13%	0.132	C	C	.	.	H	α-helix	trans	-59.3	-44.4	171.6	-178	66.7	0	0	0	110.9	H105 A110 M113 G146 M147 I152 S153 K154	H105-L150 WeakPolarHBondContact O-CD2 3.38Å; A110-L150 HydrophobicContact CB-CD2 4.13Å; M113-L150 HydrophobicContact CB-CD2 4.28Å; M113-L150 HydrophobicContact CE-CB 3.88Å; M113-L150 HydrophobicContact CE-CD2 3.6Å; M113-L150 HydrophobicContact CE-CG 3.69Å; M113-L150 HydrophobicContact CG-CD2 4.2Å; M113-L150 HydrophobicContact CG-CG 4.47Å; G146-L150 WeakPolarHBondContact O-CB 3.45Å; G146-L150 PolarHBondContact O-N 3.04Å; M147-L150 PolarHBondContact O-N 3.35Å; L150-I152 PolarHBondContact O-N 2.81Å; L150-S153 PolarHBondContact O-N 3.46Å; L150-K154 WeakPolarHBondContact O-CG 3.43Å; L150-K154 PolarHBondContact O-N 3.08Å
151	L	95.9	Very high	94.4	Very high	4 Å²	4	31.8 Å²	31.8	2%	0.021	16%	0.162	C	C	.	.	H	α-helix	trans	-63.1	-42.5	178.3	-176.8	61.8	0	0	0	111.8	I7 M113 V116 L117 M147 G148 T149 S153 K154 I155	I7-L151 HydrophobicContact CD1-CD2 4.15Å; I7-L151 HydrophobicContact CG2-CD2 3.62Å; M113-L151 HydrophobicContact CE-CB 3.76Å; M113-L151 HydrophobicContact CE-CD1 4.35Å; M113-L151 HydrophobicContact SD-CB 4.01Å; M113-L151 HydrophobicContact SD-CD1 3.5Å; M113-L151 VanDerWaalsContact SD-CD1 3.5Å; M113-L151 HydrophobicContact SD-CG 4.35Å; V116-L151 HydrophobicContact CG1-CD1 3.75Å; V116-L151 HydrophobicContact CG1-CD2 3.96Å; L117-L151 HydrophobicContact CD2-CD1 3.84Å; L117-L151 HydrophobicContact CG-CD1 4.43Å; M147-L151 WeakPolarHBondContact O-CB 3.28Å; M147-L151 PolarHBondContact O-N 3.25Å; G148-L151 WeakPolarHBondContact O-CB 3.2Å; G148-L151 PolarHBondContact O-N 3.25Å; T149-L151 VanDerWaalsContact C-N 3.3Å; T149-L151 PolarHBondContact O-N 2.87Å; L151-S153 VanDerWaalsContact C-N 3.34Å; L151-S153 PolarHBondContact O-N 2.93Å; L151-K154 PolarHBondContact O-N 3.44Å; L151-I155 HydrophobicContact CD1-CD1 3.89Å; L151-I155 HydrophobicContact CD1-CG1 4.13Å; L151-I155 HydrophobicContact CD2-CD1 4.44Å; L151-I155 HydrophobicContact CG-CD1 3.78Å; L151-I155 HydrophobicContact CG-CG1 4.37Å; L151-I155 WeakPolarHBondContact O-CB 3.48Å; L151-I155 VanDerWaalsContact O-CG1 3.26Å; L151-I155 WeakPolarHBondContact O-CG1 3.39Å; L151-I155 PolarHBondContact O-N 2.95Å
152	I	96.4	Very high	94.6	Very high	3 Å²	3	35.6 Å²	35.6	2%	0.015	17%	0.173	C	C	.	.	H	α-helix	trans	-57.6	-49.6	175.6	-67.4	169.7	0	0	0	110.1	L135 G148 T149 L150 K154 I155 R156 M164 T166 L192 N195 T196	L135-I152 HydrophobicContact CD2-CD1 3.61Å; L135-I152 HydrophobicContact CD2-CG1 3.65Å; G148-I152 VanDerWaalsContact O-CG1 3.29Å; G148-I152 WeakPolarHBondContact O-CG1 3.46Å; G148-I152 PolarHBondContact O-N 2.99Å; T149-I152 PolarHBondContact O-N 3.31Å; L150-I152 PolarHBondContact O-N 2.81Å; I152-K154 PolarHBondContact O-N 2.84Å; I152-I155 PolarHBondContact O-N 3.5Å; I152-R156 WeakPolarHBondContact O-CB 3.43Å; I152-R156 PolarHBondContact O-N 3.45Å; I152-M164 HydrophobicContact CG1-SD 4.31Å; I152-M164 HydrophobicContact CG2-CE 4.48Å; I152-M164 HydrophobicContact CG2-CG 3.9Å; I152-M164 HydrophobicContact CG2-SD 4.41Å; I152-T166 HydrophobicContact CD1-CG2 3.74Å; I152-L192 HydrophobicContact CD1-CD2 3.54Å; I152-N195 HydrophobicContact CG2-CB 3.55Å; I152-N195 WeakPolarHBondContact CG2-O 3.38Å; I152-T196 HydrophobicContact CD1-CG2 3.97Å; I152-T196 HydrophobicContact CG2-CG2 3.75Å
153	S	95.3	Very high	94.6	Very high	25 Å²	25	35.8 Å²	35.8	18%	0.175	17%	0.173	C	C	.	.	H	α-helix	trans	-59	-47.5	180	177.6	0	0	0	0	111.4	T149 L150 L151 I155 R156 E157	T149-S153 PolarHBondContact O-N 3.37Å; L150-S153 PolarHBondContact O-N 3.46Å; L151-S153 VanDerWaalsContact C-N 3.34Å; L151-S153 PolarHBondContact O-N 2.93Å; S153-I155 PolarHBondContact O-N 3Å; S153-R156 WeakPolarHBondContact O-CB 3.33Å; S153-R156 PolarHBondContact O-N 2.93Å; S153-R156 VanDerWaalsContact O-N 3.11Å; S153-E157 WeakPolarHBondContact O-CG 3.49Å; S153-E157 PolarHBondContact O-N 3.37Å
154	K	95.5	Very high	94.7	Very high	72 Å²	72	35.4 Å²	35.4	31%	0.313	17%	0.171	S	C	.	.	H	α-helix	trans	-64.7	-39.1	177.8	-68.1	-66.1	166.5	-153.1	0	113.9	M113 L117 L150 L151 I152 R156 E157 E158	M113-K154 HydrophobicContact CG-CG 4.33Å; L117-K154 HydrophobicContact CD1-CB 3.91Å; L117-K154 HydrophobicContact CD1-CG 4.26Å; L117-K154 HydrophobicContact CD2-CB 4.03Å; L150-K154 WeakPolarHBondContact O-CG 3.43Å; L150-K154 PolarHBondContact O-N 3.08Å; L151-K154 PolarHBondContact O-N 3.44Å; I152-K154 PolarHBondContact O-N 2.84Å; K154-R156 VanDerWaalsContact C-N 3.31Å; K154-E157 WeakPolarHBondContact CD-OE2 3.24Å; K154-E157 IonicContact NZ-OE1 3.93Å; K154-E157 PolarHBondContact NZ-OE1 3.27Å; K154-E157 IonicContact NZ-OE2 2.72Å; K154-E157 PolarHBondContact NZ-OE2 2.86Å; K154-E157 PolarHBondContact O-N 3.18Å; K154-E158 PolarHBondContact O-N 2.97Å; K154-E158 VanDerWaalsContact O-N 3.09Å
155	I	95.6	Very high	94.8	Very high	3 Å²	3	35.6 Å²	35.6	2%	0.015	17%	0.171	C	C	.	.	H	α-helix	trans	-66.2	-36.8	173.8	-69.7	172.9	0	0	0	110.6	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 4.19Å; V120-I155 HydrophobicContact CG1-CD1 4.33Å; F133-I155 HydrophobicContact CD1-CD1 4.21Å; F133-I155 HydrophobicContact CD1-CG2 4.22Å; F133-I155 HydrophobicContact CD2-CG2 3.34Å; F133-I155 HydrophobicContact CE1-CD1 4.48Å; F133-I155 HydrophobicContact CE1-CG2 4.16Å; F133-I155 HydrophobicContact CE2-CG2 3.26Å; F133-I155 HydrophobicContact CG-CD1 4.45Å; F133-I155 HydrophobicContact CG-CG2 3.83Å; F133-I155 HydrophobicContact CZ-CG2 3.69Å; L151-I155 HydrophobicContact CD1-CD1 3.89Å; L151-I155 HydrophobicContact CD1-CG1 4.13Å; L151-I155 HydrophobicContact CD2-CD1 4.44Å; L151-I155 HydrophobicContact CG-CD1 3.78Å; L151-I155 HydrophobicContact CG-CG1 4.37Å; L151-I155 WeakPolarHBondContact O-CB 3.48Å; L151-I155 VanDerWaalsContact O-CG1 3.26Å; L151-I155 WeakPolarHBondContact O-CG1 3.39Å; L151-I155 PolarHBondContact O-N 2.95Å; I152-I155 PolarHBondContact O-N 3.5Å; S153-I155 PolarHBondContact O-N 3Å; I155-E158 PolarHBondContact O-N 3.42Å; I155-Y159 HydrophobicContact CG2-CD2 4.13Å; I155-Y159 WeakPolarHBondContact O-CA 3.46Å; I155-Y159 WeakPolarHBondContact O-CB 3.11Å; I155-Y159 PolarHBondContact O-N 3.47Å; I155-M164 HydrophobicContact CB-CE 3.73Å; I155-M164 HydrophobicContact CD1-CE 4.17Å; I155-M164 HydrophobicContact CG2-CE 3.35Å
156	R	94.4	Very high	94.9	Very high	68 Å²	68	35.6 Å²	35.6	26%	0.257	17%	0.171	S	C	.	.	H	α-helix	trans	-68.3	-35.8	177.5	-168.9	59.8	167.6	-157.1	-13.4	112.1	I152 S153 K154 P160 R162 D197	I152-R156 WeakPolarHBondContact O-CB 3.43Å; I152-R156 PolarHBondContact O-N 3.45Å; S153-R156 WeakPolarHBondContact O-CB 3.33Å; S153-R156 PolarHBondContact O-N 2.93Å; S153-R156 VanDerWaalsContact O-N 3.11Å; K154-R156 VanDerWaalsContact C-N 3.31Å; R156-P160 WeakPolarHBondContact O-CA 3.25Å; R156-R162 PolarHBondContact NH1-O 3.46Å; R156-D197 IonicContact CZ-OD1 3.42Å; R156-D197 IonicContact CZ-OD2 3.17Å; R156-D197 IonicContact NH1-OD1 3.19Å; R156-D197 PolarHBondContact NH1-OD1 3.19Å; R156-D197 IonicContact NH1-OD2 3.29Å; R156-D197 PolarHBondContact NH1-OD2 3.23Å; R156-D197 IonicContact NH2-OD1 3.34Å; R156-D197 PolarHBondContact NH2-OD1 3.06Å; R156-D197 IonicContact NH2-OD2 3.33Å
157	E	94.6	Very high	95	Very high	123 Å²	123	35.9 Å²	35.9	58%	0.575	17%	0.173	S	C	*	.	H	α-helix	trans	-62.3	-45.4	171.6	-72.2	174.7	-169.8	0	0	111.7	S153 K154	S153-E157 WeakPolarHBondContact O-CG 3.49Å; S153-E157 PolarHBondContact O-N 3.37Å; K154-E157 WeakPolarHBondContact CD-OE2 3.24Å; K154-E157 IonicContact NZ-OE1 3.93Å; K154-E157 PolarHBondContact NZ-OE1 3.27Å; K154-E157 IonicContact NZ-OE2 2.72Å; K154-E157 PolarHBondContact NZ-OE2 2.86Å; K154-E157 PolarHBondContact O-N 3.18Å
158	E	94.9	Very high	95.1	Very high	69 Å²	69	35.7 Å²	35.7	32%	0.322	17%	0.172	S	C	.	.	H	α-helix	trans	-82.9	-32.7	-175.4	-167.1	175.7	147.8	0	0	113.5	R121 K154 I155 P160	R121-E158 WeakPolarHBondContact CD-OE1 3.01Å; R121-E158 WeakPolarHBondContact CG-OE1 3.31Å; R121-E158 IonicContact CZ-OE1 2.73Å; R121-E158 IonicContact CZ-OE2 2.67Å; R121-E158 VanDerWaalsContact CZ-OE2 3.27Å; R121-E158 VanDerWaalsContact NE-CD 3.3Å; R121-E158 IonicContact NE-OE1 2.85Å; R121-E158 PolarHBondContact NE-OE1 2.83Å; R121-E158 IonicContact NE-OE2 2.73Å; R121-E158 PolarHBondContact NE-OE2 2.88Å; R121-E158 IonicContact NH2-OE2 3.69Å; R121-E158 PolarHBondContact NH2-OE2 2.88Å; K154-E158 PolarHBondContact O-N 2.97Å; K154-E158 VanDerWaalsContact O-N 3.09Å; I155-E158 PolarHBondContact O-N 3.42Å; E158-P160 VanDerWaalsContact C-CD 3.44Å; E158-P160 WeakPolarHBondContact O-CD 3.42Å
159	Y	95.1	Very high	95.1	Very high	45 Å²	45	35.9 Å²	35.9	18%	0.176	17%	0.172	C	C	.	.			trans	-127.5	60.6	-176.1	-57.3	-84.3	0	0	0	112.2	C124 L130 F133 I155 D161 R162	C124-Y159 HydrophobicContact CB-CE1 4.28Å; L130-Y159 HydrophobicContact CD2-CD1 4.49Å; F133-Y159 HydrophobicContact CE2-CD2 4.02Å; F133-Y159 AromaticContact CE2-CG 3.92Å; F133-Y159 HydrophobicContact CE2-CG 3.92Å; F133-Y159 HydrophobicContact CZ-CD1 4.41Å; F133-Y159 AromaticContact CZ-CD2 3.7Å; F133-Y159 HydrophobicContact CZ-CD2 3.7Å; F133-Y159 HydrophobicContact CZ-CE2 4.13Å; F133-Y159 AromaticContact CZ-CG 3.88Å; F133-Y159 HydrophobicContact CZ-CG 3.88Å; I155-Y159 HydrophobicContact CG2-CD2 4.13Å; I155-Y159 WeakPolarHBondContact O-CA 3.46Å; I155-Y159 WeakPolarHBondContact O-CB 3.11Å; I155-Y159 PolarHBondContact O-N 3.47Å; Y159-D161 VanDerWaalsContact C-N 3.25Å; Y159-D161 PolarHBondContact O-N 3.4Å; Y159-R162 HydrophobicContact CD1-CG 4.43Å; Y159-R162 PolarHBondContact O-N 3.33Å; Y159-R162 VanDerWaalsContact O-N 3.12Å
160	P	93.5	Very high	94.9	Very high	73 Å²	73	35.8 Å²	35.8	47%	0.474	17%	0.172	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63	-30.3	-174.7	25.3	-35.4	0	0	0	113.5	R156 E158 R162	R156-P160 WeakPolarHBondContact O-CA 3.25Å; E158-P160 VanDerWaalsContact C-CD 3.44Å; E158-P160 WeakPolarHBondContact O-CD 3.42Å; P160-R162 VanDerWaalsContact C-N 3.27Å; P160-R162 PolarHBondContact O-N 3.13Å
161	D	91.1	Very high	94.5	Very high	128 Å²	128	35.4 Å²	35.4	68%	0.684	17%	0.171	S	C	*	.	T	Hydrogen-bonded Turn	trans	-82.3	0.8	-179.1	-66	-38.1	0	0	0	113.7	Y159 R251	Y159-D161 VanDerWaalsContact C-N 3.25Å; Y159-D161 PolarHBondContact O-N 3.4Å; D161-R251 PolarHBondContact O-NH2 2.89Å
162	R	93.8	Very high	93.9	Very high	93 Å²	93	35.2 Å²	35.2	35%	0.351	17%	0.17	S	C	.	.	S	Bend	trans	-104.2	145.7	-176.3	-56.8	-59.7	177.8	-173	-8.5	110.8	L130 F133 R156 Y159 P160	L130-R162 HydrophobicContact CD2-CG 4.17Å; L130-R162 WeakPolarHBondContact O-CD 3.44Å; L130-R162 PolarHBondContact O-NH1 3Å; F133-R162 HydrophobicContact CD2-CB 4.46Å; F133-R162 HydrophobicContact CE2-CB 4.11Å; R156-R162 PolarHBondContact NH1-O 3.46Å; Y159-R162 HydrophobicContact CD1-CG 4.43Å; Y159-R162 PolarHBondContact O-N 3.33Å; Y159-R162 VanDerWaalsContact O-N 3.12Å; P160-R162 VanDerWaalsContact C-N 3.27Å; P160-R162 PolarHBondContact O-N 3.13Å
163	I	93.5	Very high	92.8	Very high	6 Å²	6	38.8 Å²	38.8	3%	0.031	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.6	132.3	-179.5	-65.6	-65.7	0	0	0	109.8	Q131 G132 F133 N165 D197 L250 R251 A254	Q131-I163 PolarHBondContact O-N 3.45Å; G132-I163 CarbonylContact C-O 3.59Å; G132-I163 WeakPolarHBondContact CA-O 3.47Å; F133-I163 PolarHBondContact N-O 3.5Å; I163-N165 WeakPolarHBondContact CG2-OD1 3.34Å; I163-D197 VanDerWaalsContact CA-OD2 3.31Å; I163-D197 WeakPolarHBondContact CA-OD2 3.37Å; I163-D197 HydrophobicContact CD1-CB 4.31Å; I163-D197 HydrophobicContact CG2-CB 4.29Å; I163-L250 HydrophobicContact CB-CB 4.34Å; I163-L250 HydrophobicContact CG1-CB 4.46Å; I163-L250 HydrophobicContact CG2-CB 4.08Å; I163-L250 HydrophobicContact CG2-CD1 4.46Å; I163-R251 HydrophobicContact CD1-CB 4.29Å; I163-R251 HydrophobicContact CD1-CG 4.41Å; I163-R251 HydrophobicContact CG1-CB 4.1Å; I163-A254 HydrophobicContact CD1-CB 4.41Å
164	M	95.8	Very high	91.8	Very high	4 Å²	4	42.1 Å²	42.1	2%	0.02	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	112.4	175.1	178.6	56.7	72	0	0	110.6	F133 I152 I155 T196 D197 Q198	F133-M164 HydrophobicContact CB-CE 3.75Å; F133-M164 HydrophobicContact CB-SD 3.91Å; F133-M164 HydrophobicContact CD2-CE 4.05Å; F133-M164 HydrophobicContact CG-CE 4.1Å; I152-M164 HydrophobicContact CG1-SD 4.31Å; I152-M164 HydrophobicContact CG2-CE 4.48Å; I152-M164 HydrophobicContact CG2-CG 3.9Å; I152-M164 HydrophobicContact CG2-SD 4.41Å; I155-M164 HydrophobicContact CB-CE 3.73Å; I155-M164 HydrophobicContact CD1-CE 4.17Å; I155-M164 HydrophobicContact CG2-CE 3.35Å; M164-T196 HydrophobicContact CG-CG2 4.02Å; M164-D197 PolarHBondContact N-OD2 3.21Å; M164-D197 PolarHBondContact O-N 2.79Å; M164-Q198 PolarHBondContact O-N 3.42Å
165	N	94.9	Very high	90.6	Very high	6 Å²	6	40.1 Å²	40.1	3%	0.032	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	137.8	179.8	-74.3	2.9	0	0	0	111.2	F133 Q134 L135 I163 Q198 L250	F133-N165 PolarHBondContact O-N 3.06Å; Q134-N165 CarbonylContact C-O 3.48Å; Q134-N165 WeakPolarHBondContact CA-O 3.27Å; L135-N165 PolarHBondContact N-O 3.07Å; I163-N165 WeakPolarHBondContact CG2-OD1 3.34Å; N165-Q198 CarbonylContact C-O 3.26Å; N165-Q198 WeakPolarHBondContact CA-O 3.35Å; N165-Q198 PolarHBondContact ND2-OE1 3.28Å; N165-Q198 WeakPolarHBondContact OD1-CB 3.32Å; N165-Q198 WeakPolarHBondContact OD1-CG 3.45Å; N165-Q198 PolarHBondContact OD1-OE1 2.94Å; N165-Q198 VanDerWaalsContact OD1-OE1 3.12Å; N165-L250 VanDerWaalsContact ND2-CD2 3.32Å; N165-L250 WeakPolarHBondContact ND2-CD2 3.48Å
166	T	97	Very high	89.5	Confident	0 Å²	0	41.3 Å²	41.3	0%	0	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	140.5	176	79.2	0	0	0	0	112.1	L135 I152 S168 L192 T196 Q198 T199 Y200	L135-T166 HydrophobicContact CB-CG2 4.25Å; L135-T166 CarbonylContact O-C 3.59Å; L135-T166 WeakPolarHBondContact O-CA 3.48Å; I152-T166 HydrophobicContact CD1-CG2 3.74Å; T166-S168 PolarHBondContact OG1-OG 2.81Å; T166-L192 HydrophobicContact CG2-CD2 4.03Å; T166-T196 HydrophobicContact CG2-CG2 3.59Å; T166-Q198 PolarHBondContact N-O 2.93Å; T166-T199 WeakPolarHBondContact OG1-CB 3.33Å; T166-T199 WeakPolarHBondContact OG1-CG2 3.1Å; T166-T199 PolarHBondContact OG1-OG1 2.81Å; T166-Y200 WeakPolarHBondContact O-CD2 3.47Å; T166-Y200 PolarHBondContact O-N 2.93Å
167	F	97.1	Very high	88.4	Confident	6 Å²	6	45.9 Å²	45.9	3%	0.026	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	99.9	164.2	-70.5	-87.5	0	0	0	106.5	Q134 L135 T136 H137 Y200 I202 M233 V236	Q134-F167 VanDerWaalsContact CD-CE2 3.5Å; Q134-F167 HydrophobicContact CG-CD2 3.77Å; Q134-F167 HydrophobicContact CG-CE2 3.64Å; L135-F167 PolarHBondContact O-N 2.87Å; T136-F167 HydrophobicContact CG2-CB 4.04Å; T136-F167 HydrophobicContact CG2-CD2 4.42Å; H137-F167 PolarHBondContact N-O 3.22Å; H137-F167 VanDerWaalsContact N-O 3.15Å; F167-Y200 AromaticContact CD1-CD2 4Å; F167-Y200 HydrophobicContact CD1-CD2 4Å; F167-Y200 AromaticContact CD1-CG 3.94Å; F167-Y200 HydrophobicContact CD1-CG 3.94Å; F167-Y200 HydrophobicContact CE1-CD1 4.26Å; F167-Y200 AromaticContact CE1-CD2 3.62Å; F167-Y200 HydrophobicContact CE1-CD2 3.62Å; F167-Y200 HydrophobicContact CE1-CE2 4.26Å; F167-Y200 AromaticContact CE1-CG 3.65Å; F167-Y200 HydrophobicContact CE1-CG 3.65Å; F167-Y200 HydrophobicContact CE2-CD2 4.16Å; F167-Y200 HydrophobicContact CE2-CE2 4.47Å; F167-Y200 HydrophobicContact CG-CD2 4.45Å; F167-Y200 AromaticContact CZ-CD2 3.73Å; F167-Y200 HydrophobicContact CZ-CD2 3.73Å; F167-Y200 AromaticContact CZ-CE2 3.99Å; F167-Y200 HydrophobicContact CZ-CE2 3.99Å; F167-Y200 HydrophobicContact CZ-CG 4.22Å; F167-I202 HydrophobicContact CB-CD1 4.07Å; F167-I202 HydrophobicContact CD1-CD1 4.09Å; F167-M233 HydrophobicContact CD1-CG 3.61Å; F167-M233 HydrophobicContact CD1-SD 4.46Å; F167-M233 HydrophobicContact CD2-CE 4.09Å; F167-M233 HydrophobicContact CE1-CB 4.35Å; F167-M233 HydrophobicContact CE1-CG 3.68Å; F167-M233 HydrophobicContact CE2-CE 4.47Å; F167-M233 HydrophobicContact CG-CE 4.2Å; F167-M233 HydrophobicContact CG-CG 4.05Å; F167-M233 HydrophobicContact CG-SD 4.38Å; F167-M233 HydrophobicContact CZ-CG 4.2Å; F167-V236 HydrophobicContact CZ-CB 4.41Å; F167-V236 HydrophobicContact CZ-CG1 4.08Å
168	S	96.5	Very high	87.9	Confident	0 Å²	0	42.1 Å²	42.1	0%	0	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	112.4	-168.4	-68.1	0	0	0	0	110.1	H137 T166 M170 Y200 I202	H137-S168 PolarHBondContact CD2-OG 3.42Å; H137-S168 PolarHBondContact NE2-OG 2.9Å; T166-S168 PolarHBondContact OG1-OG 2.81Å; S168-M170 PolarHBondContact O-N 2.83Å; S168-Y200 PolarHBondContact N-O 3.3Å; S168-I202 PolarHBondContact O-N 2.94Å
169	V	95	Very high	87.5	Confident	3 Å²	3	42.8 Å²	42.8	2%	0.018	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.9	118.3	175.6	-175.2	0	0	0	0	110.1	I16 H137 L139 I202 N204	I16-V169 HydrophobicContact CD1-CG2 3.38Å; H137-V169 PolarHBondContact O-N 3.43Å; L139-V169 PolarHBondContact N-O 3.43Å; V169-I202 CarbonylContact C-O 3.54Å; V169-I202 VanDerWaalsContact CA-O 3.26Å; V169-I202 WeakPolarHBondContact CA-O 3.4Å; V169-I202 HydrophobicContact CG2-CB 4.33Å; V169-I202 HydrophobicContact CG2-CG2 4.26Å; V169-N204 WeakPolarHBondContact CG1-ND2 3.41Å; V169-N204 WeakPolarHBondContact CG1-OD1 3.32Å
170	M	91.5	Very high	87.4	Confident	0 Å²	0	40.8 Å²	40.8	0%	0	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.8	137.4	179.1	-57.7	-66.2	-175.4	0	0	110	L139 S168 C201 I202 D203 L377 I381	L139-M170 HydrophobicContact CD1-CE 3.87Å; L139-M170 HydrophobicContact CD1-SD 3.5Å; L139-M170 WeakPolarHBondContact CD1-SD 3.35Å; L139-M170 HydrophobicContact CG-SD 4.28Å; S168-M170 PolarHBondContact O-N 2.83Å; M170-C201 HydrophobicContact CE-CB 3.92Å; M170-C201 WeakPolarHBondContact CE-SG 3.44Å; M170-I202 PolarHBondContact N-O 3.11Å; M170-D203 HydrophobicContact CB-CB 4.48Å; M170-L377 HydrophobicContact CB-CD1 4.36Å; M170-L377 HydrophobicContact CE-CD2 3.99Å; M170-L377 HydrophobicContact CG-CD1 3.94Å; M170-L377 HydrophobicContact CG-CD2 3.94Å; M170-L377 HydrophobicContact CG-CG 4.48Å; M170-L377 HydrophobicContact SD-CD2 3.9Å; M170-I381 HydrophobicContact SD-CD1 4.28Å
171	P	88.2	Confident	87.3	Confident	12 Å²	12	38.3 Å²	38.3	8%	0.078	21%	0.205	C	C	.	.	P	Polyproline II helix	trans	-67.9	153.2	177.6	28.3	-34	0	0	0	111.8	E181 A185	P171-E181 HydrophobicContact CB-CB 3.69Å; P171-E181 HydrophobicContact CB-CG 4.26Å; P171-E181 WeakPolarHBondContact CB-OE2 3.47Å; P171-E181 HydrophobicContact CG-CB 4.18Å; P171-A185 HydrophobicContact CG-CB 3.81Å
172	S	81.8	Confident	87.5	Confident	1 Å²	1	32.7 Å²	32.7	1%	0.007	18%	0.175	C	C	.	.			trans	-143.9	133	172.9	177.9	0	0	0	0	111	K174 V175 S176 E205	S172-K174 PolarHBondContact O-N 3.28Å; S172-K174 VanDerWaalsContact O-N 3.08Å; S172-K174 PolarHBondContact OG-N 3.12Å; S172-V175 PolarHBondContact O-N 2.94Å; S172-S176 PolarHBondContact O-N 2.86Å; S172-S176 VanDerWaalsContact O-N 3.11Å; S172-E205 WeakPolarHBondContact OG-CB 3.44Å
173	P	73.7	Confident	87.5	Confident	77 Å²	77	28.2 Å²	28.2	50%	0.5	16%	0.159	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.8	-17.5	174.3	-20.8	31	0	0	0	114.3	V175	P173-V175 VanDerWaalsContact C-N 3.31Å
174	K	73.6	Confident	87.6	Confident	96 Å²	96	28 Å²	28	42%	0.417	16%	0.157	S	C	.	.	T	Hydrogen-bonded Turn	trans	-76.2	-21.5	177.1	-68.3	-175.9	-176.1	158.1	0	112.9	S172 E205 D209	S172-K174 PolarHBondContact O-N 3.28Å; S172-K174 VanDerWaalsContact O-N 3.08Å; S172-K174 PolarHBondContact OG-N 3.12Å; K174-E205 HydrophobicContact CD-CG 4.04Å; K174-E205 WeakPolarHBondContact CE-OE1 3.07Å; K174-E205 IonicContact NZ-OE1 3.84Å; K174-E205 PolarHBondContact NZ-OE1 2.86Å; K174-D209 IonicContact NZ-OD1 3.54Å; K174-D209 IonicContact NZ-OD2 2.74Å; K174-D209 PolarHBondContact NZ-OD2 2.99Å
175	V	71.4	Confident	87.6	Confident	30 Å²	30	27.8 Å²	27.8	18%	0.182	16%	0.156	C	C	.	.	T	Hydrogen-bonded Turn	trans	-115.3	-28.4	-169.1	179.1	0	0	0	0	112	S172 P173 N204 Y208 Y222 L225	S172-V175 PolarHBondContact O-N 2.94Å; P173-V175 VanDerWaalsContact C-N 3.31Å; V175-N204 HydrophobicContact CB-CB 4.07Å; V175-N204 HydrophobicContact CG1-CB 4.21Å; V175-N204 HydrophobicContact CG2-CB 3.94Å; V175-Y208 HydrophobicContact CG2-CD2 4.3Å; V175-Y208 HydrophobicContact CG2-CG 4.43Å; V175-Y222 HydrophobicContact CG1-CE1 3.76Å; V175-Y222 WeakPolarHBondContact CG1-OH 3.48Å; V175-Y222 PolarHBondContact O-OH 2.88Å; V175-L225 HydrophobicContact CG1-CD2 4.47Å
176	S	73	Confident	87.6	Confident	27 Å²	27	27.5 Å²	27.5	19%	0.189	16%	0.155	C	C	.	.			trans	-128.4	139.5	179.5	-175.8	0	0	0	0	112.2	S172 T178 E181	S172-S176 PolarHBondContact O-N 2.86Å; S172-S176 VanDerWaalsContact O-N 3.11Å; S176-T178 VanDerWaalsContact C-N 3.33Å; S176-T178 PolarHBondContact OG-N 2.79Å; S176-E181 WeakPolarHBondContact CB-OE1 3.27Å; S176-E181 PolarHBondContact OG-OE1 2.83Å
177	D	71.4	Confident	87.6	Confident	165 Å²	165	27.8 Å²	27.8	88%	0.882	16%	0.156	S	C	*	.			trans	-88.2	0.1	176	-65.5	-42.1	0	0	0	112.7	V179	D177-V179 PolarHBondContact O-N 3.37Å
178	T	83.4	Confident	87.6	Confident	43 Å²	43	27.5 Å²	27.5	26%	0.264	16%	0.155	S	C	.	.			trans	-75.6	117	-176.9	-58.5	0	0	0	0	110.6	N99 S176 V180 E181	N99-T178 HydrophobicContact CB-CG2 3.97Å; N99-T178 PolarHBondContact ND2-OG1 3.43Å; S176-T178 VanDerWaalsContact C-N 3.33Å; S176-T178 PolarHBondContact OG-N 2.79Å; T178-V180 HydrophobicContact CG2-CG2 3.7Å; T178-V180 PolarHBondContact O-N 2.77Å; T178-E181 HydrophobicContact CG2-CG 3.94Å; T178-E181 WeakPolarHBondContact O-CG 3.23Å
179	V	86.6	Confident	87.5	Confident	83 Å²	83	27.5 Å²	27.5	50%	0.503	16%	0.155	S	C	.	.	T	Hydrogen-bonded Turn	trans	-74.7	-24	-175	-62.9	0	0	0	0	114.2	D177 P182 M388 F394	D177-V179 PolarHBondContact O-N 3.37Å; V179-P182 WeakPolarHBondContact O-CD 3.09Å; V179-M388 VanDerWaalsContact O-CE 3.27Å; V179-M388 WeakPolarHBondContact O-CE 3.33Å; V179-F394 HydrophobicContact CG2-CD2 4.04Å; V179-F394 HydrophobicContact CG2-CE2 3.51Å; V179-F394 HydrophobicContact CG2-CZ 3.91Å
180	V	92.4	Very high	87.5	Confident	3 Å²	3	29 Å²	29	2%	0.018	16%	0.162	C	C	.	.	T	Hydrogen-bonded Turn	trans	-86.2	-0.7	-176	-63.2	0	0	0	0	114.4	N99 T178 P182 Y183 N184 F394 F398	N99-V180 HydrophobicContact CB-CG2 4.27Å; N99-V180 WeakPolarHBondContact O-CG2 3.27Å; T178-V180 HydrophobicContact CG2-CG2 3.7Å; T178-V180 PolarHBondContact O-N 2.77Å; V180-P182 VanDerWaalsContact C-CD 3.45Å; V180-P182 VanDerWaalsContact C-N 3.35Å; V180-Y183 HydrophobicContact CB-CD2 4.46Å; V180-Y183 WeakPolarHBondContact O-CB 3.41Å; V180-Y183 PolarHBondContact O-N 2.89Å; V180-N184 PolarHBondContact O-N 3.24Å; V180-F394 HydrophobicContact CG1-CB 3.77Å; V180-F394 HydrophobicContact CG1-CD2 4.13Å; V180-F394 HydrophobicContact CG1-CG 3.94Å; V180-F398 HydrophobicContact CB-CZ 4.49Å
181	E	92.3	Very high	87.7	Confident	22 Å²	22	30.7 Å²	30.7	10%	0.103	17%	0.17	C	C	.	.	H	α-helix	trans	-55.8	-38.4	-178.6	-64.6	-175.5	161.6	0	0	114.6	P171 S176 T178 Y183 N184 A185	P171-E181 HydrophobicContact CB-CB 3.69Å; P171-E181 HydrophobicContact CB-CG 4.26Å; P171-E181 WeakPolarHBondContact CB-OE2 3.47Å; P171-E181 HydrophobicContact CG-CB 4.18Å; S176-E181 WeakPolarHBondContact CB-OE1 3.27Å; S176-E181 PolarHBondContact OG-OE1 2.83Å; T178-E181 HydrophobicContact CG2-CG 3.94Å; T178-E181 WeakPolarHBondContact O-CG 3.23Å; E181-Y183 VanDerWaalsContact C-N 3.28Å; E181-Y183 PolarHBondContact O-N 3.26Å; E181-N184 PolarHBondContact O-N 2.9Å; E181-A185 WeakPolarHBondContact O-CB 3.22Å; E181-A185 PolarHBondContact O-N 2.95Å
182	P	94	Very high	88.1	Confident	9 Å²	9	30.1 Å²	30.1	6%	0.058	17%	0.166	C	C	.	.	H	α-helix	trans	-62.4	-33	176.4	-22.6	32.8	0	0	0	113.1	V179 V180 T186 Q384 F385 M388	V179-P182 WeakPolarHBondContact O-CD 3.09Å; V180-P182 VanDerWaalsContact C-CD 3.45Å; V180-P182 VanDerWaalsContact C-N 3.35Å; P182-T186 WeakPolarHBondContact O-CB 3.39Å; P182-T186 PolarHBondContact O-N 3.11Å; P182-T186 PolarHBondContact O-OG1 2.72Å; P182-Q384 HydrophobicContact CB-CB 3.92Å; P182-Q384 HydrophobicContact CG-CB 3.7Å; P182-F385 HydrophobicContact CB-CB 4.32Å; P182-M388 HydrophobicContact CB-CE 3.71Å; P182-M388 HydrophobicContact CG-CE 3.69Å
183	Y	95.4	Very high	88.8	Confident	0 Å²	0	30.3 Å²	30.3	0%	0	17%	0.167	C	C	.	.	H	α-helix	trans	-63.6	-52.5	173.2	-74.1	-53	0	0	0	110.9	V180 E181 A185 T186 L187 F385 M388 F389 A393 F398 F408	V180-Y183 HydrophobicContact CB-CD2 4.46Å; V180-Y183 WeakPolarHBondContact O-CB 3.41Å; V180-Y183 PolarHBondContact O-N 2.89Å; E181-Y183 VanDerWaalsContact C-N 3.28Å; E181-Y183 PolarHBondContact O-N 3.26Å; Y183-A185 VanDerWaalsContact C-N 3.26Å; Y183-A185 PolarHBondContact O-N 2.88Å; Y183-T186 PolarHBondContact O-N 3.38Å; Y183-L187 VanDerWaalsContact O-CG 3.26Å; Y183-L187 WeakPolarHBondContact O-CG 3.35Å; Y183-L187 PolarHBondContact O-N 2.8Å; Y183-L187 VanDerWaalsContact O-N 3.09Å; Y183-F385 AromaticContact CD1-CD2 3.56Å; Y183-F385 HydrophobicContact CD1-CD2 3.56Å; Y183-F385 AromaticContact CD1-CE2 3.4Å; Y183-F385 HydrophobicContact CD1-CE2 3.4Å; Y183-F385 HydrophobicContact CD1-CZ 4.19Å; Y183-F385 HydrophobicContact CE1-CD2 4.04Å; Y183-F385 AromaticContact CE1-CE2 3.86Å; Y183-F385 HydrophobicContact CE1-CE2 3.86Å; Y183-F385 HydrophobicContact CE1-CZ 4.25Å; Y183-M388 HydrophobicContact CD2-CE 3.64Å; Y183-M388 HydrophobicContact CE2-CB 3.94Å; Y183-M388 HydrophobicContact CE2-CE 3.72Å; Y183-M388 HydrophobicContact CE2-SD 4.18Å; Y183-M388 HydrophobicContact CG-CE 4.12Å; Y183-M388 WeakPolarHBondContact OH-CB 3.36Å; Y183-M388 PolarHBondContact OH-O 3.21Å; Y183-F389 HydrophobicContact CE1-CB 4.04Å; Y183-F389 HydrophobicContact CE1-CD2 4.11Å; Y183-F389 HydrophobicContact CE1-CG 4.49Å; Y183-F389 WeakPolarHBondContact OH-CA 3.24Å; Y183-F389 PolarHBondContact OH-N 2.78Å; Y183-F389 VanDerWaalsContact OH-N 3.08Å; Y183-A393 VanDerWaalsContact CE2-O 3.32Å; Y183-A393 WeakPolarHBondContact CE2-O 3.35Å; Y183-A393 PolarHBondContact OH-O 2.81Å; Y183-F398 HydrophobicContact CD2-CE2 4.03Å; Y183-F398 HydrophobicContact CD2-CZ 4.33Å; Y183-F398 HydrophobicContact CG-CE2 4.35Å; Y183-F398 HydrophobicContact CG-CZ 4.34Å; Y183-F408 AromaticContact CD1-CD1 3.71Å; Y183-F408 HydrophobicContact CD1-CD1 3.71Å; Y183-F408 AromaticContact CD1-CE1 3.54Å; Y183-F408 HydrophobicContact CD1-CE1 3.54Å; Y183-F408 AromaticContact CE1-CD1 3.99Å; Y183-F408 HydrophobicContact CE1-CD1 3.99Å; Y183-F408 HydrophobicContact CE1-CE1 4.06Å; Y183-F408 HydrophobicContact CG-CE1 4.03Å
