YF021_YEAST Loading...

Putative uncharacterized membrane protein YFL021C-A

AlphaFold DB , UniProt , Accession A0A023PXK7, Species YEAST (Saccharomyces cerevisiae (strain ATCC 204508 / S288c), Baker's yeast), Gene n/a, Length 284 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	28.9	Very low	34.1	Very low	131 Å²	131	62.8 Å²	62.8	65%	0.645	31%	0.314	S	S	*	.				0	133.4	0	-174.5	174.3	80.3	0	0	108.3	L3 V12 I14 I127	M1-L3 HydrophobicContact CE-CD1 4.13Å; M1-L3 HydrophobicContact CE-CD2 4.02Å; M1-L3 HydrophobicContact CE-CG 4.22Å; M1-L3 HydrophobicContact CG-CD2 4.5Å; M1-V12 HydrophobicContact CG-CG1 3.57Å; M1-V12 HydrophobicContact SD-CG1 3.7Å; M1-I14 HydrophobicContact CG-CG1 4.44Å; M1-I127 HydrophobicContact SD-CD1 3.95Å
2	L	26.7	Very low	34.7	Very low	32 Å²	32	57.9 Å²	57.9	17%	0.168	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	131.6	-177.9	-167.9	154.7	0	0	0	108.6	L4 V12 K13 W87 E146	L2-L4 HydrophobicContact CD2-CG 4.07Å; L2-V12 CarbonylContact O-C 3.51Å; L2-V12 WeakPolarHBondContact O-CA 3.49Å; L2-K13 HydrophobicContact CB-CB 4.36Å; L2-K13 PolarHBondContact N-O 3.33Å; L2-K13 PolarHBondContact O-N 3.09Å; L2-W87 HydrophobicContact CD2-CH2 3.33Å; L2-W87 HydrophobicContact CD2-CZ3 3.46Å; L2-W87 VanDerWaalsContact CD2-CZ3 3.46Å; L2-E146 HydrophobicContact CD1-CB 3.47Å; L2-E146 VanDerWaalsContact CD1-CB 3.47Å; L2-E146 HydrophobicContact CG-CB 4.17Å
3	L	33.7	Very low	34.8	Very low	22 Å²	22	58.4 Å²	58.4	12%	0.115	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	134.3	-174.8	-63.9	175.9	0	0	0	109	M1 L10 L11 V12 I143 L145	M1-L3 HydrophobicContact CE-CD1 4.13Å; M1-L3 HydrophobicContact CE-CD2 4.02Å; M1-L3 HydrophobicContact CE-CG 4.22Å; M1-L3 HydrophobicContact CG-CD2 4.5Å; L3-L10 HydrophobicContact CB-CD1 4.14Å; L3-L10 HydrophobicContact CD2-CD1 4.14Å; L3-L10 HydrophobicContact CD2-CD2 4.22Å; L3-L10 HydrophobicContact CD2-CG 4.43Å; L3-L11 CarbonylContact C-O 3.45Å; L3-L11 WeakPolarHBondContact CA-O 3.41Å; L3-V12 HydrophobicContact CD2-CB 3.95Å; L3-V12 HydrophobicContact CD2-CG1 3.72Å; L3-V12 HydrophobicContact CD2-CG2 3.45Å; L3-V12 VanDerWaalsContact CD2-CG2 3.45Å; L3-I143 HydrophobicContact CB-CG2 4.36Å; L3-I143 HydrophobicContact CD1-CG1 4.39Å; L3-I143 HydrophobicContact CD1-CG2 4.18Å; L3-L145 WeakPolarHBondContact O-CD2 3.33Å
4	L	30.3	Very low	35	Very low	33 Å²	33	57.4 Å²	57.4	17%	0.173	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.4	149	174.6	-79.3	-173.8	0	0	0	108.6	L2 L10 L11 W87	L2-L4 HydrophobicContact CD2-CG 4.07Å; L4-L10 CarbonylContact O-C 3.49Å; L4-L11 HydrophobicContact CB-CB 3.94Å; L4-L11 PolarHBondContact N-O 3.31Å; L4-L11 WeakPolarHBondContact O-CA 3.46Å; L4-L11 WeakPolarHBondContact O-CB 2.96Å; L4-L11 PolarHBondContact O-N 3.43Å; L4-W87 HydrophobicContact CB-CE3 4.34Å; L4-W87 HydrophobicContact CB-CH2 4.47Å; L4-W87 HydrophobicContact CB-CZ3 3.88Å; L4-W87 HydrophobicContact CD1-CD2 4.45Å; L4-W87 HydrophobicContact CD1-CE3 4Å; L4-W87 HydrophobicContact CD1-CH2 3.05Å; L4-W87 HydrophobicContact CD1-CZ2 3.6Å; L4-W87 HydrophobicContact CD1-CZ3 3.29Å; L4-W87 HydrophobicContact CG-CE3 4.33Å; L4-W87 HydrophobicContact CG-CH2 3.6Å; L4-W87 HydrophobicContact CG-CZ3 3.45Å; L4-W87 VanDerWaalsContact CG-CZ3 3.45Å
5	F	33.2	Very low	35.1	Very low	106 Å²	106	65.5 Å²	65.5	47%	0.465	32%	0.317	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	130.2	166.8	-79.9	-94.2	0	0	0	109.3	K9 L10 L119	F5-K9 WeakPolarHBondContact CA-O 3.48Å; F5-L10 HydrophobicContact CD1-CB 4.18Å; F5-L10 HydrophobicContact CD1-CD1 4.37Å; F5-L10 HydrophobicContact CD2-CD1 3.72Å; F5-L10 HydrophobicContact CE1-CB 3.75Å; F5-L10 HydrophobicContact CE1-CD1 4Å; F5-L10 HydrophobicContact CE1-CG 4.45Å; F5-L10 HydrophobicContact CE2-CD1 3.27Å; F5-L10 HydrophobicContact CE2-CG 4.46Å; F5-L10 HydrophobicContact CG-CD1 4.26Å; F5-L10 HydrophobicContact CZ-CB 3.99Å; F5-L10 HydrophobicContact CZ-CD1 3.44Å; F5-L10 VanDerWaalsContact CZ-CD1 3.44Å; F5-L10 HydrophobicContact CZ-CG 4.21Å; F5-L119 HydrophobicContact CE1-CD2 3.99Å; F5-L119 HydrophobicContact CZ-CD2 3.79Å