184	N	95.4	Very high	89.6	Confident	0 Å²	0	31.9 Å²	31.9	0%	0	17%	0.168	C	C	.	.	H	α-helix	trans	-59.5	-40.3	-179.1	-59.6	-24.1	0	0	0	111.4	N99 W101 L139 G140 G141 V180 E181 S188 F398	N99-N184 PolarHBondContact O-ND2 3.07Å; W101-N184 HydrophobicContact CB-CB 4.13Å; W101-N184 VanDerWaalsContact CB-OD1 3.22Å; W101-N184 WeakPolarHBondContact CB-OD1 3.31Å; W101-N184 PolarHBondContact N-OD1 2.73Å; W101-N184 VanDerWaalsContact N-OD1 3.14Å; L139-N184 CarbonylContact O-C 3.45Å; L139-N184 VanDerWaalsContact O-CB 3.31Å; L139-N184 WeakPolarHBondContact O-CB 3.18Å; G140-N184 PolarHBondContact O-ND2 3.4Å; G141-N184 WeakPolarHBondContact O-CB 3.48Å; G141-N184 VanDerWaalsContact O-CG 3.3Å; G141-N184 PolarHBondContact O-ND2 3.15Å; V180-N184 PolarHBondContact O-N 3.24Å; E181-N184 PolarHBondContact O-N 2.9Å; N184-S188 VanDerWaalsContact O-CB 3.29Å; N184-S188 WeakPolarHBondContact O-CB 3.39Å; N184-S188 PolarHBondContact O-N 3.03Å; N184-S188 PolarHBondContact O-OG 3.35Å; N184-F398 WeakPolarHBondContact OD1-CE1 3.27Å; N184-F398 WeakPolarHBondContact OD1-CZ 3.19Å
185	A	95.1	Very high	90.7	Very high	0 Å²	0	28.5 Å²	28.5	0%	0	15%	0.154	C	C	.	.	H	α-helix	trans	-69.9	-45.3	180	0	0	0	0	0	112.7	L139 P171 E181 Y183 L187 S188 V189 I381	L139-A185 HydrophobicContact CB-CB 4.12Å; L139-A185 PolarHBondContact O-N 2.97Å; P171-A185 HydrophobicContact CG-CB 3.81Å; E181-A185 WeakPolarHBondContact O-CB 3.22Å; E181-A185 PolarHBondContact O-N 2.95Å; Y183-A185 VanDerWaalsContact C-N 3.26Å; Y183-A185 PolarHBondContact O-N 2.88Å; A185-L187 PolarHBondContact O-N 3.3Å; A185-S188 PolarHBondContact O-N 3.16Å; A185-V189 VanDerWaalsContact O-CG2 3.32Å; A185-V189 WeakPolarHBondContact O-CG2 3.48Å; A185-V189 PolarHBondContact O-N 3.17Å; A185-I381 HydrophobicContact CB-CD1 4.39Å; A185-I381 HydrophobicContact CB-CG2 4.02Å
186	T	95.8	Very high	91.8	Very high	1 Å²	1	27.3 Å²	27.3	1%	0.006	15%	0.147	C	C	.	.	H	α-helix	trans	-61.1	-46.1	178.1	-63.3	0	0	0	0	111.6	P182 Y183 S188 V189 H190 F385 A411 M415	P182-T186 WeakPolarHBondContact O-CB 3.39Å; P182-T186 PolarHBondContact O-N 3.11Å; P182-T186 PolarHBondContact O-OG1 2.72Å; Y183-T186 PolarHBondContact O-N 3.38Å; T186-S188 VanDerWaalsContact C-N 3.3Å; T186-S188 PolarHBondContact O-N 3.25Å; T186-V189 PolarHBondContact O-N 3.02Å; T186-H190 PolarHBondContact O-N 3.07Å; T186-H190 VanDerWaalsContact O-N 3.12Å; T186-F385 VanDerWaalsContact CB-CD2 3.49Å; T186-F385 HydrophobicContact CG2-CD2 3.81Å; T186-F385 HydrophobicContact CG2-CE2 3.76Å; T186-F385 HydrophobicContact CG2-CG 4.26Å; T186-F385 HydrophobicContact CG2-CZ 4.26Å; T186-F385 VanDerWaalsContact OG1-CD2 3.31Å; T186-F385 WeakPolarHBondContact OG1-CD2 3.44Å; T186-A411 HydrophobicContact CG2-CB 4.04Å; T186-M415 HydrophobicContact CG2-CE 4.17Å
187	L	96.2	Very high	92.9	Very high	5 Å²	5	27.7 Å²	27.7	3%	0.026	15%	0.147	C	C	.	.	H	α-helix	trans	-62.7	-38.7	176.6	-64.1	172.7	0	0	0	112	W101 Y183 A185 Q191 F398 M403 F408 A411	W101-L187 HydrophobicContact CB-CD1 4.31Å; W101-L187 HydrophobicContact CD2-CB 3.84Å; W101-L187 HydrophobicContact CD2-CD1 3.89Å; W101-L187 HydrophobicContact CE3-CB 4.22Å; W101-L187 HydrophobicContact CE3-CD1 3.69Å; W101-L187 HydrophobicContact CG-CB 4.18Å; W101-L187 HydrophobicContact CG-CD1 4.16Å; W101-L187 HydrophobicContact CZ2-CB 4.16Å; W101-L187 HydrophobicContact CZ3-CD1 4.32Å; Y183-L187 VanDerWaalsContact O-CG 3.26Å; Y183-L187 WeakPolarHBondContact O-CG 3.35Å; Y183-L187 PolarHBondContact O-N 2.8Å; Y183-L187 VanDerWaalsContact O-N 3.09Å; A185-L187 PolarHBondContact O-N 3.3Å; L187-Q191 PolarHBondContact O-N 3.25Å; L187-F398 HydrophobicContact CD1-CD1 4.41Å; L187-F398 HydrophobicContact CD1-CE1 4.38Å; L187-M403 HydrophobicContact CD1-CE 3.65Å; L187-M403 HydrophobicContact CD1-SD 4.1Å; L187-M403 HydrophobicContact CD2-CE 3.41Å; L187-M403 VanDerWaalsContact CD2-CE 3.41Å; L187-M403 HydrophobicContact CG-CE 4.15Å; L187-F408 HydrophobicContact CD1-CE1 3.93Å; L187-F408 HydrophobicContact CD1-CZ 4.11Å; L187-F408 HydrophobicContact CD2-CD1 4.46Å; L187-A411 HydrophobicContact CD2-CB 3.71Å
188	S	96.3	Very high	94	Very high	0 Å²	0	19.8 Å²	19.8	0%	0	11%	0.105	C	C	.	.	H	α-helix	trans	-70.5	-43.5	179	-58.2	0	0	0	0	112.8	W101 S145 N184 A185 T186 H190 Q191 L192	W101-S188 VanDerWaalsContact CD1-OG 3.26Å; W101-S188 PolarHBondContact NE1-OG 3.03Å; W101-S188 VanDerWaalsContact NE1-OG 3.14Å; S145-S188 VanDerWaalsContact CB-OG 3.29Å; S145-S188 WeakPolarHBondContact CB-OG 3.37Å; N184-S188 VanDerWaalsContact O-CB 3.29Å; N184-S188 WeakPolarHBondContact O-CB 3.39Å; N184-S188 PolarHBondContact O-N 3.03Å; N184-S188 PolarHBondContact O-OG 3.35Å; A185-S188 PolarHBondContact O-N 3.16Å; T186-S188 VanDerWaalsContact C-N 3.3Å; T186-S188 PolarHBondContact O-N 3.25Å; S188-H190 VanDerWaalsContact C-N 3.28Å; S188-H190 PolarHBondContact O-N 2.99Å; S188-Q191 WeakPolarHBondContact O-CB 3.35Å; S188-Q191 PolarHBondContact O-N 3.28Å; S188-Q191 VanDerWaalsContact O-N 3.1Å; S188-L192 VanDerWaalsContact O-CG 3.31Å; S188-L192 WeakPolarHBondContact O-CG 3.48Å; S188-L192 PolarHBondContact O-N 3.25Å
189	V	95.7	Very high	94.6	Very high	1 Å²	1	17.8 Å²	17.8	1%	0.006	9%	0.092	C	C	.	.	H	α-helix	trans	-62	-39.3	178.5	170.1	0	0	0	0	110.7	L139 A185 T186 Q191 L192 V193 F265 F378 M415 L418	L139-V189 HydrophobicContact CD1-CG2 3.8Å; A185-V189 VanDerWaalsContact O-CG2 3.32Å; A185-V189 WeakPolarHBondContact O-CG2 3.48Å; A185-V189 PolarHBondContact O-N 3.17Å; T186-V189 PolarHBondContact O-N 3.02Å; V189-Q191 PolarHBondContact O-N 3.06Å; V189-L192 PolarHBondContact O-N 2.68Å; V189-V193 HydrophobicContact CG1-CG2 4.11Å; V189-V193 VanDerWaalsContact O-CG2 3.27Å; V189-V193 WeakPolarHBondContact O-CG2 3.24Å; V189-V193 PolarHBondContact O-N 3.26Å; V189-F265 HydrophobicContact CG1-CZ 4.27Å; V189-F378 HydrophobicContact CG1-CD1 4.27Å; V189-F378 HydrophobicContact CG1-CE1 3.8Å; V189-F378 HydrophobicContact CG2-CE1 4.08Å; V189-M415 HydrophobicContact CB-CE 3.38Å; V189-M415 HydrophobicContact CB-SD 4.27Å; V189-M415 HydrophobicContact CG1-CE 3.46Å; V189-M415 VanDerWaalsContact CG1-CE 3.46Å; V189-M415 HydrophobicContact CG1-SD 3.66Å; V189-M415 HydrophobicContact CG2-CE 3.85Å; V189-L418 HydrophobicContact CG1-CD2 4.37Å
190	H	95.4	Very high	95.1	Very high	34 Å²	34	13.9 Å²	13.9	16%	0.157	7%	0.069	C	C	.	.	H	α-helix	trans	-52.6	-44.7	173.5	167.6	48.7	0	0	0	111.9	T186 S188 A411 N414	T186-H190 PolarHBondContact O-N 3.07Å; T186-H190 VanDerWaalsContact O-N 3.12Å; S188-H190 VanDerWaalsContact C-N 3.28Å; S188-H190 PolarHBondContact O-N 2.99Å; H190-A411 HydrophobicContact CB-CB 3.91Å; H190-N414 PolarHBondContact ND1-ND2 3.31Å
191	Q	95.8	Very high	95.2	Very high	35 Å²	35	13.8 Å²	13.8	16%	0.164	7%	0.068	C	C	.	.	H	α-helix	trans	-70.4	-35.2	176	-63.7	-62	-37.3	0	0	113.5	W101 T149 L187 S188 V189 E194 N195	W101-Q191 HydrophobicContact CZ2-CG 4.22Å; T149-Q191 HydrophobicContact CG2-CB 3.85Å; T149-Q191 HydrophobicContact CG2-CG 4.47Å; L187-Q191 PolarHBondContact O-N 3.25Å; S188-Q191 WeakPolarHBondContact O-CB 3.35Å; S188-Q191 PolarHBondContact O-N 3.28Å; S188-Q191 VanDerWaalsContact O-N 3.1Å; V189-Q191 PolarHBondContact O-N 3.06Å; Q191-E194 PolarHBondContact O-N 3.38Å; Q191-N195 WeakPolarHBondContact O-CB 3.43Å; Q191-N195 PolarHBondContact O-N 2.69Å; Q191-N195 VanDerWaalsContact O-N 3.12Å; Q191-N195 PolarHBondContact O-ND2 3.1Å; Q191-N195 PolarHBondContact OE1-ND2 3.2Å
192	L	95.9	Very high	95.4	Very high	0 Å²	0	12.8 Å²	12.8	0%	0	6%	0.063	C	C	.	.	H	α-helix	trans	-68.4	-37.8	-179.8	-67.7	171.8	0	0	0	112.4	L139 I152 T166 S188 V189 E194 T196 T199 H264 F265	L139-L192 HydrophobicContact CD1-CD1 3.81Å; L139-L192 HydrophobicContact CD2-CD1 3.82Å; L139-L192 HydrophobicContact CG-CD1 4.5Å; I152-L192 HydrophobicContact CD1-CD2 3.54Å; T166-L192 HydrophobicContact CG2-CD2 4.03Å; S188-L192 VanDerWaalsContact O-CG 3.31Å; S188-L192 WeakPolarHBondContact O-CG 3.48Å; S188-L192 PolarHBondContact O-N 3.25Å; V189-L192 PolarHBondContact O-N 2.68Å; L192-E194 PolarHBondContact O-N 3.32Å; L192-T196 HydrophobicContact CB-CG2 4.42Å; L192-T196 HydrophobicContact CD2-CG2 3.55Å; L192-T196 PolarHBondContact O-N 3.34Å; L192-T196 PolarHBondContact O-OG1 3.48Å; L192-T199 HydrophobicContact CD1-CG2 4.46Å; L192-H264 PolarHBondContact O-CE1 3.48Å; L192-H264 PolarHBondContact O-NE2 3.29Å; L192-F265 HydrophobicContact CB-CE1 4.26Å; L192-F265 HydrophobicContact CB-CZ 4.26Å
193	V	95.2	Very high	95.3	Very high	6 Å²	6	12.4 Å²	12.4	4%	0.036	6%	0.061	C	C	.	.	H	α-helix	trans	-57	-33	179	170.7	0	0	0	0	111.9	V189 R262 H264 F265 L418	V189-V193 HydrophobicContact CG1-CG2 4.11Å; V189-V193 VanDerWaalsContact O-CG2 3.27Å; V189-V193 WeakPolarHBondContact O-CG2 3.24Å; V189-V193 PolarHBondContact O-N 3.26Å; V193-R262 HydrophobicContact CG1-CB 4.23Å; V193-R262 HydrophobicContact CG1-CG 3.97Å; V193-H264 PolarHBondContact O-CE1 3.37Å; V193-F265 HydrophobicContact CG2-CE2 3.77Å; V193-F265 HydrophobicContact CG2-CZ 3.73Å; V193-L418 HydrophobicContact CG2-CD1 4.44Å; V193-L418 HydrophobicContact CG2-CD2 3.84Å
194	E	92.1	Very high	95	Very high	110 Å²	110	13.5 Å²	13.5	51%	0.514	7%	0.067	S	C	.	.	H	α-helix	trans	-98.2	-35.3	-175.6	-61.8	-173.8	173.2	0	0	112.9	Q191 L192	Q191-E194 PolarHBondContact O-N 3.38Å; L192-E194 PolarHBondContact O-N 3.32Å
195	N	95.1	Very high	94.6	Very high	24 Å²	24	15.2 Å²	15.2	13%	0.128	8%	0.075	C	C	.	.	H	α-helix	trans	-105.3	-3.7	-166	-60.8	-59.1	0	0	0	114.8	I152 Q191	I152-N195 HydrophobicContact CG2-CB 3.55Å; I152-N195 WeakPolarHBondContact CG2-O 3.38Å; Q191-N195 WeakPolarHBondContact O-CB 3.43Å; Q191-N195 PolarHBondContact O-N 2.69Å; Q191-N195 VanDerWaalsContact O-N 3.12Å; Q191-N195 PolarHBondContact O-ND2 3.1Å; Q191-N195 PolarHBondContact OE1-ND2 3.2Å
196	T	95.8	Very high	94.4	Very high	6 Å²	6	15.6 Å²	15.6	4%	0.037	8%	0.078	C	C	.	.			trans	-116.5	147.3	-179.9	72.8	0	0	0	0	112.8	I152 M164 T166 L192 T199 H264	I152-T196 HydrophobicContact CD1-CG2 3.97Å; I152-T196 HydrophobicContact CG2-CG2 3.75Å; M164-T196 HydrophobicContact CG-CG2 4.02Å; T166-T196 HydrophobicContact CG2-CG2 3.59Å; L192-T196 HydrophobicContact CB-CG2 4.42Å; L192-T196 HydrophobicContact CD2-CG2 3.55Å; L192-T196 PolarHBondContact O-N 3.34Å; L192-T196 PolarHBondContact O-OG1 3.48Å; T196-T199 PolarHBondContact OG1-OG1 2.86Å; T196-H264 PolarHBondContact O-CE1 3.06Å; T196-H264 VanDerWaalsContact O-CE1 3.32Å; T196-H264 PolarHBondContact O-NE2 3.26Å; T196-H264 PolarHBondContact OG1-CD2 2.97Å; T196-H264 PolarHBondContact OG1-NE2 3.45Å
197	D	95	Very high	94.2	Very high	34 Å²	34	15.6 Å²	15.6	18%	0.182	8%	0.078	C	C	.	.	S	Bend	trans	-93.7	-27.8	176.7	-56.8	-65.6	0	0	0	111.4	R156 I163 M164 H264	R156-D197 IonicContact CZ-OD1 3.42Å; R156-D197 IonicContact CZ-OD2 3.17Å; R156-D197 IonicContact NH1-OD1 3.19Å; R156-D197 PolarHBondContact NH1-OD1 3.19Å; R156-D197 IonicContact NH1-OD2 3.29Å; R156-D197 PolarHBondContact NH1-OD2 3.23Å; R156-D197 IonicContact NH2-OD1 3.34Å; R156-D197 PolarHBondContact NH2-OD1 3.06Å; R156-D197 IonicContact NH2-OD2 3.33Å; I163-D197 VanDerWaalsContact CA-OD2 3.31Å; I163-D197 WeakPolarHBondContact CA-OD2 3.37Å; I163-D197 HydrophobicContact CD1-CB 4.31Å; I163-D197 HydrophobicContact CG2-CB 4.29Å; M164-D197 PolarHBondContact N-OD2 3.21Å; M164-D197 PolarHBondContact O-N 2.79Å; D197-H264 VanDerWaalsContact O-CB 3.27Å; D197-H264 WeakPolarHBondContact O-CB 3.34Å
198	Q	94.4	Very high	93.9	Very high	0 Å²	0	18.8 Å²	18.8	0%	0	9%	0.09	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.6	128.4	176.9	-52.3	-173.1	-51.4	0	0	111	M164 N165 T166 Y200 A254 F266	M164-Q198 PolarHBondContact O-N 3.42Å; N165-Q198 CarbonylContact C-O 3.26Å; N165-Q198 WeakPolarHBondContact CA-O 3.35Å; N165-Q198 PolarHBondContact ND2-OE1 3.28Å; N165-Q198 WeakPolarHBondContact OD1-CB 3.32Å; N165-Q198 WeakPolarHBondContact OD1-CG 3.45Å; N165-Q198 PolarHBondContact OD1-OE1 2.94Å; N165-Q198 VanDerWaalsContact OD1-OE1 3.12Å; T166-Q198 PolarHBondContact N-O 2.93Å; Q198-Y200 HydrophobicContact CB-CE2 4.41Å; Q198-A254 HydrophobicContact CG-CB 4.09Å; Q198-A254 VanDerWaalsContact NE2-N 3.17Å; Q198-F266 HydrophobicContact CB-CD2 4.41Å; Q198-F266 HydrophobicContact CB-CE2 3.72Å; Q198-F266 HydrophobicContact CB-CZ 4.48Å; Q198-F266 HydrophobicContact CG-CE2 3.88Å; Q198-F266 HydrophobicContact CG-CZ 4.33Å
199	T	96.7	Very high	93.7	Very high	0 Å²	0	20.5 Å²	20.5	0%	0	10%	0.099	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	116.8	175.3	-71.6	0	0	0	0	110.5	T166 L192 T196 C201 H264 F265 F266	T166-T199 WeakPolarHBondContact OG1-CB 3.33Å; T166-T199 WeakPolarHBondContact OG1-CG2 3.1Å; T166-T199 PolarHBondContact OG1-OG1 2.81Å; L192-T199 HydrophobicContact CD1-CG2 4.46Å; T196-T199 PolarHBondContact OG1-OG1 2.86Å; T199-C201 PolarHBondContact O-N 3.39Å; T199-H264 PolarHBondContact N-O 3.46Å; T199-F265 HydrophobicContact CG2-CD1 3.59Å; T199-F265 HydrophobicContact CG2-CE1 3.76Å; T199-F265 CarbonylContact O-C 3.58Å; T199-F265 WeakPolarHBondContact O-CA 3.49Å; T199-F266 PolarHBondContact O-N 2.89Å
200	Y	96.7	Very high	93.4	Very high	2 Å²	2	20.7 Å²	20.7	1%	0.008	10%	0.1	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.7	109.8	173.9	-63.1	-89.7	0	0	0	109.1	T166 F167 S168 Q198 I202 V236 L253 F266 I368	T166-Y200 WeakPolarHBondContact O-CD2 3.47Å; T166-Y200 PolarHBondContact O-N 2.93Å; F167-Y200 AromaticContact CD1-CD2 4Å; F167-Y200 HydrophobicContact CD1-CD2 4Å; F167-Y200 AromaticContact CD1-CG 3.94Å; F167-Y200 HydrophobicContact CD1-CG 3.94Å; F167-Y200 HydrophobicContact CE1-CD1 4.26Å; F167-Y200 AromaticContact CE1-CD2 3.62Å; F167-Y200 HydrophobicContact CE1-CD2 3.62Å; F167-Y200 HydrophobicContact CE1-CE2 4.26Å; F167-Y200 AromaticContact CE1-CG 3.65Å; F167-Y200 HydrophobicContact CE1-CG 3.65Å; F167-Y200 HydrophobicContact CE2-CD2 4.16Å; F167-Y200 HydrophobicContact CE2-CE2 4.47Å; F167-Y200 HydrophobicContact CG-CD2 4.45Å; F167-Y200 AromaticContact CZ-CD2 3.73Å; F167-Y200 HydrophobicContact CZ-CD2 3.73Å; F167-Y200 AromaticContact CZ-CE2 3.99Å; F167-Y200 HydrophobicContact CZ-CE2 3.99Å; F167-Y200 HydrophobicContact CZ-CG 4.22Å; S168-Y200 PolarHBondContact N-O 3.3Å; Q198-Y200 HydrophobicContact CB-CE2 4.41Å; Y200-I202 PolarHBondContact O-N 2.86Å; Y200-V236 HydrophobicContact CD1-CG1 4.47Å; Y200-V236 HydrophobicContact CD1-CG2 4.25Å; Y200-V236 HydrophobicContact CE1-CB 4.44Å; Y200-V236 HydrophobicContact CE1-CG1 3.61Å; Y200-V236 HydrophobicContact CE1-CG2 3.9Å; Y200-V236 HydrophobicContact CE2-CG1 4.09Å; Y200-V236 VanDerWaalsContact CZ-CG1 3.41Å; Y200-V236 VanDerWaalsContact OH-CG1 3.32Å; Y200-V236 WeakPolarHBondContact OH-CG1 3.31Å; Y200-L253 WeakPolarHBondContact OH-CD2 3.41Å; Y200-F266 HydrophobicContact CD1-CB 4.16Å; Y200-F266 HydrophobicContact CD1-CD2 4.11Å; Y200-F266 HydrophobicContact CE1-CB 4.44Å; Y200-F266 AromaticContact CE1-CD2 3.74Å; Y200-F266 HydrophobicContact CE1-CD2 3.74Å; Y200-F266 HydrophobicContact CE2-CD2 4.43Å; Y200-F266 AromaticContact CZ-CD2 3.89Å; Y200-I368 HydrophobicContact CD1-CG2 4.44Å; Y200-I368 HydrophobicContact CE1-CD1 4.12Å; Y200-I368 HydrophobicContact CE1-CG1 4.27Å; Y200-I368 HydrophobicContact CE1-CG2 3.77Å
201	C	95.6	Very high	93.2	Very high	0 Å²	0	19.1 Å²	19.1	0%	0	9%	0.093	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.5	111.7	-179.8	-62.4	0	0	0	0	110	M170 T199 F266 P268 I374	M170-C201 HydrophobicContact CE-CB 3.92Å; M170-C201 WeakPolarHBondContact CE-SG 3.44Å; T199-C201 PolarHBondContact O-N 3.39Å; C201-F266 WeakPolarHBondContact CB-O 3.41Å; C201-F266 PolarHBondContact N-O 3.43Å; C201-P268 WeakPolarHBondContact O-CD 3.22Å; C201-I374 HydrophobicContact CB-CD1 4.16Å
202	I	94.9	Very high	92.8	Very high	2 Å²	2	22.1 Å²	22.1	1%	0.01	11%	0.105	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	112.2	177.6	-65.7	156.3	0	0	0	107.6	F167 S168 V169 M170 Y200 L207 V229 P268	F167-I202 HydrophobicContact CB-CD1 4.07Å; F167-I202 HydrophobicContact CD1-CD1 4.09Å; S168-I202 PolarHBondContact O-N 2.94Å; V169-I202 CarbonylContact C-O 3.54Å; V169-I202 VanDerWaalsContact CA-O 3.26Å; V169-I202 WeakPolarHBondContact CA-O 3.4Å; V169-I202 HydrophobicContact CG2-CB 4.33Å; V169-I202 HydrophobicContact CG2-CG2 4.26Å; M170-I202 PolarHBondContact N-O 3.11Å; Y200-I202 PolarHBondContact O-N 2.86Å; I202-L207 HydrophobicContact CG2-CD1 3.63Å; I202-L207 HydrophobicContact CG2-CG 4.27Å; I202-V229 HydrophobicContact CD1-CG1 3.6Å; I202-V229 HydrophobicContact CG2-CG1 4.49Å; I202-V229 HydrophobicContact CG2-CG2 3.63Å; I202-P268 HydrophobicContact CG1-CG 4.35Å
203	D	92.6	Very high	92.4	Very high	0 Å²	0	29.4 Å²	29.4	0%	0	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.7	119.8	-176.9	-169	-10.3	0	0	0	111.6	M170 E205 A206 L207 M300 A302 L377 R380	M170-D203 HydrophobicContact CB-CB 4.48Å; D203-E205 PolarHBondContact O-N 3.09Å; D203-E205 VanDerWaalsContact OD1-CB 3.3Å; D203-E205 WeakPolarHBondContact OD1-CB 3.34Å; D203-E205 PolarHBondContact OD1-N 3.22Å; D203-A206 HydrophobicContact CB-CB 4.14Å; D203-A206 PolarHBondContact O-N 3.4Å; D203-A206 VanDerWaalsContact O-N 3.07Å; D203-L207 WeakPolarHBondContact O-CG 3.46Å; D203-L207 PolarHBondContact O-N 3.45Å; D203-M300 PolarHBondContact N-O 2.84Å; D203-A302 WeakPolarHBondContact OD2-CB 3.31Å; D203-A302 PolarHBondContact OD2-N 3.02Å; D203-L377 HydrophobicContact CB-CD1 4.18Å; D203-R380 IonicContact OD1-NH1 3.8Å; D203-R380 IonicContact OD1-NH2 3.59Å; D203-R380 PolarHBondContact OD1-NH2 3.37Å; D203-R380 IonicContact OD2-CZ 3.36Å; D203-R380 VanDerWaalsContact OD2-CZ 3.26Å; D203-R380 IonicContact OD2-NH1 3.92Å; D203-R380 PolarHBondContact OD2-NH1 3.04Å; D203-R380 IonicContact OD2-NH2 2.98Å; D203-R380 PolarHBondContact OD2-NH2 2.83Å
204	N	88.9	Confident	92	Very high	23 Å²	23	31 Å²	31	12%	0.123	14%	0.143	C	C	.	.	H	α-helix	trans	-56.7	-30.6	174.2	-82.4	-20.8	0	0	0	112.6	V169 V175 Y208	V169-N204 WeakPolarHBondContact CG1-ND2 3.41Å; V169-N204 WeakPolarHBondContact CG1-OD1 3.32Å; V175-N204 HydrophobicContact CB-CB 4.07Å; V175-N204 HydrophobicContact CG1-CB 4.21Å; V175-N204 HydrophobicContact CG2-CB 3.94Å; N204-Y208 VanDerWaalsContact O-CB 3.3Å; N204-Y208 WeakPolarHBondContact O-CB 3.49Å; N204-Y208 PolarHBondContact O-N 2.88Å
205	E	88.2	Confident	91.7	Very high	37 Å²	37	27.3 Å²	27.3	17%	0.173	13%	0.126	C	C	.	.	H	α-helix	trans	-63	-47.7	174.5	-175.9	153	-173.1	0	0	111.9	S172 K174 D203 Y208 D209 A302 R380	S172-E205 WeakPolarHBondContact OG-CB 3.44Å; K174-E205 HydrophobicContact CD-CG 4.04Å; K174-E205 WeakPolarHBondContact CE-OE1 3.07Å; K174-E205 IonicContact NZ-OE1 3.84Å; K174-E205 PolarHBondContact NZ-OE1 2.86Å; D203-E205 PolarHBondContact O-N 3.09Å; D203-E205 VanDerWaalsContact OD1-CB 3.3Å; D203-E205 WeakPolarHBondContact OD1-CB 3.34Å; D203-E205 PolarHBondContact OD1-N 3.22Å; E205-Y208 PolarHBondContact O-N 2.79Å; E205-D209 WeakPolarHBondContact O-CB 3.41Å; E205-D209 PolarHBondContact O-N 3.38Å; E205-A302 HydrophobicContact CB-CB 4.08Å; E205-A302 HydrophobicContact CG-CB 4.09Å; E205-R380 IonicContact OE2-CZ 3.99Å; E205-R380 IonicContact OE2-NH1 2.9Å; E205-R380 PolarHBondContact OE2-NH1 3.39Å
206	A	91.1	Very high	91.4	Very high	8 Å²	8	33.5 Å²	33.5	7%	0.066	15%	0.152	C	C	.	.	H	α-helix	trans	-67.9	-42.9	179.9	0	0	0	0	0	111.4	D203 Y208 D209 I210 A302	D203-A206 HydrophobicContact CB-CB 4.14Å; D203-A206 PolarHBondContact O-N 3.4Å; D203-A206 VanDerWaalsContact O-N 3.07Å; A206-Y208 VanDerWaalsContact C-N 3.32Å; A206-Y208 PolarHBondContact O-N 2.83Å; A206-D209 PolarHBondContact O-N 3.28Å; A206-I210 WeakPolarHBondContact O-CB 3.42Å; A206-I210 VanDerWaalsContact O-CG1 3.28Å; A206-I210 WeakPolarHBondContact O-CG1 3.48Å; A206-I210 PolarHBondContact O-N 2.95Å; A206-A302 HydrophobicContact CB-CB 4.06Å
207	L	91.6	Very high	90.9	Very high	1 Å²	1	35.5 Å²	35.5	1%	0.005	16%	0.162	C	C	.	.	H	α-helix	trans	-59.2	-43.5	176	-65.6	177.6	0	0	0	111.9	I202 D203 I210 C211 L225 L228 V229 M300	I202-L207 HydrophobicContact CG2-CD1 3.63Å; I202-L207 HydrophobicContact CG2-CG 4.27Å; D203-L207 WeakPolarHBondContact O-CG 3.46Å; D203-L207 PolarHBondContact O-N 3.45Å; L207-I210 PolarHBondContact O-N 2.9Å; L207-C211 WeakPolarHBondContact O-CB 3.4Å; L207-C211 PolarHBondContact O-N 3.44Å; L207-C211 PolarHBondContact O-SG 3.09Å; L207-L225 HydrophobicContact CB-CB 4.43Å; L207-L225 HydrophobicContact CB-CD2 4.1Å; L207-L225 HydrophobicContact CB-CG 3.92Å; L207-L225 HydrophobicContact CD1-CB 4.26Å; L207-L225 HydrophobicContact CD1-CD2 4.5Å; L207-L228 HydrophobicContact CD2-CB 3.9Å; L207-L228 HydrophobicContact CD2-CD1 4.09Å; L207-V229 HydrophobicContact CD1-CG2 3.54Å; L207-V229 HydrophobicContact CD2-CG2 4.17Å; L207-M300 HydrophobicContact CD2-CB 4.45Å; L207-M300 HydrophobicContact CD2-CG 4.45Å; L207-M300 HydrophobicContact CD2-SD 3.4Å; L207-M300 WeakPolarHBondContact CD2-SD 3.29Å
208	Y	89.8	Confident	90.4	Very high	72 Å²	72	39.3 Å²	39.3	28%	0.282	19%	0.187	S	C	.	.	H	α-helix	trans	-64.2	-47	177.1	-172.1	-87	0	0	0	111.4	V175 N204 E205 A206 I210 C211 F212 P220	V175-Y208 HydrophobicContact CG2-CD2 4.3Å; V175-Y208 HydrophobicContact CG2-CG 4.43Å; N204-Y208 VanDerWaalsContact O-CB 3.3Å; N204-Y208 WeakPolarHBondContact O-CB 3.49Å; N204-Y208 PolarHBondContact O-N 2.88Å; E205-Y208 PolarHBondContact O-N 2.79Å; A206-Y208 VanDerWaalsContact C-N 3.32Å; A206-Y208 PolarHBondContact O-N 2.83Å; Y208-I210 VanDerWaalsContact C-N 3.33Å; Y208-I210 PolarHBondContact O-N 3.38Å; Y208-C211 PolarHBondContact O-N 3.21Å; Y208-F212 HydrophobicContact CE1-CB 4.27Å; Y208-F212 WeakPolarHBondContact O-CB 3.36Å; Y208-F212 PolarHBondContact O-N 2.7Å; Y208-P220 HydrophobicContact CD2-CB 4.05Å; Y208-P220 HydrophobicContact CD2-CG 4.08Å; Y208-P220 HydrophobicContact CE2-CB 4.01Å; Y208-P220 HydrophobicContact CE2-CG 3.79Å
209	D	90.3	Very high	90.1	Very high	36 Å²	36	44.5 Å²	44.5	19%	0.193	22%	0.219	C	C	.	.	H	α-helix	trans	-63.8	-37.2	179.2	-80.4	-14.7	0	0	0	111.8	K174 E205 A206 R213	K174-D209 IonicContact NZ-OD1 3.54Å; K174-D209 IonicContact NZ-OD2 2.74Å; K174-D209 PolarHBondContact NZ-OD2 2.99Å; E205-D209 WeakPolarHBondContact O-CB 3.41Å; E205-D209 PolarHBondContact O-N 3.38Å; A206-D209 PolarHBondContact O-N 3.28Å; D209-R213 WeakPolarHBondContact O-CA 3.44Å; D209-R213 WeakPolarHBondContact O-CB 3.4Å; D209-R213 WeakPolarHBondContact O-CG 3.23Å; D209-R213 PolarHBondContact O-N 3Å; D209-R213 IonicContact OD1-NE 3.71Å
210	I	90.6	Very high	89.6	Confident	5 Å²	5	45.5 Å²	45.5	3%	0.026	23%	0.226	C	C	.	.	I	π-helix	trans	-61.8	-50.9	171.9	-73.2	166.5	0	0	0	110.7	A206 L207 Y208 F212 T214 L215 L228 L273 R297 M299 M300	A206-I210 WeakPolarHBondContact O-CB 3.42Å; A206-I210 VanDerWaalsContact O-CG1 3.28Å; A206-I210 WeakPolarHBondContact O-CG1 3.48Å; A206-I210 PolarHBondContact O-N 2.95Å; L207-I210 PolarHBondContact O-N 2.9Å; Y208-I210 VanDerWaalsContact C-N 3.33Å; Y208-I210 PolarHBondContact O-N 3.38Å; I210-F212 VanDerWaalsContact C-N 3.34Å; I210-F212 PolarHBondContact O-N 2.89Å; I210-T214 WeakPolarHBondContact O-CA 3.31Å; I210-T214 VanDerWaalsContact O-CB 3.23Å; I210-T214 WeakPolarHBondContact O-CB 3.45Å; I210-T214 PolarHBondContact O-N 3.38Å; I210-L215 HydrophobicContact CG2-CG 4.46Å; I210-L215 PolarHBondContact O-N 3.34Å; I210-L228 HydrophobicContact CB-CD1 4.21Å; I210-L228 HydrophobicContact CG2-CD1 3.66Å; I210-L273 HydrophobicContact CD1-CD1 4.17Å; I210-L273 HydrophobicContact CG1-CD1 4.43Å; I210-L273 HydrophobicContact CG2-CD1 3.82Å; I210-L273 HydrophobicContact CG2-CD2 4.37Å; I210-R297 VanDerWaalsContact CG1-O 3.32Å; I210-R297 WeakPolarHBondContact CG1-O 3.43Å; I210-M299 WeakPolarHBondContact CD1-O 3.34Å; I210-M300 HydrophobicContact CD1-CE 4.33Å; I210-M300 HydrophobicContact CD1-SD 3.6Å
211	C	90	Very high	89.2	Confident	0 Å²	0	49.1 Å²	49.1	0%	0	25%	0.248	C	C	.	.	I	π-helix	trans	-60.7	-45.1	-178.7	-70.9	0	0	0	0	111.6	L207 Y208 L215 K216 L217 P220 L228	L207-C211 WeakPolarHBondContact O-CB 3.4Å; L207-C211 PolarHBondContact O-N 3.44Å; L207-C211 PolarHBondContact O-SG 3.09Å; Y208-C211 PolarHBondContact O-N 3.21Å; C211-L215 CarbonylContact O-C 3.55Å; C211-L215 WeakPolarHBondContact O-CB 3.32Å; C211-K216 PolarHBondContact O-N 2.84Å; C211-L217 HydrophobicContact CB-CD1 4.22Å; C211-L217 WeakPolarHBondContact O-CB 3.32Å; C211-L217 PolarHBondContact O-N 2.9Å; C211-P220 HydrophobicContact CB-CB 3.68Å; C211-P220 HydrophobicContact CB-CG 3.73Å; C211-L228 VanDerWaalsContact SG-CD1 3.59Å
212	F	88.8	Confident	88.8	Confident	98 Å²	98	54.8 Å²	54.8	43%	0.43	27%	0.27	S	S	.	.	I	π-helix	trans	-74.9	-50.9	-176.8	-173.3	-103.2	0	0	0	112.5	Y208 I210 K216 L217 P220	Y208-F212 HydrophobicContact CE1-CB 4.27Å; Y208-F212 WeakPolarHBondContact O-CB 3.36Å; Y208-F212 PolarHBondContact O-N 2.7Å; I210-F212 VanDerWaalsContact C-N 3.34Å; I210-F212 PolarHBondContact O-N 2.89Å; F212-K216 WeakPolarHBondContact O-CA 3.33Å; F212-L217 WeakPolarHBondContact CA-O 3.26Å; F212-L217 VanDerWaalsContact CD2-O 3.3Å; F212-L217 WeakPolarHBondContact CD2-O 3.41Å; F212-P220 HydrophobicContact CB-CG 4.19Å
213	R	86.9	Confident	88.4	Confident	154 Å²	154	56.5 Å²	56.5	58%	0.581	29%	0.289	S	S	*	.	I	π-helix	trans	-86.3	-41.4	-172	-58.5	179.9	-179.7	179.9	1.4	112.9	D209 K216	D209-R213 WeakPolarHBondContact O-CA 3.44Å; D209-R213 WeakPolarHBondContact O-CB 3.4Å; D209-R213 WeakPolarHBondContact O-CG 3.23Å; D209-R213 PolarHBondContact O-N 3Å; D209-R213 IonicContact OD1-NE 3.71Å; R213-K216 WeakPolarHBondContact O-CD 3.32Å; R213-K216 VanDerWaalsContact O-CE 3.22Å; R213-K216 WeakPolarHBondContact O-CE 3.08Å; R213-K216 PolarHBondContact O-NZ 2.79Å
214	T	86.2	Confident	88.2	Confident	39 Å²	39	58.3 Å²	58.3	24%	0.239	30%	0.298	C	S	.	.	I	π-helix	trans	-91.1	-50.2	-173.8	-55.9	0	0	0	0	111.3	I210 K216 L273	I210-T214 WeakPolarHBondContact O-CA 3.31Å; I210-T214 VanDerWaalsContact O-CB 3.23Å; I210-T214 WeakPolarHBondContact O-CB 3.45Å; I210-T214 PolarHBondContact O-N 3.38Å; T214-K216 VanDerWaalsContact C-N 3.3Å; T214-K216 PolarHBondContact O-N 2.88Å; T214-L273 HydrophobicContact CG2-CB 4.04Å
215	L	86.7	Confident	88.3	Confident	33 Å²	33	57.4 Å²	57.4	17%	0.173	29%	0.293	C	S	.	.	S	Bend	trans	-81.5	-8.8	179.8	-57.7	-179.6	0	0	0	113.8	I210 C211 L217 L228 A275	I210-L215 HydrophobicContact CG2-CG 4.46Å; I210-L215 PolarHBondContact O-N 3.34Å; C211-L215 CarbonylContact O-C 3.55Å; C211-L215 WeakPolarHBondContact O-CB 3.32Å; L215-L217 VanDerWaalsContact C-N 3.26Å; L215-L217 HydrophobicContact CB-CD1 4.36Å; L215-L217 HydrophobicContact CB-CG 4.09Å; L215-L217 PolarHBondContact O-N 2.99Å; L215-L228 HydrophobicContact CD1-CD2 4.3Å; L215-A275 WeakPolarHBondContact O-CB 3.37Å
216	K	87.9	Confident	88.4	Confident	153 Å²	153	56.2 Å²	56.2	67%	0.665	29%	0.288	S	S	*	.			trans	59.5	33.7	179.3	-54.7	-59.2	-174.9	-166.1	0	113.4	C211 F212 R213 T214	C211-K216 PolarHBondContact O-N 2.84Å; F212-K216 WeakPolarHBondContact O-CA 3.33Å; R213-K216 WeakPolarHBondContact O-CD 3.32Å; R213-K216 VanDerWaalsContact O-CE 3.22Å; R213-K216 WeakPolarHBondContact O-CE 3.08Å; R213-K216 PolarHBondContact O-NZ 2.79Å; T214-K216 VanDerWaalsContact C-N 3.3Å; T214-K216 PolarHBondContact O-N 2.88Å
217	L	86.4	Confident	88.4	Confident	48 Å²	48	60.8 Å²	60.8	25%	0.251	31%	0.308	S	S	.	.			trans	-82.2	119.6	172.4	-58.9	178.4	0	0	0	109	C211 F212 L215 T219 P220 D224	C211-L217 HydrophobicContact CB-CD1 4.22Å; C211-L217 WeakPolarHBondContact O-CB 3.32Å; C211-L217 PolarHBondContact O-N 2.9Å; F212-L217 WeakPolarHBondContact CA-O 3.26Å; F212-L217 VanDerWaalsContact CD2-O 3.3Å; F212-L217 WeakPolarHBondContact CD2-O 3.41Å; L215-L217 VanDerWaalsContact C-N 3.26Å; L215-L217 HydrophobicContact CB-CD1 4.36Å; L215-L217 HydrophobicContact CB-CG 4.09Å; L215-L217 PolarHBondContact O-N 2.99Å; L217-T219 VanDerWaalsContact C-N 3.31Å; L217-T219 PolarHBondContact O-N 3.39Å; L217-P220 HydrophobicContact CB-CG 4.45Å; L217-D224 HydrophobicContact CD1-CB 3.98Å
218	T	85.3	Confident	88.3	Confident	115 Å²	115	61.1 Å²	61.1	71%	0.706	31%	0.31	S	S	*	.	S	Bend	trans	-68.8	-31.3	-178.2	48.6	0	0	0	0	112.9
219	T	86.1	Confident	88.5	Confident	109 Å²	109	57.8 Å²	57.8	67%	0.669	30%	0.297	S	S	*	.	S	Bend	trans	-136.5	83.7	179.7	42.5	0	0	0	0	109.5	L217 T221	L217-T219 VanDerWaalsContact C-N 3.31Å; L217-T219 PolarHBondContact O-N 3.39Å; T219-T221 PolarHBondContact O-N 2.83Å
220	P	87	Confident	88.6	Confident	21 Å²	21	56.1 Å²	56.1	14%	0.136	29%	0.288	C	S	.	.			trans	-59.5	131	177	-23.3	34.5	0	0	0	111.5	Y208 C211 F212 L217 L225	Y208-P220 HydrophobicContact CD2-CB 4.05Å; Y208-P220 HydrophobicContact CD2-CG 4.08Å; Y208-P220 HydrophobicContact CE2-CB 4.01Å; Y208-P220 HydrophobicContact CE2-CG 3.79Å; C211-P220 HydrophobicContact CB-CB 3.68Å; C211-P220 HydrophobicContact CB-CG 3.73Å; F212-P220 HydrophobicContact CB-CG 4.19Å; L217-P220 HydrophobicContact CB-CG 4.45Å; P220-L225 HydrophobicContact CB-CD1 4.01Å
221	T	89.1	Confident	88.7	Confident	77 Å²	77	56.6 Å²	56.6	47%	0.472	29%	0.292	S	S	.	.			trans	-103.4	159.9	175	68	0	0	0	0	110.9	T219 G223 D224 L225	T219-T221 PolarHBondContact O-N 2.83Å; T221-G223 PolarHBondContact O-N 3.45Å; T221-G223 VanDerWaalsContact O-N 3.09Å; T221-G223 PolarHBondContact OG1-N 2.98Å; T221-D224 PolarHBondContact N-OD2 3.39Å; T221-D224 WeakPolarHBondContact O-CB 3.49Å; T221-D224 PolarHBondContact O-N 3.47Å; T221-D224 PolarHBondContact OG1-OD2 3.49Å; T221-L225 WeakPolarHBondContact O-CD1 3.4Å; T221-L225 PolarHBondContact O-N 2.89Å
222	Y	85.8	Confident	88.8	Confident	119 Å²	119	56.7 Å²	56.7	47%	0.467	29%	0.293	S	S	.	.	H	α-helix	trans	-54.4	-29.4	173.1	-78.8	-69	0	0	0	113.1	V175 D224 L225 N226	V175-Y222 HydrophobicContact CG1-CE1 3.76Å; V175-Y222 WeakPolarHBondContact CG1-OH 3.48Å; V175-Y222 PolarHBondContact O-OH 2.88Å; Y222-D224 VanDerWaalsContact C-N 3.33Å; Y222-D224 PolarHBondContact O-N 3.5Å; Y222-L225 PolarHBondContact O-N 2.74Å; Y222-N226 VanDerWaalsContact O-CB 3.24Å; Y222-N226 WeakPolarHBondContact O-CB 3.34Å; Y222-N226 PolarHBondContact O-N 2.95Å; Y222-N226 PolarHBondContact O-ND2 2.81Å; Y222-N226 PolarHBondContact O-OD1 3.32Å
223	G	87.4	Confident	89	Confident	39 Å²	39	52 Å²	52	40%	0.402	27%	0.272	S	S	.	.	H	α-helix	trans	-62.5	-38.2	173.2	0	0	0	0	0	113.2	T221 H227	T221-G223 PolarHBondContact O-N 3.45Å; T221-G223 VanDerWaalsContact O-N 3.09Å; T221-G223 PolarHBondContact OG1-N 2.98Å; G223-H227 PolarHBondContact O-N 2.96Å
224	D	88.9	Confident	89.3	Confident	37 Å²	37	44.7 Å²	44.7	20%	0.198	25%	0.245	C	C	.	.	H	α-helix	trans	-71.3	-41.8	177.5	-56.6	-60.1	0	0	0	111.3	L217 T221 Y222 H227 L228	L217-D224 HydrophobicContact CD1-CB 3.98Å; T221-D224 PolarHBondContact N-OD2 3.39Å; T221-D224 WeakPolarHBondContact O-CB 3.49Å; T221-D224 PolarHBondContact O-N 3.47Å; T221-D224 PolarHBondContact OG1-OD2 3.49Å; Y222-D224 VanDerWaalsContact C-N 3.33Å; Y222-D224 PolarHBondContact O-N 3.5Å; D224-H227 WeakPolarHBondContact O-CB 3.4Å; D224-H227 PolarHBondContact O-N 2.95Å; D224-L228 PolarHBondContact O-N 2.87Å
225	L	90.3	Very high	89.5	Confident	4 Å²	4	42.9 Å²	42.9	2%	0.021	23%	0.234	C	C	.	.	H	α-helix	trans	-61.6	-49.7	175.2	-78.5	73.1	0	0	0	110.2	V175 L207 P220 T221 Y222 H227 L228 V229	V175-L225 HydrophobicContact CG1-CD2 4.47Å; L207-L225 HydrophobicContact CB-CB 4.43Å; L207-L225 HydrophobicContact CB-CD2 4.1Å; L207-L225 HydrophobicContact CB-CG 3.92Å; L207-L225 HydrophobicContact CD1-CB 4.26Å; L207-L225 HydrophobicContact CD1-CD2 4.5Å; P220-L225 HydrophobicContact CB-CD1 4.01Å; T221-L225 WeakPolarHBondContact O-CD1 3.4Å; T221-L225 PolarHBondContact O-N 2.89Å; Y222-L225 PolarHBondContact O-N 2.74Å; L225-H227 PolarHBondContact O-N 3Å; L225-L228 WeakPolarHBondContact O-CB 3.45Å; L225-L228 PolarHBondContact O-N 3.09Å; L225-L228 VanDerWaalsContact O-N 3.09Å; L225-V229 WeakPolarHBondContact O-CG2 3.49Å; L225-V229 PolarHBondContact O-N 2.92Å; L225-V229 VanDerWaalsContact O-N 3.11Å
226	N	91.4	Very high	89.6	Confident	13 Å²	13	41.5 Å²	41.5	7%	0.07	23%	0.227	C	C	.	.	H	α-helix	trans	-63	-30.2	-179.7	-66.9	-14.2	0	0	0	112.2	I16 K19 Y222 V229 S230	I16-N226 WeakPolarHBondContact CG1-OD1 3.49Å; K19-N226 HydrophobicContact CG-CB 4.08Å; Y222-N226 VanDerWaalsContact O-CB 3.24Å; Y222-N226 WeakPolarHBondContact O-CB 3.34Å; Y222-N226 PolarHBondContact O-N 2.95Å; Y222-N226 PolarHBondContact O-ND2 2.81Å; Y222-N226 PolarHBondContact O-OD1 3.32Å; N226-V229 PolarHBondContact O-N 2.93Å; N226-S230 WeakPolarHBondContact O-CB 3.5Å; N226-S230 PolarHBondContact O-N 2.82Å; N226-S230 PolarHBondContact O-OG 3.32Å
227	H	89.3	Confident	89.7	Confident	104 Å²	104	34.4 Å²	34.4	48%	0.481	20%	0.196	S	C	.	.	H	α-helix	trans	-62.9	-45.7	173.4	-177.4	57.2	0	0	0	111.7	G223 D224 L225 V229 S230 A231	G223-H227 PolarHBondContact O-N 2.96Å; D224-H227 WeakPolarHBondContact O-CB 3.4Å; D224-H227 PolarHBondContact O-N 2.95Å; L225-H227 PolarHBondContact O-N 3Å; H227-V229 VanDerWaalsContact C-N 3.32Å; H227-V229 PolarHBondContact O-N 3.11Å; H227-S230 WeakPolarHBondContact CA-OG 3.23Å; H227-S230 PolarHBondContact O-N 2.93Å; H227-S230 PolarHBondContact O-OG 3.17Å; H227-A231 PolarHBondContact O-N 3.18Å
228	L	90.9	Very high	89.9	Confident	8 Å²	8	32.1 Å²	32.1	4%	0.042	18%	0.184	C	C	.	.	H	α-helix	trans	-61.4	-41	175.4	-67.1	178.7	0	0	0	112.4	L207 I210 C211 L215 D224 L225 A231 T232 L273 M300	L207-L228 HydrophobicContact CD2-CB 3.9Å; L207-L228 HydrophobicContact CD2-CD1 4.09Å; I210-L228 HydrophobicContact CB-CD1 4.21Å; I210-L228 HydrophobicContact CG2-CD1 3.66Å; C211-L228 VanDerWaalsContact SG-CD1 3.59Å; L215-L228 HydrophobicContact CD1-CD2 4.3Å; D224-L228 PolarHBondContact O-N 2.87Å; L225-L228 WeakPolarHBondContact O-CB 3.45Å; L225-L228 PolarHBondContact O-N 3.09Å; L225-L228 VanDerWaalsContact O-N 3.09Å; L228-A231 PolarHBondContact O-N 3.49Å; L228-T232 WeakPolarHBondContact O-CB 3.3Å; L228-T232 PolarHBondContact O-N 3.22Å; L228-T232 VanDerWaalsContact O-N 3.08Å; L228-T232 PolarHBondContact O-OG1 3.4Å; L228-L273 HydrophobicContact CD2-CD2 3.5Å; L228-M300 HydrophobicContact CB-CE 4.06Å; L228-M300 HydrophobicContact CB-SD 4.39Å; L228-M300 HydrophobicContact CD2-CE 4.33Å
229	V	93.4	Very high	89.8	Confident	1 Å²	1	27.3 Å²	27.3	1%	0.006	16%	0.156	C	C	.	.	H	α-helix	trans	-65	-45.6	177.2	-177.4	0	0	0	0	110.9	I16 I202 L207 L225 N226 H227 A231 T232 M233	I16-V229 HydrophobicContact CD1-CG1 4.25Å; I16-V229 HydrophobicContact CG1-CG1 4.43Å; I16-V229 HydrophobicContact CG2-CB 4.23Å; I16-V229 HydrophobicContact CG2-CG1 3.43Å; I16-V229 VanDerWaalsContact CG2-CG1 3.43Å; I202-V229 HydrophobicContact CD1-CG1 3.6Å; I202-V229 HydrophobicContact CG2-CG1 4.49Å; I202-V229 HydrophobicContact CG2-CG2 3.63Å; L207-V229 HydrophobicContact CD1-CG2 3.54Å; L207-V229 HydrophobicContact CD2-CG2 4.17Å; L225-V229 WeakPolarHBondContact O-CG2 3.49Å; L225-V229 PolarHBondContact O-N 2.92Å; L225-V229 VanDerWaalsContact O-N 3.11Å; N226-V229 PolarHBondContact O-N 2.93Å; H227-V229 VanDerWaalsContact C-N 3.32Å; H227-V229 PolarHBondContact O-N 3.11Å; V229-A231 VanDerWaalsContact C-N 3.35Å; V229-A231 PolarHBondContact O-N 3.34Å; V229-T232 WeakPolarHBondContact O-CB 3.26Å; V229-T232 PolarHBondContact O-N 2.95Å; V229-M233 HydrophobicContact CG1-CG 4.22Å; V229-M233 HydrophobicContact CG1-SD 3.92Å; V229-M233 WeakPolarHBondContact O-CG 3.48Å; V229-M233 PolarHBondContact O-N 3.12Å
230	S	92.6	Very high	89.8	Confident	2 Å²	2	22.6 Å²	22.6	1%	0.014	13%	0.126	C	C	.	.	H	α-helix	trans	-61.5	-40.8	178.6	66.8	0	0	0	0	112.6	N226 H227 T232 M233 S234	N226-S230 WeakPolarHBondContact O-CB 3.5Å; N226-S230 PolarHBondContact O-N 2.82Å; N226-S230 PolarHBondContact O-OG 3.32Å; H227-S230 WeakPolarHBondContact CA-OG 3.23Å; H227-S230 PolarHBondContact O-N 2.93Å; H227-S230 PolarHBondContact O-OG 3.17Å; S230-T232 VanDerWaalsContact C-N 3.33Å; S230-T232 PolarHBondContact O-N 3.42Å; S230-M233 PolarHBondContact O-N 3.48Å; S230-S234 WeakPolarHBondContact O-CB 3.48Å; S230-S234 PolarHBondContact O-N 3.23Å
231	A	91.4	Very high	89.9	Confident	14 Å²	14	21.6 Å²	21.6	12%	0.116	12%	0.12	C	C	.	.	H	α-helix	trans	-63.3	-40.5	175.7	0	0	0	0	0	111.8	H227 L228 V229 G235 F270	H227-A231 PolarHBondContact O-N 3.18Å; L228-A231 PolarHBondContact O-N 3.49Å; V229-A231 VanDerWaalsContact C-N 3.35Å; V229-A231 PolarHBondContact O-N 3.34Å; A231-G235 PolarHBondContact O-N 2.73Å; A231-F270 HydrophobicContact CB-CD2 4.31Å; A231-F270 HydrophobicContact CB-CE1 4.4Å; A231-F270 HydrophobicContact CB-CE2 4.11Å; A231-F270 HydrophobicContact CB-CZ 4.16Å
232	T	92.2	Very high	89.8	Confident	2 Å²	2	18 Å²	18	1%	0.012	10%	0.097	C	C	.	.	H	α-helix	trans	-64.8	-49	175.7	-57.8	0	0	0	0	111.3	L228 V229 S230 S234 G235 V236 P268	L228-T232 WeakPolarHBondContact O-CB 3.3Å; L228-T232 PolarHBondContact O-N 3.22Å; L228-T232 VanDerWaalsContact O-N 3.08Å; L228-T232 PolarHBondContact O-OG1 3.4Å; V229-T232 WeakPolarHBondContact O-CB 3.26Å; V229-T232 PolarHBondContact O-N 2.95Å; S230-T232 VanDerWaalsContact C-N 3.33Å; S230-T232 PolarHBondContact O-N 3.42Å; T232-S234 VanDerWaalsContact C-N 3.34Å; T232-S234 PolarHBondContact O-N 3.2Å; T232-G235 PolarHBondContact O-N 3.47Å; T232-G235 VanDerWaalsContact O-N 3.17Å; T232-V236 HydrophobicContact CG2-CG2 4.46Å; T232-V236 WeakPolarHBondContact O-CG2 3.38Å; T232-V236 PolarHBondContact O-N 3.44Å; T232-P268 HydrophobicContact CG2-CB 3.52Å; T232-P268 HydrophobicContact CG2-CG 4.23Å
233	M	93.7	Very high	89.5	Confident	0 Å²	0	14.2 Å²	14.2	0%	0	9%	0.087	C	C	.	.	H	α-helix	trans	-61.2	-42.3	177.5	-70.7	175.9	69.1	0	0	112	I16 F20 T136 F167 V229 S230 G235 T237	I16-M233 HydrophobicContact CG2-SD 3.48Å; I16-M233 WeakPolarHBondContact CG2-SD 3.44Å; F20-M233 HydrophobicContact CB-CE 3.69Å; F20-M233 HydrophobicContact CB-SD 4.04Å; F20-M233 HydrophobicContact CD1-CE 4.06Å; F20-M233 HydrophobicContact CD2-CB 3.54Å; F20-M233 HydrophobicContact CD2-CE 3.74Å; F20-M233 HydrophobicContact CD2-SD 4.38Å; F20-M233 HydrophobicContact CE2-CB 4Å; F20-M233 HydrophobicContact CE2-CE 4.36Å; F20-M233 HydrophobicContact CG-CB 4.42Å; F20-M233 HydrophobicContact CG-CE 3.54Å; F20-M233 HydrophobicContact CG-SD 4.37Å; T136-M233 HydrophobicContact CG2-CE 3.3Å; T136-M233 HydrophobicContact CG2-SD 4.19Å; F167-M233 HydrophobicContact CD1-CG 3.61Å; F167-M233 HydrophobicContact CD1-SD 4.46Å; F167-M233 HydrophobicContact CD2-CE 4.09Å; F167-M233 HydrophobicContact CE1-CB 4.35Å; F167-M233 HydrophobicContact CE1-CG 3.68Å; F167-M233 HydrophobicContact CE2-CE 4.47Å; F167-M233 HydrophobicContact CG-CE 4.2Å; F167-M233 HydrophobicContact CG-CG 4.05Å; F167-M233 HydrophobicContact CG-SD 4.38Å; F167-M233 HydrophobicContact CZ-CG 4.2Å; V229-M233 HydrophobicContact CG1-CG 4.22Å; V229-M233 HydrophobicContact CG1-SD 3.92Å; V229-M233 WeakPolarHBondContact O-CG 3.48Å; V229-M233 PolarHBondContact O-N 3.12Å; S230-M233 PolarHBondContact O-N 3.48Å; M233-G235 VanDerWaalsContact C-N 3.33Å; M233-G235 PolarHBondContact O-N 2.93Å; M233-T237 WeakPolarHBondContact O-CB 3.45Å; M233-T237 VanDerWaalsContact O-CG2 3.24Å; M233-T237 WeakPolarHBondContact O-CG2 3.5Å; M233-T237 PolarHBondContact O-N 2.71Å; M233-T237 VanDerWaalsContact O-N 3.09Å; M233-T237 PolarHBondContact O-OG1 3.33Å
234	S	92.6	Very high	88.7	Confident	1 Å²	1	13.3 Å²	13.3	1%	0.007	8%	0.078	C	C	.	.	H	α-helix	trans	-59.6	-45.5	174	174.8	0	0	0	0	111	E27 S230 T232 T237 T238 R241 R318	E27-S234 VanDerWaalsContact CD-OG 3.23Å; E27-S234 PolarHBondContact OE1-OG 3.33Å; E27-S234 PolarHBondContact OE2-OG 2.97Å; S230-S234 WeakPolarHBondContact O-CB 3.48Å; S230-S234 PolarHBondContact O-N 3.23Å; T232-S234 VanDerWaalsContact C-N 3.34Å; T232-S234 PolarHBondContact O-N 3.2Å; S234-T237 PolarHBondContact O-N 3.16Å; S234-T237 PolarHBondContact O-OG1 3.41Å; S234-T238 PolarHBondContact O-N 3.24Å; S234-T238 VanDerWaalsContact O-N 3.08Å; S234-T238 PolarHBondContact O-OG1 3.32Å; S234-R241 PolarHBondContact O-NH2 3Å; S234-R241 PolarHBondContact OG-NH2 3.37Å; S234-R318 PolarHBondContact OG-NH1 3.24Å; S234-R318 VanDerWaalsContact OG-NH1 3.08Å
235	G	90.3	Very high	87.3	Confident	0 Å²	0	18.8 Å²	18.8	0%	0	10%	0.102	C	C	.	.	H	α-helix	trans	-60	-50.5	177	0	0	0	0	0	114.1	A231 T232 M233 T237 T238 T366	A231-G235 PolarHBondContact O-N 2.73Å; T232-G235 PolarHBondContact O-N 3.47Å; T232-G235 VanDerWaalsContact O-N 3.17Å; M233-G235 VanDerWaalsContact C-N 3.33Å; M233-G235 PolarHBondContact O-N 2.93Å; G235-T237 VanDerWaalsContact C-N 3.27Å; G235-T237 PolarHBondContact O-N 3.45Å; G235-T238 WeakPolarHBondContact CA-OG1 3.31Å; G235-T238 VanDerWaalsContact O-CB 3.28Å; G235-T238 WeakPolarHBondContact O-CB 3.34Å; G235-T238 PolarHBondContact O-N 3.33Å; G235-T238 PolarHBondContact O-OG1 3.17Å; G235-T238 VanDerWaalsContact O-OG1 3.09Å; G235-T366 VanDerWaalsContact CA-OG1 3.24Å; G235-T366 WeakPolarHBondContact CA-OG1 3.44Å
236	V	89.4	Confident	86.1	Confident	5 Å²	5	22.3 Å²	22.3	3%	0.03	12%	0.121	C	C	.	.	H	α-helix	trans	-59.4	-39.2	178.2	171.1	0	0	0	0	111.4	F167 Y200 T232 T238 T366 I368	F167-V236 HydrophobicContact CZ-CB 4.41Å; F167-V236 HydrophobicContact CZ-CG1 4.08Å; Y200-V236 HydrophobicContact CD1-CG1 4.47Å; Y200-V236 HydrophobicContact CD1-CG2 4.25Å; Y200-V236 HydrophobicContact CE1-CB 4.44Å; Y200-V236 HydrophobicContact CE1-CG1 3.61Å; Y200-V236 HydrophobicContact CE1-CG2 3.9Å; Y200-V236 HydrophobicContact CE2-CG1 4.09Å; Y200-V236 VanDerWaalsContact CZ-CG1 3.41Å; Y200-V236 VanDerWaalsContact OH-CG1 3.32Å; Y200-V236 WeakPolarHBondContact OH-CG1 3.31Å; T232-V236 HydrophobicContact CG2-CG2 4.46Å; T232-V236 WeakPolarHBondContact O-CG2 3.38Å; T232-V236 PolarHBondContact O-N 3.44Å; V236-T238 VanDerWaalsContact C-N 3.34Å; V236-T366 HydrophobicContact CG2-CG2 4.04Å; V236-I368 HydrophobicContact CB-CD1 4.35Å; V236-I368 HydrophobicContact CG1-CD1 4.07Å; V236-I368 HydrophobicContact CG2-CD1 3.89Å; V236-I368 HydrophobicContact CG2-CG1 4Å
237	T	90.8	Very high	84.4	Confident	3 Å²	3	25.4 Å²	25.4	2%	0.018	14%	0.137	C	C	.	.	T	Hydrogen-bonded Turn	trans	-87.8	-0.4	-176.7	60.7	0	0	0	0	113.7	F20 Y50 M233 S234 G235 S239 L240 R241	F20-T237 HydrophobicContact CE2-CG2 4.34Å; F20-T237 HydrophobicContact CZ-CG2 4.41Å; Y50-T237 WeakPolarHBondContact OH-CG2 3.32Å; M233-T237 WeakPolarHBondContact O-CB 3.45Å; M233-T237 VanDerWaalsContact O-CG2 3.24Å; M233-T237 WeakPolarHBondContact O-CG2 3.5Å; M233-T237 PolarHBondContact O-N 2.71Å; M233-T237 VanDerWaalsContact O-N 3.09Å; M233-T237 PolarHBondContact O-OG1 3.33Å; S234-T237 PolarHBondContact O-N 3.16Å; S234-T237 PolarHBondContact O-OG1 3.41Å; G235-T237 VanDerWaalsContact C-N 3.27Å; G235-T237 PolarHBondContact O-N 3.45Å; T237-S239 PolarHBondContact O-N 3.47Å; T237-L240 HydrophobicContact CG2-CD1 4.4Å; T237-L240 WeakPolarHBondContact O-CB 3.13Å; T237-L240 PolarHBondContact O-N 2.96Å; T237-L240 VanDerWaalsContact O-N 3.11Å; T237-R241 WeakPolarHBondContact O-CG 3.43Å; T237-R241 PolarHBondContact O-N 2.91Å; T237-R241 VanDerWaalsContact O-N 3.09Å; T237-R241 PolarHBondContact OG1-NE 3.47Å; T237-R241 VanDerWaalsContact OG1-NE 3.12Å
238	T	89.6	Confident	83.2	Confident	0 Å²	0	20.9 Å²	20.9	0%	0	12%	0.118	C	C	.	.	H	α-helix	trans	-60.5	-42.8	-175.3	-65.4	0	0	0	0	112.2	S234 G235 V236 L240 R241 F242 V316 R318 C354	S234-T238 PolarHBondContact O-N 3.24Å; S234-T238 VanDerWaalsContact O-N 3.08Å; S234-T238 PolarHBondContact O-OG1 3.32Å; G235-T238 WeakPolarHBondContact CA-OG1 3.31Å; G235-T238 VanDerWaalsContact O-CB 3.28Å; G235-T238 WeakPolarHBondContact O-CB 3.34Å; G235-T238 PolarHBondContact O-N 3.33Å; G235-T238 PolarHBondContact O-OG1 3.17Å; G235-T238 VanDerWaalsContact O-OG1 3.09Å; V236-T238 VanDerWaalsContact C-N 3.34Å; T238-L240 PolarHBondContact O-N 3.14Å; T238-R241 PolarHBondContact O-N 2.82Å; T238-F242 HydrophobicContact CG2-CD2 4.05Å; T238-F242 PolarHBondContact O-N 3.29Å; T238-V316 HydrophobicContact CG2-CG1 4.37Å; T238-R318 HydrophobicContact CG2-CG 3.96Å; T238-R318 WeakPolarHBondContact OG1-CD 3.47Å; T238-R318 PolarHBondContact OG1-NE 3.02Å; T238-R318 PolarHBondContact OG1-NH1 3.47Å; T238-C354 HydrophobicContact CG2-CB 3.64Å
239	S	83.5	Confident	82.3	Confident	15 Å²	15	22 Å²	22	11%	0.105	12%	0.124	C	C	.	.	H	α-helix	trans	-64.3	-21.5	179.5	54.4	0	0	0	0	113.6	R46 T237	R46-S239 PolarHBondContact NH1-O 3.01Å; T237-S239 PolarHBondContact O-N 3.47Å
240	L	85.8	Confident	81.7	Confident	9 Å²	9	22.3 Å²	22.3	5%	0.047	13%	0.126	C	C	.	.	H	α-helix	trans	-84.7	-44.4	176.9	-50.7	167.7	0	0	0	110.2	I4 R46 V49 T237 T238 A248 L250	I4-L240 HydrophobicContact CD1-CD1 3.73Å; R46-L240 VanDerWaalsContact CD-O 3.31Å; R46-L240 WeakPolarHBondContact CD-O 3.34Å; V49-L240 HydrophobicContact CG1-CB 4.36Å; T237-L240 HydrophobicContact CG2-CD1 4.4Å; T237-L240 WeakPolarHBondContact O-CB 3.13Å; T237-L240 PolarHBondContact O-N 2.96Å; T237-L240 VanDerWaalsContact O-N 3.11Å; T238-L240 PolarHBondContact O-N 3.14Å; L240-A248 WeakPolarHBondContact CD2-O 3.39Å; L240-L250 HydrophobicContact CD1-CD2 3.38Å; L240-L250 HydrophobicContact CD1-CG 4.03Å; L240-L250 HydrophobicContact CD2-CD2 3.98Å; L240-L250 HydrophobicContact CD2-CG 4.08Å; L240-L250 HydrophobicContact CG-CD2 4.3Å
241	R	89	Confident	81.3	Confident	1 Å²	1	28.2 Å²	28.2	0%	0.004	15%	0.148	C	C	.	.	H	α-helix	trans	-81.7	-25.7	-171.6	-71.7	-173.7	-56.9	103.3	-1.2	115.1	E27 H28 R46 Y50 S234 T237 T238	E27-R241 IonicContact OE1-NH2 3.52Å; E27-R241 IonicContact OE2-CZ 2.9Å; E27-R241 IonicContact OE2-NH1 3.06Å; E27-R241 PolarHBondContact OE2-NH1 3.04Å; E27-R241 IonicContact OE2-NH2 2.68Å; E27-R241 PolarHBondContact OE2-NH2 2.76Å; H28-R241 PolarHBondContact CE1-O 2.98Å; H28-R241 PolarHBondContact NE2-NH1 2.82Å; R46-R241 WeakPolarHBondContact CB-O 3.45Å; Y50-R241 HydrophobicContact CD2-CG 3.58Å; Y50-R241 HydrophobicContact CE2-CG 3.6Å; S234-R241 PolarHBondContact O-NH2 3Å; S234-R241 PolarHBondContact OG-NH2 3.37Å; T237-R241 WeakPolarHBondContact O-CG 3.43Å; T237-R241 PolarHBondContact O-N 2.91Å; T237-R241 VanDerWaalsContact O-N 3.09Å; T237-R241 PolarHBondContact OG1-NE 3.47Å; T237-R241 VanDerWaalsContact OG1-NE 3.12Å; T238-R241 PolarHBondContact O-N 2.82Å
242	F	87.1	Confident	81.1	Confident	0 Å²	0	32 Å²	32	0%	0	16%	0.161	C	C	.	.	S	Bend	trans	-123.7	145.1	179.4	-61.9	-66.4	0	0	0	110.9	E27 H28 T238 G244 I356	E27-F242 HydrophobicContact CB-CZ 4.14Å; E27-F242 WeakPolarHBondContact OE2-CE2 3.29Å; H28-F242 AromaticContact CE1-CE1 3.69Å; H28-F242 AromaticContact CE1-CZ 3.94Å; H28-F242 AromaticContact ND1-CE1 3.97Å; T238-F242 HydrophobicContact CG2-CD2 4.05Å; T238-F242 PolarHBondContact O-N 3.29Å; F242-G244 PolarHBondContact O-N 3.23Å; F242-I356 HydrophobicContact CB-CD1 4.35Å; F242-I356 HydrophobicContact CD1-CD1 3.31Å; F242-I356 HydrophobicContact CE1-CD1 3.62Å; F242-I356 HydrophobicContact CE1-CG2 4.33Å; F242-I356 HydrophobicContact CE2-CG2 4.29Å; F242-I356 HydrophobicContact CG-CD1 3.85Å; F242-I356 HydrophobicContact CZ-CD1 4.39Å; F242-I356 HydrophobicContact CZ-CG2 4.09Å
243	P	79	Confident	80.7	Confident	40 Å²	40	32.9 Å²	32.9	26%	0.26	17%	0.166	S	C	.	.			trans	-62.9	125.2	168.7	28.4	-33.9	0	0	0	108.8	L42 D45	L42-P243 HydrophobicContact CD2-CG 3.9Å; D45-P243 HydrophobicContact CB-CG 4.36Å; D45-P243 WeakPolarHBondContact OD2-CG 3.43Å
244	G	70.4	Confident	80.4	Confident	20 Å²	20	33.4 Å²	33.4	21%	0.206	17%	0.17	C	C	.	.			trans	-131.4	160.2	174.7	0	0	0	0	0	109.8	F242 L246 N247	F242-G244 PolarHBondContact O-N 3.23Å; G244-L246 PolarHBondContact O-N 3.48Å; G244-N247 PolarHBondContact O-OD1 2.75Å; G244-N247 VanDerWaalsContact O-OD1 3.12Å
245	Q	61.2	Low	80.3	Confident	152 Å²	152	38.7 Å²	38.7	71%	0.71	20%	0.202	S	C	*	.	S	Bend	trans	-64	-30.6	179.9	-63.6	-165.8	1.7	0	0	111.9	N247 M323	Q245-N247 PolarHBondContact O-N 2.94Å; Q245-M323 HydrophobicContact CB-CE 4.38Å; Q245-M323 HydrophobicContact CG-CE 3.88Å; Q245-M323 PolarHBondContact OE1-SD 3.37Å
246	L	64.9	Low	80.2	Confident	78 Å²	78	41.8 Å²	41.8	41%	0.408	22%	0.219	S	C	.	.	S	Bend	trans	-92.2	85.5	168.4	-154.7	88	0	0	0	110	G244 A248 A352	G244-L246 PolarHBondContact O-N 3.48Å; L246-A248 PolarHBondContact O-N 3.49Å; L246-A352 HydrophobicContact CB-CB 4.17Å; L246-A352 HydrophobicContact CD2-CB 4.03Å
247	N	55.6	Low	80.2	Confident	78 Å²	78	41.6 Å²	41.6	42%	0.417	22%	0.218	S	C	.	.			trans	-66.9	93.2	172.9	-73.9	-42.3	0	0	0	110.2	R46 G244 Q245 K252	R46-N247 PolarHBondContact NH2-OD1 3.2Å; G244-N247 PolarHBondContact O-OD1 2.75Å; G244-N247 VanDerWaalsContact O-OD1 3.12Å; Q245-N247 PolarHBondContact O-N 2.94Å; N247-K252 PolarHBondContact O-NZ 3.38Å
248	A	63.7	Low	80.3	Confident	10 Å²	10	42.8 Å²	42.8	8%	0.083	23%	0.225	C	C	.	.			trans	-104.7	118.7	174.8	0	0	0	0	0	109.6	L240 L246	L240-A248 WeakPolarHBondContact CD2-O 3.39Å; L246-A248 PolarHBondContact O-N 3.49Å
249	D	72.9	Confident	80.4	Confident	31 Å²	31	45.1 Å²	45.1	17%	0.166	24%	0.24	C	C	.	.			trans	-79.4	169.6	159.2	36.7	62.2	0	0	0	110.2	R2 R251 K252 L253	R2-D249 IonicContact CZ-OD2 3.96Å; R2-D249 IonicContact NH1-OD2 3.26Å; R2-D249 PolarHBondContact NH1-OD2 2.86Å; R2-D249 IonicContact NH2-OD2 3.53Å; R2-D249 PolarHBondContact NH2-OD2 3.43Å; D249-R251 PolarHBondContact O-N 3.03Å; D249-K252 PolarHBondContact O-N 3.49Å; D249-K252 WeakPolarHBondContact OD1-CA 3.24Å; D249-K252 WeakPolarHBondContact OD1-CB 3.42Å; D249-K252 PolarHBondContact OD1-N 3.41Å; D249-L253 PolarHBondContact O-N 3.24Å
250	L	79.3	Confident	80.8	Confident	7 Å²	7	47 Å²	47	4%	0.037	25%	0.247	C	C	.	.	H	α-helix	trans	-54.4	-41.2	174	-72	-175.4	0	0	0	112.3	I4 Q131 I163 N165 L240 L253 A254	I4-L250 HydrophobicContact CD1-CD1 3.7Å; I4-L250 HydrophobicContact CD1-CG 4.08Å; I4-L250 HydrophobicContact CG1-CD1 3.94Å; Q131-L250 HydrophobicContact CB-CD1 4.29Å; I163-L250 HydrophobicContact CB-CB 4.34Å; I163-L250 HydrophobicContact CG1-CB 4.46Å; I163-L250 HydrophobicContact CG2-CB 4.08Å; I163-L250 HydrophobicContact CG2-CD1 4.46Å; N165-L250 VanDerWaalsContact ND2-CD2 3.32Å; N165-L250 WeakPolarHBondContact ND2-CD2 3.48Å; L240-L250 HydrophobicContact CD1-CD2 3.38Å; L240-L250 HydrophobicContact CD1-CG 4.03Å; L240-L250 HydrophobicContact CD2-CD2 3.98Å; L240-L250 HydrophobicContact CD2-CG 4.08Å; L240-L250 HydrophobicContact CG-CD2 4.3Å; L250-L253 PolarHBondContact O-N 2.99Å; L250-A254 WeakPolarHBondContact O-CB 3.07Å; L250-A254 PolarHBondContact O-N 3.47Å
251	R	85.8	Confident	81	Confident	127 Å²	127	51.9 Å²	51.9	48%	0.479	28%	0.279	S	S	.	.	H	α-helix	trans	-65.4	-43.9	-179.9	-176.4	173.1	-64.6	-76.5	-1.7	112.1	D161 I163 D249 L253 A254 V255	D161-R251 PolarHBondContact O-NH2 2.89Å; I163-R251 HydrophobicContact CD1-CB 4.29Å; I163-R251 HydrophobicContact CD1-CG 4.41Å; I163-R251 HydrophobicContact CG1-CB 4.1Å; D249-R251 PolarHBondContact O-N 3.03Å; R251-L253 VanDerWaalsContact C-N 3.32Å; R251-A254 WeakPolarHBondContact O-CB 3.45Å; R251-A254 PolarHBondContact O-N 3.18Å; R251-V255 HydrophobicContact CG-CG2 4.44Å; R251-V255 VanDerWaalsContact O-CG2 3.29Å; R251-V255 WeakPolarHBondContact O-CG2 3.44Å; R251-V255 PolarHBondContact O-N 3.34Å