6	K	36.3	Very low	35.2	Very low	123 Å²	123	66.9 Å²	66.9	54%	0.535	32%	0.318	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.5	127.8	175.6	-174.4	-177.2	178.3	-174.7	0	109.2	G8 K9 L11	K6-G8 VanDerWaalsContact C-N 3.28Å; K6-G8 PolarHBondContact O-N 2.86Å; K6-K9 PolarHBondContact N-O 3.06Å; K6-K9 WeakPolarHBondContact O-CB 3Å; K6-K9 PolarHBondContact O-N 3.22Å; K6-L11 HydrophobicContact CB-CD1 3.55Å; K6-L11 HydrophobicContact CB-CG 4.22Å; K6-L11 HydrophobicContact CD-CD1 4.06Å; K6-L11 HydrophobicContact CG-CD1 4.43Å
7	N	36.6	Very low	35.1	Very low	131 Å²	131	69.2 Å²	69.2	70%	0.701	34%	0.344	S	S	*	.	T	Hydrogen-bonded Turn	trans	48.8	45.4	176.6	-59.9	-5.6	0	0	0	113.7	K9	N7-K9 PolarHBondContact O-N 3.34Å
8	G	35.7	Very low	35.4	Very low	24 Å²	24	67.6 Å²	67.6	25%	0.247	34%	0.34	C	S	.	.	T	Hydrogen-bonded Turn	trans	79.8	-6.4	-179.9	0	0	0	0	0	116.2	K6 L98	K6-G8 VanDerWaalsContact C-N 3.28Å; K6-G8 PolarHBondContact O-N 2.86Å; G8-L98 VanDerWaalsContact CA-CB 3.49Å; G8-L98 VanDerWaalsContact CA-CD1 3.45Å
9	K	37.3	Very low	35.9	Very low	71 Å²	71	72.5 Å²	72.5	31%	0.309	36%	0.359	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	136.3	-177.4	-70.5	167.6	155.8	-164.6	0	110.6	F5 K6 N7 L11 E55 S89	F5-K9 WeakPolarHBondContact CA-O 3.48Å; K6-K9 PolarHBondContact N-O 3.06Å; K6-K9 WeakPolarHBondContact O-CB 3Å; K6-K9 PolarHBondContact O-N 3.22Å; N7-K9 PolarHBondContact O-N 3.34Å; K9-L11 PolarHBondContact O-N 2.86Å; K9-E55 IonicContact NZ-OE2 2.72Å; K9-E55 PolarHBondContact NZ-OE2 3.4Å; K9-S89 WeakPolarHBondContact CB-OG 3.25Å; K9-S89 WeakPolarHBondContact CD-OG 3.37Å; K9-S89 WeakPolarHBondContact CG-OG 3.41Å
10	L	41.8	Very low	36.3	Very low	5 Å²	5	76.4 Å²	76.4	3%	0.026	38%	0.376	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.3	116.1	168	176.9	74.9	0	0	0	108.8	L3 L4 F5 V12 S89 V90 L119 I123	L3-L10 HydrophobicContact CB-CD1 4.14Å; L3-L10 HydrophobicContact CD2-CD1 4.14Å; L3-L10 HydrophobicContact CD2-CD2 4.22Å; L3-L10 HydrophobicContact CD2-CG 4.43Å; L4-L10 CarbonylContact O-C 3.49Å; F5-L10 HydrophobicContact CD1-CB 4.18Å; F5-L10 HydrophobicContact CD1-CD1 4.37Å; F5-L10 HydrophobicContact CD2-CD1 3.72Å; F5-L10 HydrophobicContact CE1-CB 3.75Å; F5-L10 HydrophobicContact CE1-CD1 4Å; F5-L10 HydrophobicContact CE1-CG 4.45Å; F5-L10 HydrophobicContact CE2-CD1 3.27Å; F5-L10 HydrophobicContact CE2-CG 4.46Å; F5-L10 HydrophobicContact CG-CD1 4.26Å; F5-L10 HydrophobicContact CZ-CB 3.99Å; F5-L10 HydrophobicContact CZ-CD1 3.44Å; F5-L10 VanDerWaalsContact CZ-CD1 3.44Å; F5-L10 HydrophobicContact CZ-CG 4.21Å; L10-V12 HydrophobicContact CD2-CG2 3.88Å; L10-V12 HydrophobicContact CG-CG2 4.02Å; L10-S89 CarbonylContact O-C 3.55Å; L10-S89 VanDerWaalsContact O-CA 3.31Å; L10-S89 WeakPolarHBondContact O-CA 3.45Å; L10-V90 PolarHBondContact O-N 2.7Å; L10-L119 HydrophobicContact CB-CD1 4.09Å; L10-L119 HydrophobicContact CB-CD2 3.92Å; L10-L119 HydrophobicContact CB-CG 4.45Å; L10-L119 HydrophobicContact CD2-CD1 4.06Å; L10-L119 HydrophobicContact CD2-CD2 3.78Å; L10-L119 HydrophobicContact CD2-CG 3.87Å; L10-L119 HydrophobicContact CG-CD2 4.34Å; L10-I123 HydrophobicContact CD2-CD1 3.24Å; L10-I123 HydrophobicContact CD2-CG1 4.03Å
11	L	34.8	Very low	36.5	Very low	13 Å²	13	75.8 Å²	75.8	7%	0.068	37%	0.374	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.7	113.2	172	-64.2	-179.3	0	0	0	110.3	L3 L4 K6 K9 V57 W87 L88	L3-L11 CarbonylContact C-O 3.45Å; L3-L11 WeakPolarHBondContact CA-O 3.41Å; L4-L11 HydrophobicContact CB-CB 3.94Å; L4-L11 PolarHBondContact N-O 3.31Å; L4-L11 WeakPolarHBondContact O-CA 3.46Å; L4-L11 WeakPolarHBondContact O-CB 2.96Å; L4-L11 PolarHBondContact O-N 3.43Å; K6-L11 HydrophobicContact CB-CD1 3.55Å; K6-L11 HydrophobicContact CB-CG 4.22Å; K6-L11 HydrophobicContact CD-CD1 4.06Å; K6-L11 HydrophobicContact CG-CD1 4.43Å; K9-L11 PolarHBondContact O-N 2.86Å; L11-V57 HydrophobicContact CD2-CG2 4.04Å; L11-W87 HydrophobicContact CB-CB 4.16Å; L11-W87 HydrophobicContact CB-CD2 4.4Å; L11-W87 HydrophobicContact CB-CE3 3.81Å; L11-W87 HydrophobicContact CD1-CB 4.46Å; L11-W87 HydrophobicContact CD2-CB 4.03Å; L11-W87 HydrophobicContact CG-CB 4.46Å; L11-L88 CarbonylContact C-O 3.48Å; L11-L88 VanDerWaalsContact CA-O 3.25Å; L11-L88 WeakPolarHBondContact CA-O 3.35Å