252	K	85.9	Confident	81.2	Confident	92 Å²	92	55.1 Å²	55.1	40%	0.4	29%	0.291	S	S	.	.	H	α-helix	trans	-68.5	-34	177.7	-176	171.5	177.3	-173.7	0	111	N247 D249 N256	N247-K252 PolarHBondContact O-NZ 3.38Å; D249-K252 PolarHBondContact O-N 3.49Å; D249-K252 WeakPolarHBondContact OD1-CA 3.24Å; D249-K252 WeakPolarHBondContact OD1-CB 3.42Å; D249-K252 PolarHBondContact OD1-N 3.41Å; K252-N256 WeakPolarHBondContact O-CB 3.22Å; K252-N256 PolarHBondContact O-N 3.09Å; K252-N256 VanDerWaalsContact O-N 3.17Å; K252-N256 PolarHBondContact O-ND2 3.2Å
253	L	84.3	Confident	81.6	Confident	21 Å²	21	55.1 Å²	55.1	11%	0.11	29%	0.291	C	S	.	.	H	α-helix	trans	-62.9	-47.2	169.3	-174.4	65.7	0	0	0	110.4	Y200 D249 L250 R251 N256 M257 A314	Y200-L253 WeakPolarHBondContact OH-CD2 3.41Å; D249-L253 PolarHBondContact O-N 3.24Å; L250-L253 PolarHBondContact O-N 2.99Å; R251-L253 VanDerWaalsContact C-N 3.32Å; L253-N256 PolarHBondContact O-N 2.88Å; L253-M257 HydrophobicContact CD1-CG 3.85Å; L253-M257 HydrophobicContact CG-CG 4.26Å; L253-M257 VanDerWaalsContact O-CB 3.27Å; L253-M257 WeakPolarHBondContact O-CB 3.4Å; L253-M257 VanDerWaalsContact O-CG 3.22Å; L253-M257 WeakPolarHBondContact O-CG 3.36Å; L253-M257 PolarHBondContact O-N 3.25Å; L253-A314 HydrophobicContact CD1-CB 4.33Å
254	A	87.4	Confident	82.4	Confident	11 Å²	11	53.2 Å²	53.2	9%	0.091	28%	0.279	C	S	.	.	H	α-helix	trans	-59.2	-49.5	178.1	0	0	0	0	0	112.3	I163 Q198 L250 R251 N256 M257 V258	I163-A254 HydrophobicContact CD1-CB 4.41Å; Q198-A254 HydrophobicContact CG-CB 4.09Å; Q198-A254 VanDerWaalsContact NE2-N 3.17Å; L250-A254 WeakPolarHBondContact O-CB 3.07Å; L250-A254 PolarHBondContact O-N 3.47Å; R251-A254 WeakPolarHBondContact O-CB 3.45Å; R251-A254 PolarHBondContact O-N 3.18Å; A254-N256 VanDerWaalsContact C-N 3.27Å; A254-N256 PolarHBondContact O-N 2.78Å; A254-M257 PolarHBondContact O-N 2.95Å; A254-M257 VanDerWaalsContact O-N 3.12Å; A254-V258 WeakPolarHBondContact O-CB 3.34Å; A254-V258 PolarHBondContact O-N 3.43Å
255	V	89.4	Confident	83.6	Confident	112 Å²	112	52.2 Å²	52.2	68%	0.679	27%	0.269	S	S	*	.	H	α-helix	trans	-60.4	-34.7	179.1	171.6	0	0	0	0	112.5	R251	R251-V255 HydrophobicContact CG-CG2 4.44Å; R251-V255 VanDerWaalsContact O-CG2 3.29Å; R251-V255 WeakPolarHBondContact O-CG2 3.44Å; R251-V255 PolarHBondContact O-N 3.34Å
256	N	89.3	Confident	85.3	Confident	65 Å²	65	45 Å²	45	35%	0.348	24%	0.235	S	C	.	.	H	α-helix	trans	-81.3	-24.7	178.2	-75.7	-61.5	0	0	0	113.5	K252 L253 A254 T312 K350	K252-N256 WeakPolarHBondContact O-CB 3.22Å; K252-N256 PolarHBondContact O-N 3.09Å; K252-N256 VanDerWaalsContact O-N 3.17Å; K252-N256 PolarHBondContact O-ND2 3.2Å; L253-N256 PolarHBondContact O-N 2.88Å; A254-N256 VanDerWaalsContact C-N 3.27Å; A254-N256 PolarHBondContact O-N 2.78Å; N256-T312 WeakPolarHBondContact O-CG2 3.45Å; N256-K350 HydrophobicContact CB-CG 4.35Å
257	M	90.1	Very high	86.7	Confident	1 Å²	1	41.3 Å²	41.3	1%	0.005	22%	0.216	C	C	.	.	H	α-helix	trans	-103.3	-23.5	-171.2	-68.1	-59.9	-63.1	0	0	113.8	L253 A254 P259 F266 T312 A314 I368 N370	L253-M257 HydrophobicContact CD1-CG 3.85Å; L253-M257 HydrophobicContact CG-CG 4.26Å; L253-M257 VanDerWaalsContact O-CB 3.27Å; L253-M257 WeakPolarHBondContact O-CB 3.4Å; L253-M257 VanDerWaalsContact O-CG 3.22Å; L253-M257 WeakPolarHBondContact O-CG 3.36Å; L253-M257 PolarHBondContact O-N 3.25Å; A254-M257 PolarHBondContact O-N 2.95Å; A254-M257 VanDerWaalsContact O-N 3.12Å; M257-P259 VanDerWaalsContact O-CD 3.23Å; M257-P259 WeakPolarHBondContact O-CD 3.38Å; M257-F266 HydrophobicContact CB-CE1 3.79Å; M257-F266 HydrophobicContact CB-CE2 4.34Å; M257-F266 HydrophobicContact CB-CZ 3.49Å; M257-F266 VanDerWaalsContact CB-CZ 3.49Å; M257-F266 HydrophobicContact CE-CD1 4.49Å; M257-F266 HydrophobicContact CE-CE1 4.38Å; M257-F266 HydrophobicContact CG-CZ 4.44Å; M257-T312 WeakPolarHBondContact CA-OG1 3.45Å; M257-T312 PolarHBondContact O-OG1 3.04Å; M257-A314 HydrophobicContact CE-CB 4.15Å; M257-A314 HydrophobicContact CG-CB 4.44Å; M257-A314 HydrophobicContact SD-CB 3.52Å; M257-A314 VanDerWaalsContact SD-CB 3.52Å; M257-I368 HydrophobicContact CE-CB 4.33Å; M257-I368 HydrophobicContact CE-CG2 3.92Å; M257-I368 VanDerWaalsContact CE-O 3.26Å; M257-I368 WeakPolarHBondContact CE-O 3.45Å; M257-N370 HydrophobicContact CE-CB 4.48Å; M257-N370 PolarHBondContact O-ND2 3Å
258	V	93.3	Very high	88.6	Confident	28 Å²	28	37.6 Å²	37.6	17%	0.17	20%	0.196	C	C	.	.			trans	-112.7	92.7	-174.4	-174.2	0	0	0	0	109.3	A254 F260 H264 F266	A254-V258 WeakPolarHBondContact O-CB 3.34Å; A254-V258 PolarHBondContact O-N 3.43Å; V258-F260 VanDerWaalsContact C-N 3.34Å; V258-F260 WeakPolarHBondContact CG1-O 3.4Å; V258-H264 HydrophobicContact CG1-CB 3.91Å; V258-H264 HydrophobicContact CG2-CB 3.85Å; V258-F266 HydrophobicContact CG2-CE1 4.13Å; V258-F266 HydrophobicContact CG2-CZ 3.63Å
259	P	90.5	Very high	90	Very high	50 Å²	50	37.1 Å²	37.1	33%	0.325	19%	0.192	S	C	.	.	S	Bend	trans	-71.7	-31.5	175.4	28.1	-33.1	0	0	0	112.1	M257 L311 I345	M257-P259 VanDerWaalsContact O-CD 3.23Å; M257-P259 WeakPolarHBondContact O-CD 3.38Å; P259-L311 HydrophobicContact CG-CB 4.32Å; P259-L311 HydrophobicContact CG-CD1 4.43Å; P259-I345 HydrophobicContact CB-CD1 4.03Å; P259-I345 HydrophobicContact CG-CD1 4.15Å
260	F	92.5	Very high	90.9	Very high	55 Å²	55	36.3 Å²	36.3	24%	0.241	19%	0.187	C	C	.	.	S	Bend	trans	-127.5	134.4	-179.3	-57.7	-69.7	0	0	0	110.5	V258 R262 L263 W344 Y425	V258-F260 VanDerWaalsContact C-N 3.34Å; V258-F260 WeakPolarHBondContact CG1-O 3.4Å; F260-R262 VanDerWaalsContact C-N 3.3Å; F260-R262 PolarHBondContact O-N 3.21Å; F260-R262 VanDerWaalsContact O-N 3.16Å; F260-L263 HydrophobicContact CB-CB 4.3Å; F260-L263 HydrophobicContact CB-CD1 4.35Å; F260-L263 HydrophobicContact CB-CG 4.14Å; F260-L263 HydrophobicContact CD2-CD1 3.98Å; F260-L263 PolarHBondContact O-N 2.9Å; F260-W344 AromaticContact CE2-CH2 3.49Å; F260-W344 HydrophobicContact CE2-CH2 3.49Å; F260-W344 VanDerWaalsContact CE2-CH2 3.49Å; F260-W344 HydrophobicContact CE2-CZ2 4.3Å; F260-W344 HydrophobicContact CE2-CZ3 4.15Å; F260-W344 AromaticContact CZ-CH2 3.82Å; F260-W344 HydrophobicContact CZ-CH2 3.82Å; F260-W344 HydrophobicContact CZ-CZ3 4.05Å; F260-Y425 HydrophobicContact CD2-CD1 4.45Å; F260-Y425 HydrophobicContact CD2-CD2 4.26Å; F260-Y425 HydrophobicContact CD2-CE1 4.07Å; F260-Y425 AromaticContact CD2-CE2 3.84Å; F260-Y425 HydrophobicContact CD2-CE2 3.84Å; F260-Y425 AromaticContact CD2-CZ 3.72Å; F260-Y425 AromaticContact CE1-CE1 3.94Å; F260-Y425 HydrophobicContact CE1-CE1 3.94Å; F260-Y425 AromaticContact CE1-CZ 3.8Å; F260-Y425 WeakPolarHBondContact CE1-OH 3.17Å; F260-Y425 AromaticContact CE2-CD1 3.59Å; F260-Y425 HydrophobicContact CE2-CD1 3.59Å; F260-Y425 HydrophobicContact CE2-CD2 4.16Å; F260-Y425 AromaticContact CE2-CE1 3.25Å; F260-Y425 HydrophobicContact CE2-CE1 3.25Å; F260-Y425 AromaticContact CE2-CE2 3.86Å; F260-Y425 HydrophobicContact CE2-CE2 3.86Å; F260-Y425 HydrophobicContact CE2-CG 4.03Å; F260-Y425 AromaticContact CE2-CZ 3.38Å; F260-Y425 HydrophobicContact CG-CE2 4.25Å; F260-Y425 AromaticContact CZ-CD1 3.92Å; F260-Y425 HydrophobicContact CZ-CD1 3.92Å; F260-Y425 AromaticContact CZ-CE1 3.19Å; F260-Y425 HydrophobicContact CZ-CE1 3.19Å; F260-Y425 HydrophobicContact CZ-CE2 4.36Å; F260-Y425 AromaticContact CZ-CZ 3.45Å; F260-Y425 VanDerWaalsContact CZ-CZ 3.45Å
261	P	89.7	Confident	91.5	Very high	111 Å²	111	36 Å²	36	72%	0.721	19%	0.186	S	C	*	.	T	Hydrogen-bonded Turn	trans	-55.1	-37.5	-171.8	-29.1	35.3	0	0	0	115.2	H264	P261-H264 PolarHBondContact O-ND1 2.93Å
262	R	93.4	Very high	91.7	Very high	68 Å²	68	30.3 Å²	30.3	26%	0.257	17%	0.165	S	C	.	.	T	Hydrogen-bonded Turn	trans	-79.9	-22.1	-179.4	-69.1	169.7	62.4	101.2	-2.9	113.3	V193 F260 H264 N414 L418 E421	V193-R262 HydrophobicContact CG1-CB 4.23Å; V193-R262 HydrophobicContact CG1-CG 3.97Å; F260-R262 VanDerWaalsContact C-N 3.3Å; F260-R262 PolarHBondContact O-N 3.21Å; F260-R262 VanDerWaalsContact O-N 3.16Å; R262-H264 VanDerWaalsContact C-N 3.34Å; R262-H264 PolarHBondContact O-N 2.97Å; R262-N414 PolarHBondContact NH1-OD1 3.5Å; R262-N414 PolarHBondContact NH2-OD1 2.83Å; R262-L418 HydrophobicContact CB-CD1 4.45Å; R262-E421 WeakPolarHBondContact CB-OE2 3.48Å; R262-E421 IonicContact CZ-OE1 3.6Å; R262-E421 IonicContact NE-OE1 2.87Å; R262-E421 PolarHBondContact NE-OE1 3.25Å; R262-E421 IonicContact NE-OE2 3.26Å; R262-E421 PolarHBondContact NE-OE2 3.03Å; R262-E421 IonicContact NH2-OE1 2.79Å; R262-E421 PolarHBondContact NH2-OE1 2.84Å
263	L	94.8	Very high	91.7	Very high	0 Å²	0	26.3 Å²	26.3	0%	0	15%	0.148	C	C	.	.			trans	-95.3	58.2	-176.8	-52.1	-170.1	0	0	0	111.5	F260 L311 N370 L418 E421 Y422 Y425	F260-L263 HydrophobicContact CB-CB 4.3Å; F260-L263 HydrophobicContact CB-CD1 4.35Å; F260-L263 HydrophobicContact CB-CG 4.14Å; F260-L263 HydrophobicContact CD2-CD1 3.98Å; F260-L263 PolarHBondContact O-N 2.9Å; L263-L311 HydrophobicContact CD1-CD1 4.12Å; L263-N370 PolarHBondContact O-ND2 3.42Å; L263-L418 HydrophobicContact CD2-CD1 3.81Å; L263-E421 HydrophobicContact CD2-CB 4.08Å; L263-Y422 HydrophobicContact CB-CE1 4Å; L263-Y422 HydrophobicContact CD1-CD1 4.19Å; L263-Y422 HydrophobicContact CD1-CE1 4.18Å; L263-Y422 HydrophobicContact CD2-CD1 4.02Å; L263-Y422 HydrophobicContact CD2-CD2 3.91Å; L263-Y422 HydrophobicContact CD2-CE1 3.84Å; L263-Y422 HydrophobicContact CD2-CE2 3.69Å; L263-Y422 HydrophobicContact CD2-CG 4.07Å; L263-Y422 HydrophobicContact CG-CE1 4.22Å; L263-Y425 HydrophobicContact CD1-CD2 3.42Å; L263-Y425 VanDerWaalsContact CD1-CD2 3.42Å; L263-Y425 HydrophobicContact CD1-CE2 3.71Å; L263-Y425 HydrophobicContact CD1-CG 4.4Å
264	H	95.6	Very high	91.3	Very high	0 Å²	0	26.5 Å²	26.5	0%	0	15%	0.15	C	C	.	.			trans	-109.4	16.9	-177.8	60.8	-100.5	0	0	0	113.7	L192 V193 T196 D197 T199 V258 P261 R262	L192-H264 PolarHBondContact O-CE1 3.48Å; L192-H264 PolarHBondContact O-NE2 3.29Å; V193-H264 PolarHBondContact O-CE1 3.37Å; T196-H264 PolarHBondContact O-CE1 3.06Å; T196-H264 VanDerWaalsContact O-CE1 3.32Å; T196-H264 PolarHBondContact O-NE2 3.26Å; T196-H264 PolarHBondContact OG1-CD2 2.97Å; T196-H264 PolarHBondContact OG1-NE2 3.45Å; D197-H264 VanDerWaalsContact O-CB 3.27Å; D197-H264 WeakPolarHBondContact O-CB 3.34Å; T199-H264 PolarHBondContact N-O 3.46Å; V258-H264 HydrophobicContact CG1-CB 3.91Å; V258-H264 HydrophobicContact CG2-CB 3.85Å; P261-H264 PolarHBondContact O-ND1 2.93Å; R262-H264 VanDerWaalsContact C-N 3.34Å; R262-H264 PolarHBondContact O-N 2.97Å
265	F	96.7	Very high	90.7	Very high	0 Å²	0	26.7 Å²	26.7	0%	0	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.9	117.5	175.5	-61.9	-85.3	0	0	0	110.7	V189 L192 V193 T199 I374 F378 L418	V189-F265 HydrophobicContact CG1-CZ 4.27Å; L192-F265 HydrophobicContact CB-CE1 4.26Å; L192-F265 HydrophobicContact CB-CZ 4.26Å; V193-F265 HydrophobicContact CG2-CE2 3.77Å; V193-F265 HydrophobicContact CG2-CZ 3.73Å; T199-F265 HydrophobicContact CG2-CD1 3.59Å; T199-F265 HydrophobicContact CG2-CE1 3.76Å; T199-F265 CarbonylContact O-C 3.58Å; T199-F265 WeakPolarHBondContact O-CA 3.49Å; F265-I374 HydrophobicContact CB-CG1 4.36Å; F265-F378 HydrophobicContact CB-CE2 4.31Å; F265-F378 HydrophobicContact CB-CZ 4.12Å; F265-F378 AromaticContact CD1-CZ 3.73Å; F265-F378 HydrophobicContact CD1-CZ 3.73Å; F265-F378 HydrophobicContact CD2-CE2 4.21Å; F265-F378 AromaticContact CD2-CZ 3.88Å; F265-F378 HydrophobicContact CD2-CZ 3.88Å; F265-F378 HydrophobicContact CE1-CZ 4.08Å; F265-F378 HydrophobicContact CE2-CZ 4.23Å; F265-F378 HydrophobicContact CG-CE2 4.15Å; F265-F378 AromaticContact CG-CZ 3.62Å; F265-F378 HydrophobicContact CG-CZ 3.62Å; F265-F378 HydrophobicContact CZ-CZ 4.33Å; F265-L418 HydrophobicContact CD2-CD2 4.13Å; F265-L418 HydrophobicContact CE2-CD1 4.31Å; F265-L418 HydrophobicContact CE2-CD2 3.71Å; F265-L418 HydrophobicContact CZ-CD2 4.38Å
266	F	96	Very high	89.8	Confident	0 Å²	0	31.2 Å²	31.2	0%	0	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102	145.2	-177.5	-56.4	-39.3	0	0	0	112.1	Q198 T199 Y200 C201 M257 V258 P268 I368 G369 N370	Q198-F266 HydrophobicContact CB-CD2 4.41Å; Q198-F266 HydrophobicContact CB-CE2 3.72Å; Q198-F266 HydrophobicContact CB-CZ 4.48Å; Q198-F266 HydrophobicContact CG-CE2 3.88Å; Q198-F266 HydrophobicContact CG-CZ 4.33Å; T199-F266 PolarHBondContact O-N 2.89Å; Y200-F266 HydrophobicContact CD1-CB 4.16Å; Y200-F266 HydrophobicContact CD1-CD2 4.11Å; Y200-F266 HydrophobicContact CE1-CB 4.44Å; Y200-F266 AromaticContact CE1-CD2 3.74Å; Y200-F266 HydrophobicContact CE1-CD2 3.74Å; Y200-F266 HydrophobicContact CE2-CD2 4.43Å; Y200-F266 AromaticContact CZ-CD2 3.89Å; C201-F266 WeakPolarHBondContact CB-O 3.41Å; C201-F266 PolarHBondContact N-O 3.43Å; M257-F266 HydrophobicContact CB-CE1 3.79Å; M257-F266 HydrophobicContact CB-CE2 4.34Å; M257-F266 HydrophobicContact CB-CZ 3.49Å; M257-F266 VanDerWaalsContact CB-CZ 3.49Å; M257-F266 HydrophobicContact CE-CD1 4.49Å; M257-F266 HydrophobicContact CE-CE1 4.38Å; M257-F266 HydrophobicContact CG-CZ 4.44Å; V258-F266 HydrophobicContact CG2-CE1 4.13Å; V258-F266 HydrophobicContact CG2-CZ 3.63Å; F266-P268 VanDerWaalsContact O-CD 3.32Å; F266-P268 WeakPolarHBondContact O-CD 3.5Å; F266-I368 HydrophobicContact CB-CG2 3.82Å; F266-I368 HydrophobicContact CD1-CG2 4.49Å; F266-I368 HydrophobicContact CD2-CG2 3.9Å; F266-I368 HydrophobicContact CG-CG2 3.82Å; F266-G369 WeakPolarHBondContact CA-O 3.37Å; F266-N370 HydrophobicContact CD1-CB 3.87Å; F266-N370 HydrophobicContact CE1-CB 3.97Å
267	M	94.6	Very high	88.7	Confident	0 Å²	0	30.9 Å²	30.9	0%	0	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.8	104.4	167.2	-65.8	179.2	68.2	0	0	108.8	M299 A301 C303 P305 G369 A373 I374	M267-M299 HydrophobicContact CE-CB 4.39Å; M267-M299 HydrophobicContact CE-CG 4.32Å; M267-A301 HydrophobicContact CB-CB 4.41Å; M267-A301 HydrophobicContact CE-CB 4.19Å; M267-A301 HydrophobicContact CG-CB 4.06Å; M267-C303 HydrophobicContact CE-CB 3.64Å; M267-C303 HydrophobicContact SD-CB 4.35Å; M267-P305 HydrophobicContact CE-CG 4.28Å; M267-G369 PolarHBondContact N-O 2.67Å; M267-G369 PolarHBondContact O-N 3.01Å; M267-A373 HydrophobicContact SD-CB 4.46Å; M267-I374 HydrophobicContact CG-CB 4.33Å; M267-I374 HydrophobicContact CG-CD1 3.62Å; M267-I374 HydrophobicContact CG-CG1 4.34Å; M267-I374 HydrophobicContact SD-CB 4.37Å; M267-I374 HydrophobicContact SD-CD1 4.33Å
268	P	94.8	Very high	87.9	Confident	0 Å²	0	34.1 Å²	34.1	0%	0	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.8	152.2	175	26.6	-20.3	0	0	0	111	C201 I202 T232 F266 M300 F367	C201-P268 WeakPolarHBondContact O-CD 3.22Å; I202-P268 HydrophobicContact CG1-CG 4.35Å; T232-P268 HydrophobicContact CG2-CB 3.52Å; T232-P268 HydrophobicContact CG2-CG 4.23Å; F266-P268 VanDerWaalsContact O-CD 3.32Å; F266-P268 WeakPolarHBondContact O-CD 3.5Å; P268-M300 HydrophobicContact CG-CB 4.07Å; P268-M300 WeakPolarHBondContact O-CB 3.45Å; P268-M300 PolarHBondContact O-N 3.5Å; P268-F367 CarbonylContact C-O 3.55Å; P268-F367 WeakPolarHBondContact CA-O 3.45Å
269	G	93.4	Very high	86.8	Confident	1 Å²	1	37 Å²	37	1%	0.01	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.8	154.8	172.9	0	0	0	0	0	110.7	N298 F367	G269-N298 WeakPolarHBondContact CA-O 3.37Å; G269-F367 PolarHBondContact N-O 2.86Å; G269-F367 PolarHBondContact O-N 3.3Å
270	F	92.7	Very high	85.6	Confident	14 Å²	14	43 Å²	43	6%	0.061	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.1	140	178	-174	-94.4	0	0	0	110.6	A231 L273 M300 L361 A364	A231-F270 HydrophobicContact CB-CD2 4.31Å; A231-F270 HydrophobicContact CB-CE1 4.4Å; A231-F270 HydrophobicContact CB-CE2 4.11Å; A231-F270 HydrophobicContact CB-CZ 4.16Å; F270-L273 HydrophobicContact CD1-CD2 4.09Å; F270-L273 WeakPolarHBondContact O-CG 3.26Å; F270-M300 HydrophobicContact CB-CE 3.76Å; F270-L361 HydrophobicContact CE1-CD1 4.29Å; F270-L361 HydrophobicContact CZ-CD1 4.11Å; F270-A364 HydrophobicContact CE2-CB 4.22Å; F270-A364 HydrophobicContact CZ-CB 3.97Å
271	A	91.7	Very high	84.5	Confident	0 Å²	0	49.8 Å²	49.8	0%	0	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.5	142.3	170.8	0	0	0	0	0	109.2	L289 Q292 M293 A364 A365	A271-L289 HydrophobicContact CB-CD2 4.04Å; A271-Q292 HydrophobicContact CB-CB 3.88Å; A271-M293 HydrophobicContact CB-CG 4.15Å; A271-A364 CarbonylContact O-C 3.52Å; A271-A364 WeakPolarHBondContact O-CA 3.34Å; A271-A365 PolarHBondContact N-O 3.14Å; A271-A365 PolarHBondContact O-N 3.06Å; A271-A365 VanDerWaalsContact O-O 3.08Å
272	P	90.4	Very high	83.6	Confident	7 Å²	7	49.5 Å²	49.5	5%	0.045	24%	0.236	C	C	.	.			cis	-86.6	144.1	2.2	34.4	-35.3	0	0	0	113.7	T274 L284 L289 L361	P272-T274 HydrophobicContact CB-CG2 4.25Å; P272-L284 HydrophobicContact CB-CD2 3.38Å; P272-L284 HydrophobicContact CG-CD1 3.94Å; P272-L284 HydrophobicContact CG-CD2 3.61Å; P272-L284 HydrophobicContact CG-CG 4.45Å; P272-L289 HydrophobicContact CB-CD2 4.24Å; P272-L289 HydrophobicContact CG-CD2 4.43Å; P272-L361 HydrophobicContact CG-CD1 4.27Å; P272-L361 HydrophobicContact CG-CD2 4.1Å
273	L	85.4	Confident	82.5	Confident	9 Å²	9	50 Å²	50	5%	0.047	26%	0.256	C	S	.	.			trans	-104.5	94.2	166.7	-64.9	171.8	0	0	0	108.1	I210 T214 L228 F270 N298 M300	I210-L273 HydrophobicContact CD1-CD1 4.17Å; I210-L273 HydrophobicContact CG1-CD1 4.43Å; I210-L273 HydrophobicContact CG2-CD1 3.82Å; I210-L273 HydrophobicContact CG2-CD2 4.37Å; T214-L273 HydrophobicContact CG2-CB 4.04Å; L228-L273 HydrophobicContact CD2-CD2 3.5Å; F270-L273 HydrophobicContact CD1-CD2 4.09Å; F270-L273 WeakPolarHBondContact O-CG 3.26Å; L273-N298 HydrophobicContact CD1-CB 4.06Å; L273-M300 HydrophobicContact CD2-CE 4.38Å
274	T	76	Confident	81.9	Confident	24 Å²	24	52 Å²	52	15%	0.147	27%	0.266	C	S	.	.			trans	-121.1	133.4	-178.7	53.9	0	0	0	0	110.9	P272	P272-T274 HydrophobicContact CB-CG2 4.25Å
275	A	75.3	Confident	81.6	Confident	15 Å²	15	53.9 Å²	53.9	12%	0.124	28%	0.279	C	S	.	.			trans	-60.7	143.5	172.2	0	0	0	0	0	110.3	L215 G277 S278 Q279	L215-A275 WeakPolarHBondContact O-CB 3.37Å; A275-G277 PolarHBondContact O-N 3.2Å; A275-S278 PolarHBondContact O-N 2.99Å; A275-Q279 PolarHBondContact O-N 3.48Å
276	R	70.1	Confident	81.4	Confident	207 Å²	207	54.1 Å²	54.1	78%	0.781	28%	0.28	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52	-35.6	-176.9	-65.6	-177.3	-177.8	171.6	4.2	113.4
277	G	66.8	Low	81.2	Confident	59 Å²	59	56.2 Å²	56.2	61%	0.608	29%	0.294	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.6	-22.3	178.2	0	0	0	0	0	115.1	A275	A275-G277 PolarHBondContact O-N 3.2Å
278	S	72.3	Confident	81	Confident	69 Å²	69	59 Å²	59	48%	0.483	31%	0.307	S	S	.	.	T	Hydrogen-bonded Turn	trans	-98.8	-10.1	-177	-57.5	0	0	0	0	113.2	A275 Q280 Y281 R282	A275-S278 PolarHBondContact O-N 2.99Å; S278-Q280 VanDerWaalsContact C-N 3.28Å; S278-Q280 PolarHBondContact O-N 2.93Å; S278-Y281 PolarHBondContact O-N 2.82Å; S278-R282 PolarHBondContact O-N 3.23Å
279	Q	69.9	Low	80.8	Confident	88 Å²	88	59 Å²	59	41%	0.411	31%	0.307	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.6	-32.6	-175.1	-166.2	178.5	1.8	0	0	113	A275	A275-Q279 PolarHBondContact O-N 3.48Å
280	Q	65.9	Low	80.8	Confident	176 Å²	176	59 Å²	59	82%	0.822	31%	0.307	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.2	-21.7	-179.8	-65.5	-177.4	-1	0	0	113.8	S278	S278-Q280 VanDerWaalsContact C-N 3.28Å; S278-Q280 PolarHBondContact O-N 2.93Å
281	Y	69.1	Low	80.7	Confident	197 Å²	197	65.4 Å²	65.4	77%	0.773	34%	0.337	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.4	-10.2	-173.7	-60.5	-77.4	0	0	0	113.3	S278	S278-Y281 PolarHBondContact O-N 2.82Å
282	R	70.9	Confident	80.6	Confident	105 Å²	105	66.1 Å²	66.1	40%	0.396	34%	0.34	S	S	.	.			trans	-101	117.7	-175.3	-162.6	174.3	-172.4	163.6	8.2	111.2	S278 L284 E288	S278-R282 PolarHBondContact O-N 3.23Å; R282-L284 PolarHBondContact O-N 2.86Å; R282-E288 IonicContact CZ-OE2 2.89Å; R282-E288 IonicContact NE-OE2 2.74Å; R282-E288 PolarHBondContact NE-OE2 3.19Å; R282-E288 IonicContact NH2-OE2 3.27Å
283	A	70.1	Confident	80.6	Confident	80 Å²	80	65.9 Å²	65.9	66%	0.661	34%	0.339	S	S	*	.			trans	-79.5	100.4	170.8	0	0	0	0	0	109.2	S285	A283-S285 PolarHBondContact O-N 3.42Å
284	L	82.4	Confident	80.8	Confident	42 Å²	42	66.8 Å²	66.8	22%	0.22	34%	0.342	C	S	.	.			trans	-64.7	128.4	174.7	-70.5	157.8	0	0	0	109.5	P272 R282 L289 M363	P272-L284 HydrophobicContact CB-CD2 3.38Å; P272-L284 HydrophobicContact CG-CD1 3.94Å; P272-L284 HydrophobicContact CG-CD2 3.61Å; P272-L284 HydrophobicContact CG-CG 4.45Å; R282-L284 PolarHBondContact O-N 2.86Å; L284-L289 HydrophobicContact CD2-CD2 4.16Å; L284-M363 VanDerWaalsContact C-CE 3.48Å; L284-M363 HydrophobicContact CB-CE 4Å; L284-M363 WeakPolarHBondContact O-CE 3.46Å
285	S	90	Very high	81.5	Confident	39 Å²	39	67.1 Å²	67.1	27%	0.273	34%	0.343	S	S	.	.			trans	-133.9	160.4	175.3	65.5	0	0	0	0	110	A283 E288 L289	A283-S285 PolarHBondContact O-N 3.42Å; S285-E288 PolarHBondContact O-N 3.06Å; S285-E288 WeakPolarHBondContact OG-CG 3.46Å; S285-E288 PolarHBondContact OG-N 3.44Å; S285-L289 WeakPolarHBondContact O-CG 3.28Å; S285-L289 PolarHBondContact O-N 3.25Å
286	V	91.2	Very high	82.1	Confident	4 Å²	4	67.8 Å²	67.8	2%	0.024	35%	0.348	C	S	.	.	H	α-helix	trans	-57	-46.3	178.1	176	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 2.94Å; V286-L289 PolarHBondContact O-N 3.08Å; V286-T290 PolarHBondContact O-N 2.98Å; V286-T290 PolarHBondContact O-OG1 3.15Å; V286-T290 VanDerWaalsContact O-OG1 3.05Å; V286-F317 HydrophobicContact CG1-CE1 4.42Å; V286-M321 HydrophobicContact CG2-CB 4Å; V286-M321 HydrophobicContact CG2-SD 4.16Å; V286-E325 HydrophobicContact CB-CG 4.16Å; V286-E325 HydrophobicContact CG1-CG 4.31Å; V286-V326 HydrophobicContact CG1-CB 4.32Å; V286-V326 HydrophobicContact CG1-CG2 3.78Å; V286-V326 HydrophobicContact CG2-CG2 4.3Å; V286-Q329 HydrophobicContact CG1-CG 4.2Å
287	P	92.1	Very high	82.9	Confident	44 Å²	44	66.1 Å²	66.1	29%	0.286	34%	0.342	S	S	.	.	H	α-helix	trans	-58.9	-39.2	176.1	-23.9	33.5	0	0	0	113.8	Q291 Q329	P287-Q291 WeakPolarHBondContact O-CB 3.48Å; P287-Q291 PolarHBondContact O-N 3.42Å; P287-Q329 HydrophobicContact CB-CG 4.29Å; P287-Q329 HydrophobicContact CG-CG 3.98Å
288	E	90.3	Very high	83.8	Confident	58 Å²	58	63.6 Å²	63.6	27%	0.271	32%	0.315	S	S	.	.	H	α-helix	trans	-67.8	-38.3	177.5	-77.8	-168.9	-157.2	0	0	112.8	R282 S285 V286 Q292	R282-E288 IonicContact CZ-OE2 2.89Å; R282-E288 IonicContact NE-OE2 2.74Å; R282-E288 PolarHBondContact NE-OE2 3.19Å; R282-E288 IonicContact NH2-OE2 3.27Å; S285-E288 PolarHBondContact O-N 3.06Å; S285-E288 WeakPolarHBondContact OG-CG 3.46Å; S285-E288 PolarHBondContact OG-N 3.44Å; V286-E288 VanDerWaalsContact C-N 3.32Å; V286-E288 PolarHBondContact O-N 2.94Å; E288-Q292 WeakPolarHBondContact O-CB 3.47Å; E288-Q292 WeakPolarHBondContact O-CG 3.34Å; E288-Q292 PolarHBondContact O-N 3.07Å
289	L	91.9	Very high	84.7	Confident	0 Å²	0	60.5 Å²	60.5	0%	0	29%	0.293	C	S	.	.	H	α-helix	trans	-64.6	-48.3	175.3	-71.2	174.2	0	0	0	110.3	A271 P272 L284 S285 V286 Q291 Q292 M293 F317 M363 A365	A271-L289 HydrophobicContact CB-CD2 4.04Å; P272-L289 HydrophobicContact CB-CD2 4.24Å; P272-L289 HydrophobicContact CG-CD2 4.43Å; L284-L289 HydrophobicContact CD2-CD2 4.16Å; S285-L289 WeakPolarHBondContact O-CG 3.28Å; S285-L289 PolarHBondContact O-N 3.25Å; V286-L289 PolarHBondContact O-N 3.08Å; L289-Q291 VanDerWaalsContact C-N 3.34Å; L289-Q291 PolarHBondContact O-N 2.98Å; L289-Q292 PolarHBondContact O-N 3.33Å; L289-M293 VanDerWaalsContact O-CG 3.31Å; L289-M293 WeakPolarHBondContact O-CG 3.35Å; L289-M293 PolarHBondContact O-N 3.24Å; L289-F317 HydrophobicContact CB-CE1 4.23Å; L289-M363 HydrophobicContact CD1-CB 3.85Å; L289-A365 HydrophobicContact CB-CB 4.19Å
290	T	92.1	Very high	85.7	Confident	1 Å²	1	56.3 Å²	56.3	1%	0.006	27%	0.273	C	S	.	.	H	α-helix	trans	-60	-43.9	177.8	-55.9	0	0	0	0	111.3	V286 Q292 M293 F294 Q329 M330 V333	V286-T290 PolarHBondContact O-N 2.98Å; V286-T290 PolarHBondContact O-OG1 3.15Å; V286-T290 VanDerWaalsContact O-OG1 3.05Å; T290-Q292 PolarHBondContact O-N 2.92Å; T290-M293 PolarHBondContact O-N 2.94Å; T290-F294 HydrophobicContact CG2-CD2 4.43Å; T290-F294 HydrophobicContact CG2-CE2 4.41Å; T290-F294 WeakPolarHBondContact O-CD2 3.4Å; T290-F294 PolarHBondContact O-N 3.35Å; T290-Q329 HydrophobicContact CG2-CB 4.25Å; T290-M330 HydrophobicContact CG2-SD 3.76Å; T290-V333 HydrophobicContact CG2-CG2 3.66Å
291	Q	90.1	Very high	86.9	Confident	150 Å²	150	48 Å²	48	70%	0.701	23%	0.234	S	C	*	.	H	α-helix	trans	-64.1	-40.2	177.6	-172.4	178.1	11.2	0	0	112.4	P287 L289 D295	P287-Q291 WeakPolarHBondContact O-CB 3.48Å; P287-Q291 PolarHBondContact O-N 3.42Å; L289-Q291 VanDerWaalsContact C-N 3.34Å; L289-Q291 PolarHBondContact O-N 2.98Å; Q291-D295 PolarHBondContact O-N 2.92Å
292	Q	90.3	Very high	87.8	Confident	15 Å²	15	40.1 Å²	40.1	7%	0.07	21%	0.21	C	C	.	.	H	α-helix	trans	-68.1	-37.9	177.7	-84.3	-178.8	61.8	0	0	112.8	A271 E288 L289 T290 F294 D295 N298	A271-Q292 HydrophobicContact CB-CB 3.88Å; E288-Q292 WeakPolarHBondContact O-CB 3.47Å; E288-Q292 WeakPolarHBondContact O-CG 3.34Å; E288-Q292 PolarHBondContact O-N 3.07Å; L289-Q292 PolarHBondContact O-N 3.33Å; T290-Q292 PolarHBondContact O-N 2.92Å; Q292-F294 VanDerWaalsContact C-N 3.26Å; Q292-F294 PolarHBondContact O-N 2.81Å; Q292-D295 WeakPolarHBondContact O-CB 3.38Å; Q292-D295 PolarHBondContact O-N 3.41Å; Q292-D295 VanDerWaalsContact O-N 3.13Å; Q292-N298 VanDerWaalsContact O-CB 3.24Å; Q292-N298 WeakPolarHBondContact O-CB 3.46Å; Q292-N298 PolarHBondContact O-ND2 3.3Å
293	M	90.6	Very high	88.6	Confident	1 Å²	1	35.6 Å²	35.6	1%	0.005	19%	0.194	C	C	.	.	H	α-helix	trans	-58.8	-37.6	178.7	-77.5	164	39.9	0	0	113	A271 L289 T290 M299 A315 F317 M330 A365 F367	A271-M293 HydrophobicContact CB-CG 4.15Å; L289-M293 VanDerWaalsContact O-CG 3.31Å; L289-M293 WeakPolarHBondContact O-CG 3.35Å; L289-M293 PolarHBondContact O-N 3.24Å; T290-M293 PolarHBondContact O-N 2.94Å; M293-M299 WeakPolarHBondContact O-CE 3.31Å; M293-A315 HydrophobicContact CE-CB 3.44Å; M293-A315 VanDerWaalsContact CE-CB 3.44Å; M293-F317 HydrophobicContact CE-CE2 4.29Å; M293-F317 HydrophobicContact CE-CZ 4.08Å; M293-F317 HydrophobicContact SD-CE1 4.04Å; M293-F317 HydrophobicContact SD-CE2 4.26Å; M293-F317 HydrophobicContact SD-CZ 3.67Å; M293-M330 HydrophobicContact CE-CE 4.41Å; M293-M330 HydrophobicContact CE-SD 4.16Å; M293-A365 HydrophobicContact CG-CB 3.96Å; M293-A365 HydrophobicContact SD-CB 3.29Å; M293-A365 WeakPolarHBondContact SD-CB 3.44Å; M293-F367 HydrophobicContact CB-CB 4.2Å; M293-F367 HydrophobicContact CB-CD2 4.32Å; M293-F367 HydrophobicContact CE-CD2 4.08Å; M293-F367 HydrophobicContact CG-CB 4.24Å
294	F	89.7	Confident	89.5	Confident	29 Å²	29	33.9 Å²	33.9	13%	0.127	17%	0.174	C	C	.	.	T	Hydrogen-bonded Turn	trans	-92	5.6	179.7	-72.5	-85	0	0	0	113.3	T290 Q292 Y310 V313 M330 V333 F341 F367	T290-F294 HydrophobicContact CG2-CD2 4.43Å; T290-F294 HydrophobicContact CG2-CE2 4.41Å; T290-F294 WeakPolarHBondContact O-CD2 3.4Å; T290-F294 PolarHBondContact O-N 3.35Å; Q292-F294 VanDerWaalsContact C-N 3.26Å; Q292-F294 PolarHBondContact O-N 2.81Å; F294-Y310 HydrophobicContact CD1-CE2 4.1Å; F294-Y310 HydrophobicContact CE1-CE2 4.21Å; F294-V313 HydrophobicContact CZ-CG1 4.26Å; F294-M330 HydrophobicContact CE2-CE 4.05Å; F294-M330 HydrophobicContact CE2-SD 4.06Å; F294-M330 HydrophobicContact CZ-CE 4.12Å; F294-V333 HydrophobicContact CD1-CG1 4.21Å; F294-V333 HydrophobicContact CD2-CG1 3.76Å; F294-V333 HydrophobicContact CD2-CG2 4.45Å; F294-V333 HydrophobicContact CE1-CG1 4.25Å; F294-V333 HydrophobicContact CE2-CB 4.41Å; F294-V333 HydrophobicContact CE2-CG1 3.8Å; F294-V333 HydrophobicContact CG-CG1 3.96Å; F294-V333 HydrophobicContact CZ-CG1 4.04Å; F294-F341 HydrophobicContact CE1-CE1 4.27Å; F294-F341 AromaticContact CE1-CZ 3.72Å; F294-F341 HydrophobicContact CE1-CZ 3.72Å; F294-F341 HydrophobicContact CZ-CZ 4.17Å; F294-F367 HydrophobicContact CD1-CE2 4.07Å; F294-F367 AromaticContact CE1-CE2 3.67Å; F294-F367 HydrophobicContact CE1-CE2 3.67Å; F294-F367 HydrophobicContact CE1-CZ 4.29Å; F294-F367 AromaticContact CZ-CE2 3.92Å; F294-F367 HydrophobicContact CZ-CE2 3.92Å
295	D	90.1	Very high	89.7	Confident	31 Å²	31	32.2 Å²	32.2	17%	0.166	17%	0.166	C	C	.	.			trans	-79.8	129.1	173.1	-166.5	-13	0	0	0	109.7	Q291 Q292 R297 N298	Q291-D295 PolarHBondContact O-N 2.92Å; Q292-D295 WeakPolarHBondContact O-CB 3.38Å; Q292-D295 PolarHBondContact O-N 3.41Å; Q292-D295 VanDerWaalsContact O-N 3.13Å; D295-R297 PolarHBondContact O-N 2.95Å; D295-R297 VanDerWaalsContact O-N 3.09Å; D295-R297 PolarHBondContact OD1-N 2.77Å; D295-R297 IonicContact OD1-NE 3.85Å; D295-R297 PolarHBondContact OD1-NE 2.74Å; D295-R297 IonicContact OD2-CZ 3.21Å; D295-R297 VanDerWaalsContact OD2-CZ 3.24Å; D295-R297 IonicContact OD2-NE 3.11Å; D295-R297 PolarHBondContact OD2-NE 3.32Å; D295-R297 IonicContact OD2-NH2 3.52Å; D295-R297 PolarHBondContact OD2-NH2 3.49Å; D295-N298 PolarHBondContact O-N 2.85Å
296	A	87.5	Confident	89.6	Confident	28 Å²	28	38.8 Å²	38.8	23%	0.231	19%	0.185	C	C	.	.	G	3₁₀ helix	trans	-55.8	-29.5	176.8	0	0	0	0	0	112	N298 M299	A296-N298 PolarHBondContact O-N 2.99Å; A296-M299 PolarHBondContact O-N 3.03Å
297	R	86.9	Confident	89.6	Confident	172 Å²	172	43.9 Å²	43.9	65%	0.649	21%	0.208	S	C	*	.	G	3₁₀ helix	trans	-70.6	-13.5	179.2	-63.1	179.2	-67.4	-179	0.7	114.4	I210 D295	I210-R297 VanDerWaalsContact CG1-O 3.32Å; I210-R297 WeakPolarHBondContact CG1-O 3.43Å; D295-R297 PolarHBondContact O-N 2.95Å; D295-R297 VanDerWaalsContact O-N 3.09Å; D295-R297 PolarHBondContact OD1-N 2.77Å; D295-R297 IonicContact OD1-NE 3.85Å; D295-R297 PolarHBondContact OD1-NE 2.74Å; D295-R297 IonicContact OD2-CZ 3.21Å; D295-R297 VanDerWaalsContact OD2-CZ 3.24Å; D295-R297 IonicContact OD2-NE 3.11Å; D295-R297 PolarHBondContact OD2-NE 3.32Å; D295-R297 IonicContact OD2-NH2 3.52Å; D295-R297 PolarHBondContact OD2-NH2 3.49Å
298	N	86.7	Confident	89.5	Confident	7 Å²	7	42.1 Å²	42.1	4%	0.037	20%	0.197	C	C	.	.	G	3₁₀ helix	trans	-105.2	0.3	-178.6	-75.8	41.4	0	0	0	112.6	G269 L273 Q292 D295 A296	G269-N298 WeakPolarHBondContact CA-O 3.37Å; L273-N298 HydrophobicContact CD1-CB 4.06Å; Q292-N298 VanDerWaalsContact O-CB 3.24Å; Q292-N298 WeakPolarHBondContact O-CB 3.46Å; Q292-N298 PolarHBondContact O-ND2 3.3Å; D295-N298 PolarHBondContact O-N 2.85Å; A296-N298 PolarHBondContact O-N 2.99Å
299	M	90.6	Very high	89.7	Confident	3 Å²	3	43.2 Å²	43.2	2%	0.015	20%	0.199	C	C	.	.	B	Isolated β-bridge	trans	-76	135.8	175.4	-63.4	-60.5	169.4	0	0	110	I210 M267 M293 A296 P305 F367	I210-M299 WeakPolarHBondContact CD1-O 3.34Å; M267-M299 HydrophobicContact CE-CB 4.39Å; M267-M299 HydrophobicContact CE-CG 4.32Å; M293-M299 WeakPolarHBondContact O-CE 3.31Å; A296-M299 PolarHBondContact O-N 3.03Å; M299-P305 HydrophobicContact CE-CG 3.87Å; M299-P305 HydrophobicContact CG-CG 3.88Å; M299-P305 HydrophobicContact SD-CG 4.47Å; M299-F367 HydrophobicContact CE-CD1 3.71Å; M299-F367 HydrophobicContact CE-CE1 3.47Å; M299-F367 VanDerWaalsContact CE-CE1 3.47Å; M299-F367 HydrophobicContact CE-CG 4.47Å; M299-F367 HydrophobicContact CE-CZ 4.06Å; M299-F367 HydrophobicContact SD-CD1 3.76Å; M299-F367 HydrophobicContact SD-CE1 3.81Å
300	M	91.1	Very high	89.8	Confident	1 Å²	1	43.6 Å²	43.6	1%	0.005	20%	0.2	C	C	.	.	S	Bend	trans	-85.3	0.7	176.1	-57.2	-64	-178.8	0	0	112.1	D203 L207 I210 L228 P268 F270 L273	D203-M300 PolarHBondContact N-O 2.84Å; L207-M300 HydrophobicContact CD2-CB 4.45Å; L207-M300 HydrophobicContact CD2-CG 4.45Å; L207-M300 HydrophobicContact CD2-SD 3.4Å; L207-M300 WeakPolarHBondContact CD2-SD 3.29Å; I210-M300 HydrophobicContact CD1-CE 4.33Å; I210-M300 HydrophobicContact CD1-SD 3.6Å; L228-M300 HydrophobicContact CB-CE 4.06Å; L228-M300 HydrophobicContact CB-SD 4.39Å; L228-M300 HydrophobicContact CD2-CE 4.33Å; P268-M300 HydrophobicContact CG-CB 4.07Å; P268-M300 WeakPolarHBondContact O-CB 3.45Å; P268-M300 PolarHBondContact O-N 3.5Å; F270-M300 HydrophobicContact CB-CE 3.76Å; L273-M300 HydrophobicContact CD2-CE 4.38Å
301	A	90.6	Very high	89.9	Confident	1 Å²	1	43.5 Å²	43.5	1%	0.008	20%	0.2	C	C	.	.	S	Bend	trans	-112.6	134.9	168.9	0	0	0	0	0	108.6	M267 C303 I374 L377	M267-A301 HydrophobicContact CB-CB 4.41Å; M267-A301 HydrophobicContact CE-CB 4.19Å; M267-A301 HydrophobicContact CG-CB 4.06Å; A301-C303 PolarHBondContact O-N 3.32Å; A301-I374 HydrophobicContact CB-CD1 4.14Å; A301-L377 HydrophobicContact CB-CD1 4.37Å
302	A	88.5	Confident	90.1	Very high	32 Å²	32	36.6 Å²	36.6	26%	0.264	17%	0.168	S	C	.	.	S	Bend	trans	-80.3	67.6	-176.4	0	0	0	0	0	111.1	D203 E205 A206	D203-A302 WeakPolarHBondContact OD2-CB 3.31Å; D203-A302 PolarHBondContact OD2-N 3.02Å; E205-A302 HydrophobicContact CB-CB 4.08Å; E205-A302 HydrophobicContact CG-CB 4.09Å; A206-A302 HydrophobicContact CB-CB 4.06Å
303	C	88	Confident	90.2	Very high	9 Å²	9	35.9 Å²	35.9	6%	0.061	17%	0.165	C	C	.	.	S	Bend	trans	-133.8	145.8	173.4	-41	0	0	0	0	108.8	M267 A301 P305 A373 E376	M267-C303 HydrophobicContact CE-CB 3.64Å; M267-C303 HydrophobicContact SD-CB 4.35Å; A301-C303 PolarHBondContact O-N 3.32Å; C303-P305 VanDerWaalsContact O-CD 3.31Å; C303-P305 WeakPolarHBondContact O-CD 3.4Å; C303-A373 HydrophobicContact CB-CB 4.36Å; C303-A373 WeakPolarHBondContact CB-O 3.42Å; C303-E376 WeakPolarHBondContact CA-OE2 3.42Å; C303-E376 HydrophobicContact CB-CB 4.28Å
304	D	88.1	Confident	90.3	Very high	45 Å²	45	36.2 Å²	36.2	24%	0.241	17%	0.167	C	C	.	.			trans	-85.8	113.3	171.1	-167.9	-23.2	0	0	0	109.3	R306 H307 A373 E376	D304-R306 PolarHBondContact O-N 3.11Å; D304-R306 VanDerWaalsContact OD1-CB 3.26Å; D304-R306 WeakPolarHBondContact OD1-CB 3.46Å; D304-R306 VanDerWaalsContact OD1-CG 3.3Å; D304-R306 WeakPolarHBondContact OD1-CG 3.37Å; D304-R306 PolarHBondContact OD1-N 2.73Å; D304-H307 PolarHBondContact O-N 3.29Å; D304-A373 WeakPolarHBondContact O-CB 3.33Å; D304-E376 PolarHBondContact N-OE2 3.46Å; D304-E376 VanDerWaalsContact N-OE2 3.11Å
305	P	87.7	Confident	90.4	Very high	6 Å²	6	34.9 Å²	34.9	4%	0.039	16%	0.162	C	C	.	.	G	3₁₀ helix	trans	-61.8	-16.4	-179.9	-18.4	30.9	0	0	0	113.8	M267 M299 C303 H307 G308 Y310	M267-P305 HydrophobicContact CE-CG 4.28Å; M299-P305 HydrophobicContact CE-CG 3.87Å; M299-P305 HydrophobicContact CG-CG 3.88Å; M299-P305 HydrophobicContact SD-CG 4.47Å; C303-P305 VanDerWaalsContact O-CD 3.31Å; C303-P305 WeakPolarHBondContact O-CD 3.4Å; P305-H307 VanDerWaalsContact C-N 3.31Å; P305-G308 PolarHBondContact O-N 3.03Å; P305-Y310 HydrophobicContact CB-CE1 4.3Å; P305-Y310 HydrophobicContact CB-CE2 4.22Å; P305-Y310 WeakPolarHBondContact CB-OH 3.16Å
306	R	88.1	Confident	90.4	Very high	178 Å²	178	33.8 Å²	33.8	67%	0.672	16%	0.157	S	C	*	.	G	3₁₀ helix	trans	-74.4	-20.7	177.2	-60.5	171.5	-178.9	-179.2	3.1	113.1	D304	D304-R306 PolarHBondContact O-N 3.11Å; D304-R306 VanDerWaalsContact OD1-CB 3.26Å; D304-R306 WeakPolarHBondContact OD1-CB 3.46Å; D304-R306 VanDerWaalsContact OD1-CG 3.3Å; D304-R306 WeakPolarHBondContact OD1-CG 3.37Å; D304-R306 PolarHBondContact OD1-N 2.73Å
307	H	90.1	Very high	90.6	Very high	111 Å²	111	32.5 Å²	32.5	51%	0.514	15%	0.145	S	C	.	.	G	3₁₀ helix	trans	-80.4	-6.6	175.9	-64.9	165.2	0	0	0	113	D304 P305 E376 Q426	D304-H307 PolarHBondContact O-N 3.29Å; P305-H307 VanDerWaalsContact C-N 3.31Å; H307-E376 IonicContact CE1-OE1 3.83Å; H307-E376 IonicContact CG-OE1 2.7Å; H307-E376 IonicContact ND1-OE1 3.99Å; H307-E376 PolarHBondContact ND1-OE1 3.17Å; H307-Q426 PolarHBondContact O-NE2 2.85Å
308	G	90.8	Very high	90.8	Very high	6 Å²	6	24.4 Å²	24.4	6%	0.062	12%	0.115	C	C	.	.	S	Bend	trans	-131.4	-167.3	177.3	0	0	0	0	0	113	P305 T372	P305-G308 PolarHBondContact O-N 3.03Å; G308-T372 VanDerWaalsContact CA-OG1 3.31Å; G308-T372 WeakPolarHBondContact CA-OG1 3.27Å
309	R	93.5	Very high	90.9	Very high	81 Å²	81	24 Å²	24	31%	0.306	11%	0.113	S	C	.	.			trans	-123.2	144.4	173.3	-64.3	-176.9	175.9	164.8	1.3	109.8	S340 V342 S371 T372 Q426 A428	R309-S340 CarbonylContact C-O 3.57Å; R309-S340 VanDerWaalsContact CA-O 3.27Å; R309-S340 WeakPolarHBondContact CA-O 3.45Å; R309-V342 HydrophobicContact CB-CG1 3.87Å; R309-S371 WeakPolarHBondContact O-CA 3.35Å; R309-S371 PolarHBondContact O-OG 3.3Å; R309-T372 PolarHBondContact N-OG1 3Å; R309-T372 PolarHBondContact O-N 3.18Å; R309-T372 PolarHBondContact O-OG1 3.31Å; R309-Q426 PolarHBondContact NH1-O 3.2Å; R309-A428 PolarHBondContact NH1-O 3.32Å
310	Y	94.5	Very high	90.7	Very high	8 Å²	8	28.6 Å²	28.6	3%	0.031	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.8	120.2	171	-69.4	-68.2	0	0	0	109.6	F294 P305 V313 S340 F341 V342 N348 F367	F294-Y310 HydrophobicContact CD1-CE2 4.1Å; F294-Y310 HydrophobicContact CE1-CE2 4.21Å; P305-Y310 HydrophobicContact CB-CE1 4.3Å; P305-Y310 HydrophobicContact CB-CE2 4.22Å; P305-Y310 WeakPolarHBondContact CB-OH 3.16Å; Y310-V313 HydrophobicContact CD1-CG2 3.74Å; Y310-V313 HydrophobicContact CD2-CG2 4.43Å; Y310-V313 HydrophobicContact CE1-CG2 4.41Å; Y310-V313 HydrophobicContact CG-CG2 3.75Å; Y310-S340 PolarHBondContact N-O 3.16Å; Y310-F341 HydrophobicContact CD2-CD1 4.27Å; Y310-F341 AromaticContact CD2-CE1 3.96Å; Y310-F341 HydrophobicContact CD2-CE1 3.96Å; Y310-F341 HydrophobicContact CD2-CZ 4.21Å; Y310-F341 HydrophobicContact CG-CD1 4.44Å; Y310-F341 HydrophobicContact CG-CE1 4.29Å; Y310-V342 WeakPolarHBondContact O-CG2 3.48Å; Y310-V342 PolarHBondContact O-N 3.5Å; Y310-N348 PolarHBondContact O-ND2 2.96Å; Y310-F367 HydrophobicContact CD1-CZ 4.29Å; Y310-F367 HydrophobicContact CE1-CE1 4.05Å; Y310-F367 AromaticContact CE1-CZ 3.52Å; Y310-F367 HydrophobicContact CE1-CZ 3.52Å; Y310-F367 AromaticContact CZ-CZ 3.75Å
311	L	94	Very high	90.5	Very high	0 Å²	0	30 Å²	30	0%	0	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.5	-55.1	168.2	-60.6	174.1	0	0	0	109	P259 L263 V342 W344 I345 N348 N370 T372	P259-L311 HydrophobicContact CG-CB 4.32Å; P259-L311 HydrophobicContact CG-CD1 4.43Å; L263-L311 HydrophobicContact CD1-CD1 4.12Å; L311-V342 HydrophobicContact CD2-CG1 3.9Å; L311-V342 HydrophobicContact CD2-CG2 4.46Å; L311-W344 HydrophobicContact CD2-CH2 4.13Å; L311-W344 HydrophobicContact CD2-CZ2 3.72Å; L311-I345 HydrophobicContact CB-CD1 4.46Å; L311-I345 WeakPolarHBondContact O-CD1 3.42Å; L311-N348 VanDerWaalsContact O-CB 3.25Å; L311-N348 WeakPolarHBondContact O-CB 3.31Å; L311-N348 PolarHBondContact O-ND2 3.22Å; L311-N348 VanDerWaalsContact O-ND2 3.13Å; L311-N370 HydrophobicContact CB-CB 4.43Å; L311-N370 PolarHBondContact N-O 3.4Å; L311-T372 HydrophobicContact CD2-CG2 4.26Å; L311-T372 HydrophobicContact CG-CG2 4.27Å
312	T	93.9	Very high	90.5	Very high	5 Å²	5	33 Å²	33	3%	0.031	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.6	152	179.2	62.5	0	0	0	0	110.3	N256 M257 I345 N348 N370	N256-T312 WeakPolarHBondContact O-CG2 3.45Å; M257-T312 WeakPolarHBondContact CA-OG1 3.45Å; M257-T312 PolarHBondContact O-OG1 3.04Å; T312-I345 HydrophobicContact CG2-CD1 4.34Å; T312-N348 WeakPolarHBondContact CA-O 3.5Å; T312-N370 PolarHBondContact N-O 2.94Å; T312-N370 PolarHBondContact O-N 3.1Å; T312-N370 WeakPolarHBondContact OG1-CB 3.28Å
313	V	93.9	Very high	90.4	Very high	0 Å²	0	34.4 Å²	34.4	0%	0	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.6	134.1	177.8	173.6	0	0	0	0	109.5	F294 Y310 F341 N348 V349 K350 F367 I368	F294-V313 HydrophobicContact CZ-CG1 4.26Å; Y310-V313 HydrophobicContact CD1-CG2 3.74Å; 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 3.96Å; V313-N348 PolarHBondContact N-O 3.19Å; V313-V349 HydrophobicContact CB-CB 4.47Å; V313-V349 HydrophobicContact CB-CG1 4.19Å; V313-V349 HydrophobicContact CB-CG2 4.15Å; V313-V349 HydrophobicContact CG1-CG1 4.13Å; V313-V349 CarbonylContact O-C 3.58Å; V313-V349 VanDerWaalsContact O-CA 3.31Å; V313-V349 WeakPolarHBondContact O-CA 3.29Å; V313-K350 PolarHBondContact O-N 2.99Å; V313-F367 HydrophobicContact CB-CE2 4.41Å; V313-F367 HydrophobicContact CG1-CD2 3.97Å; V313-F367 HydrophobicContact CG1-CE2 3.33Å; V313-F367 HydrophobicContact CG1-CZ 4.03Å; V313-F367 HydrophobicContact CG2-CE2 4.22Å; V313-F367 HydrophobicContact CG2-CZ 4.19Å; V313-I368 WeakPolarHBondContact CA-O 3.5Å
314	A	91.4	Very high	90.5	Very high	7 Å²	7	41 Å²	41	6%	0.058	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117	133.6	164.2	0	0	0	0	0	110.2	L253 M257 K350 I368	L253-A314 HydrophobicContact CD1-CB 4.33Å; M257-A314 HydrophobicContact CE-CB 4.15Å; M257-A314 HydrophobicContact CG-CB 4.44Å; M257-A314 HydrophobicContact SD-CB 3.52Å; M257-A314 VanDerWaalsContact SD-CB 3.52Å; A314-K350 CarbonylContact C-O 3.5Å; A314-K350 VanDerWaalsContact CA-O 3.31Å; A314-K350 WeakPolarHBondContact CA-O 3.07Å; A314-I368 HydrophobicContact CB-CB 4.25Å; A314-I368 HydrophobicContact CB-CD1 4.45Å; A314-I368 PolarHBondContact N-O 3.27Å; A314-I368 PolarHBondContact O-N 3.03Å
315	A	91.6	Very high	90.7	Very high	1 Å²	1	42.7 Å²	42.7	1%	0.008	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	121.9	173.9	0	0	0	0	0	109.6	M293 F317 M330 K350 V351 A352 T366	M293-A315 HydrophobicContact CE-CB 3.44Å; M293-A315 VanDerWaalsContact CE-CB 3.44Å; A315-F317 HydrophobicContact CB-CD2 4.23Å; A315-F317 HydrophobicContact CB-CE2 3.72Å; A315-M330 HydrophobicContact CB-CE 3.77Å; A315-M330 HydrophobicContact CB-SD 4.43Å; A315-K350 PolarHBondContact N-O 3.24Å; A315-V351 CarbonylContact O-C 3.49Å; A315-V351 WeakPolarHBondContact O-CA 3.39Å; A315-A352 PolarHBondContact O-N 3.23Å; A315-T366 CarbonylContact C-O 3.53Å; A315-T366 WeakPolarHBondContact CA-O 3.49Å
316	V	91.4	Very high	90.8	Very high	9 Å²	9	42.4 Å²	42.4	6%	0.055	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	103.3	177.2	-174.3	0	0	0	0	108.5	T238 A352 A365 T366	T238-V316 HydrophobicContact CG2-CG1 4.37Å; V316-A352 CarbonylContact C-O 3.52Å; V316-A352 WeakPolarHBondContact CA-O 3.44Å; V316-A352 HydrophobicContact CG2-CB 4.43Å; V316-A365 CarbonylContact O-C 3.5Å; V316-A365 WeakPolarHBondContact O-CA 3.38Å; V316-T366 PolarHBondContact N-O 3.42Å; V316-T366 PolarHBondContact O-N 3.17Å
317	F	92	Very high	90.9	Very high	0 Å²	0	38.2 Å²	38.2	0%	0	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.1	141.1	174.6	-70.7	-96.8	0	0	0	110.8	V286 L289 M293 A315 M321 V326 M330 V351 A352 V353 C354 A365	V286-F317 HydrophobicContact CG1-CE1 4.42Å; L289-F317 HydrophobicContact CB-CE1 4.23Å; M293-F317 HydrophobicContact CE-CE2 4.29Å; M293-F317 HydrophobicContact CE-CZ 4.08Å; M293-F317 HydrophobicContact SD-CE1 4.04Å; M293-F317 HydrophobicContact SD-CE2 4.26Å; M293-F317 HydrophobicContact SD-CZ 3.67Å; A315-F317 HydrophobicContact CB-CD2 4.23Å; A315-F317 HydrophobicContact CB-CE2 3.72Å; F317-M321 HydrophobicContact CB-CE 3.81Å; F317-M321 HydrophobicContact CB-SD 3.47Å; F317-M321 WeakPolarHBondContact CB-SD 3.42Å; F317-M321 HydrophobicContact CD1-CE 4.33Å; F317-M321 HydrophobicContact CD1-SD 3.78Å; F317-M321 HydrophobicContact CG-SD 3.92Å; F317-V326 HydrophobicContact CD1-CG1 4.41Å; F317-V326 HydrophobicContact CD1-CG2 4.5Å; F317-V326 HydrophobicContact CD2-CG1 3.52Å; F317-V326 HydrophobicContact CE1-CG1 4.32Å; F317-V326 HydrophobicContact CE2-CG1 3.4Å; F317-V326 VanDerWaalsContact CE2-CG1 3.4Å; F317-V326 HydrophobicContact CG-CG1 4.04Å; F317-V326 HydrophobicContact CG-CG2 4.47Å; F317-V326 HydrophobicContact CZ-CG1 3.84Å; F317-M330 HydrophobicContact CE2-CG 4.38Å; F317-M330 HydrophobicContact CE2-SD 4.21Å; F317-M330 HydrophobicContact CZ-SD 4.21Å; F317-V351 HydrophobicContact CD2-CG1 3.96Å; F317-V351 HydrophobicContact CE2-CG1 4.19Å; F317-A352 PolarHBondContact N-O 3.18Å; F317-V353 HydrophobicContact CB-CG2 4.35Å; F317-V353 CarbonylContact O-C 3.45Å; F317-V353 WeakPolarHBondContact O-CA 3.47Å; F317-C354 PolarHBondContact O-N 3.21Å; F317-A365 HydrophobicContact CD1-CB 3.66Å; F317-A365 HydrophobicContact CE1-CB 3.75Å; F317-A365 HydrophobicContact CG-CB 4.2Å; F317-A365 HydrophobicContact CZ-CB 4.35Å
318	R	90.7	Very high	91	Very high	2 Å²	2	37 Å²	37	1%	0.008	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.5	137	-177.9	-61.1	-173.4	66.7	178.6	-0.8	111	E27 S234 T238 M321 C354 I356 M363 A364	E27-R318 IonicContact OE1-CZ 2.77Å; E27-R318 IonicContact OE1-NH1 2.7Å; E27-R318 PolarHBondContact OE1-NH1 2.8Å; E27-R318 IonicContact OE1-NH2 2.82Å; E27-R318 PolarHBondContact OE1-NH2 2.84Å; E27-R318 IonicContact OE2-CZ 2.95Å; E27-R318 IonicContact OE2-NH1 3.9Å; E27-R318 PolarHBondContact OE2-NH1 3.41Å; E27-R318 IonicContact OE2-NH2 3.38Å; E27-R318 PolarHBondContact OE2-NH2 3.32Å; S234-R318 PolarHBondContact OG-NH1 3.24Å; S234-R318 VanDerWaalsContact OG-NH1 3.08Å; T238-R318 HydrophobicContact CG2-CG 3.96Å; T238-R318 WeakPolarHBondContact OG1-CD 3.47Å; T238-R318 PolarHBondContact OG1-NE 3.02Å; T238-R318 PolarHBondContact OG1-NH1 3.47Å; R318-M321 VanDerWaalsContact O-CE 3.25Å; R318-M321 WeakPolarHBondContact O-CE 3.45Å; R318-C354 CarbonylContact C-O 3.49Å; R318-C354 VanDerWaalsContact CA-O 3.29Å; R318-C354 WeakPolarHBondContact CA-O 3.43Å; R318-C354 HydrophobicContact CG-CB 4.44Å; R318-I356 PolarHBondContact NE-O 3.48Å; R318-I356 VanDerWaalsContact NE-O 3.14Å; R318-I356 PolarHBondContact NH2-O 2.72Å; R318-M363 CarbonylContact O-C 3.55Å; R318-M363 VanDerWaalsContact O-CA 3.22Å; R318-M363 WeakPolarHBondContact O-CA 3.32Å; R318-A364 HydrophobicContact CB-CB 4.47Å; R318-A364 PolarHBondContact N-O 3.36Å; R318-A364 PolarHBondContact O-N 3.05Å
319	G	88.7	Confident	91.1	Very high	0 Å²	0	38.9 Å²	38.9	0%	0	20%	0.2	C	C	.	.	S	Bend	trans	106	170.1	-179.8	0	0	0	0	0	113.3	M321 C354	G319-M321 WeakPolarHBondContact O-CE 3.49Å; G319-M321 PolarHBondContact O-N 3.29Å; G319-M321 VanDerWaalsContact O-N 3.12Å; G319-C354 PolarHBondContact N-O 3.21Å
320	P	85.8	Confident	91	Very high	98 Å²	98	35.2 Å²	35.2	64%	0.636	19%	0.187	S	C	*	.	S	Bend	trans	-70.3	109.5	-175.6	28.3	-34.1	0	0	0	110.7
321	M	88.2	Confident	90.9	Very high	31 Å²	31	39.1 Å²	39.1	15%	0.153	21%	0.207	C	C	.	.			trans	-148	160	179.4	65.2	-172.1	78	0	0	113	V286 F317 R318 G319 V326 V353 M363	V286-M321 HydrophobicContact CG2-CB 4Å; V286-M321 HydrophobicContact CG2-SD 4.16Å; F317-M321 HydrophobicContact CB-CE 3.81Å; F317-M321 HydrophobicContact CB-SD 3.47Å; F317-M321 WeakPolarHBondContact CB-SD 3.42Å; F317-M321 HydrophobicContact CD1-CE 4.33Å; F317-M321 HydrophobicContact CD1-SD 3.78Å; F317-M321 HydrophobicContact CG-SD 3.92Å; R318-M321 VanDerWaalsContact O-CE 3.25Å; R318-M321 WeakPolarHBondContact O-CE 3.45Å; G319-M321 WeakPolarHBondContact O-CE 3.49Å; G319-M321 PolarHBondContact O-N 3.29Å; G319-M321 VanDerWaalsContact O-N 3.12Å; M321-V326 HydrophobicContact CG-CG2 3.97Å; M321-V326 HydrophobicContact SD-CG2 3.55Å; M321-V326 VanDerWaalsContact SD-CG2 3.55Å; M321-V353 HydrophobicContact CG-CG1 3.87Å; M321-V353 HydrophobicContact SD-CG1 4.36Å; M321-M363 HydrophobicContact CE-CB 4.41Å; M321-M363 HydrophobicContact CE-CG 4.31Å; M321-M363 HydrophobicContact CE-SD 4.45Å
322	S	88.8	Confident	90.8	Very high	63 Å²	63	41.8 Å²	41.8	44%	0.441	22%	0.222	S	C	.	.			trans	-80.1	119	177.2	178.1	0	0	0	0	110.6	K324 E325 V326	S322-K324 PolarHBondContact O-N 2.82Å; S322-E325 WeakPolarHBondContact O-CB 3.07Å; S322-E325 PolarHBondContact O-N 3.08Å; S322-V326 PolarHBondContact O-N 3.39Å; S322-V326 VanDerWaalsContact O-N 3.13Å
323	M	86.6	Confident	90.7	Very high	63 Å²	63	42.5 Å²	42.5	31%	0.31	23%	0.226	S	C	.	.	H	α-helix	trans	-58.2	-39.4	177.7	-65.2	-173.5	-172.4	0	0	112.4	Q245 E325 V326 D327 V353	Q245-M323 HydrophobicContact CB-CE 4.38Å; Q245-M323 HydrophobicContact CG-CE 3.88Å; Q245-M323 PolarHBondContact OE1-SD 3.37Å; M323-E325 VanDerWaalsContact C-N 3.25Å; M323-E325 PolarHBondContact O-N 3.45Å; M323-V326 WeakPolarHBondContact O-CB 3.34Å; M323-V326 PolarHBondContact O-N 3.02Å; M323-V326 VanDerWaalsContact O-N 3.12Å; M323-D327 PolarHBondContact O-N 3.21Å; M323-V353 HydrophobicContact CE-CB 4.33Å; M323-V353 HydrophobicContact CG-CG2 4.29Å
324	K	90.3	Very high	90.5	Very high	147 Å²	147	44.6 Å²	44.6	64%	0.639	24%	0.236	S	C	*	.	H	α-helix	trans	-57.7	-42.3	176.5	-175.4	-176.5	175.9	-176.1	0	111.5	S322 D327 D328	S322-K324 PolarHBondContact O-N 2.82Å; K324-D327 PolarHBondContact O-N 3.1Å; K324-D328 VanDerWaalsContact O-CB 3.3Å; K324-D328 WeakPolarHBondContact O-CB 3.44Å; K324-D328 PolarHBondContact O-N 3.33Å
325	E	92.3	Very high	90.4	Very high	81 Å²	81	49.6 Å²	49.6	38%	0.379	26%	0.261	S	S	.	.	H	α-helix	trans	-67.2	-39.3	179	-171.5	179	-178.3	0	0	111.3	V286 S322 M323 Q329	V286-E325 HydrophobicContact CB-CG 4.16Å; V286-E325 HydrophobicContact CG1-CG 4.31Å; S322-E325 WeakPolarHBondContact O-CB 3.07Å; S322-E325 PolarHBondContact O-N 3.08Å; M323-E325 VanDerWaalsContact C-N 3.25Å; M323-E325 PolarHBondContact O-N 3.45Å; E325-Q329 WeakPolarHBondContact O-CB 3.3Å; E325-Q329 VanDerWaalsContact O-CG 3.29Å; E325-Q329 WeakPolarHBondContact O-CG 3.48Å; E325-Q329 PolarHBondContact O-N 3.22Å
326	V	90.8	Very high	90.3	Very high	0 Å²	0	56.3 Å²	56.3	0%	0	29%	0.291	C	S	.	.	H	α-helix	trans	-62.4	-49	175.4	-178	0	0	0	0	110.7	V286 F317 M321 S322 M323 D328 Q329 M330 V351 V353	V286-V326 HydrophobicContact CG1-CB 4.32Å; V286-V326 HydrophobicContact CG1-CG2 3.78Å; V286-V326 HydrophobicContact CG2-CG2 4.3Å; F317-V326 HydrophobicContact CD1-CG1 4.41Å; F317-V326 HydrophobicContact CD1-CG2 4.5Å; F317-V326 HydrophobicContact CD2-CG1 3.52Å; F317-V326 HydrophobicContact CE1-CG1 4.32Å; F317-V326 HydrophobicContact CE2-CG1 3.4Å; F317-V326 VanDerWaalsContact CE2-CG1 3.4Å; F317-V326 HydrophobicContact CG-CG1 4.04Å; F317-V326 HydrophobicContact CG-CG2 4.47Å; F317-V326 HydrophobicContact CZ-CG1 3.84Å; M321-V326 HydrophobicContact CG-CG2 3.97Å; M321-V326 HydrophobicContact SD-CG2 3.55Å; M321-V326 VanDerWaalsContact SD-CG2 3.55Å; S322-V326 PolarHBondContact O-N 3.39Å; S322-V326 VanDerWaalsContact O-N 3.13Å; M323-V326 WeakPolarHBondContact O-CB 3.34Å; M323-V326 PolarHBondContact O-N 3.02Å; M323-V326 VanDerWaalsContact O-N 3.12Å; V326-D328 PolarHBondContact O-N 2.73Å; V326-Q329 PolarHBondContact O-N 2.87Å; V326-M330 HydrophobicContact CG1-CG 4.31Å; V326-M330 WeakPolarHBondContact O-CB 3.49Å; V326-M330 VanDerWaalsContact O-CG 3.26Å; V326-M330 WeakPolarHBondContact O-CG 3.48Å; V326-M330 PolarHBondContact O-N 3.36Å; V326-V351 HydrophobicContact CG1-CG1 3.48Å; V326-V351 VanDerWaalsContact CG1-CG1 3.48Å; V326-V353 HydrophobicContact CG2-CG2 4.46Å
327	D	89.9	Confident	90.2	Very high	89 Å²	89	59.2 Å²	59.2	48%	0.476	31%	0.306	S	S	.	.	H	α-helix	trans	-62.1	-45.1	179.7	-69.2	-23.8	0	0	0	111.4	M323 K324 Q329 M330 L331	M323-D327 PolarHBondContact O-N 3.21Å; K324-D327 PolarHBondContact O-N 3.1Å; D327-Q329 VanDerWaalsContact C-N 3.34Å; D327-Q329 PolarHBondContact O-N 3.04Å; D327-M330 PolarHBondContact O-N 3.4Å; D327-L331 WeakPolarHBondContact O-CB 3.36Å; D327-L331 PolarHBondContact O-N 2.72Å
328	D	92.6	Very high	89.9	Confident	85 Å²	85	62.7 Å²	62.7	46%	0.455	33%	0.33	S	S	.	.	H	α-helix	trans	-60.6	-41.7	177.2	-73.4	-19.8	0	0	0	111.4	K324 V326 N332	K324-D328 VanDerWaalsContact O-CB 3.3Å; K324-D328 WeakPolarHBondContact O-CB 3.44Å; K324-D328 PolarHBondContact O-N 3.33Å; V326-D328 PolarHBondContact O-N 2.73Å; D328-N332 VanDerWaalsContact O-CB 3.3Å; D328-N332 WeakPolarHBondContact O-CB 3.07Å; D328-N332 PolarHBondContact O-N 2.84Å