12	V	40.7	Very low	37	Very low	4 Å²	4	72.5 Å²	72.5	2%	0.024	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	121.6	175.5	-171.4	0	0	0	0	109.5	M1 L2 L3 L10 I14 L88 V90	M1-V12 HydrophobicContact CG-CG1 3.57Å; M1-V12 HydrophobicContact SD-CG1 3.7Å; L2-V12 CarbonylContact O-C 3.51Å; L2-V12 WeakPolarHBondContact O-CA 3.49Å; L3-V12 HydrophobicContact CD2-CB 3.95Å; L3-V12 HydrophobicContact CD2-CG1 3.72Å; L3-V12 HydrophobicContact CD2-CG2 3.45Å; L3-V12 VanDerWaalsContact CD2-CG2 3.45Å; L10-V12 HydrophobicContact CD2-CG2 3.88Å; L10-V12 HydrophobicContact CG-CG2 4.02Å; V12-I14 HydrophobicContact CG1-CG1 4.11Å; V12-L88 HydrophobicContact CB-CB 4.29Å; V12-L88 PolarHBondContact N-O 2.91Å; V12-L88 WeakPolarHBondContact O-CB 3.5Å; V12-L88 PolarHBondContact O-N 2.96Å; V12-V90 HydrophobicContact CG2-CG2 4.37Å
13	K	36.5	Very low	37.7	Very low	64 Å²	64	77.7 Å²	77.7	28%	0.278	38%	0.381	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	112.2	168.5	-173.4	170.2	-175.4	172.9	0	109.4	L2 W87	L2-K13 HydrophobicContact CB-CB 4.36Å; L2-K13 PolarHBondContact N-O 3.33Å; L2-K13 PolarHBondContact O-N 3.09Å; K13-W87 HydrophobicContact CB-CD2 4.07Å; K13-W87 HydrophobicContact CB-CE3 3.57Å; K13-W87 HydrophobicContact CB-CH2 4.05Å; K13-W87 HydrophobicContact CB-CZ3 3.55Å; K13-W87 HydrophobicContact CD-CD2 4.4Å; K13-W87 HydrophobicContact CD-CH2 4.08Å; K13-W87 HydrophobicContact CD-CZ2 3.89Å; K13-W87 HydrophobicContact CD-CZ3 4.41Å
14	I	37.7	Very low	38.1	Very low	44 Å²	44	80 Å²	80	23%	0.226	39%	0.391	C	S	.	.			trans	-90.7	118.6	171.1	-55.6	-175.3	0	0	0	107.3	M1 V12 W16 M80 L88 I127	M1-I14 HydrophobicContact CG-CG1 4.44Å; V12-I14 HydrophobicContact CG1-CG1 4.11Å; I14-W16 HydrophobicContact CG2-CD2 4.32Å; I14-W16 HydrophobicContact CG2-CZ2 4.11Å; I14-M80 HydrophobicContact CD1-CE 4.11Å; I14-M80 HydrophobicContact CD1-SD 3.4Å; I14-M80 WeakPolarHBondContact CD1-SD 3.29Å; I14-L88 HydrophobicContact CD1-CD1 4.41Å; I14-I127 HydrophobicContact CD1-CD1 4.34Å
15	K	37.1	Very low	38.4	Very low	180 Å²	180	81.4 Å²	81.4	78%	0.783	40%	0.401	S	S	*	.			trans	-106.9	110.1	172.1	-171.3	-179.4	-179	-174.9	0	106.7
16	W	35.6	Very low	38.6	Very low	87 Å²	87	80.4 Å²	80.4	33%	0.33	41%	0.407	S	S	.	.			trans	-71.1	126.6	168.6	-56.6	102.7	0	0	0	107.9	I14 S18 V25 L77	I14-W16 HydrophobicContact CG2-CD2 4.32Å; I14-W16 HydrophobicContact CG2-CZ2 4.11Å; W16-S18 VanDerWaalsContact C-N 3.33Å; W16-V25 HydrophobicContact CZ3-CG2 4.4Å; W16-L77 HydrophobicContact CH2-CD2 4.19Å; W16-L77 HydrophobicContact CZ2-CD2 4.41Å
17	S	34.3	Very low	38.7	Very low	107 Å²	107	83.4 Å²	83.4	75%	0.748	42%	0.415	S	S	*	.	S	Bend	trans	-72.2	-28.8	179.7	23.2	0	0	0	0	112.2	D21	S17-D21 WeakPolarHBondContact CB-OD2 3.35Å; S17-D21 PolarHBondContact OG-OD2 3.18Å
18	S	39.5	Very low	38.6	Very low	40 Å²	40	82.7 Å²	82.7	28%	0.28	41%	0.406	S	S	.	.			trans	-156.1	163.7	179.4	69	0	0	0	0	111.9	W16 E20 D21	W16-S18 VanDerWaalsContact C-N 3.33Å; S18-E20 PolarHBondContact O-N 3.23Å; S18-E20 PolarHBondContact OG-N 2.93Å; S18-D21 PolarHBondContact N-OD2 3.31Å; S18-D21 VanDerWaalsContact N-OD2 3.12Å; S18-D21 PolarHBondContact O-N 2.73Å; S18-D21 PolarHBondContact OG-N 3.32Å; S18-D21 VanDerWaalsContact OG-N 3.09Å; S18-D21 PolarHBondContact OG-OD2 3.41Å
19	K	44.6	Very low	38.5	Very low	161 Å²	161	84.7 Å²	84.7	70%	0.7	41%	0.41	S	S	*	.	H	α-helix	trans	-65.4	-26.6	169.2	-85	-175.3	174.5	-178.8	0	112.2	E22 Q23	K19-E22 WeakPolarHBondContact O-CB 3.46Å; K19-E22 PolarHBondContact O-N 3.04Å; K19-Q23 PolarHBondContact O-N 2.87Å
20	E	44.8	Very low	38.2	Very low	150 Å²	150	84.2 Å²	84.2	70%	0.701	43%	0.426	S	S	*	.	H	α-helix	trans	-67.9	-39.5	178.5	-68.5	158.4	-173.4	0	0	110.5	S18 E22 Q23 E24	S18-E20 PolarHBondContact O-N 3.23Å; S18-E20 PolarHBondContact OG-N 2.93Å; E20-E22 VanDerWaalsContact C-N 3.29Å; E20-E22 PolarHBondContact O-N 3.18Å; E20-Q23 PolarHBondContact O-N 3.1Å; E20-E24 VanDerWaalsContact O-CB 3.29Å; E20-E24 WeakPolarHBondContact O-CB 3.32Å; E20-E24 PolarHBondContact O-N 2.74Å
21	D	40.9	Very low	37.6	Very low	63 Å²	63	92 Å²	92	34%	0.337	46%	0.46	S	S	.	.	H	α-helix	trans	-62	-35.1	174	-62.8	-45.8	0	0	0	112.4	S17 S18 V25	S17-D21 WeakPolarHBondContact CB-OD2 3.35Å; S17-D21 PolarHBondContact OG-OD2 3.18Å; S18-D21 PolarHBondContact N-OD2 3.31Å; S18-D21 VanDerWaalsContact N-OD2 3.12Å; S18-D21 PolarHBondContact O-N 2.73Å; S18-D21 PolarHBondContact OG-N 3.32Å; S18-D21 VanDerWaalsContact OG-N 3.09Å; S18-D21 PolarHBondContact OG-OD2 3.41Å; D21-V25 VanDerWaalsContact O-CG2 3.24Å; D21-V25 WeakPolarHBondContact O-CG2 3.5Å; D21-V25 PolarHBondContact O-N 2.7Å
22	E	38.2	Very low	37.6	Very low	63 Å²	63	94.7 Å²	94.7	29%	0.294	48%	0.477	S	S	.	.	H	α-helix	trans	-67.8	-42.5	177.3	-171.5	179.7	175.8	0	0	111.5	K19 E20 S26 S81	K19-E22 WeakPolarHBondContact O-CB 3.46Å; K19-E22 PolarHBondContact O-N 3.04Å; E20-E22 VanDerWaalsContact C-N 3.29Å; E20-E22 PolarHBondContact O-N 3.18Å; E22-S26 PolarHBondContact O-N 2.89Å; E22-S81 VanDerWaalsContact OE1-CB 3.3Å; E22-S81 WeakPolarHBondContact OE1-CB 2.93Å
23	Q	42.6	Very low	37	Very low	140 Å²	140	99.2 Å²	99.2	65%	0.654	50%	0.498	S	S	*	.	H	α-helix	trans	-75.1	-39	179.2	-70.9	-177.9	-12.8	0	0	113.1	K19 E20 V25 S26 R27	K19-Q23 PolarHBondContact O-N 2.87Å; E20-Q23 PolarHBondContact O-N 3.1Å; Q23-V25 VanDerWaalsContact C-N 3.3Å; Q23-V25 PolarHBondContact O-N 2.14Å; Q23-S26 PolarHBondContact O-N 3.37Å; Q23-R27 WeakPolarHBondContact O-CB 3.29Å; Q23-R27 PolarHBondContact O-N 3.29Å
24	E	41	Very low	36.6	Very low	72 Å²	72	100 Å²	100	34%	0.336	52%	0.517	S	S	.	.	H	α-helix	trans	-62.4	-38.3	178.4	-172.1	79	-159	0	0	111.3	E20 R27 K28	E20-E24 VanDerWaalsContact O-CB 3.29Å; E20-E24 WeakPolarHBondContact O-CB 3.32Å; E20-E24 PolarHBondContact O-N 2.74Å; E24-R27 IonicContact OE1-NH2 3.1Å; E24-R27 PolarHBondContact OE1-NH2 3.23Å; E24-R27 VanDerWaalsContact OE1-NH2 3.1Å; E24-R27 IonicContact OE2-CZ 3.9Å; E24-R27 IonicContact OE2-NH2 3.18Å; E24-R27 PolarHBondContact OE2-NH2 3.34Å; E24-K28 HydrophobicContact CG-CD 4.36Å; E24-K28 WeakPolarHBondContact O-CB 3.15Å; E24-K28 WeakPolarHBondContact O-CG 3.24Å; E24-K28 PolarHBondContact O-N 3.48Å; E24-K28 WeakPolarHBondContact OE1-CE 3.26Å; E24-K28 IonicContact OE1-NZ 2.84Å; E24-K28 PolarHBondContact OE1-NZ 2.77Å
25	V	37.9	Very low	36.3	Very low	61 Å²	61	105 Å²	105	37%	0.37	54%	0.543	S	S	.	.	H	α-helix	trans	-66.6	-45.9	173.3	172	0	0	0	0	110.6	W16 D21 Q23 R27 K28 L29 L77	W16-V25 HydrophobicContact CZ3-CG2 4.4Å; D21-V25 VanDerWaalsContact O-CG2 3.24Å; D21-V25 WeakPolarHBondContact O-CG2 3.5Å; D21-V25 PolarHBondContact O-N 2.7Å; Q23-V25 VanDerWaalsContact C-N 3.3Å; Q23-V25 PolarHBondContact O-N 2.14Å; V25-R27 VanDerWaalsContact C-N 3.31Å; V25-R27 PolarHBondContact O-N 3.23Å; V25-K28 PolarHBondContact O-N 2.57Å; V25-L29 WeakPolarHBondContact O-CD1 3.19Å; V25-L29 VanDerWaalsContact O-CG 3.29Å; V25-L29 WeakPolarHBondContact O-CG 3.31Å; V25-L77 HydrophobicContact CG1-CD1 4.35Å
26	S	37	Very low	35.9	Very low	86 Å²	86	100.4 Å²	100.4	60%	0.601	53%	0.533	S	S	*	.	H	α-helix	trans	-59.1	-40.3	178	-164.8	0	0	0	0	112.7	E22 Q23	E22-S26 PolarHBondContact O-N 2.89Å; Q23-S26 PolarHBondContact O-N 3.37Å
27	R	37.1	Very low	35.5	Very low	185 Å²	185	102 Å²	102	70%	0.698	54%	0.544	S	S	*	.	H	α-helix	trans	-69.7	-33.6	179.8	-168.4	-179.2	69.9	177.5	-4.4	113.8	Q23 E24 V25	Q23-R27 WeakPolarHBondContact O-CB 3.29Å; Q23-R27 PolarHBondContact O-N 3.29Å; E24-R27 IonicContact OE1-NH2 3.1Å; E24-R27 PolarHBondContact OE1-NH2 3.23Å; E24-R27 VanDerWaalsContact OE1-NH2 3.1Å; E24-R27 IonicContact OE2-CZ 3.9Å; E24-R27 IonicContact OE2-NH2 3.18Å; E24-R27 PolarHBondContact OE2-NH2 3.34Å; V25-R27 VanDerWaalsContact C-N 3.31Å; V25-R27 PolarHBondContact O-N 3.23Å
28	K	36.2	Very low	35.3	Very low	117 Å²	117	99.8 Å²	99.8	51%	0.509	53%	0.532	S	S	.	.	H	α-helix	trans	-83.9	-6.6	-173.3	-78.3	178.8	177.8	160	0	115.1	E24 V25 G30	E24-K28 HydrophobicContact CG-CD 4.36Å; E24-K28 WeakPolarHBondContact O-CB 3.15Å; E24-K28 WeakPolarHBondContact O-CG 3.24Å; E24-K28 PolarHBondContact O-N 3.48Å; E24-K28 WeakPolarHBondContact OE1-CE 3.26Å; E24-K28 IonicContact OE1-NZ 2.84Å; E24-K28 PolarHBondContact OE1-NZ 2.77Å; V25-K28 PolarHBondContact O-N 2.57Å; K28-G30 PolarHBondContact O-N 3.12Å
29	L	33.5	Very low	34.8	Very low	65 Å²	65	106.2 Å²	106.2	34%	0.34	55%	0.55	S	S	.	*			trans	-69.3	16.6	-175.1	-72.2	161.2	0	0	0	115.9	V25 K31 L77	V25-L29 WeakPolarHBondContact O-CD1 3.19Å; V25-L29 VanDerWaalsContact O-CG 3.29Å; V25-L29 WeakPolarHBondContact O-CG 3.31Å; L29-K31 PolarHBondContact O-N 2.76Å; L29-K31 VanDerWaalsContact O-N 3.11Å; L29-L77 HydrophobicContact CD1-CD1 3.87Å
30	G	30.7	Very low	34.1	Very low	62 Å²	62	102.2 Å²	102.2	64%	0.639	53%	0.531	S	S	*	.			trans	-70.2	99.2	177.6	0	0	0	0	0	113.2	K28	K28-G30 PolarHBondContact O-N 3.12Å