329	Q	93.3	Very high	89.8	Confident	47 Å²	47	66.6 Å²	66.6	22%	0.22	36%	0.358	C	S	.	.	H	α-helix	trans	-70.2	-40.1	177.6	-70.4	-50.4	-48.4	0	0	112.8	V286 P287 T290 E325 V326 D327 N332 V333	V286-Q329 HydrophobicContact CG1-CG 4.2Å; P287-Q329 HydrophobicContact CB-CG 4.29Å; P287-Q329 HydrophobicContact CG-CG 3.98Å; T290-Q329 HydrophobicContact CG2-CB 4.25Å; E325-Q329 WeakPolarHBondContact O-CB 3.3Å; E325-Q329 VanDerWaalsContact O-CG 3.29Å; E325-Q329 WeakPolarHBondContact O-CG 3.48Å; E325-Q329 PolarHBondContact O-N 3.22Å; V326-Q329 PolarHBondContact O-N 2.87Å; D327-Q329 VanDerWaalsContact C-N 3.34Å; D327-Q329 PolarHBondContact O-N 3.04Å; Q329-N332 WeakPolarHBondContact O-CB 3.44Å; Q329-N332 PolarHBondContact O-N 3.42Å; Q329-V333 PolarHBondContact O-N 3.47Å
330	M	91.3	Very high	89.7	Confident	4 Å²	4	67.9 Å²	67.9	2%	0.02	37%	0.367	C	S	.	.	H	α-helix	trans	-67	-40.1	178.6	-70.9	-63	-70	0	0	111.4	T290 M293 F294 A315 F317 V326 D327 V333 Q334 V349 V351	T290-M330 HydrophobicContact CG2-SD 3.76Å; M293-M330 HydrophobicContact CE-CE 4.41Å; M293-M330 HydrophobicContact CE-SD 4.16Å; F294-M330 HydrophobicContact CE2-CE 4.05Å; F294-M330 HydrophobicContact CE2-SD 4.06Å; F294-M330 HydrophobicContact CZ-CE 4.12Å; A315-M330 HydrophobicContact CB-CE 3.77Å; A315-M330 HydrophobicContact CB-SD 4.43Å; F317-M330 HydrophobicContact CE2-CG 4.38Å; F317-M330 HydrophobicContact CE2-SD 4.21Å; F317-M330 HydrophobicContact CZ-SD 4.21Å; V326-M330 HydrophobicContact CG1-CG 4.31Å; V326-M330 WeakPolarHBondContact O-CB 3.49Å; V326-M330 VanDerWaalsContact O-CG 3.26Å; V326-M330 WeakPolarHBondContact O-CG 3.48Å; V326-M330 PolarHBondContact O-N 3.36Å; D327-M330 PolarHBondContact O-N 3.4Å; M330-V333 PolarHBondContact O-N 3Å; M330-Q334 WeakPolarHBondContact O-CG 3.3Å; M330-Q334 PolarHBondContact O-N 3.24Å; M330-Q334 VanDerWaalsContact O-N 3.1Å; M330-V349 HydrophobicContact CE-CG1 3.37Å; M330-V351 HydrophobicContact CB-CG2 4.2Å; M330-V351 HydrophobicContact CE-CG2 4.08Å; M330-V351 HydrophobicContact CG-CG2 3.76Å
331	L	90.8	Very high	90	Very high	89 Å²	89	63.9 Å²	63.9	47%	0.466	34%	0.339	S	S	.	.	H	α-helix	trans	-64.4	-40	173	-175.7	63.4	0	0	0	111.8	D327 V333 Q334 N335	D327-L331 WeakPolarHBondContact O-CB 3.36Å; D327-L331 PolarHBondContact O-N 2.72Å; L331-V333 VanDerWaalsContact C-N 3.34Å; L331-V333 PolarHBondContact O-N 3.29Å; L331-Q334 PolarHBondContact O-N 2.75Å; L331-N335 WeakPolarHBondContact O-CB 3.3Å; L331-N335 VanDerWaalsContact O-CG 3.28Å; L331-N335 PolarHBondContact O-N 3Å; L331-N335 PolarHBondContact O-ND2 3.31Å
332	N	92.9	Very high	90.1	Very high	57 Å²	57	62.7 Å²	62.7	31%	0.305	33%	0.334	S	S	.	.	H	α-helix	trans	-61.2	-40.7	176.2	-172.3	22.2	0	0	0	112.2	D328 Q329 K336	D328-N332 VanDerWaalsContact O-CB 3.3Å; D328-N332 WeakPolarHBondContact O-CB 3.07Å; D328-N332 PolarHBondContact O-N 2.84Å; Q329-N332 WeakPolarHBondContact O-CB 3.44Å; Q329-N332 PolarHBondContact O-N 3.42Å; N332-K336 PolarHBondContact ND2-NZ 3.24Å; N332-K336 WeakPolarHBondContact O-CB 3.23Å; N332-K336 VanDerWaalsContact O-CG 3.32Å; N332-K336 WeakPolarHBondContact O-CG 3.37Å; N332-K336 PolarHBondContact O-N 3.48Å; N332-K336 WeakPolarHBondContact OD1-CE 3.19Å; N332-K336 PolarHBondContact OD1-NZ 3.13Å
333	V	91	Very high	90	Very high	19 Å²	19	66.3 Å²	66.3	12%	0.115	34%	0.344	C	S	.	.	H	α-helix	trans	-66.6	-43.9	176	171.7	0	0	0	0	111.5	T290 F294 Q329 M330 L331 N335 K336 N337	T290-V333 HydrophobicContact CG2-CG2 3.66Å; F294-V333 HydrophobicContact CD1-CG1 4.21Å; F294-V333 HydrophobicContact CD2-CG1 3.76Å; F294-V333 HydrophobicContact CD2-CG2 4.45Å; F294-V333 HydrophobicContact CE1-CG1 4.25Å; F294-V333 HydrophobicContact CE2-CB 4.41Å; F294-V333 HydrophobicContact CE2-CG1 3.8Å; F294-V333 HydrophobicContact CG-CG1 3.96Å; F294-V333 HydrophobicContact CZ-CG1 4.04Å; Q329-V333 PolarHBondContact O-N 3.47Å; M330-V333 PolarHBondContact O-N 3Å; L331-V333 VanDerWaalsContact C-N 3.34Å; L331-V333 PolarHBondContact O-N 3.29Å; V333-N335 VanDerWaalsContact C-N 3.34Å; V333-N335 PolarHBondContact O-N 3.44Å; V333-K336 PolarHBondContact O-N 3Å; V333-N337 WeakPolarHBondContact O-CB 3.19Å; V333-N337 PolarHBondContact O-N 3.41Å
334	Q	89.3	Confident	90.1	Very high	45 Å²	45	67.2 Å²	67.2	21%	0.21	34%	0.344	C	S	.	.	H	α-helix	trans	-59.3	-45.6	176.1	-73.3	171.3	37.6	0	0	111.7	M330 L331 K336 N337 S338 F341 V349	M330-Q334 WeakPolarHBondContact O-CG 3.3Å; M330-Q334 PolarHBondContact O-N 3.24Å; M330-Q334 VanDerWaalsContact O-N 3.1Å; L331-Q334 PolarHBondContact O-N 2.75Å; Q334-K336 PolarHBondContact O-N 2.88Å; Q334-N337 CarbonylContact O-C 3.58Å; Q334-N337 PolarHBondContact O-N 3.21Å; Q334-S338 WeakPolarHBondContact O-CA 3.46Å; Q334-S338 PolarHBondContact O-N 3.29Å; Q334-F341 HydrophobicContact CG-CE1 4.45Å; Q334-F341 HydrophobicContact CG-CE2 4.2Å; Q334-F341 HydrophobicContact CG-CZ 4.13Å; Q334-V349 HydrophobicContact CG-CG2 3.87Å
335	N	89.8	Confident	89.9	Confident	111 Å²	111	61.7 Å²	61.7	59%	0.594	32%	0.321	S	S	*	.	H	α-helix	trans	-66.5	-37	180	-71.6	-22.6	0	0	0	112.8	L331 V333	L331-N335 WeakPolarHBondContact O-CB 3.3Å; L331-N335 VanDerWaalsContact O-CG 3.28Å; L331-N335 PolarHBondContact O-N 3Å; L331-N335 PolarHBondContact O-ND2 3.31Å; V333-N335 VanDerWaalsContact C-N 3.34Å; V333-N335 PolarHBondContact O-N 3.44Å
336	K	90.4	Very high	89.5	Confident	143 Å²	143	62.8 Å²	62.8	62%	0.622	34%	0.335	S	S	*	.	H	α-helix	trans	-72.9	-35.4	178.4	-77.7	174.1	175.8	167.9	0	112.9	N332 V333 Q334	N332-K336 PolarHBondContact ND2-NZ 3.24Å; N332-K336 WeakPolarHBondContact O-CB 3.23Å; N332-K336 VanDerWaalsContact O-CG 3.32Å; N332-K336 WeakPolarHBondContact O-CG 3.37Å; N332-K336 PolarHBondContact O-N 3.48Å; N332-K336 WeakPolarHBondContact OD1-CE 3.19Å; N332-K336 PolarHBondContact OD1-NZ 3.13Å; V333-K336 PolarHBondContact O-N 3Å; Q334-K336 PolarHBondContact O-N 2.88Å
337	N	88.3	Confident	89.2	Confident	70 Å²	70	68.9 Å²	68.9	37%	0.374	37%	0.367	S	S	.	.	T	Hydrogen-bonded Turn	trans	-115.5	34.5	-173.9	-59.9	-19.6	0	0	0	111.3	V333 Q334 S339 S340 F341	V333-N337 WeakPolarHBondContact O-CB 3.19Å; V333-N337 PolarHBondContact O-N 3.41Å; Q334-N337 CarbonylContact O-C 3.58Å; Q334-N337 PolarHBondContact O-N 3.21Å; N337-S339 PolarHBondContact O-N 3.46Å; N337-S339 VanDerWaalsContact O-N 3.11Å; N337-S340 WeakPolarHBondContact O-CB 3.2Å; N337-S340 PolarHBondContact O-N 3.31Å; N337-F341 HydrophobicContact CB-CE2 4.24Å; N337-F341 VanDerWaalsContact O-CD2 3.27Å; N337-F341 WeakPolarHBondContact O-CD2 3.35Å
338	S	86.4	Confident	89.1	Confident	72 Å²	72	65.2 Å²	65.2	50%	0.503	35%	0.348	S	S	.	.	G	3₁₀ helix	trans	-57	-32.9	-172.4	62.2	0	0	0	0	112.8	Q334 S340 F341	Q334-S338 WeakPolarHBondContact O-CA 3.46Å; Q334-S338 PolarHBondContact O-N 3.29Å; S338-S340 PolarHBondContact O-N 3.46Å; S338-F341 PolarHBondContact O-N 3.01Å; S338-F341 VanDerWaalsContact O-N 3.15Å; S338-F341 VanDerWaalsContact O-O 3.1Å
339	S	87.5	Confident	88.9	Confident	85 Å²	85	62 Å²	62	59%	0.594	33%	0.331	S	S	*	.	G	3₁₀ helix	trans	-65.8	-21.1	175.9	56.5	0	0	0	0	114.7	N337	N337-S339 PolarHBondContact O-N 3.46Å; N337-S339 VanDerWaalsContact O-N 3.11Å
340	S	88.1	Confident	88.7	Confident	27 Å²	27	63.4 Å²	63.4	19%	0.189	34%	0.337	C	S	.	.	G	3₁₀ helix	trans	-87.9	-5.5	176.3	-58.3	0	0	0	0	112.8	R309 Y310 N337 S338	R309-S340 CarbonylContact C-O 3.57Å; R309-S340 VanDerWaalsContact CA-O 3.27Å; R309-S340 WeakPolarHBondContact CA-O 3.45Å; Y310-S340 PolarHBondContact N-O 3.16Å; N337-S340 WeakPolarHBondContact O-CB 3.2Å; N337-S340 PolarHBondContact O-N 3.31Å; S338-S340 PolarHBondContact O-N 3.46Å
341	F	91.4	Very high	88.6	Confident	13 Å²	13	64.7 Å²	64.7	6%	0.057	34%	0.344	C	S	.	.	B	Isolated β-bridge	trans	-108.4	143.7	173.5	-65.1	-89	0	0	0	109.1	F294 Y310 V313 Q334 N337 S338 V349	F294-F341 HydrophobicContact CE1-CE1 4.27Å; F294-F341 AromaticContact CE1-CZ 3.72Å; F294-F341 HydrophobicContact CE1-CZ 3.72Å; F294-F341 HydrophobicContact CZ-CZ 4.17Å; Y310-F341 HydrophobicContact CD2-CD1 4.27Å; Y310-F341 AromaticContact CD2-CE1 3.96Å; Y310-F341 HydrophobicContact CD2-CE1 3.96Å; Y310-F341 HydrophobicContact CD2-CZ 4.21Å; Y310-F341 HydrophobicContact CG-CD1 4.44Å; Y310-F341 HydrophobicContact CG-CE1 4.29Å; V313-F341 HydrophobicContact CG2-CE1 3.96Å; Q334-F341 HydrophobicContact CG-CE1 4.45Å; Q334-F341 HydrophobicContact CG-CE2 4.2Å; Q334-F341 HydrophobicContact CG-CZ 4.13Å; N337-F341 HydrophobicContact CB-CE2 4.24Å; N337-F341 VanDerWaalsContact O-CD2 3.27Å; N337-F341 WeakPolarHBondContact O-CD2 3.35Å; S338-F341 PolarHBondContact O-N 3.01Å; S338-F341 VanDerWaalsContact O-N 3.15Å; S338-F341 VanDerWaalsContact O-O 3.1Å; F341-V349 HydrophobicContact CD1-CG2 4.09Å; F341-V349 HydrophobicContact CE1-CG2 3.69Å; F341-V349 HydrophobicContact CZ-CG2 4.48Å
342	V	91.3	Very high	88.4	Confident	6 Å²	6	61 Å²	61	4%	0.036	33%	0.327	C	S	.	.			trans	-69.8	134.7	174.5	-63.1	0	0	0	0	111	R309 Y310 L311 W344 I345	R309-V342 HydrophobicContact CB-CG1 3.87Å; Y310-V342 WeakPolarHBondContact O-CG2 3.48Å; Y310-V342 PolarHBondContact O-N 3.5Å; L311-V342 HydrophobicContact CD2-CG1 3.9Å; L311-V342 HydrophobicContact CD2-CG2 4.46Å; V342-W344 HydrophobicContact CB-CZ2 4.3Å; V342-W344 HydrophobicContact CG1-CZ2 4.31Å; V342-W344 HydrophobicContact CG2-CD2 4.49Å; V342-W344 HydrophobicContact CG2-CZ2 4.16Å; V342-I345 HydrophobicContact CG2-CB 3.9Å; V342-I345 HydrophobicContact CG2-CD1 3.91Å; V342-I345 HydrophobicContact CG2-CG1 3.78Å
343	E	86.8	Confident	88.2	Confident	140 Å²	140	59.1 Å²	59.1	65%	0.654	32%	0.317	S	S	*	.	S	Bend	trans	-78.1	-28.5	-176.2	-61.8	-178.9	170.5	0	0	112.6	I345	E343-I345 PolarHBondContact O-N 3.22Å
344	W	87.3	Confident	88	Confident	82 Å²	82	58.5 Å²	58.5	31%	0.311	31%	0.314	S	S	.	.	S	Bend	trans	-80.9	-10.8	-174.8	55.7	-97.3	0	0	0	114	F260 L311 V342 P346 Y425 A430	F260-W344 AromaticContact CE2-CH2 3.49Å; F260-W344 HydrophobicContact CE2-CH2 3.49Å; F260-W344 VanDerWaalsContact CE2-CH2 3.49Å; F260-W344 HydrophobicContact CE2-CZ2 4.3Å; F260-W344 HydrophobicContact CE2-CZ3 4.15Å; F260-W344 AromaticContact CZ-CH2 3.82Å; F260-W344 HydrophobicContact CZ-CH2 3.82Å; F260-W344 HydrophobicContact CZ-CZ3 4.05Å; L311-W344 HydrophobicContact CD2-CH2 4.13Å; L311-W344 HydrophobicContact CD2-CZ2 3.72Å; V342-W344 HydrophobicContact CB-CZ2 4.3Å; V342-W344 HydrophobicContact CG1-CZ2 4.31Å; V342-W344 HydrophobicContact CG2-CD2 4.49Å; V342-W344 HydrophobicContact CG2-CZ2 4.16Å; W344-P346 VanDerWaalsContact O-CD 3.3Å; W344-P346 WeakPolarHBondContact O-CD 3.29Å; W344-Y425 HydrophobicContact CZ2-CD1 4.22Å; W344-A430 HydrophobicContact CB-CB 4.33Å
345	I	87.3	Confident	87.8	Confident	31 Å²	31	61.2 Å²	61.2	16%	0.159	33%	0.33	C	S	.	.	S	Bend	trans	-102.7	97.9	166.6	-54.3	-179.3	0	0	0	108.7	P259 L311 T312 V342 E343 N348	P259-I345 HydrophobicContact CB-CD1 4.03Å; P259-I345 HydrophobicContact CG-CD1 4.15Å; L311-I345 HydrophobicContact CB-CD1 4.46Å; L311-I345 WeakPolarHBondContact O-CD1 3.42Å; T312-I345 HydrophobicContact CG2-CD1 4.34Å; V342-I345 HydrophobicContact CG2-CB 3.9Å; V342-I345 HydrophobicContact CG2-CD1 3.91Å; V342-I345 HydrophobicContact CG2-CG1 3.78Å; E343-I345 PolarHBondContact O-N 3.22Å; I345-N348 HydrophobicContact CB-CB 4.03Å; I345-N348 HydrophobicContact CG2-CB 3.65Å
346	P	84	Confident	87.6	Confident	104 Å²	104	57.3 Å²	57.3	68%	0.675	31%	0.309	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.7	142.2	176.2	27.9	-34.1	0	0	0	110.8	W344 N348	W344-P346 VanDerWaalsContact O-CD 3.3Å; W344-P346 WeakPolarHBondContact O-CD 3.29Å; P346-N348 VanDerWaalsContact C-N 3.31Å; P346-N348 PolarHBondContact O-N 3.06Å
347	N	83.6	Confident	87.5	Confident	127 Å²	127	52.7 Å²	52.7	68%	0.679	29%	0.294	S	S	*	.	T	Hydrogen-bonded Turn	trans	53	44.7	176.3	-57.5	-47.7	0	0	0	113.8	V349 K350	N347-V349 PolarHBondContact O-N 2.97Å; N347-K350 PolarHBondContact O-NZ 2.92Å
348	N	87.4	Confident	87.4	Confident	13 Å²	13	49.8 Å²	49.8	7%	0.07	28%	0.278	C	S	.	.			trans	-73.4	-2.4	-176.7	66.1	-13.8	0	0	0	115.3	Y310 L311 T312 V313 I345 P346	Y310-N348 PolarHBondContact O-ND2 2.96Å; L311-N348 VanDerWaalsContact O-CB 3.25Å; L311-N348 WeakPolarHBondContact O-CB 3.31Å; L311-N348 PolarHBondContact O-ND2 3.22Å; L311-N348 VanDerWaalsContact O-ND2 3.13Å; T312-N348 WeakPolarHBondContact CA-O 3.5Å; V313-N348 PolarHBondContact N-O 3.19Å; I345-N348 HydrophobicContact CB-CB 4.03Å; I345-N348 HydrophobicContact CG2-CB 3.65Å; P346-N348 VanDerWaalsContact C-N 3.31Å; P346-N348 PolarHBondContact O-N 3.06Å
349	V	89.4	Confident	87	Confident	17 Å²	17	54.1 Å²	54.1	10%	0.103	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	124.7	177.6	-173.6	0	0	0	0	110.3	V313 M330 Q334 F341 N347	V313-V349 HydrophobicContact CB-CB 4.47Å; V313-V349 HydrophobicContact CB-CG1 4.19Å; V313-V349 HydrophobicContact CB-CG2 4.15Å; V313-V349 HydrophobicContact CG1-CG1 4.13Å; V313-V349 CarbonylContact O-C 3.58Å; V313-V349 VanDerWaalsContact O-CA 3.31Å; V313-V349 WeakPolarHBondContact O-CA 3.29Å; M330-V349 HydrophobicContact CE-CG1 3.37Å; Q334-V349 HydrophobicContact CG-CG2 3.87Å; F341-V349 HydrophobicContact CD1-CG2 4.09Å; F341-V349 HydrophobicContact CE1-CG2 3.69Å; F341-V349 HydrophobicContact CZ-CG2 4.48Å; N347-V349 PolarHBondContact O-N 2.97Å
350	K	88.8	Confident	86.7	Confident	77 Å²	77	53.2 Å²	53.2	34%	0.335	29%	0.288	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	137.3	175.9	-58.3	-54.4	-179.6	-150.7	0	110.3	N256 V313 A314 A315 N347	N256-K350 HydrophobicContact CB-CG 4.35Å; V313-K350 PolarHBondContact O-N 2.99Å; A314-K350 CarbonylContact C-O 3.5Å; A314-K350 VanDerWaalsContact CA-O 3.31Å; A314-K350 WeakPolarHBondContact CA-O 3.07Å; A315-K350 PolarHBondContact N-O 3.24Å; N347-K350 PolarHBondContact O-NZ 2.92Å
351	V	88.7	Confident	86.5	Confident	30 Å²	30	53.7 Å²	53.7	18%	0.182	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	132.8	179.8	-179.8	0	0	0	0	108.5	A315 F317 V326 M330 V353	A315-V351 CarbonylContact O-C 3.49Å; A315-V351 WeakPolarHBondContact O-CA 3.39Å; F317-V351 HydrophobicContact CD2-CG1 3.96Å; F317-V351 HydrophobicContact CE2-CG1 4.19Å; V326-V351 HydrophobicContact CG1-CG1 3.48Å; V326-V351 VanDerWaalsContact CG1-CG1 3.48Å; M330-V351 HydrophobicContact CB-CG2 4.2Å; M330-V351 HydrophobicContact CE-CG2 4.08Å; M330-V351 HydrophobicContact CG-CG2 3.76Å; V351-V353 HydrophobicContact CG1-CG2 4.37Å
352	A	87.7	Confident	86.3	Confident	12 Å²	12	61.4 Å²	61.4	10%	0.099	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	138.6	169.5	0	0	0	0	0	109	L246 A315 V316 F317	L246-A352 HydrophobicContact CB-CB 4.17Å; L246-A352 HydrophobicContact CD2-CB 4.03Å; A315-A352 PolarHBondContact O-N 3.23Å; V316-A352 CarbonylContact C-O 3.52Å; V316-A352 WeakPolarHBondContact CA-O 3.44Å; V316-A352 HydrophobicContact CG2-CB 4.43Å; F317-A352 PolarHBondContact N-O 3.18Å
353	V	87.9	Confident	86.2	Confident	17 Å²	17	62.4 Å²	62.4	10%	0.103	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	129.9	175.3	-175.5	0	0	0	0	108.5	F317 M321 M323 V326 V351	F317-V353 HydrophobicContact CB-CG2 4.35Å; F317-V353 CarbonylContact O-C 3.45Å; F317-V353 WeakPolarHBondContact O-CA 3.47Å; M321-V353 HydrophobicContact CG-CG1 3.87Å; M321-V353 HydrophobicContact SD-CG1 4.36Å; M323-V353 HydrophobicContact CE-CB 4.33Å; M323-V353 HydrophobicContact CG-CG2 4.29Å; V326-V353 HydrophobicContact CG2-CG2 4.46Å; V351-V353 HydrophobicContact CG1-CG2 4.37Å
354	C	87.4	Confident	86.5	Confident	7 Å²	7	55.7 Å²	55.7	5%	0.047	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	131.3	173.6	-177.5	0	0	0	0	109.3	T238 F317 R318 G319 I356	T238-C354 HydrophobicContact CG2-CB 3.64Å; F317-C354 PolarHBondContact O-N 3.21Å; R318-C354 CarbonylContact C-O 3.49Å; R318-C354 VanDerWaalsContact CA-O 3.29Å; R318-C354 WeakPolarHBondContact CA-O 3.43Å; R318-C354 HydrophobicContact CG-CB 4.44Å; G319-C354 PolarHBondContact N-O 3.21Å; C354-I356 PolarHBondContact O-N 2.91Å
355	D	84.9	Confident	86.8	Confident	102 Å²	102	51.8 Å²	51.8	55%	0.545	28%	0.28	S	S	.	.	S	Bend	trans	-71.2	-20.5	-177	-64	-33	0	0	0	112.9	P357	D355-P357 VanDerWaalsContact O-CD 3.25Å; D355-P357 WeakPolarHBondContact O-CD 3.44Å
356	I	85.6	Confident	87.1	Confident	29 Å²	29	50.3 Å²	50.3	15%	0.149	27%	0.272	C	S	.	.	S	Bend	trans	-87.7	109.8	-177.5	-62.4	169.7	0	0	0	109.8	L42 F242 R318 C354	L42-I356 HydrophobicContact CB-CD1 3.71Å; L42-I356 HydrophobicContact CD1-CD1 4.28Å; F242-I356 HydrophobicContact CB-CD1 4.35Å; F242-I356 HydrophobicContact CD1-CD1 3.31Å; F242-I356 HydrophobicContact CE1-CD1 3.62Å; F242-I356 HydrophobicContact CE1-CG2 4.33Å; F242-I356 HydrophobicContact CE2-CG2 4.29Å; F242-I356 HydrophobicContact CG-CD1 3.85Å; F242-I356 HydrophobicContact CZ-CD1 4.39Å; F242-I356 HydrophobicContact CZ-CG2 4.09Å; R318-I356 PolarHBondContact NE-O 3.48Å; R318-I356 VanDerWaalsContact NE-O 3.14Å; R318-I356 PolarHBondContact NH2-O 2.72Å; C354-I356 PolarHBondContact O-N 2.91Å
357	P	87.3	Confident	87.5	Confident	46 Å²	46	45.4 Å²	45.4	30%	0.299	24%	0.24	S	C	.	.	P	Polyproline II helix	trans	-73.2	158.1	175.6	33.8	-35.4	0	0	0	111.2	D355 L361 K362	D355-P357 VanDerWaalsContact O-CD 3.25Å; D355-P357 WeakPolarHBondContact O-CD 3.44Å; P357-L361 WeakPolarHBondContact CB-O 3.47Å; P357-K362 WeakPolarHBondContact CB-O 3.29Å
358	P	86.1	Confident	88	Confident	9 Å²	9	39.4 Å²	39.4	6%	0.058	21%	0.208	C	C	.	.	P	Polyproline II helix	trans	-68.8	161.4	170.3	28.2	-30.7	0	0	0	111.2	G360 L361 A364	P358-G360 PolarHBondContact O-N 2.95Å; P358-L361 HydrophobicContact CG-CB 4.19Å; P358-L361 HydrophobicContact CG-CD1 4.17Å; P358-L361 PolarHBondContact O-N 2.87Å; P358-L361 VanDerWaalsContact O-O 3.1Å; P358-A364 HydrophobicContact CG-CB 3.52Å
359	R	78.7	Confident	88.4	Confident	163 Å²	163	38.8 Å²	38.8	62%	0.615	21%	0.205	S	C	*	.	T	Hydrogen-bonded Turn	trans	-62.7	135.1	-175.9	-169.1	175.9	-176.5	-179.8	9.6	111.2	D26 L361	D26-R359 IonicContact OD1-NH1 3.24Å; D26-R359 PolarHBondContact OD1-NH1 3.01Å; D26-R359 VanDerWaalsContact OD1-NH1 3.11Å; D26-R359 IonicContact OD2-CZ 2.77Å; D26-R359 IonicContact OD2-NH1 3.2Å; D26-R359 PolarHBondContact OD2-NH1 3.07Å; R359-L361 PolarHBondContact O-N 2.74Å
360	G	80.2	Confident	88.6	Confident	66 Å²	66	38 Å²	38	68%	0.68	20%	0.2	S	C	*	.	T	Hydrogen-bonded Turn	trans	78.5	-1.5	177.1	0	0	0	0	0	115.4	P358	P358-G360 PolarHBondContact O-N 2.95Å
361	L	84.9	Confident	88.9	Confident	36 Å²	36	34.3 Å²	34.3	19%	0.188	18%	0.184	C	C	.	.			trans	-124.1	148.1	175.1	-63.5	171.9	0	0	0	110.2	F270 P272 P357 P358 R359 A364	F270-L361 HydrophobicContact CE1-CD1 4.29Å; F270-L361 HydrophobicContact CZ-CD1 4.11Å; P272-L361 HydrophobicContact CG-CD1 4.27Å; P272-L361 HydrophobicContact CG-CD2 4.1Å; P357-L361 WeakPolarHBondContact CB-O 3.47Å; P358-L361 HydrophobicContact CG-CB 4.19Å; P358-L361 HydrophobicContact CG-CD1 4.17Å; P358-L361 PolarHBondContact O-N 2.87Å; P358-L361 VanDerWaalsContact O-O 3.1Å; R359-L361 PolarHBondContact O-N 2.74Å; L361-A364 HydrophobicContact CD1-CB 4.4Å
362	K	87.1	Confident	89.3	Confident	175 Å²	175	32.9 Å²	32.9	76%	0.761	18%	0.175	S	C	*	.	S	Bend	trans	-85.8	-33.2	173.7	-69.2	-173.9	178.5	-178.3	0	112.3	P357	P357-K362 WeakPolarHBondContact CB-O 3.29Å
363	M	90.1	Very high	89.6	Confident	27 Å²	27	32.3 Å²	32.3	13%	0.133	17%	0.171	C	C	.	.			trans	-143.5	144.3	177.9	-62.8	-176.6	-66.1	0	0	109.1	L284 L289 R318 M321	L284-M363 VanDerWaalsContact C-CE 3.48Å; L284-M363 HydrophobicContact CB-CE 4Å; L284-M363 WeakPolarHBondContact O-CE 3.46Å; L289-M363 HydrophobicContact CD1-CB 3.85Å; R318-M363 CarbonylContact O-C 3.55Å; R318-M363 VanDerWaalsContact O-CA 3.22Å; R318-M363 WeakPolarHBondContact O-CA 3.32Å; M321-M363 HydrophobicContact CE-CB 4.41Å; M321-M363 HydrophobicContact CE-CG 4.31Å; M321-M363 HydrophobicContact CE-SD 4.45Å
364	A	92.1	Very high	89.9	Confident	0 Å²	0	31.5 Å²	31.5	0%	0	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.9	161.8	172.6	0	0	0	0	0	109.6	F270 A271 R318 P358 L361	F270-A364 HydrophobicContact CE2-CB 4.22Å; F270-A364 HydrophobicContact CZ-CB 3.97Å; A271-A364 CarbonylContact O-C 3.52Å; A271-A364 WeakPolarHBondContact O-CA 3.34Å; R318-A364 HydrophobicContact CB-CB 4.47Å; R318-A364 PolarHBondContact N-O 3.36Å; R318-A364 PolarHBondContact O-N 3.05Å; P358-A364 HydrophobicContact CG-CB 3.52Å; L361-A364 HydrophobicContact CD1-CB 4.4Å
365	A	92.8	Very high	90.2	Very high	0 Å²	0	31.6 Å²	31.6	0%	0	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.8	134.7	172.7	0	0	0	0	0	109.5	A271 L289 M293 V316 F317	A271-A365 PolarHBondContact N-O 3.14Å; A271-A365 PolarHBondContact O-N 3.06Å; A271-A365 VanDerWaalsContact O-O 3.08Å; L289-A365 HydrophobicContact CB-CB 4.19Å; M293-A365 HydrophobicContact CG-CB 3.96Å; M293-A365 HydrophobicContact SD-CB 3.29Å; M293-A365 WeakPolarHBondContact SD-CB 3.44Å; V316-A365 CarbonylContact O-C 3.5Å; V316-A365 WeakPolarHBondContact O-CA 3.38Å; F317-A365 HydrophobicContact CD1-CB 3.66Å; F317-A365 HydrophobicContact CE1-CB 3.75Å; F317-A365 HydrophobicContact CG-CB 4.2Å; F317-A365 HydrophobicContact CZ-CB 4.35Å
366	T	93.6	Very high	90.6	Very high	0 Å²	0	29.8 Å²	29.8	0%	0	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	129	177.2	-53.4	0	0	0	0	108.4	G235 V236 A315 V316	G235-T366 VanDerWaalsContact CA-OG1 3.24Å; G235-T366 WeakPolarHBondContact CA-OG1 3.44Å; V236-T366 HydrophobicContact CG2-CG2 4.04Å; A315-T366 CarbonylContact C-O 3.53Å; A315-T366 WeakPolarHBondContact CA-O 3.49Å; V316-T366 PolarHBondContact N-O 3.42Å; V316-T366 PolarHBondContact O-N 3.17Å
367	F	94	Very high	90.9	Very high	0 Å²	0	28.5 Å²	28.5	0%	0	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104	136.2	-179.3	178	-95.3	0	0	0	109.2	P268 G269 M293 F294 M299 Y310 V313	P268-F367 CarbonylContact C-O 3.55Å; P268-F367 WeakPolarHBondContact CA-O 3.45Å; G269-F367 PolarHBondContact N-O 2.86Å; G269-F367 PolarHBondContact O-N 3.3Å; M293-F367 HydrophobicContact CB-CB 4.2Å; M293-F367 HydrophobicContact CB-CD2 4.32Å; M293-F367 HydrophobicContact CE-CD2 4.08Å; M293-F367 HydrophobicContact CG-CB 4.24Å; F294-F367 HydrophobicContact CD1-CE2 4.07Å; F294-F367 AromaticContact CE1-CE2 3.67Å; F294-F367 HydrophobicContact CE1-CE2 3.67Å; F294-F367 HydrophobicContact CE1-CZ 4.29Å; F294-F367 AromaticContact CZ-CE2 3.92Å; F294-F367 HydrophobicContact CZ-CE2 3.92Å; M299-F367 HydrophobicContact CE-CD1 3.71Å; M299-F367 HydrophobicContact CE-CE1 3.47Å; M299-F367 VanDerWaalsContact CE-CE1 3.47Å; M299-F367 HydrophobicContact CE-CG 4.47Å; M299-F367 HydrophobicContact CE-CZ 4.06Å; M299-F367 HydrophobicContact SD-CD1 3.76Å; M299-F367 HydrophobicContact SD-CE1 3.81Å; Y310-F367 HydrophobicContact CD1-CZ 4.29Å; Y310-F367 HydrophobicContact CE1-CE1 4.05Å; Y310-F367 AromaticContact CE1-CZ 3.52Å; Y310-F367 HydrophobicContact CE1-CZ 3.52Å; Y310-F367 AromaticContact CZ-CZ 3.75Å; V313-F367 HydrophobicContact CB-CE2 4.41Å; V313-F367 HydrophobicContact CG1-CD2 3.97Å; V313-F367 HydrophobicContact CG1-CE2 3.33Å; V313-F367 HydrophobicContact CG1-CZ 4.03Å; V313-F367 HydrophobicContact CG2-CE2 4.22Å; V313-F367 HydrophobicContact CG2-CZ 4.19Å
368	I	94.3	Very high	91.2	Very high	1 Å²	1	26.3 Å²	26.3	1%	0.005	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.5	106.4	171.9	-50.7	169.2	0	0	0	105.8	Y200 V236 M257 F266 V313 A314	Y200-I368 HydrophobicContact CD1-CG2 4.44Å; Y200-I368 HydrophobicContact CE1-CD1 4.12Å; Y200-I368 HydrophobicContact CE1-CG1 4.27Å; Y200-I368 HydrophobicContact CE1-CG2 3.77Å; V236-I368 HydrophobicContact CB-CD1 4.35Å; V236-I368 HydrophobicContact CG1-CD1 4.07Å; V236-I368 HydrophobicContact CG2-CD1 3.89Å; V236-I368 HydrophobicContact CG2-CG1 4Å; M257-I368 HydrophobicContact CE-CB 4.33Å; M257-I368 HydrophobicContact CE-CG2 3.92Å; M257-I368 VanDerWaalsContact CE-O 3.26Å; M257-I368 WeakPolarHBondContact CE-O 3.45Å; F266-I368 HydrophobicContact CB-CG2 3.82Å; F266-I368 HydrophobicContact CD1-CG2 4.49Å; F266-I368 HydrophobicContact CD2-CG2 3.9Å; F266-I368 HydrophobicContact CG-CG2 3.82Å; V313-I368 WeakPolarHBondContact CA-O 3.5Å; A314-I368 HydrophobicContact CB-CB 4.25Å; A314-I368 HydrophobicContact CB-CD1 4.45Å; A314-I368 PolarHBondContact N-O 3.27Å; A314-I368 PolarHBondContact O-N 3.03Å
369	G	94	Very high	91.5	Very high	0 Å²	0	29.9 Å²	29.9	0%	0	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	128.8	178.4	0	0	0	0	0	111.2	F266 M267	F266-G369 WeakPolarHBondContact CA-O 3.37Å; M267-G369 PolarHBondContact N-O 2.67Å; M267-G369 PolarHBondContact O-N 3.01Å
370	N	95.4	Very high	92.2	Very high	0 Å²	0	24 Å²	24	0%	0	13%	0.126	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.2	101.1	159	-166.4	-12.4	0	0	0	107.3	M257 L263 F266 L311 T312	M257-N370 HydrophobicContact CE-CB 4.48Å; M257-N370 PolarHBondContact O-ND2 3Å; L263-N370 PolarHBondContact O-ND2 3.42Å; F266-N370 HydrophobicContact CD1-CB 3.87Å; F266-N370 HydrophobicContact CE1-CB 3.97Å; L311-N370 HydrophobicContact CB-CB 4.43Å; L311-N370 PolarHBondContact N-O 3.4Å; T312-N370 PolarHBondContact N-O 2.94Å; T312-N370 PolarHBondContact O-N 3.1Å; T312-N370 WeakPolarHBondContact OG1-CB 3.28Å
371	S	95.1	Very high	92.7	Very high	0 Å²	0	21 Å²	21	0%	0	9%	0.094	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	142	-175.1	-176.5	0	0	0	0	110.5	R309 A373 I374	R309-S371 WeakPolarHBondContact O-CA 3.35Å; R309-S371 PolarHBondContact O-OG 3.3Å; S371-A373 PolarHBondContact O-N 3.23Å; S371-A373 WeakPolarHBondContact OG-CB 3.44Å; S371-A373 PolarHBondContact OG-N 3.48Å; S371-I374 WeakPolarHBondContact O-CB 3.42Å; S371-I374 VanDerWaalsContact O-CG2 3.23Å; S371-I374 WeakPolarHBondContact O-CG2 3.41Å; S371-I374 PolarHBondContact O-N 3.49Å
372	T	95.3	Very high	93.1	Very high	0 Å²	0	19.8 Å²	19.8	0%	0	9%	0.088	C	C	.	.	G	3₁₀ helix	trans	-64.8	-17.4	172.4	66	0	0	0	0	112.7	G308 R309 L311 I374 Q375 Y422 Q426	G308-T372 VanDerWaalsContact CA-OG1 3.31Å; G308-T372 WeakPolarHBondContact CA-OG1 3.27Å; R309-T372 PolarHBondContact N-OG1 3Å; R309-T372 PolarHBondContact O-N 3.18Å; R309-T372 PolarHBondContact O-OG1 3.31Å; L311-T372 HydrophobicContact CD2-CG2 4.26Å; L311-T372 HydrophobicContact CG-CG2 4.27Å; T372-I374 PolarHBondContact O-N 2.99Å; T372-Q375 WeakPolarHBondContact O-CB 3.43Å; T372-Q375 WeakPolarHBondContact O-CG 3.36Å; T372-Q375 PolarHBondContact O-N 3.12Å; T372-Q375 PolarHBondContact O-NE2 3.41Å; T372-Y422 HydrophobicContact CG2-CD1 4.36Å; T372-Q426 HydrophobicContact CG2-CB 3.98Å; T372-Q426 PolarHBondContact OG1-OE1 3.42Å