31	K	30	Very low	33.4	Very low	169 Å²	169	101.2 Å²	101.2	74%	0.735	53%	0.526	S	S	*	.			trans	36.3	102	158	-63.2	-174.3	177.8	-174.9	0	118.1	L29	L29-K31 PolarHBondContact O-N 2.76Å; L29-K31 VanDerWaalsContact O-N 3.11Å
32	P	32.9	Very low	32.9	Very low	68 Å²	68	101.2 Å²	101.2	44%	0.442	54%	0.535	S	S	.	.			trans	-137.1	93.1	135.6	28.6	-9.3	0	0	0	110.3
33	E	28.4	Very low	32.5	Very low	100 Å²	100	101.8 Å²	101.8	47%	0.467	54%	0.54	S	S	.	.			trans	-81.6	-35.2	-177.4	-86.2	128.7	-152.2	0	0	113.6	L35 E37 K130	E33-L35 PolarHBondContact O-N 3.09Å; E33-E37 PolarHBondContact O-N 3.45Å; E33-K130 IonicContact OE1-NZ 2.7Å; E33-K130 PolarHBondContact OE1-NZ 2.98Å
34	A	29.7	Very low	31.7	Very low	81 Å²	81	96.6 Å²	96.6	67%	0.669	52%	0.519	S	S	*	.	H	α-helix	trans	-68.8	-31.2	-164.4	0	0	0	0	0	116.3	A38	A34-A38 PolarHBondContact O-N 3.21Å
35	L	29.8	Very low	31	Very low	147 Å²	147	100.9 Å²	100.9	77%	0.77	54%	0.541	S	S	*	.	H	α-helix	trans	-89.5	-26.1	-170.5	-131.4	145.4	0	0	0	113.1	E33	E33-L35 PolarHBondContact O-N 3.09Å
36	C	29.4	Very low	30.6	Very low	84 Å²	84	101.3 Å²	101.3	57%	0.568	55%	0.547	S	S	*	.	H	α-helix	trans	-80.3	-38.4	174.2	-157.7	0	0	0	0	110.4	A38 R39 W40	C36-A38 PolarHBondContact O-N 3.15Å; C36-R39 PolarHBondContact O-N 3.21Å; C36-W40 WeakPolarHBondContact O-CA 3.22Å; C36-W40 WeakPolarHBondContact O-CB 3.32Å; C36-W40 PolarHBondContact O-N 3.46Å
37	E	27.7	Very low	30.5	Very low	121 Å²	121	98.6 Å²	98.6	57%	0.565	53%	0.525	S	S	*	.	H	α-helix	trans	-59.2	-44.4	174.4	-78.9	-174.1	165.9	0	0	112.3	E33 R39 W40 E41	E33-E37 PolarHBondContact O-N 3.45Å; E37-R39 PolarHBondContact O-N 3.47Å; E37-W40 CarbonylContact O-C 3.4Å; E37-W40 PolarHBondContact O-N 3.06Å; E37-E41 WeakPolarHBondContact O-CB 3.18Å; E37-E41 PolarHBondContact O-N 2.86Å
38	A	30	Very low	30.2	Very low	60 Å²	60	94.1 Å²	94.1	50%	0.496	52%	0.522	S	S	.	.	H	α-helix	trans	-63.2	-39.6	179.1	0	0	0	0	0	113.4	A34 C36 A42	A34-A38 PolarHBondContact O-N 3.21Å; C36-A38 PolarHBondContact O-N 3.15Å; A38-A42 PolarHBondContact O-N 2.91Å
39	R	28.3	Very low	30.2	Very low	176 Å²	176	99.8 Å²	99.8	66%	0.664	54%	0.54	S	S	*	.	H	α-helix	trans	-77.8	-29.5	178.2	-136.4	173.1	-176.9	177.3	-0.2	111.7	C36 E37 L43	C36-R39 PolarHBondContact O-N 3.21Å; E37-R39 PolarHBondContact O-N 3.47Å; R39-L43 WeakPolarHBondContact O-CB 3.21Å; R39-L43 WeakPolarHBondContact O-CG 3.4Å; R39-L43 PolarHBondContact O-N 2.85Å
40	W	30.3	Very low	30.7	Very low	76 Å²	76	97.8 Å²	97.8	29%	0.288	53%	0.532	S	S	.	.	H	α-helix	trans	-73.7	-40.8	173.8	177.8	-94.5	0	0	0	111.9	C36 E37 A42 L43 S44 R125	C36-W40 WeakPolarHBondContact O-CA 3.22Å; C36-W40 WeakPolarHBondContact O-CB 3.32Å; C36-W40 PolarHBondContact O-N 3.46Å; E37-W40 CarbonylContact O-C 3.4Å; E37-W40 PolarHBondContact O-N 3.06Å; W40-A42 VanDerWaalsContact C-N 3.29Å; W40-A42 PolarHBondContact O-N 3.12Å; W40-L43 PolarHBondContact O-N 3.31Å; W40-S44 VanDerWaalsContact CZ2-CB 3.46Å; W40-S44 PolarHBondContact NE1-OG 2.88Å; W40-S44 WeakPolarHBondContact O-CA 3.34Å; W40-S44 WeakPolarHBondContact O-CB 3.46Å; W40-S44 PolarHBondContact O-N 3.37Å; W40-S44 PolarHBondContact O-OG 3.29Å; W40-R125 HydrophobicContact CH2-CG 4.37Å; W40-R125 HydrophobicContact CZ3-CG 4.01Å
41	E	29.3	Very low	31.4	Very low	129 Å²	129	99.5 Å²	99.5	60%	0.603	52%	0.523	S	S	*	.	H	α-helix	trans	-59.4	-44.7	171.6	-80.9	-174.1	152.1	0	0	109.8	E37 L43 M45	E37-E41 WeakPolarHBondContact O-CB 3.18Å; E37-E41 PolarHBondContact O-N 2.86Å; E41-L43 VanDerWaalsContact C-N 3.34Å; E41-L43 PolarHBondContact O-N 3.35Å; E41-M45 WeakPolarHBondContact O-CB 3.22Å; E41-M45 VanDerWaalsContact O-CG 3.24Å; E41-M45 WeakPolarHBondContact O-CG 3.39Å; E41-M45 PolarHBondContact O-N 3.28Å; E41-M45 VanDerWaalsContact O-N 3.12Å
42	A	31.1	Very low	32.2	Very low	64 Å²	64	92.5 Å²	92.5	53%	0.529	50%	0.496	S	S	.	.	H	α-helix	trans	-60.9	-38.4	175.9	0	0	0	0	0	113.5	A38 W40	A38-A42 PolarHBondContact O-N 2.91Å; W40-A42 VanDerWaalsContact C-N 3.29Å; W40-A42 PolarHBondContact O-N 3.12Å