373	A	94.8	Very high	93.4	Very high	1 Å²	1	18.1 Å²	18.1	1%	0.008	8%	0.083	C	C	.	.	G	3₁₀ helix	trans	-62.5	-19.9	175.4	0	0	0	0	0	113.2	M267 C303 D304 S371 Q375 E376	M267-A373 HydrophobicContact SD-CB 4.46Å; C303-A373 HydrophobicContact CB-CB 4.36Å; C303-A373 WeakPolarHBondContact CB-O 3.42Å; D304-A373 WeakPolarHBondContact O-CB 3.33Å; S371-A373 PolarHBondContact O-N 3.23Å; S371-A373 WeakPolarHBondContact OG-CB 3.44Å; S371-A373 PolarHBondContact OG-N 3.48Å; A373-Q375 PolarHBondContact O-N 2.83Å; A373-E376 WeakPolarHBondContact O-CB 3.38Å; A373-E376 PolarHBondContact O-N 3.06Å
374	I	94.8	Very high	93.5	Very high	0 Å²	0	19.6 Å²	19.6	0%	0	9%	0.09	C	C	.	.	G	3₁₀ helix	trans	-58.9	-19.9	176.6	-160	55.2	0	0	0	112.7	C201 F265 M267 A301 S371 T372 E376 L377 F378 Y422	C201-I374 HydrophobicContact CB-CD1 4.16Å; F265-I374 HydrophobicContact CB-CG1 4.36Å; M267-I374 HydrophobicContact CG-CB 4.33Å; M267-I374 HydrophobicContact CG-CD1 3.62Å; M267-I374 HydrophobicContact CG-CG1 4.34Å; M267-I374 HydrophobicContact SD-CB 4.37Å; M267-I374 HydrophobicContact SD-CD1 4.33Å; A301-I374 HydrophobicContact CB-CD1 4.14Å; S371-I374 WeakPolarHBondContact O-CB 3.42Å; S371-I374 VanDerWaalsContact O-CG2 3.23Å; S371-I374 WeakPolarHBondContact O-CG2 3.41Å; S371-I374 PolarHBondContact O-N 3.49Å; T372-I374 PolarHBondContact O-N 2.99Å; I374-E376 PolarHBondContact O-N 3.45Å; I374-E376 VanDerWaalsContact O-N 3.17Å; I374-L377 HydrophobicContact CD1-CB 4.19Å; I374-L377 HydrophobicContact CD1-CD1 4.23Å; I374-L377 WeakPolarHBondContact O-CB 3.01Å; I374-L377 PolarHBondContact O-N 3.01Å; I374-F378 HydrophobicContact CG1-CE2 4.03Å; I374-F378 HydrophobicContact CG2-CD2 4.49Å; I374-F378 HydrophobicContact CG2-CE2 4.08Å; I374-F378 WeakPolarHBondContact O-CD2 3.13Å; I374-F378 PolarHBondContact O-N 2.99Å; I374-Y422 HydrophobicContact CG2-CD1 4.08Å; I374-Y422 HydrophobicContact CG2-CD2 4.03Å; I374-Y422 HydrophobicContact CG2-CE1 3.63Å; I374-Y422 HydrophobicContact CG2-CE2 3.59Å; I374-Y422 HydrophobicContact CG2-CG 4.26Å
375	Q	93.4	Very high	93.6	Very high	8 Å²	8	19.6 Å²	19.6	4%	0.037	9%	0.09	C	C	.	.	H	α-helix	trans	-56.2	-28.1	172.8	73.6	173.3	-65.4	0	0	113.3	T372 A373 L377 F378 K379 V419	T372-Q375 WeakPolarHBondContact O-CB 3.43Å; T372-Q375 WeakPolarHBondContact O-CG 3.36Å; T372-Q375 PolarHBondContact O-N 3.12Å; T372-Q375 PolarHBondContact O-NE2 3.41Å; A373-Q375 PolarHBondContact O-N 2.83Å; Q375-L377 VanDerWaalsContact C-N 3.27Å; Q375-L377 PolarHBondContact O-N 3.3Å; Q375-F378 PolarHBondContact O-N 3.48Å; Q375-K379 WeakPolarHBondContact O-CB 3.49Å; Q375-K379 VanDerWaalsContact O-CG 3.28Å; Q375-K379 WeakPolarHBondContact O-CG 3.46Å; Q375-K379 PolarHBondContact O-N 2.93Å; Q375-K379 VanDerWaalsContact OE1-CE 3.29Å; Q375-V419 HydrophobicContact CB-CG1 4.43Å
376	E	92.4	Very high	93.6	Very high	65 Å²	65	20.7 Å²	20.7	30%	0.304	10%	0.098	S	C	.	.	H	α-helix	trans	-62.1	-38.4	176.9	-67	-173.6	153.7	0	0	111.3	C303 D304 H307 A373 I374 R380	C303-E376 WeakPolarHBondContact CA-OE2 3.42Å; C303-E376 HydrophobicContact CB-CB 4.28Å; D304-E376 PolarHBondContact N-OE2 3.46Å; D304-E376 VanDerWaalsContact N-OE2 3.11Å; H307-E376 IonicContact CE1-OE1 3.83Å; H307-E376 IonicContact CG-OE1 2.7Å; H307-E376 IonicContact ND1-OE1 3.99Å; H307-E376 PolarHBondContact ND1-OE1 3.17Å; A373-E376 WeakPolarHBondContact O-CB 3.38Å; A373-E376 PolarHBondContact O-N 3.06Å; I374-E376 PolarHBondContact O-N 3.45Å; I374-E376 VanDerWaalsContact O-N 3.17Å; E376-R380 WeakPolarHBondContact O-CB 3.09Å; E376-R380 PolarHBondContact O-N 3.25Å
377	L	92.3	Very high	93.6	Very high	1 Å²	1	22.7 Å²	22.7	1%	0.005	11%	0.114	C	C	.	.	H	α-helix	trans	-64.6	-45.9	177	-173.7	145.9	0	0	0	110.9	M170 D203 A301 I374 Q375 R380 I381	M170-L377 HydrophobicContact CB-CD1 4.36Å; M170-L377 HydrophobicContact CE-CD2 3.99Å; M170-L377 HydrophobicContact CG-CD1 3.94Å; M170-L377 HydrophobicContact CG-CD2 3.94Å; M170-L377 HydrophobicContact CG-CG 4.48Å; M170-L377 HydrophobicContact SD-CD2 3.9Å; D203-L377 HydrophobicContact CB-CD1 4.18Å; A301-L377 HydrophobicContact CB-CD1 4.37Å; I374-L377 HydrophobicContact CD1-CB 4.19Å; I374-L377 HydrophobicContact CD1-CD1 4.23Å; I374-L377 WeakPolarHBondContact O-CB 3.01Å; I374-L377 PolarHBondContact O-N 3.01Å; Q375-L377 VanDerWaalsContact C-N 3.27Å; Q375-L377 PolarHBondContact O-N 3.3Å; L377-R380 PolarHBondContact O-N 3.43Å; L377-I381 HydrophobicContact CD2-CD1 3.78Å; L377-I381 WeakPolarHBondContact O-CG1 3.39Å; L377-I381 PolarHBondContact O-N 3.03Å
378	F	94.1	Very high	93.6	Very high	0 Å²	0	24 Å²	24	0%	0	12%	0.121	C	C	.	.	H	α-helix	trans	-68.8	-40.2	178.8	-64.6	-55.9	0	0	0	112.3	V189 F265 I374 Q375 R380 I381 S382 M415 L418 V419 Y422	V189-F378 HydrophobicContact CG1-CD1 4.27Å; V189-F378 HydrophobicContact CG1-CE1 3.8Å; V189-F378 HydrophobicContact CG2-CE1 4.08Å; F265-F378 HydrophobicContact CB-CE2 4.31Å; F265-F378 HydrophobicContact CB-CZ 4.12Å; F265-F378 AromaticContact CD1-CZ 3.73Å; F265-F378 HydrophobicContact CD1-CZ 3.73Å; F265-F378 HydrophobicContact CD2-CE2 4.21Å; F265-F378 AromaticContact CD2-CZ 3.88Å; F265-F378 HydrophobicContact CD2-CZ 3.88Å; F265-F378 HydrophobicContact CE1-CZ 4.08Å; F265-F378 HydrophobicContact CE2-CZ 4.23Å; F265-F378 HydrophobicContact CG-CE2 4.15Å; F265-F378 AromaticContact CG-CZ 3.62Å; F265-F378 HydrophobicContact CG-CZ 3.62Å; F265-F378 HydrophobicContact CZ-CZ 4.33Å; I374-F378 HydrophobicContact CG1-CE2 4.03Å; I374-F378 HydrophobicContact CG2-CD2 4.49Å; I374-F378 HydrophobicContact CG2-CE2 4.08Å; I374-F378 WeakPolarHBondContact O-CD2 3.13Å; I374-F378 PolarHBondContact O-N 2.99Å; Q375-F378 PolarHBondContact O-N 3.48Å; F378-R380 VanDerWaalsContact C-N 3.33Å; F378-R380 PolarHBondContact O-N 3.07Å; F378-I381 PolarHBondContact O-N 2.8Å; F378-S382 VanDerWaalsContact O-CB 3.28Å; F378-S382 WeakPolarHBondContact O-CB 3.22Å; F378-S382 PolarHBondContact O-N 3.11Å; F378-M415 HydrophobicContact CB-SD 3.89Å; F378-M415 HydrophobicContact CD1-CE 4.4Å; F378-M415 HydrophobicContact CD1-SD 3.44Å; F378-M415 WeakPolarHBondContact CD1-SD 3.38Å; F378-M415 HydrophobicContact CE1-SD 4.26Å; F378-M415 HydrophobicContact CG-SD 3.93Å; F378-L418 HydrophobicContact CD2-CD2 4.1Å; F378-L418 HydrophobicContact CE1-CD2 4.29Å; F378-L418 HydrophobicContact CE2-CD2 3.81Å; F378-L418 HydrophobicContact CG-CD2 4.47Å; F378-L418 HydrophobicContact CZ-CD2 3.91Å; F378-V419 HydrophobicContact CB-CG2 3.56Å; F378-Y422 HydrophobicContact CD2-CE2 4.46Å; F378-Y422 HydrophobicContact CE2-CE2 4.03Å
379	K	93.3	Very high	93.5	Very high	84 Å²	84	25.5 Å²	25.5	37%	0.365	13%	0.127	S	C	.	.	H	α-helix	trans	-57.8	-44.9	172.9	-77.9	173.5	172.5	170	0	111.3	Q375 I381 S382 E383 V419	Q375-K379 WeakPolarHBondContact O-CB 3.49Å; Q375-K379 VanDerWaalsContact O-CG 3.28Å; Q375-K379 WeakPolarHBondContact O-CG 3.46Å; Q375-K379 PolarHBondContact O-N 2.93Å; Q375-K379 VanDerWaalsContact OE1-CE 3.29Å; K379-I381 PolarHBondContact O-N 3.02Å; K379-S382 PolarHBondContact O-N 3.04Å; K379-E383 WeakPolarHBondContact O-CB 3.43Å; K379-E383 WeakPolarHBondContact O-CG 3.31Å; K379-E383 PolarHBondContact O-N 3.31Å; K379-V419 HydrophobicContact CD-CG1 4.22Å; K379-V419 VanDerWaalsContact CE-CG1 3.41Å; K379-V419 HydrophobicContact CG-CG1 3.85Å; K379-V419 HydrophobicContact CG-CG2 4.33Å
380	R	91.8	Very high	93.5	Very high	41 Å²	41	34.9 Å²	34.9	16%	0.155	16%	0.163	C	C	.	.	H	α-helix	trans	-59.8	-45.3	177.1	-174.7	-174.2	66.2	-157.8	-12.2	112.2	D203 E205 E376 L377 F378 Q384	D203-R380 IonicContact OD1-NH1 3.8Å; D203-R380 IonicContact OD1-NH2 3.59Å; D203-R380 PolarHBondContact OD1-NH2 3.37Å; D203-R380 IonicContact OD2-CZ 3.36Å; D203-R380 VanDerWaalsContact OD2-CZ 3.26Å; D203-R380 IonicContact OD2-NH1 3.92Å; D203-R380 PolarHBondContact OD2-NH1 3.04Å; D203-R380 IonicContact OD2-NH2 2.98Å; D203-R380 PolarHBondContact OD2-NH2 2.83Å; E205-R380 IonicContact OE2-CZ 3.99Å; E205-R380 IonicContact OE2-NH1 2.9Å; E205-R380 PolarHBondContact OE2-NH1 3.39Å; E376-R380 WeakPolarHBondContact O-CB 3.09Å; E376-R380 PolarHBondContact O-N 3.25Å; L377-R380 PolarHBondContact O-N 3.43Å; F378-R380 VanDerWaalsContact C-N 3.33Å; F378-R380 PolarHBondContact O-N 3.07Å; R380-Q384 WeakPolarHBondContact O-CG 3.46Å; R380-Q384 PolarHBondContact O-N 3.39Å
381	I	91.8	Very high	93.5	Very high	1 Å²	1	44.9 Å²	44.9	1%	0.005	20%	0.2	C	C	.	.	H	α-helix	trans	-67	-44.3	178.1	-64.7	172.6	0	0	0	110.2	M170 A185 L377 F378 K379 Q384 F385	M170-I381 HydrophobicContact SD-CD1 4.28Å; A185-I381 HydrophobicContact CB-CD1 4.39Å; A185-I381 HydrophobicContact CB-CG2 4.02Å; L377-I381 HydrophobicContact CD2-CD1 3.78Å; L377-I381 WeakPolarHBondContact O-CG1 3.39Å; L377-I381 PolarHBondContact O-N 3.03Å; F378-I381 PolarHBondContact O-N 2.8Å; K379-I381 PolarHBondContact O-N 3.02Å; I381-Q384 PolarHBondContact O-N 3.06Å; I381-F385 WeakPolarHBondContact O-CB 3.37Å; I381-F385 PolarHBondContact O-N 3.27Å
382	S	93.4	Very high	93.3	Very high	11 Å²	11	50.3 Å²	50.3	8%	0.077	22%	0.224	C	C	.	.	H	α-helix	trans	-59.9	-46.9	178.4	-175.1	0	0	0	0	111.7	F378 K379 Q384 F385 S386 N416	F378-S382 VanDerWaalsContact O-CB 3.28Å; F378-S382 WeakPolarHBondContact O-CB 3.22Å; F378-S382 PolarHBondContact O-N 3.11Å; K379-S382 PolarHBondContact O-N 3.04Å; S382-Q384 VanDerWaalsContact C-N 3.33Å; S382-Q384 PolarHBondContact O-N 3.28Å; S382-F385 WeakPolarHBondContact O-CB 3.38Å; S382-F385 PolarHBondContact O-N 3.25Å; S382-S386 PolarHBondContact O-N 3.35Å; S382-S386 PolarHBondContact O-OG 3.48Å; S382-N416 PolarHBondContact OG-OD1 2.53Å
383	E	92.9	Very high	93.2	Very high	140 Å²	140	51.7 Å²	51.7	65%	0.654	24%	0.236	S	C	*	.	H	α-helix	trans	-59.2	-42.4	177.7	-76.4	178	-173.8	0	0	112.9	K379 A387	K379-E383 WeakPolarHBondContact O-CB 3.43Å; K379-E383 WeakPolarHBondContact O-CG 3.31Å; K379-E383 PolarHBondContact O-N 3.31Å; E383-A387 WeakPolarHBondContact O-CB 3.42Å; E383-A387 PolarHBondContact O-N 3.08Å
384	Q	91.5	Very high	93.1	Very high	58 Å²	58	55.4 Å²	55.4	27%	0.271	25%	0.251	S	S	.	.	H	α-helix	trans	-67.7	-42.6	177	-68.7	175.3	5.7	0	0	111.4	P182 R380 I381 S382 A387 M388	P182-Q384 HydrophobicContact CB-CB 3.92Å; P182-Q384 HydrophobicContact CG-CB 3.7Å; R380-Q384 WeakPolarHBondContact O-CG 3.46Å; R380-Q384 PolarHBondContact O-N 3.39Å; I381-Q384 PolarHBondContact O-N 3.06Å; S382-Q384 VanDerWaalsContact C-N 3.33Å; S382-Q384 PolarHBondContact O-N 3.28Å; Q384-A387 PolarHBondContact O-N 2.7Å; Q384-M388 PolarHBondContact O-N 3.21Å
385	F	94.1	Very high	93	Very high	0 Å²	0	55.7 Å²	55.7	0%	0	25%	0.253	C	S	.	.	H	α-helix	trans	-58	-54.6	174	176.8	-81.5	0	0	0	111	P182 Y183 T186 I381 S382 A387 M388 F389 F408 E412	P182-F385 HydrophobicContact CB-CB 4.32Å; Y183-F385 AromaticContact CD1-CD2 3.56Å; Y183-F385 HydrophobicContact CD1-CD2 3.56Å; Y183-F385 AromaticContact CD1-CE2 3.4Å; Y183-F385 HydrophobicContact CD1-CE2 3.4Å; Y183-F385 HydrophobicContact CD1-CZ 4.19Å; Y183-F385 HydrophobicContact CE1-CD2 4.04Å; Y183-F385 AromaticContact CE1-CE2 3.86Å; Y183-F385 HydrophobicContact CE1-CE2 3.86Å; Y183-F385 HydrophobicContact CE1-CZ 4.25Å; T186-F385 VanDerWaalsContact CB-CD2 3.49Å; T186-F385 HydrophobicContact CG2-CD2 3.81Å; T186-F385 HydrophobicContact CG2-CE2 3.76Å; T186-F385 HydrophobicContact CG2-CG 4.26Å; T186-F385 HydrophobicContact CG2-CZ 4.26Å; T186-F385 VanDerWaalsContact OG1-CD2 3.31Å; T186-F385 WeakPolarHBondContact OG1-CD2 3.44Å; I381-F385 WeakPolarHBondContact O-CB 3.37Å; I381-F385 PolarHBondContact O-N 3.27Å; S382-F385 WeakPolarHBondContact O-CB 3.38Å; S382-F385 PolarHBondContact O-N 3.25Å; F385-A387 VanDerWaalsContact C-N 3.25Å; F385-A387 PolarHBondContact O-N 3.06Å; F385-M388 PolarHBondContact O-N 3.4Å; F385-F389 HydrophobicContact CD1-CB 4.22Å; F385-F389 HydrophobicContact CE1-CB 3.88Å; F385-F389 HydrophobicContact CE1-CD1 4.08Å; F385-F389 AromaticContact CE1-CG 3.99Å; F385-F389 HydrophobicContact CE1-CG 3.99Å; F385-F389 HydrophobicContact CZ-CB 4.43Å; F385-F389 HydrophobicContact CZ-CG 4.32Å; F385-F389 WeakPolarHBondContact O-CB 3.35Å; F385-F389 PolarHBondContact O-N 3.08Å; F385-F408 AromaticContact CE2-CD1 3.92Å; F385-F408 HydrophobicContact CE2-CD1 3.92Å; F385-F408 HydrophobicContact CZ-CB 4.07Å; F385-F408 AromaticContact CZ-CD1 3.94Å; F385-F408 HydrophobicContact CZ-CD1 3.94Å; F385-F408 WeakPolarHBondContact CZ-O 3.46Å; F385-E412 HydrophobicContact CD1-CB 4.17Å; F385-E412 HydrophobicContact CD1-CG 3.97Å; F385-E412 HydrophobicContact CE1-CB 3.58Å; F385-E412 HydrophobicContact CE1-CG 3.8Å; F385-E412 HydrophobicContact CZ-CB 4.16Å
386	S	94.3	Very high	92.9	Very high	24 Å²	24	61.1 Å²	61.1	17%	0.168	28%	0.278	C	S	.	.	H	α-helix	trans	-62.8	-32.6	-178.3	-51.3	0	0	0	0	111.9	S382 R390 E412	S382-S386 PolarHBondContact O-N 3.35Å; S382-S386 PolarHBondContact O-OG 3.48Å; S386-R390 VanDerWaalsContact O-CB 3.3Å; S386-R390 WeakPolarHBondContact O-CB 3.47Å; S386-R390 WeakPolarHBondContact O-CG 3.26Å; S386-R390 PolarHBondContact O-N 3.35Å; S386-R390 VanDerWaalsContact O-N 3.13Å; S386-R390 PolarHBondContact O-NE 2.87Å; S386-E412 WeakPolarHBondContact CB-OE1 3.39Å; S386-E412 PolarHBondContact OG-OE1 3.32Å
387	A	93	Very high	92.9	Very high	41 Å²	41	63.3 Å²	63.3	34%	0.339	28%	0.284	S	S	.	.	H	α-helix	trans	-64.8	-38.8	175.1	0	0	0	0	0	112.4	E383 Q384 F385	E383-A387 WeakPolarHBondContact O-CB 3.42Å; E383-A387 PolarHBondContact O-N 3.08Å; Q384-A387 PolarHBondContact O-N 2.7Å; F385-A387 VanDerWaalsContact C-N 3.25Å; F385-A387 PolarHBondContact O-N 3.06Å
388	M	92.9	Very high	93	Very high	29 Å²	29	63.3 Å²	63.3	14%	0.143	28%	0.284	C	S	.	.	H	α-helix	trans	-77.3	-45.5	176.1	-66.9	-159.4	-64.4	0	0	112.4	V179 P182 Y183 Q384 F385 R390 R391 K392 A393	V179-M388 VanDerWaalsContact O-CE 3.27Å; V179-M388 WeakPolarHBondContact O-CE 3.33Å; P182-M388 HydrophobicContact CB-CE 3.71Å; P182-M388 HydrophobicContact CG-CE 3.69Å; Y183-M388 HydrophobicContact CD2-CE 3.64Å; Y183-M388 HydrophobicContact CE2-CB 3.94Å; Y183-M388 HydrophobicContact CE2-CE 3.72Å; Y183-M388 HydrophobicContact CE2-SD 4.18Å; Y183-M388 HydrophobicContact CG-CE 4.12Å; Y183-M388 WeakPolarHBondContact OH-CB 3.36Å; Y183-M388 PolarHBondContact OH-O 3.21Å; Q384-M388 PolarHBondContact O-N 3.21Å; F385-M388 PolarHBondContact O-N 3.4Å; M388-R390 PolarHBondContact O-N 2.52Å; M388-R391 CarbonylContact O-C 3.51Å; M388-R391 WeakPolarHBondContact O-CA 3.35Å; M388-R391 PolarHBondContact O-N 3.14Å; M388-K392 PolarHBondContact O-N 3.4Å; M388-K392 VanDerWaalsContact O-N 3.15Å; M388-A393 PolarHBondContact O-N 3.03Å
389	F	93.9	Very high	92.9	Very high	31 Å²	31	66 Å²	66	14%	0.136	30%	0.3	C	S	.	.	H	α-helix	trans	-64.3	-39.2	-175.5	-168.9	-123	0	0	0	112.4	Y183 F385 R391 K392 L395 F408	Y183-F389 HydrophobicContact CE1-CB 4.04Å; Y183-F389 HydrophobicContact CE1-CD2 4.11Å; Y183-F389 HydrophobicContact CE1-CG 4.49Å; Y183-F389 WeakPolarHBondContact OH-CA 3.24Å; Y183-F389 PolarHBondContact OH-N 2.78Å; Y183-F389 VanDerWaalsContact OH-N 3.08Å; F385-F389 HydrophobicContact CD1-CB 4.22Å; F385-F389 HydrophobicContact CE1-CB 3.88Å; F385-F389 HydrophobicContact CE1-CD1 4.08Å; F385-F389 AromaticContact CE1-CG 3.99Å; F385-F389 HydrophobicContact CE1-CG 3.99Å; F385-F389 HydrophobicContact CZ-CB 4.43Å; F385-F389 HydrophobicContact CZ-CG 4.32Å; F385-F389 WeakPolarHBondContact O-CB 3.35Å; F385-F389 PolarHBondContact O-N 3.08Å; F389-R391 PolarHBondContact O-N 2.87Å; F389-R391 VanDerWaalsContact O-N 3.11Å; F389-K392 PolarHBondContact O-N 2.82Å; F389-L395 HydrophobicContact CD2-CD1 4.4Å; F389-L395 HydrophobicContact CE2-CD1 4.13Å; F389-L395 HydrophobicContact CE2-CD2 4.24Å; F389-F408 HydrophobicContact CD2-CB 4.2Å; F389-F408 HydrophobicContact CD2-CG 4.49Å; F389-F408 HydrophobicContact CE2-CB 3.56Å; F389-F408 HydrophobicContact CE2-CD1 4.48Å; F389-F408 HydrophobicContact CE2-CG 4.02Å; F389-F408 HydrophobicContact CZ-CB 3.75Å
390	R	93.6	Very high	92.9	Very high	198 Å²	198	64.9 Å²	64.9	75%	0.747	31%	0.312	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.6	-27.6	172.1	-77.8	-177.5	-69.9	175.3	-7.3	113.9	S386 M388	S386-R390 VanDerWaalsContact O-CB 3.3Å; S386-R390 WeakPolarHBondContact O-CB 3.47Å; S386-R390 WeakPolarHBondContact O-CG 3.26Å; S386-R390 PolarHBondContact O-N 3.35Å; S386-R390 VanDerWaalsContact O-N 3.13Å; S386-R390 PolarHBondContact O-NE 2.87Å; M388-R390 PolarHBondContact O-N 2.52Å
391	R	94.3	Very high	92.9	Very high	209 Å²	209	65.4 Å²	65.4	79%	0.789	32%	0.317	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.3	-3.1	177.6	-62.7	177.8	-177.5	173.4	2.8	112.8	M388 F389 A393	M388-R391 CarbonylContact O-C 3.51Å; M388-R391 WeakPolarHBondContact O-CA 3.35Å; M388-R391 PolarHBondContact O-N 3.14Å; F389-R391 PolarHBondContact O-N 2.87Å; F389-R391 VanDerWaalsContact O-N 3.11Å; R391-A393 PolarHBondContact O-N 3.26Å; R391-A393 VanDerWaalsContact O-N 3.14Å
392	K	92.4	Very high	92.8	Very high	114 Å²	114	68.6 Å²	68.6	50%	0.496	35%	0.35	S	S	.	.	T	Hydrogen-bonded Turn	trans	49	34.2	-171.4	-58.5	-168.2	166.9	-149.5	0	112.8	M388 F389 L395 E405	M388-K392 PolarHBondContact O-N 3.4Å; M388-K392 VanDerWaalsContact O-N 3.15Å; F389-K392 PolarHBondContact O-N 2.82Å; K392-L395 HydrophobicContact CB-CD2 4.12Å; K392-L395 HydrophobicContact CD-CD2 4.32Å; K392-L395 HydrophobicContact CG-CD2 4.18Å; K392-E405 IonicContact NZ-OE1 2.83Å; K392-E405 PolarHBondContact NZ-OE1 2.94Å; K392-E405 IonicContact NZ-OE2 2.66Å; K392-E405 PolarHBondContact NZ-OE2 2.83Å
393	A	91.4	Very high	92.8	Very high	30 Å²	30	68.3 Å²	68.3	25%	0.248	35%	0.347	C	S	.	.	T	Hydrogen-bonded Turn	trans	-69.3	133.7	-177.8	0	0	0	0	0	110	Y183 M388 R391 L395	Y183-A393 VanDerWaalsContact CE2-O 3.32Å; Y183-A393 WeakPolarHBondContact CE2-O 3.35Å; Y183-A393 PolarHBondContact OH-O 2.81Å; M388-A393 PolarHBondContact O-N 3.03Å; R391-A393 PolarHBondContact O-N 3.26Å; R391-A393 VanDerWaalsContact O-N 3.14Å; A393-L395 PolarHBondContact O-N 3.31Å
394	F	92.9	Very high	92.8	Very high	78 Å²	78	66 Å²	66	34%	0.342	34%	0.34	S	S	.	.	T	Hydrogen-bonded Turn	trans	58.2	5.9	178.8	-53.9	-76.6	0	0	0	116.6	V179 V180 H396 W397	V179-F394 HydrophobicContact CG2-CD2 4.04Å; V179-F394 HydrophobicContact CG2-CE2 3.51Å; V179-F394 HydrophobicContact CG2-CZ 3.91Å; V180-F394 HydrophobicContact CG1-CB 3.77Å; V180-F394 HydrophobicContact CG1-CD2 4.13Å; V180-F394 HydrophobicContact CG1-CG 3.94Å; F394-H396 VanDerWaalsContact C-N 3.25Å; F394-H396 PolarHBondContact O-N 3.31Å; F394-W397 HydrophobicContact CD1-CD2 4.49Å; F394-W397 HydrophobicContact CD1-CH2 4.32Å; F394-W397 HydrophobicContact CD1-CZ2 4.11Å; F394-W397 HydrophobicContact CE1-CZ2 4.45Å; F394-W397 WeakPolarHBondContact O-CB 3.28Å; F394-W397 PolarHBondContact O-N 3.09Å
395	L	92.5	Very high	92.8	Very high	6 Å²	6	66.7 Å²	66.7	3%	0.031	34%	0.343	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59.9	-34.8	-176.5	-167.8	61.4	0	0	0	113.1	F389 K392 A393 W397 F398 T399 E405 F408	F389-L395 HydrophobicContact CD2-CD1 4.4Å; F389-L395 HydrophobicContact CE2-CD1 4.13Å; F389-L395 HydrophobicContact CE2-CD2 4.24Å; K392-L395 HydrophobicContact CB-CD2 4.12Å; K392-L395 HydrophobicContact CD-CD2 4.32Å; K392-L395 HydrophobicContact CG-CD2 4.18Å; A393-L395 PolarHBondContact O-N 3.31Å; L395-W397 PolarHBondContact O-N 3.35Å; L395-W397 VanDerWaalsContact O-N 3.12Å; L395-F398 PolarHBondContact O-N 2.99Å; L395-T399 HydrophobicContact CG-CG2 4.16Å; L395-T399 PolarHBondContact O-N 3.27Å; L395-T399 PolarHBondContact O-OG1 2.87Å; L395-E405 HydrophobicContact CD2-CG 3.82Å; L395-E405 VanDerWaalsContact CD2-OE1 3.29Å; L395-E405 WeakPolarHBondContact CD2-OE1 3.38Å; L395-F408 HydrophobicContact CD1-CD1 4.28Å; L395-F408 HydrophobicContact CD1-CD2 3.85Å; L395-F408 HydrophobicContact CD1-CE1 4.12Å; L395-F408 HydrophobicContact CD1-CE2 3.66Å; L395-F408 HydrophobicContact CD1-CG 4.16Å; L395-F408 HydrophobicContact CD1-CZ 3.82Å
396	H	92	Very high	92.8	Very high	123 Å²	123	72.2 Å²	72.2	57%	0.569	37%	0.37	S	S	*	.	H	α-helix	trans	-59.1	-21	176.6	69.8	-72.2	0	0	0	114.6	F394 F398 T399 G400	F394-H396 VanDerWaalsContact C-N 3.25Å; F394-H396 PolarHBondContact O-N 3.31Å; H396-F398 VanDerWaalsContact C-N 3.31Å; H396-T399 WeakPolarHBondContact CA-OG1 3.31Å; H396-G400 PolarHBondContact O-N 3.45Å; H396-G400 VanDerWaalsContact O-N 3.08Å
397	W	92.1	Very high	92.8	Very high	111 Å²	111	73.4 Å²	73.4	42%	0.42	37%	0.373	S	S	.	.	H	α-helix	trans	-71.4	-30.4	174	-68.7	5.6	0	0	0	111.8	N100 F394 L395 E401	N100-W397 PolarHBondContact ND2-O 3.02Å; F394-W397 HydrophobicContact CD1-CD2 4.49Å; F394-W397 HydrophobicContact CD1-CH2 4.32Å; F394-W397 HydrophobicContact CD1-CZ2 4.11Å; F394-W397 HydrophobicContact CE1-CZ2 4.45Å; F394-W397 WeakPolarHBondContact O-CB 3.28Å; F394-W397 PolarHBondContact O-N 3.09Å; L395-W397 PolarHBondContact O-N 3.35Å; L395-W397 VanDerWaalsContact O-N 3.12Å; W397-E401 WeakPolarHBondContact O-CG 3.48Å
398	F	94.3	Very high	92.8	Very high	1 Å²	1	71.5 Å²	71.5	0%	0.004	36%	0.357	C	S	.	.	H	α-helix	trans	-89.4	-44.8	-179.7	-61.5	-98.2	0	0	0	110.8	N100 W101 A102 V180 Y183 N184 L187 L395 H396 G400 E401 M403 F408	N100-F398 WeakPolarHBondContact OD1-CD1 3.35Å; W101-F398 HydrophobicContact CB-CE1 4.05Å; A102-F398 HydrophobicContact CB-CB 4.26Å; A102-F398 HydrophobicContact CB-CD1 3.97Å; V180-F398 HydrophobicContact CB-CZ 4.49Å; Y183-F398 HydrophobicContact CD2-CE2 4.03Å; Y183-F398 HydrophobicContact CD2-CZ 4.33Å; Y183-F398 HydrophobicContact CG-CE2 4.35Å; Y183-F398 HydrophobicContact CG-CZ 4.34Å; N184-F398 WeakPolarHBondContact OD1-CE1 3.27Å; N184-F398 WeakPolarHBondContact OD1-CZ 3.19Å; L187-F398 HydrophobicContact CD1-CD1 4.41Å; L187-F398 HydrophobicContact CD1-CE1 4.38Å; L395-F398 PolarHBondContact O-N 2.99Å; H396-F398 VanDerWaalsContact C-N 3.31Å; F398-G400 PolarHBondContact O-N 3.03Å; F398-E401 PolarHBondContact O-N 2.89Å; F398-M403 HydrophobicContact CB-SD 4.15Å; F398-M403 HydrophobicContact CD1-SD 4.4Å; F398-M403 WeakPolarHBondContact O-CB 3.36Å; F398-M403 PolarHBondContact O-N 3.32Å; F398-F408 HydrophobicContact CB-CE2 3.88Å; F398-F408 HydrophobicContact CB-CZ 3.5Å; F398-F408 HydrophobicContact CD1-CE1 4.46Å; F398-F408 AromaticContact CD1-CZ 3.79Å; F398-F408 HydrophobicContact CD1-CZ 3.79Å; F398-F408 HydrophobicContact CD2-CZ 4.03Å; F398-F408 HydrophobicContact CE1-CZ 4.49Å; F398-F408 HydrophobicContact CG-CE1 4.37Å; F398-F408 HydrophobicContact CG-CE2 4.39Å; F398-F408 AromaticContact CG-CZ 3.52Å; F398-F408 HydrophobicContact CG-CZ 3.52Å
399	T	93.2	Very high	92.9	Very high	55 Å²	55	73.5 Å²	73.5	34%	0.337	37%	0.371	S	S	.	.	H	α-helix	trans	-68.3	-26.5	178.1	63.5	0	0	0	0	112.8	L395 H396 E401 G402 M403 E405	L395-T399 HydrophobicContact CG-CG2 4.16Å; L395-T399 PolarHBondContact O-N 3.27Å; L395-T399 PolarHBondContact O-OG1 2.87Å; H396-T399 WeakPolarHBondContact CA-OG1 3.31Å; T399-E401 PolarHBondContact O-N 3.33Å; T399-G402 PolarHBondContact O-N 3.44Å; T399-G402 VanDerWaalsContact O-N 3.14Å; T399-M403 VanDerWaalsContact CA-O 3.31Å; T399-M403 WeakPolarHBondContact CA-O 3.46Å; T399-M403 WeakPolarHBondContact CG2-O 3.24Å; T399-E405 HydrophobicContact CG2-CG 4.32Å
400	G	92.1	Very high	92.9	Very high	61 Å²	61	77 Å²	77	63%	0.629	39%	0.387	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.6	-22	171.4	0	0	0	0	0	114.1	H396 F398	H396-G400 PolarHBondContact O-N 3.45Å; H396-G400 VanDerWaalsContact O-N 3.08Å; F398-G400 PolarHBondContact O-N 3.03Å
401	E	92.1	Very high	93	Very high	52 Å²	52	67.5 Å²	67.5	24%	0.243	35%	0.352	C	S	.	.	T	Hydrogen-bonded Turn	trans	-95.1	7.3	177.2	-55.6	-65.5	144.2	0	0	112.3	A102 K103 T107 W397 F398 T399	A102-E401 HydrophobicContact CB-CB 3.88Å; A102-E401 HydrophobicContact CB-CG 4.3Å; K103-E401 VanDerWaalsContact CE-CD 3.43Å; K103-E401 WeakPolarHBondContact CE-OE1 3.24Å; K103-E401 VanDerWaalsContact CG-CD 3.44Å; K103-E401 HydrophobicContact CG-CG 3.71Å; K103-E401 WeakPolarHBondContact CG-OE2 3.43Å; K103-E401 IonicContact NZ-OE1 2.89Å; T107-E401 HydrophobicContact CG2-CB 4.26Å; T107-E401 VanDerWaalsContact CG2-OE2 3.24Å; T107-E401 WeakPolarHBondContact CG2-OE2 3.33Å; T107-E401 PolarHBondContact OG1-OE2 2.67Å; W397-E401 WeakPolarHBondContact O-CG 3.48Å; F398-E401 PolarHBondContact O-N 2.89Å; T399-E401 PolarHBondContact O-N 3.33Å
402	G	89.1	Confident	93	Very high	68 Å²	68	59.2 Å²	59.2	70%	0.701	32%	0.322	S	S	*	.	T	Hydrogen-bonded Turn	trans	99.5	3.4	175.3	0	0	0	0	0	115.7	T399	T399-G402 PolarHBondContact O-N 3.44Å; T399-G402 VanDerWaalsContact O-N 3.14Å
403	M	93.8	Very high	93.2	Very high	5 Å²	5	56.7 Å²	56.7	3%	0.025	32%	0.319	C	S	.	.			trans	-78.8	140.7	179.3	-165	176.5	174.5	0	0	112.3	W101 A102 Y106 L187 F398 T399 E407 F408	W101-M403 HydrophobicContact CE3-SD 4.33Å; W101-M403 HydrophobicContact CZ3-CE 4.29Å; W101-M403 HydrophobicContact CZ3-SD 4.26Å; A102-M403 HydrophobicContact CB-CB 4.45Å; A102-M403 HydrophobicContact CB-SD 4.24Å; Y106-M403 HydrophobicContact CE2-CB 4.31Å; Y106-M403 HydrophobicContact CE2-CG 4.1Å; Y106-M403 HydrophobicContact CE2-SD 4.5Å; L187-M403 HydrophobicContact CD1-CE 3.65Å; L187-M403 HydrophobicContact CD1-SD 4.1Å; L187-M403 HydrophobicContact CD2-CE 3.41Å; L187-M403 VanDerWaalsContact CD2-CE 3.41Å; L187-M403 HydrophobicContact CG-CE 4.15Å; F398-M403 HydrophobicContact CB-SD 4.15Å; F398-M403 HydrophobicContact CD1-SD 4.4Å; F398-M403 WeakPolarHBondContact O-CB 3.36Å; F398-M403 PolarHBondContact O-N 3.32Å; T399-M403 VanDerWaalsContact CA-O 3.31Å; T399-M403 WeakPolarHBondContact CA-O 3.46Å; T399-M403 WeakPolarHBondContact CG2-O 3.24Å; M403-E407 HydrophobicContact CE-CB 3.5Å; M403-E407 HydrophobicContact CE-CG 4.45Å; M403-E407 WeakPolarHBondContact CE-OE2 3.4Å; M403-E407 HydrophobicContact CG-CB 4.28Å; M403-E407 WeakPolarHBondContact CG-OE2 2.87Å; M403-F408 HydrophobicContact CE-CD2 3.78Å; M403-F408 HydrophobicContact CE-CE2 3.5Å; M403-F408 VanDerWaalsContact CE-CE2 3.5Å; M403-F408 HydrophobicContact CE-CG 4.41Å; M403-F408 HydrophobicContact CE-CZ 3.89Å; M403-F408 HydrophobicContact CG-CE2 4.06Å; M403-F408 HydrophobicContact SD-CD2 4.29Å; M403-F408 HydrophobicContact SD-CE2 3.44Å; M403-F408 WeakPolarHBondContact SD-CE2 3.4Å; M403-F408 HydrophobicContact SD-CZ 3.72Å