43	L	28.7	Very low	32.9	Very low	74 Å²	74	91.5 Å²	91.5	39%	0.387	49%	0.488	S	S	.	.	H	α-helix	trans	-88.9	-34.5	-178.9	-77	163	0	0	0	113.6	R39 W40 E41 S46 L47	R39-L43 WeakPolarHBondContact O-CB 3.21Å; R39-L43 WeakPolarHBondContact O-CG 3.4Å; R39-L43 PolarHBondContact O-N 2.85Å; W40-L43 PolarHBondContact O-N 3.31Å; E41-L43 VanDerWaalsContact C-N 3.34Å; E41-L43 PolarHBondContact O-N 3.35Å; L43-S46 PolarHBondContact O-N 3.43Å; L43-S46 VanDerWaalsContact O-N 3.11Å; L43-S46 PolarHBondContact O-OG 3.25Å; L43-L47 WeakPolarHBondContact O-CG 3.34Å; L43-L47 PolarHBondContact O-N 2.86Å; L43-L47 VanDerWaalsContact O-N 3.07Å
44	S	26.6	Very low	33.9	Very low	32 Å²	32	86.9 Å²	86.9	22%	0.224	47%	0.467	C	S	.	.	H	α-helix	trans	-74.9	-28.2	-178.7	68.3	0	0	0	0	113	W40 S46 L47	W40-S44 VanDerWaalsContact CZ2-CB 3.46Å; W40-S44 PolarHBondContact NE1-OG 2.88Å; W40-S44 WeakPolarHBondContact O-CA 3.34Å; W40-S44 WeakPolarHBondContact O-CB 3.46Å; W40-S44 PolarHBondContact O-N 3.37Å; W40-S44 PolarHBondContact O-OG 3.29Å; S44-S46 PolarHBondContact O-N 2.95Å; S44-L47 CarbonylContact O-C 3.5Å; S44-L47 PolarHBondContact O-N 3.2Å
45	M	25.9	Very low	34.9	Very low	161 Å²	161	86.2 Å²	86.2	79%	0.793	45%	0.45	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.4	-25.5	166.9	-75.4	-161.9	-65.9	0	0	112.1	E41	E41-M45 WeakPolarHBondContact O-CB 3.22Å; E41-M45 VanDerWaalsContact O-CG 3.24Å; E41-M45 WeakPolarHBondContact O-CG 3.39Å; E41-M45 PolarHBondContact O-N 3.28Å; E41-M45 VanDerWaalsContact O-N 3.12Å
46	S	29.9	Very low	35.7	Very low	70 Å²	70	79.5 Å²	79.5	49%	0.49	42%	0.415	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.7	-19.2	174.7	77.3	0	0	0	0	114.4	L43 S44 S48	L43-S46 PolarHBondContact O-N 3.43Å; L43-S46 VanDerWaalsContact O-N 3.11Å; L43-S46 PolarHBondContact O-OG 3.25Å; S44-S46 PolarHBondContact O-N 2.95Å; S46-S48 PolarHBondContact O-N 3.3Å
47	L	34.4	Very low	36.7	Very low	30 Å²	30	78.2 Å²	78.2	16%	0.157	41%	0.405	C	S	.	.	S	Bend	trans	-103.6	62.6	-177.6	-66.7	168.9	0	0	0	109.9	L43 S44 R49 E118	L43-L47 WeakPolarHBondContact O-CG 3.34Å; L43-L47 PolarHBondContact O-N 2.86Å; L43-L47 VanDerWaalsContact O-N 3.07Å; S44-L47 CarbonylContact O-C 3.5Å; S44-L47 PolarHBondContact O-N 3.2Å; L47-R49 PolarHBondContact O-N 2.74Å; L47-R49 VanDerWaalsContact O-N 3.08Å; L47-E118 HydrophobicContact CD2-CG 3.5Å; L47-E118 VanDerWaalsContact CD2-CG 3.5Å
48	S	32.4	Very low	37.7	Very low	91 Å²	91	75.1 Å²	75.1	64%	0.636	40%	0.396	S	S	*	.			trans	-61.8	111.1	173.9	61.1	0	0	0	0	110.3	S46 S50	S46-S48 PolarHBondContact O-N 3.3Å; S48-S50 PolarHBondContact O-N 3.38Å
49	R	35.7	Very low	38.4	Very low	235 Å²	235	77 Å²	77	89%	0.887	40%	0.402	S	S	*	.	S	Bend	trans	67.4	23	155.1	-55.6	-179.4	176	177.1	-1.5	118.8	L47 E51	L47-R49 PolarHBondContact O-N 2.74Å; L47-R49 VanDerWaalsContact O-N 3.08Å; R49-E51 PolarHBondContact O-N 3.15Å
50	S	43.8	Very low	39	Very low	23 Å²	23	71.7 Å²	71.7	16%	0.161	39%	0.391	C	S	.	.			trans	-71.6	112.2	168.5	-5.9	0	0	0	0	110.3	S48 C52	S48-S50 PolarHBondContact O-N 3.38Å; S50-C52 PolarHBondContact O-N 3.14Å
51	E	45.8	Very low	39.3	Very low	98 Å²	98	74.4 Å²	74.4	46%	0.458	42%	0.422	S	S	.	.			trans	-78	112.9	173	-44.5	-164.8	105.7	0	0	109.2	R49 T53 K72 S93	R49-E51 PolarHBondContact O-N 3.15Å; E51-T53 PolarHBondContact O-N 2.88Å; E51-K72 IonicContact OE1-NZ 2.82Å; E51-K72 PolarHBondContact OE1-NZ 3.43Å; E51-S93 WeakPolarHBondContact CA-OG 3.3Å; E51-S93 WeakPolarHBondContact CB-OG 3.38Å; E51-S93 WeakPolarHBondContact CG-OG 3.43Å; E51-S93 PolarHBondContact N-OG 3.29Å; E51-S93 WeakPolarHBondContact O-CB 3.43Å; E51-S93 PolarHBondContact O-N 3.18Å; E51-S93 PolarHBondContact O-OG 3.48Å
52	C	46.1	Very low	39.8	Very low	23 Å²	23	72.3 Å²	72.3	16%	0.155	42%	0.421	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.1	115.5	168.8	-159.7	0	0	0	0	107.8	S50 S91 C122 L126	S50-C52 PolarHBondContact O-N 3.14Å; C52-S91 CarbonylContact C-O 3.46Å; C52-S91 WeakPolarHBondContact CA-O 3.4Å; C52-C122 VanDerWaalsContact CA-SG 3.58Å; C52-C122 HydrophobicContact CB-CB 4.45Å; C52-C122 WeakPolarHBondContact CB-SG 3.46Å; C52-C122 WeakPolarHBondContact SG-CB 3.38Å; C52-C122 CovalentContact SG-SG 2.02Å; C52-C122 PolarHBondContact SG-SG 2.82Å; C52-L126 WeakPolarHBondContact SG-CD1 3.39Å
53	T	48.4	Very low	40	Very low	46 Å²	46	75.2 Å²	75.2	28%	0.282	44%	0.438	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	135.4	170.5	52.5	0	0	0	0	109.3	E51 S91	E51-T53 PolarHBondContact O-N 2.88Å; T53-S91 PolarHBondContact N-O 3.47Å; T53-S91 PolarHBondContact O-N 2.67Å; T53-S91 PolarHBondContact O-OG 3Å; T53-S91 PolarHBondContact OG1-OG 3Å
54	M	48.6	Very low	40.6	Very low	3 Å²	3	76 Å²	76	2%	0.015	45%	0.449	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122	129.7	175.7	179.1	-167.4	-65.9	0	0	109.3	T69 F70 F79 L88 S89 V90 L126	M54-T69 CarbonylContact O-C 3.58Å; M54-T69 WeakPolarHBondContact O-CA 3.27Å; M54-F70 HydrophobicContact CB-CB 3.74Å; M54-F70 HydrophobicContact CB-CG 4.39Å; M54-F70 HydrophobicContact CG-CB 4.39Å; M54-F70 PolarHBondContact O-N 3.48Å; M54-F70 HydrophobicContact SD-CB 4.44Å; M54-F79 HydrophobicContact CG-CE1 4.14Å; M54-F79 HydrophobicContact SD-CD1 3.76Å; M54-F79 HydrophobicContact SD-CE1 3.55Å; M54-F79 VanDerWaalsContact SD-CE1 3.55Å; M54-L88 HydrophobicContact CE-CD1 4.4Å; M54-L88 HydrophobicContact CG-CB 4.19Å; M54-L88 HydrophobicContact CG-CD2 4.21Å; M54-L88 HydrophobicContact SD-CB 4.24Å; M54-L88 HydrophobicContact SD-CD1 4.07Å; M54-L88 HydrophobicContact SD-CD2 3.71Å; M54-L88 HydrophobicContact SD-CG 4.21Å; M54-S89 CarbonylContact C-O 3.58Å; M54-S89 VanDerWaalsContact CA-O 3.23Å; M54-S89 WeakPolarHBondContact CA-O 3.34Å; M54-V90 HydrophobicContact CE-CG2 4.42Å; M54-L126 HydrophobicContact CE-CB 3.74Å; M54-L126 HydrophobicContact CE-CD1 3.24Å; M54-L126 HydrophobicContact CE-CD2 3.54Å; M54-L126 HydrophobicContact CE-CG 3.65Å
55	E	50.7	Low	41.4	Very low	67 Å²	67	81 Å²	81	31%	0.313	48%	0.484	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	130.5	175.5	-67.8	173.3	166.7	0	0	109.8	K9 V57 N68 T69 L88 S89	K9-E55 IonicContact NZ-OE2 2.72Å; K9-E55 PolarHBondContact NZ-OE2 3.4Å; E55-V57 PolarHBondContact O-N 2.92Å; E55-N68 CarbonylContact C-O 3.53Å; E55-N68 VanDerWaalsContact CA-O 3.27Å; E55-N68 WeakPolarHBondContact CA-O 3.05Å; E55-T69 HydrophobicContact CG-CG2 4.31Å; E55-L88 CarbonylContact O-C 3.53Å; E55-S89 PolarHBondContact N-O 2.73Å; E55-S89 WeakPolarHBondContact O-CB 3.3Å; E55-S89 PolarHBondContact O-N 2.65Å
56	C	46.9	Very low	42.7	Very low	7 Å²	7	76 Å²	76	5%	0.047	47%	0.466	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82	111	171.1	174.4	0	0	0	0	109.4	N68 F79 R83 C86 L88	C56-N68 PolarHBondContact N-O 3.2Å; C56-F79 HydrophobicContact CB-CE1 4.41Å; C56-F79 HydrophobicContact CB-CZ 4.2Å; C56-R83 WeakPolarHBondContact SG-CD 3.16Å; C56-C86 HydrophobicContact CB-CB 4.18Å; C56-C86 WeakPolarHBondContact CB-SG 3.32Å; C56-C86 WeakPolarHBondContact SG-CB 3.41Å; C56-C86 CovalentContact SG-SG 2.03Å; C56-C86 PolarHBondContact SG-SG 3.18Å; C56-L88 HydrophobicContact CB-CD2 4.47Å
57	V	49	Very low	43.8	Very low	57 Å²	57	75.9 Å²	75.9	35%	0.345	47%	0.465	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.6	97.7	173.1	-173.7	0	0	0	0	107.5	L11 E55 W87	L11-V57 HydrophobicContact CD2-CG2 4.04Å; E55-V57 PolarHBondContact O-N 2.92Å; V57-W87 HydrophobicContact CB-CB 4.32Å; V57-W87 PolarHBondContact N-O 3.41Å; V57-W87 PolarHBondContact O-N 2.73Å
58	S	50	Low	44.9	Very low	56 Å²	56	78.2 Å²	78.2	39%	0.392	48%	0.477	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.1	138.3	172.3	46.1	0	0	0	0	110.4	S60	S58-S60 VanDerWaalsContact C-N 3.29Å
59	T	44.6	Very low	46.2	Very low	100 Å²	100	76.9 Å²	76.9	61%	0.613	47%	0.466	S	S	*	.	S	Bend	trans	-81.8	-10.4	171.1	49	0	0	0	0	113
60	S	40.4	Very low	46.9	Very low	63 Å²	63	67 Å²	67	44%	0.441	43%	0.429	S	S	.	.	S	Bend	trans	-109.4	131	178.7	49.9	0	0	0	0	110.3	S58 S62	S58-S60 VanDerWaalsContact C-N 3.29Å; S60-S62 PolarHBondContact O-N 3.31Å
61	S	37.2	Very low	47.5	Very low	133 Å²	133	67.7 Å²	67.7	93%	0.93	43%	0.434	S	S	*	.			trans	-73.2	30.6	179.7	49.9	0	0	0	0	114.3
62	S	39.7	Very low	47.8	Very low	85 Å²	85	70.3 Å²	70.3	59%	0.594	44%	0.444	S	S	*	.			trans	-100.1	95.2	174.7	41.5	0	0	0	0	109.7	S60 S64	S60-S62 PolarHBondContact O-N 3.31Å; S62-S64 PolarHBondContact O-N 2.82Å
63	S	35.3	Very low	48.2	Very low	126 Å²	126	75.5 Å²	75.5	88%	0.881	48%	0.475	S	S	*	.			trans	-61.7	108.2	173.1	49.6	0	0	0	0	110.8
64	S	40.5	Very low	48.3	Very low	89 Å²	89	76.2 Å²	76.2	62%	0.622	48%	0.475	S	S	*	.			trans	-99.5	138.6	156.2	40.9	0	0	0	0	107.8	S62 S66	S62-S64 PolarHBondContact O-N 2.82Å; S64-S66 PolarHBondContact O-N 2.85Å
65	S	43.3	Very low	48.5	Very low	137 Å²	137	79.3 Å²	79.3	96%	0.958	49%	0.492	S	S	*	.	S	Bend	trans	-70.4	17.1	-169.6	42.7	0	0	0	0	115.5