404	D	93	Very high	93.3	Very high	92 Å²	92	56 Å²	56	49%	0.492	31%	0.311	S	S	.	.			trans	-87.3	150.1	174.9	-160.6	-11.1	0	0	0	112	M406 E407	D404-M406 HydrophobicContact CB-CB 4.42Å; D404-M406 PolarHBondContact O-N 2.63Å; D404-M406 PolarHBondContact OD1-N 3.31Å; D404-E407 PolarHBondContact N-OE1 2.99Å; D404-E407 PolarHBondContact O-N 2.85Å
405	E	91.8	Very high	93.4	Very high	72 Å²	72	52.4 Å²	52.4	34%	0.336	30%	0.295	S	S	.	.	H	α-helix	trans	-60.5	-24.3	170.1	-59.3	-165.7	164.5	0	0	111.8	K392 L395 T399 F408 T409	K392-E405 IonicContact NZ-OE1 2.83Å; K392-E405 PolarHBondContact NZ-OE1 2.94Å; K392-E405 IonicContact NZ-OE2 2.66Å; K392-E405 PolarHBondContact NZ-OE2 2.83Å; L395-E405 HydrophobicContact CD2-CG 3.82Å; L395-E405 VanDerWaalsContact CD2-OE1 3.29Å; L395-E405 WeakPolarHBondContact CD2-OE1 3.38Å; T399-E405 HydrophobicContact CG2-CG 4.32Å; E405-F408 WeakPolarHBondContact O-CB 3.43Å; E405-F408 PolarHBondContact O-N 2.87Å; E405-T409 PolarHBondContact O-N 3.47Å; E405-T409 PolarHBondContact O-OG1 3.09Å
406	M	93.6	Very high	93.5	Very high	116 Å²	116	55 Å²	55	57%	0.571	31%	0.309	S	S	*	.	H	α-helix	trans	-63.1	-40.1	176.1	-170.6	166.8	-72.4	0	0	111.9	D404 F408 T409 E410	D404-M406 HydrophobicContact CB-CB 4.42Å; D404-M406 PolarHBondContact O-N 2.63Å; D404-M406 PolarHBondContact OD1-N 3.31Å; M406-F408 VanDerWaalsContact C-N 3.25Å; M406-F408 PolarHBondContact O-N 3.26Å; M406-T409 WeakPolarHBondContact O-CA 3.39Å; M406-T409 WeakPolarHBondContact O-CB 3.27Å; M406-T409 PolarHBondContact O-N 2.9Å; M406-E410 HydrophobicContact CG-CG 4.42Å; M406-E410 WeakPolarHBondContact O-CG 3.42Å; M406-E410 PolarHBondContact O-N 2.97Å
407	E	93.8	Very high	93.6	Very high	50 Å²	50	52.8 Å²	52.8	23%	0.234	30%	0.301	C	S	.	.	H	α-helix	trans	-60.9	-34.7	178.4	-68.6	176.5	-128.9	0	0	112.2	Y106 M403 D404 T409 A411	Y106-E407 PolarHBondContact OH-OE2 2.98Å; M403-E407 HydrophobicContact CE-CB 3.5Å; M403-E407 HydrophobicContact CE-CG 4.45Å; M403-E407 WeakPolarHBondContact CE-OE2 3.4Å; M403-E407 HydrophobicContact CG-CB 4.28Å; M403-E407 WeakPolarHBondContact CG-OE2 2.87Å; D404-E407 PolarHBondContact N-OE1 2.99Å; D404-E407 PolarHBondContact O-N 2.85Å; E407-T409 VanDerWaalsContact C-N 3.34Å; E407-A411 WeakPolarHBondContact O-CB 3.44Å; E407-A411 PolarHBondContact O-N 3.05Å
408	F	94.3	Very high	93.7	Very high	0 Å²	0	47.5 Å²	47.5	0%	0	28%	0.281	C	S	.	.	H	α-helix	trans	-64.3	-41.1	173.3	-75.6	-92	0	0	0	111.9	Y183 L187 F385 F389 L395 F398 M403 E405 M406 E412	Y183-F408 AromaticContact CD1-CD1 3.71Å; Y183-F408 HydrophobicContact CD1-CD1 3.71Å; Y183-F408 AromaticContact CD1-CE1 3.54Å; Y183-F408 HydrophobicContact CD1-CE1 3.54Å; Y183-F408 AromaticContact CE1-CD1 3.99Å; Y183-F408 HydrophobicContact CE1-CD1 3.99Å; Y183-F408 HydrophobicContact CE1-CE1 4.06Å; Y183-F408 HydrophobicContact CG-CE1 4.03Å; L187-F408 HydrophobicContact CD1-CE1 3.93Å; L187-F408 HydrophobicContact CD1-CZ 4.11Å; 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 4.07Å; F385-F408 AromaticContact CZ-CD1 3.94Å; F385-F408 HydrophobicContact CZ-CD1 3.94Å; F385-F408 WeakPolarHBondContact CZ-O 3.46Å; F389-F408 HydrophobicContact CD2-CB 4.2Å; F389-F408 HydrophobicContact CD2-CG 4.49Å; F389-F408 HydrophobicContact CE2-CB 3.56Å; F389-F408 HydrophobicContact CE2-CD1 4.48Å; F389-F408 HydrophobicContact CE2-CG 4.02Å; F389-F408 HydrophobicContact CZ-CB 3.75Å; L395-F408 HydrophobicContact CD1-CD1 4.28Å; L395-F408 HydrophobicContact CD1-CD2 3.85Å; L395-F408 HydrophobicContact CD1-CE1 4.12Å; L395-F408 HydrophobicContact CD1-CE2 3.66Å; L395-F408 HydrophobicContact CD1-CG 4.16Å; L395-F408 HydrophobicContact CD1-CZ 3.82Å; F398-F408 HydrophobicContact CB-CE2 3.88Å; F398-F408 HydrophobicContact CB-CZ 3.5Å; F398-F408 HydrophobicContact CD1-CE1 4.46Å; F398-F408 AromaticContact CD1-CZ 3.79Å; F398-F408 HydrophobicContact CD1-CZ 3.79Å; F398-F408 HydrophobicContact CD2-CZ 4.03Å; F398-F408 HydrophobicContact CE1-CZ 4.49Å; F398-F408 HydrophobicContact CG-CE1 4.37Å; F398-F408 HydrophobicContact CG-CE2 4.39Å; F398-F408 AromaticContact CG-CZ 3.52Å; F398-F408 HydrophobicContact CG-CZ 3.52Å; M403-F408 HydrophobicContact CE-CD2 3.78Å; M403-F408 HydrophobicContact CE-CE2 3.5Å; M403-F408 VanDerWaalsContact CE-CE2 3.5Å; M403-F408 HydrophobicContact CE-CG 4.41Å; M403-F408 HydrophobicContact CE-CZ 3.89Å; M403-F408 HydrophobicContact CG-CE2 4.06Å; M403-F408 HydrophobicContact SD-CD2 4.29Å; M403-F408 HydrophobicContact SD-CE2 3.44Å; 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 2.87Å; M406-F408 VanDerWaalsContact C-N 3.25Å; M406-F408 PolarHBondContact O-N 3.26Å; F408-E412 WeakPolarHBondContact O-CB 3.38Å; F408-E412 PolarHBondContact O-N 3.47Å
409	T	94.6	Very high	93.8	Very high	71 Å²	71	48 Å²	48	44%	0.436	29%	0.285	S	S	.	.	H	α-helix	trans	-69.9	-39.6	-179.2	-52.1	0	0	0	0	110.7	E405 M406 E407 E412 S413	E405-T409 PolarHBondContact O-N 3.47Å; E405-T409 PolarHBondContact O-OG1 3.09Å; M406-T409 WeakPolarHBondContact O-CA 3.39Å; M406-T409 WeakPolarHBondContact O-CB 3.27Å; M406-T409 PolarHBondContact O-N 2.9Å; E407-T409 VanDerWaalsContact C-N 3.34Å; T409-E412 PolarHBondContact O-N 2.9Å; T409-S413 WeakPolarHBondContact O-CB 3.38Å; T409-S413 PolarHBondContact O-N 3.44Å
410	E	95.1	Very high	93.8	Very high	104 Å²	104	48.8 Å²	48.8	49%	0.486	29%	0.292	S	S	.	.	H	α-helix	trans	-63.2	-46.4	174.7	-71.1	177.1	178.9	0	0	111.5	M406 E412 S413 N414	M406-E410 HydrophobicContact CG-CG 4.42Å; M406-E410 WeakPolarHBondContact O-CG 3.42Å; M406-E410 PolarHBondContact O-N 2.97Å; E410-E412 PolarHBondContact O-N 3.35Å; E410-S413 PolarHBondContact O-N 3.32Å; E410-N414 WeakPolarHBondContact O-CB 3.47Å; E410-N414 PolarHBondContact O-N 3.24Å
411	A	95	Very high	93.9	Very high	0 Å²	0	48 Å²	48	0%	0	27%	0.272	C	S	.	.	H	α-helix	trans	-64.5	-38.9	177.4	0	0	0	0	0	112.5	T186 L187 H190 E407 M415	T186-A411 HydrophobicContact CG2-CB 4.04Å; L187-A411 HydrophobicContact CD2-CB 3.71Å; H190-A411 HydrophobicContact CB-CB 3.91Å; E407-A411 WeakPolarHBondContact O-CB 3.44Å; E407-A411 PolarHBondContact O-N 3.05Å; A411-M415 WeakPolarHBondContact O-CB 3.46Å; A411-M415 PolarHBondContact O-N 2.95Å
412	E	94.7	Very high	94	Very high	35 Å²	35	45.5 Å²	45.5	16%	0.164	26%	0.26	C	S	.	.	H	α-helix	trans	-62.8	-45.2	173.2	-173.7	175.1	-144.9	0	0	111.5	F385 S386 F408 T409 E410 M415 N416	F385-E412 HydrophobicContact CD1-CB 4.17Å; F385-E412 HydrophobicContact CD1-CG 3.97Å; F385-E412 HydrophobicContact CE1-CB 3.58Å; F385-E412 HydrophobicContact CE1-CG 3.8Å; F385-E412 HydrophobicContact CZ-CB 4.16Å; S386-E412 WeakPolarHBondContact CB-OE1 3.39Å; S386-E412 PolarHBondContact OG-OE1 3.32Å; F408-E412 WeakPolarHBondContact O-CB 3.38Å; F408-E412 PolarHBondContact O-N 3.47Å; T409-E412 PolarHBondContact O-N 2.9Å; E410-E412 PolarHBondContact O-N 3.35Å; E412-M415 PolarHBondContact O-N 2.78Å; E412-N416 VanDerWaalsContact O-CG 3.26Å; E412-N416 PolarHBondContact O-N 3.04Å; E412-N416 PolarHBondContact O-ND2 3.31Å; E412-N416 VanDerWaalsContact O-ND2 3.09Å
413	S	95	Very high	94.2	Very high	60 Å²	60	45 Å²	45	42%	0.42	24%	0.24	S	C	.	.	H	α-helix	trans	-60.4	-51.4	177.1	-167.2	0	0	0	0	110.9	T409 E410 M415 N416 D417	T409-S413 WeakPolarHBondContact O-CB 3.38Å; T409-S413 PolarHBondContact O-N 3.44Å; E410-S413 PolarHBondContact O-N 3.32Å; S413-M415 VanDerWaalsContact C-N 3.28Å; S413-M415 PolarHBondContact O-N 3.33Å; S413-N416 CarbonylContact O-C 3.35Å; S413-N416 PolarHBondContact O-N 3.14Å; S413-D417 VanDerWaalsContact O-CG 3.22Å; S413-D417 PolarHBondContact O-N 3.34Å
414	N	94.9	Very high	94.2	Very high	16 Å²	16	50.7 Å²	50.7	9%	0.086	27%	0.266	C	S	.	.	H	α-helix	trans	-63	-34.9	-178	-172.3	48.4	0	0	0	112.4	H190 R262 E410 D417 L418	H190-N414 PolarHBondContact ND1-ND2 3.31Å; R262-N414 PolarHBondContact NH1-OD1 3.5Å; R262-N414 PolarHBondContact NH2-OD1 2.83Å; E410-N414 WeakPolarHBondContact O-CB 3.47Å; E410-N414 PolarHBondContact O-N 3.24Å; N414-D417 PolarHBondContact O-N 3.47Å; N414-L418 PolarHBondContact O-N 2.94Å
415	M	94.1	Very high	94.1	Very high	2 Å²	2	48.8 Å²	48.8	1%	0.01	25%	0.253	C	S	.	.	H	α-helix	trans	-62.9	-44.4	172	-176.2	74.2	72.5	0	0	111.7	T186 V189 F378 A411 E412 S413 D417 L418 V419	T186-M415 HydrophobicContact CG2-CE 4.17Å; V189-M415 HydrophobicContact CB-CE 3.38Å; V189-M415 HydrophobicContact CB-SD 4.27Å; V189-M415 HydrophobicContact CG1-CE 3.46Å; V189-M415 VanDerWaalsContact CG1-CE 3.46Å; V189-M415 HydrophobicContact CG1-SD 3.66Å; V189-M415 HydrophobicContact CG2-CE 3.85Å; F378-M415 HydrophobicContact CB-SD 3.89Å; F378-M415 HydrophobicContact CD1-CE 4.4Å; F378-M415 HydrophobicContact CD1-SD 3.44Å; F378-M415 WeakPolarHBondContact CD1-SD 3.38Å; F378-M415 HydrophobicContact CE1-SD 4.26Å; F378-M415 HydrophobicContact CG-SD 3.93Å; A411-M415 WeakPolarHBondContact O-CB 3.46Å; A411-M415 PolarHBondContact O-N 2.95Å; E412-M415 PolarHBondContact O-N 2.78Å; S413-M415 VanDerWaalsContact C-N 3.28Å; S413-M415 PolarHBondContact O-N 3.33Å; M415-D417 VanDerWaalsContact C-N 3.34Å; M415-L418 WeakPolarHBondContact O-CB 3.36Å; M415-L418 PolarHBondContact O-N 3.49Å; M415-V419 WeakPolarHBondContact O-CG2 3.39Å; M415-V419 PolarHBondContact O-N 3.4Å
416	N	94.6	Very high	94	Very high	62 Å²	62	47 Å²	47	33%	0.332	24%	0.244	S	C	.	.	H	α-helix	trans	-69.5	-33.5	179	-67.8	-32.4	0	0	0	112	S382 E412 S413 V419 S420	S382-N416 PolarHBondContact OG-OD1 2.53Å; E412-N416 VanDerWaalsContact O-CG 3.26Å; E412-N416 PolarHBondContact O-N 3.04Å; E412-N416 PolarHBondContact O-ND2 3.31Å; E412-N416 VanDerWaalsContact O-ND2 3.09Å; S413-N416 CarbonylContact O-C 3.35Å; S413-N416 PolarHBondContact O-N 3.14Å; N416-V419 PolarHBondContact O-N 3.32Å; N416-S420 WeakPolarHBondContact O-CB 3.41Å; N416-S420 PolarHBondContact O-N 3.22Å; N416-S420 PolarHBondContact O-OG 3.06Å
417	D	95.5	Very high	93.7	Very high	75 Å²	75	47.7 Å²	47.7	40%	0.401	25%	0.246	S	C	.	.	H	α-helix	trans	-64.5	-45.1	172.8	-65	-27.9	0	0	0	110.4	S413 N414 M415 V419 S420 E421	S413-D417 VanDerWaalsContact O-CG 3.22Å; S413-D417 PolarHBondContact O-N 3.34Å; N414-D417 PolarHBondContact O-N 3.47Å; M415-D417 VanDerWaalsContact C-N 3.34Å; D417-V419 VanDerWaalsContact C-N 3.33Å; D417-V419 PolarHBondContact O-N 3.25Å; D417-S420 CarbonylContact O-C 3.6Å; D417-S420 WeakPolarHBondContact O-CA 3.47Å; D417-S420 WeakPolarHBondContact O-CB 3.39Å; D417-S420 PolarHBondContact O-N 3.23Å; D417-E421 WeakPolarHBondContact O-CG 3.47Å; D417-E421 PolarHBondContact O-N 2.81Å
418	L	94.4	Very high	93.2	Very high	0 Å²	0	46.6 Å²	46.6	0%	0	25%	0.246	C	C	.	.	H	α-helix	trans	-58.5	-43.8	174.2	-179	70.1	0	0	0	112.1	V189 V193 R262 L263 F265 F378 N414 M415 S420 E421 Y422	V189-L418 HydrophobicContact CG1-CD2 4.37Å; V193-L418 HydrophobicContact CG2-CD1 4.44Å; V193-L418 HydrophobicContact CG2-CD2 3.84Å; R262-L418 HydrophobicContact CB-CD1 4.45Å; L263-L418 HydrophobicContact CD2-CD1 3.81Å; F265-L418 HydrophobicContact CD2-CD2 4.13Å; F265-L418 HydrophobicContact CE2-CD1 4.31Å; F265-L418 HydrophobicContact CE2-CD2 3.71Å; F265-L418 HydrophobicContact CZ-CD2 4.38Å; F378-L418 HydrophobicContact CD2-CD2 4.1Å; F378-L418 HydrophobicContact CE1-CD2 4.29Å; F378-L418 HydrophobicContact CE2-CD2 3.81Å; F378-L418 HydrophobicContact CG-CD2 4.47Å; F378-L418 HydrophobicContact CZ-CD2 3.91Å; N414-L418 PolarHBondContact O-N 2.94Å; M415-L418 WeakPolarHBondContact O-CB 3.36Å; M415-L418 PolarHBondContact O-N 3.49Å; L418-S420 VanDerWaalsContact C-N 3.29Å; L418-S420 PolarHBondContact O-N 3.17Å; L418-E421 PolarHBondContact O-N 3.19Å; L418-Y422 HydrophobicContact CD1-CD2 4.3Å; L418-Y422 HydrophobicContact CD1-CE2 3.89Å; L418-Y422 HydrophobicContact CD2-CE2 4.42Å; L418-Y422 HydrophobicContact CG-CD2 4.13Å; L418-Y422 HydrophobicContact CG-CE2 3.95Å; L418-Y422 VanDerWaalsContact O-CD2 3.29Å; L418-Y422 WeakPolarHBondContact O-CD2 3.32Å; L418-Y422 PolarHBondContact O-N 2.56Å; L418-Y422 VanDerWaalsContact O-N 3.08Å
419	V	94.6	Very high	92.1	Very high	13 Å²	13	48.7 Å²	48.7	8%	0.079	26%	0.26	C	S	.	.	H	α-helix	trans	-60.6	-41.5	174.8	167.5	0	0	0	0	111.1	Q375 F378 K379 M415 N416 D417 Y422 Q423	Q375-V419 HydrophobicContact CB-CG1 4.43Å; F378-V419 HydrophobicContact CB-CG2 3.56Å; K379-V419 HydrophobicContact CD-CG1 4.22Å; K379-V419 VanDerWaalsContact CE-CG1 3.41Å; K379-V419 HydrophobicContact CG-CG1 3.85Å; K379-V419 HydrophobicContact CG-CG2 4.33Å; M415-V419 WeakPolarHBondContact O-CG2 3.39Å; M415-V419 PolarHBondContact O-N 3.4Å; N416-V419 PolarHBondContact O-N 3.32Å; D417-V419 VanDerWaalsContact C-N 3.33Å; D417-V419 PolarHBondContact O-N 3.25Å; V419-Y422 PolarHBondContact O-N 2.81Å; V419-Q423 PolarHBondContact O-N 3.49Å
420	S	94.4	Very high	90.5	Very high	70 Å²	70	47 Å²	47	49%	0.49	25%	0.253	S	S	.	.	H	α-helix	trans	-67.5	-39.2	179.3	-57.7	0	0	0	0	111.8	N416 D417 L418 Q423 Q424	N416-S420 WeakPolarHBondContact O-CB 3.41Å; N416-S420 PolarHBondContact O-N 3.22Å; N416-S420 PolarHBondContact O-OG 3.06Å; D417-S420 CarbonylContact O-C 3.6Å; D417-S420 WeakPolarHBondContact O-CA 3.47Å; D417-S420 WeakPolarHBondContact O-CB 3.39Å; D417-S420 PolarHBondContact O-N 3.23Å; L418-S420 VanDerWaalsContact C-N 3.29Å; L418-S420 PolarHBondContact O-N 3.17Å; S420-Q423 WeakPolarHBondContact O-CB 3.49Å; S420-Q423 PolarHBondContact O-N 3.24Å; S420-Q424 PolarHBondContact O-N 3.27Å
421	E	94	Very high	88.5	Confident	45 Å²	45	51.4 Å²	51.4	21%	0.21	27%	0.266	C	S	.	.	H	α-helix	trans	-59.5	-47.6	172.9	-72.8	172	-150.8	0	0	111.2	R262 L263 D417 L418 Q423 Q424 Y425	R262-E421 WeakPolarHBondContact CB-OE2 3.48Å; R262-E421 IonicContact CZ-OE1 3.6Å; R262-E421 IonicContact NE-OE1 2.87Å; R262-E421 PolarHBondContact NE-OE1 3.25Å; R262-E421 IonicContact NE-OE2 3.26Å; R262-E421 PolarHBondContact NE-OE2 3.03Å; R262-E421 IonicContact NH2-OE1 2.79Å; R262-E421 PolarHBondContact NH2-OE1 2.84Å; L263-E421 HydrophobicContact CD2-CB 4.08Å; D417-E421 WeakPolarHBondContact O-CG 3.47Å; D417-E421 PolarHBondContact O-N 2.81Å; L418-E421 PolarHBondContact O-N 3.19Å; E421-Q423 VanDerWaalsContact C-N 3.29Å; E421-Q423 PolarHBondContact O-N 2.97Å; E421-Q424 WeakPolarHBondContact O-CB 3.46Å; E421-Q424 PolarHBondContact O-N 3.37Å; E421-Y425 WeakPolarHBondContact O-CD2 3.34Å; E421-Y425 PolarHBondContact O-N 2.95Å; E421-Y425 VanDerWaalsContact O-N 3.16Å
422	Y	94.3	Very high	86.3	Confident	0 Å²	0	57.1 Å²	57.1	0%	0	29%	0.292	C	S	.	.	H	α-helix	trans	-60.1	-38.8	175.5	-83.6	-64.2	0	0	0	112.5	L263 T372 I374 F378 L418 V419 Q426	L263-Y422 HydrophobicContact CB-CE1 4Å; L263-Y422 HydrophobicContact CD1-CD1 4.19Å; L263-Y422 HydrophobicContact CD1-CE1 4.18Å; L263-Y422 HydrophobicContact CD2-CD1 4.02Å; L263-Y422 HydrophobicContact CD2-CD2 3.91Å; L263-Y422 HydrophobicContact CD2-CE1 3.84Å; L263-Y422 HydrophobicContact CD2-CE2 3.69Å; L263-Y422 HydrophobicContact CD2-CG 4.07Å; L263-Y422 HydrophobicContact CG-CE1 4.22Å; T372-Y422 HydrophobicContact CG2-CD1 4.36Å; I374-Y422 HydrophobicContact CG2-CD1 4.08Å; I374-Y422 HydrophobicContact CG2-CD2 4.03Å; I374-Y422 HydrophobicContact CG2-CE1 3.63Å; I374-Y422 HydrophobicContact CG2-CE2 3.59Å; I374-Y422 HydrophobicContact CG2-CG 4.26Å; F378-Y422 HydrophobicContact CD2-CE2 4.46Å; F378-Y422 HydrophobicContact CE2-CE2 4.03Å; L418-Y422 HydrophobicContact CD1-CD2 4.3Å; L418-Y422 HydrophobicContact CD1-CE2 3.89Å; L418-Y422 HydrophobicContact CD2-CE2 4.42Å; L418-Y422 HydrophobicContact CG-CD2 4.13Å; L418-Y422 HydrophobicContact CG-CE2 3.95Å; L418-Y422 VanDerWaalsContact O-CD2 3.29Å; L418-Y422 WeakPolarHBondContact O-CD2 3.32Å; L418-Y422 PolarHBondContact O-N 2.56Å; L418-Y422 VanDerWaalsContact O-N 3.08Å; V419-Y422 PolarHBondContact O-N 2.81Å; Y422-Q426 WeakPolarHBondContact O-CB 3.41Å; Y422-Q426 PolarHBondContact O-N 3.04Å; Y422-Q426 VanDerWaalsContact O-N 3.1Å
423	Q	92.9	Very high	84	Confident	56 Å²	56	60.7 Å²	60.7	26%	0.262	31%	0.313	S	S	.	.	H	α-helix	trans	-65.7	-42.6	176.4	-171.7	65.3	29.9	0	0	111.7	V419 S420 E421 Y425 Q426 E427	V419-Q423 PolarHBondContact O-N 3.49Å; S420-Q423 WeakPolarHBondContact O-CB 3.49Å; S420-Q423 PolarHBondContact O-N 3.24Å; E421-Q423 VanDerWaalsContact C-N 3.29Å; E421-Q423 PolarHBondContact O-N 2.97Å; Q423-Y425 PolarHBondContact O-N 3.12Å; Q423-Q426 WeakPolarHBondContact O-CB 3.31Å; Q423-Q426 PolarHBondContact O-N 3.04Å; Q423-E427 PolarHBondContact NE2-OE1 3.38Å; Q423-E427 PolarHBondContact O-N 3.48Å; Q423-E427 VanDerWaalsContact O-N 3.14Å
424	Q	93.1	Very high	81.7	Confident	126 Å²	126	63.1 Å²	63.1	59%	0.589	32%	0.321	S	S	*	.	H	α-helix	trans	-57.3	-49.2	178	-177.1	-177.1	-1.5	0	0	111.3	S420 E421 Q426 E427 A428	S420-Q424 PolarHBondContact O-N 3.27Å; E421-Q424 WeakPolarHBondContact O-CB 3.46Å; E421-Q424 PolarHBondContact O-N 3.37Å; Q424-Q426 VanDerWaalsContact C-N 3.29Å; Q424-Q426 PolarHBondContact O-N 3.3Å; Q424-E427 PolarHBondContact O-N 3.08Å; Q424-A428 WeakPolarHBondContact O-CB 3.17Å; Q424-A428 PolarHBondContact O-N 3.04Å
425	Y	91.1	Very high	79.1	Confident	52 Å²	52	68.4 Å²	68.4	20%	0.204	35%	0.345	C	S	.	.	H	α-helix	trans	-74	-19.4	179.5	-66.7	-66.6	0	0	0	114	F260 L263 W344 E421 Q423	F260-Y425 HydrophobicContact CD2-CD1 4.45Å; F260-Y425 HydrophobicContact CD2-CD2 4.26Å; F260-Y425 HydrophobicContact CD2-CE1 4.07Å; F260-Y425 AromaticContact CD2-CE2 3.84Å; F260-Y425 HydrophobicContact CD2-CE2 3.84Å; F260-Y425 AromaticContact CD2-CZ 3.72Å; F260-Y425 AromaticContact CE1-CE1 3.94Å; F260-Y425 HydrophobicContact CE1-CE1 3.94Å; F260-Y425 AromaticContact CE1-CZ 3.8Å; F260-Y425 WeakPolarHBondContact CE1-OH 3.17Å; F260-Y425 AromaticContact CE2-CD1 3.59Å; F260-Y425 HydrophobicContact CE2-CD1 3.59Å; F260-Y425 HydrophobicContact CE2-CD2 4.16Å; F260-Y425 AromaticContact CE2-CE1 3.25Å; F260-Y425 HydrophobicContact CE2-CE1 3.25Å; F260-Y425 AromaticContact CE2-CE2 3.86Å; F260-Y425 HydrophobicContact CE2-CE2 3.86Å; F260-Y425 HydrophobicContact CE2-CG 4.03Å; F260-Y425 AromaticContact CE2-CZ 3.38Å; F260-Y425 HydrophobicContact CG-CE2 4.25Å; F260-Y425 AromaticContact CZ-CD1 3.92Å; F260-Y425 HydrophobicContact CZ-CD1 3.92Å; F260-Y425 AromaticContact CZ-CE1 3.19Å; F260-Y425 HydrophobicContact CZ-CE1 3.19Å; F260-Y425 HydrophobicContact CZ-CE2 4.36Å; F260-Y425 AromaticContact CZ-CZ 3.45Å; F260-Y425 VanDerWaalsContact CZ-CZ 3.45Å; L263-Y425 HydrophobicContact CD1-CD2 3.42Å; L263-Y425 VanDerWaalsContact CD1-CD2 3.42Å; L263-Y425 HydrophobicContact CD1-CE2 3.71Å; L263-Y425 HydrophobicContact CD1-CG 4.4Å; W344-Y425 HydrophobicContact CZ2-CD1 4.22Å; E421-Y425 WeakPolarHBondContact O-CD2 3.34Å; E421-Y425 PolarHBondContact O-N 2.95Å; E421-Y425 VanDerWaalsContact O-N 3.16Å; Q423-Y425 PolarHBondContact O-N 3.12Å
426	Q	89.4	Confident	76.6	Confident	34 Å²	34	73 Å²	73	16%	0.159	37%	0.37	C	S	.	.	H	α-helix	trans	-69.8	-39.7	172.3	-177.7	166.9	-48.2	0	0	111.5	H307 R309 T372 Y422 Q423 Q424	H307-Q426 PolarHBondContact O-NE2 2.85Å; R309-Q426 PolarHBondContact NH1-O 3.2Å; T372-Q426 HydrophobicContact CG2-CB 3.98Å; T372-Q426 PolarHBondContact OG1-OE1 3.42Å; Y422-Q426 WeakPolarHBondContact O-CB 3.41Å; Y422-Q426 PolarHBondContact O-N 3.04Å; Y422-Q426 VanDerWaalsContact O-N 3.1Å; Q423-Q426 WeakPolarHBondContact O-CB 3.31Å; Q423-Q426 PolarHBondContact O-N 3.04Å; Q424-Q426 VanDerWaalsContact C-N 3.29Å; Q424-Q426 PolarHBondContact O-N 3.3Å
427	E	88.2	Confident	74.2	Confident	130 Å²	130	76.7 Å²	76.7	61%	0.607	38%	0.383	S	S	*	.	H	α-helix	trans	-83.6	-26.8	-179.4	-68	177.9	-176.4	0	0	112.5	Q423 Q424 S429	Q423-E427 PolarHBondContact NE2-OE1 3.38Å; Q423-E427 PolarHBondContact O-N 3.48Å; Q423-E427 VanDerWaalsContact O-N 3.14Å; Q424-E427 PolarHBondContact O-N 3.08Å; E427-S429 PolarHBondContact O-N 2.92Å
428	A	83.3	Confident	71.6	Confident	28 Å²	28	79.6 Å²	79.6	23%	0.231	39%	0.394	C	S	.	.			trans	-49.6	129.5	177.9	0	0	0	0	0	112.3	R309 Q424	R309-A428 PolarHBondContact NH1-O 3.32Å; Q424-A428 WeakPolarHBondContact O-CB 3.17Å; Q424-A428 PolarHBondContact O-N 3.04Å
429	S	71.3	Confident	69.2	Low	43 Å²	43	85.7 Å²	85.7	30%	0.301	42%	0.423	S	S	.	.			trans	-123	142.4	176.6	77.5	0	0	0	0	110.1	E427 R431 E432	E427-S429 PolarHBondContact O-N 2.92Å; S429-R431 PolarHBondContact O-N 3.31Å; S429-E432 PolarHBondContact O-N 3.32Å
430	A	61.3	Low	66.7	Low	35 Å²	35	91.9 Å²	91.9	29%	0.289	45%	0.451	S	S	.	.	H	α-helix	trans	-62.1	-12.4	-179.1	0	0	0	0	0	113.7	W344	W344-A430 HydrophobicContact CB-CB 4.33Å
431	R	52.7	Low	64.3	Low	198 Å²	198	96.4 Å²	96.4	75%	0.747	46%	0.464	S	S	*	.	H	α-helix	trans	-87	-18.1	-177.8	-65.3	-175	-178.3	179.5	0.6	114.3	S429	S429-R431 PolarHBondContact O-N 3.31Å
432	E	48.4	Very low	62.1	Low	119 Å²	119	102.1 Å²	102.1	56%	0.556	49%	0.493	S	S	*	.	H	α-helix	trans	-78	-28.1	-179.3	-75.7	176.1	164.4	0	0	112.1	S429	S429-E432 PolarHBondContact O-N 3.32Å
433	D	47.4	Very low	59.9	Low	111 Å²	111	109 Å²	109	59%	0.594	53%	0.528	S	S	*	.	H	α-helix	trans	-75.9	-38.9	175.1	-73.8	-26	0	0	0	112.2	Q435 N436 F437	D433-Q435 VanDerWaalsContact C-N 3.29Å; D433-Q435 PolarHBondContact O-N 3.15Å; D433-N436 PolarHBondContact O-N 3Å; D433-F437 VanDerWaalsContact O-CD2 3.24Å; D433-F437 WeakPolarHBondContact O-CD2 3.44Å; D433-F437 PolarHBondContact O-N 3.44Å
434	D	45	Very low	57.2	Low	110 Å²	110	118.2 Å²	118.2	59%	0.588	57%	0.571	S	S	*	*	H	α-helix	trans	-64.9	-30.3	177.9	-83.5	-17.3	0	0	0	112.7	F437 E438	D434-F437 PolarHBondContact O-N 3.08Å; D434-E438 PolarHBondContact O-N 3.11Å
435	Q	40.3	Very low	55.4	Low	127 Å²	127	117.8 Å²	117.8	59%	0.593	57%	0.57	S	S	*	*	H	α-helix	trans	-71.9	-32.6	176.3	-76.3	-175.5	-16.5	0	0	113	D433 E439	D433-Q435 VanDerWaalsContact C-N 3.29Å; D433-Q435 PolarHBondContact O-N 3.15Å; Q435-E439 WeakPolarHBondContact O-CB 3.29Å; Q435-E439 PolarHBondContact O-N 3.05Å
436	N	41.8	Very low	53.5	Low	100 Å²	100	121.3 Å²	121.3	54%	0.535	59%	0.589	S	S	.	*	H	α-helix	trans	-71.6	-33.2	175.3	-78.6	-25.5	0	0	0	111.9	D433 E440	D433-N436 PolarHBondContact O-N 3Å; N436-E440 PolarHBondContact O-N 3.13Å; N436-E440 VanDerWaalsContact O-N 3.17Å
437	F	44	Very low	51.5	Low	138 Å²	138	126.1 Å²	126.1	61%	0.605	61%	0.613	S	S	*	*	H	α-helix	trans	-72.8	-38.4	174	-78.5	-73.3	0	0	0	112.7	D433 D434 E440 E441	D433-F437 VanDerWaalsContact O-CD2 3.24Å; D433-F437 WeakPolarHBondContact O-CD2 3.44Å; D433-F437 PolarHBondContact O-N 3.44Å; D434-F437 PolarHBondContact O-N 3.08Å; F437-E440 PolarHBondContact O-N 2.9Å; F437-E441 PolarHBondContact O-N 2.66Å; F437-E441 VanDerWaalsContact O-N 3.07Å
438	E	42	Very low	49.4	Very low	136 Å²	136	125.9 Å²	125.9	64%	0.636	61%	0.614	S	S	*	*	H	α-helix	trans	-69.4	-31.7	174.8	-75	-173.7	167.5	0	0	112.7	D434 M442	D434-E438 PolarHBondContact O-N 3.11Å; E438-M442 WeakPolarHBondContact O-CG 3.3Å; E438-M442 PolarHBondContact O-N 2.98Å
439	E	43	Very low	47.3	Very low	128 Å²	128	132 Å²	132	60%	0.598	64%	0.638	S	S	*	*	H	α-helix	trans	-72	-34.1	173.2	-79.8	-169.7	168.5	0	0	112.8	Q435 I443	Q435-E439 WeakPolarHBondContact O-CB 3.29Å; Q435-E439 PolarHBondContact O-N 3.05Å; E439-I443 VanDerWaalsContact O-CD1 3.31Å; E439-I443 WeakPolarHBondContact O-CD1 3.45Å; E439-I443 VanDerWaalsContact O-CG1 3.27Å; E439-I443 WeakPolarHBondContact O-CG1 3.2Å
440	E	42.7	Very low	45.7	Very low	143 Å²	143	137.9 Å²	137.9	67%	0.668	66%	0.66	S	S	*	*	H	α-helix	trans	-71.4	-38.1	173.7	-79.1	-172.2	163.1	0	0	112.8	N436 F437 M442 I443	N436-E440 PolarHBondContact O-N 3.13Å; N436-E440 VanDerWaalsContact O-N 3.17Å; F437-E440 PolarHBondContact O-N 2.9Å; E440-M442 VanDerWaalsContact C-N 3.3Å; E440-M442 PolarHBondContact O-N 3.14Å; E440-I443 PolarHBondContact O-N 2.83Å
441	E	44.4	Very low	44.5	Very low	166 Å²	166	145.3 Å²	145.3	78%	0.776	69%	0.686	S	S	*	*	H	α-helix	trans	-71.4	-20.6	175.2	-82.4	-168.9	164	0	0	113.7	F437 I443	F437-E441 PolarHBondContact O-N 2.66Å; F437-E441 VanDerWaalsContact O-N 3.07Å; E441-I443 VanDerWaalsContact C-N 3.3Å
442	M	46.6	Very low	43.9	Very low	165 Å²	165	141.2 Å²	141.2	81%	0.813	68%	0.682	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.8	-1.1	172.9	-76.9	-137.5	-63	0	0	114.1	E438 E440	E438-M442 WeakPolarHBondContact O-CG 3.3Å; E438-M442 PolarHBondContact O-N 2.98Å; E440-M442 VanDerWaalsContact C-N 3.3Å; E440-M442 PolarHBondContact O-N 3.14Å
443	I	48.7	Very low	43.5	Very low	144 Å²	144	143.1 Å²	143.1	74%	0.738	69%	0.692	S	S	*	*			trans	-106.9	-2	-179.5	-64.9	170.5	0	0	0	112.8	E439 E440 E441	E439-I443 VanDerWaalsContact O-CD1 3.31Å; E439-I443 WeakPolarHBondContact O-CD1 3.45Å; E439-I443 VanDerWaalsContact O-CG1 3.27Å; E439-I443 WeakPolarHBondContact O-CG1 3.2Å; E440-I443 PolarHBondContact O-N 2.83Å; E441-I443 VanDerWaalsContact C-N 3.3Å
444	E	36.4	Very low	43.2	Very low	249 Å²	249	146 Å²	146	100%	1.164	70%	0.701	S	S	*	*			trans	-91.1	0	170.6	-78.1	-162.2	153.7	0	0	115.3

Retrieved 444 of 444 residues in 159.8 ms (Link to these results)

U.S. Privacy Notice - Disclaimer / Registrations / Copyright Statement - Linking Policy - Notice of Privacy Practices (HIPAA) - Notice of Non‑Discrimination
© Copyright 2026 St. Jude Children's Research Hospital, a not-for-profit, section 501(c)(3).