66	S	53.2	Low	48.4	Very low	57 Å²	57	76.4 Å²	76.4	40%	0.399	48%	0.479	S	S	.	.	S	Bend	trans	-77.5	138.2	168.8	60.6	0	0	0	0	109.7	S64 N68	S64-S66 PolarHBondContact O-N 2.85Å; S66-N68 PolarHBondContact O-N 3.49Å
67	S	53.3	Low	48.4	Very low	68 Å²	68	77.3 Å²	77.3	48%	0.476	48%	0.483	S	S	.	.			trans	-50.4	127.7	170.7	54.3	0	0	0	0	109.9	T69 R83	S67-T69 PolarHBondContact O-N 2.94Å; S67-R83 PolarHBondContact O-NH2 2.95Å
68	N	58.7	Low	48.5	Very low	78 Å²	78	82.2 Å²	82.2	42%	0.417	50%	0.495	S	S	.	.	S	Bend	trans	-76.5	-8.9	174.4	-77.2	-24.4	0	0	0	112	E55 C56 S66	E55-N68 CarbonylContact C-O 3.53Å; E55-N68 VanDerWaalsContact CA-O 3.27Å; E55-N68 WeakPolarHBondContact CA-O 3.05Å; C56-N68 PolarHBondContact N-O 3.2Å; S66-N68 PolarHBondContact O-N 3.49Å
69	T	58.4	Low	48.7	Very low	64 Å²	64	79.6 Å²	79.6	39%	0.393	48%	0.477	S	S	.	.	B	Isolated β-bridge	trans	-99.5	130.6	-177.2	-44.4	0	0	0	0	110.1	M54 E55 S67	M54-T69 CarbonylContact O-C 3.58Å; M54-T69 WeakPolarHBondContact O-CA 3.27Å; E55-T69 HydrophobicContact CG-CG2 4.31Å; S67-T69 PolarHBondContact O-N 2.94Å
70	F	50.3	Low	48.9	Very low	27 Å²	27	75.6 Å²	75.6	12%	0.118	45%	0.451	C	S	.	.	P	Polyproline II helix	trans	-66.9	126.8	173.7	174.7	-103.7	0	0	0	110.7	M54 E74 P76 F79 L126	M54-F70 HydrophobicContact CB-CB 3.74Å; M54-F70 HydrophobicContact CB-CG 4.39Å; M54-F70 HydrophobicContact CG-CB 4.39Å; M54-F70 PolarHBondContact O-N 3.48Å; M54-F70 HydrophobicContact SD-CB 4.44Å; F70-E74 HydrophobicContact CD2-CB 4.18Å; F70-E74 HydrophobicContact CE2-CB 3.89Å; F70-E74 VanDerWaalsContact CE2-O 3.29Å; F70-E74 WeakPolarHBondContact CE2-O 3.49Å; F70-E74 WeakPolarHBondContact CZ-O 3.45Å; F70-P76 HydrophobicContact CE2-CB 4.15Å; F70-P76 HydrophobicContact CE2-CG 3.94Å; F70-P76 HydrophobicContact CZ-CB 4.44Å; F70-P76 HydrophobicContact CZ-CG 3.81Å; F70-F79 HydrophobicContact CB-CD1 4.41Å; F70-F79 HydrophobicContact CB-CD2 4.38Å; F70-F79 HydrophobicContact CB-CE1 4.14Å; F70-F79 HydrophobicContact CB-CE2 4.08Å; F70-F79 HydrophobicContact CB-CZ 3.96Å; F70-F79 HydrophobicContact CD2-CB 4.03Å; F70-F79 HydrophobicContact CD2-CD1 4.14Å; F70-F79 HydrophobicContact CD2-CD2 4.12Å; F70-F79 AromaticContact CD2-CG 3.84Å; F70-F79 HydrophobicContact CD2-CG 3.84Å; F70-F79 HydrophobicContact CE2-CB 4.45Å; F70-L126 HydrophobicContact CD1-CD2 4.14Å; F70-L126 HydrophobicContact CE1-CD2 3.91Å; F70-L126 HydrophobicContact CZ-CD2 4.4Å
71	S	58	Low	49.3	Very low	38 Å²	38	73.9 Å²	73.9	27%	0.266	44%	0.44	S	S	.	.	P	Polyproline II helix	trans	-88.9	144	168.4	70.5	0	0	0	0	110.6	T73 E74	S71-T73 PolarHBondContact O-N 3.41Å; S71-T73 PolarHBondContact OG-OG1 2.85Å; S71-E74 PolarHBondContact O-N 3.19Å; S71-E74 VanDerWaalsContact OG-CG 3.22Å; S71-E74 WeakPolarHBondContact OG-CG 3.26Å; S71-E74 PolarHBondContact OG-N 2.73Å; S71-E74 PolarHBondContact OG-OE1 3.23Å
72	K	51.8	Low	50.1	Low	153 Å²	153	73 Å²	73	67%	0.665	42%	0.42	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.5	-20.6	176.6	-71.2	174.9	-172.9	159.3	0	112.8	E51	E51-K72 IonicContact OE1-NZ 2.82Å; E51-K72 PolarHBondContact OE1-NZ 3.43Å
73	T	54.3	Low	50.9	Low	132 Å²	132	70.4 Å²	70.4	81%	0.81	40%	0.398	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.1	-16.7	178.1	43.4	0	0	0	0	113.9	S71	S71-T73 PolarHBondContact O-N 3.41Å; S71-T73 PolarHBondContact OG-OG1 2.85Å
74	E	50.2	Low	51.6	Low	61 Å²	61	71.5 Å²	71.5	29%	0.285	39%	0.387	S	S	.	.	S	Bend	trans	-80.7	147	178.4	-83.9	159.3	-132.2	0	0	112.3	F70 S71 P76 F79	F70-E74 HydrophobicContact CD2-CB 4.18Å; F70-E74 HydrophobicContact CE2-CB 3.89Å; F70-E74 VanDerWaalsContact CE2-O 3.29Å; F70-E74 WeakPolarHBondContact CE2-O 3.49Å; F70-E74 WeakPolarHBondContact CZ-O 3.45Å; S71-E74 PolarHBondContact O-N 3.19Å; S71-E74 VanDerWaalsContact OG-CG 3.22Å; S71-E74 WeakPolarHBondContact OG-CG 3.26Å; S71-E74 PolarHBondContact OG-N 2.73Å; S71-E74 PolarHBondContact OG-OE1 3.23Å; E74-P76 WeakPolarHBondContact O-CD 3.27Å; E74-F79 WeakPolarHBondContact OE2-CD2 3.44Å
75	D	52.5	Low	51.9	Low	67 Å²	67	72.9 Å²	72.9	36%	0.358	39%	0.387	S	S	.	.			trans	-71.1	119.7	167.2	179.2	0.8	0	0	0	109.1	L77 R78 F79	D75-L77 VanDerWaalsContact C-N 3.26Å; D75-L77 PolarHBondContact O-N 3.27Å; D75-L77 PolarHBondContact OD1-N 3.12Å; D75-L77 VanDerWaalsContact OD1-N 3.08Å; D75-R78 HydrophobicContact CB-CB 3.92Å; D75-R78 PolarHBondContact O-N 2.77Å; D75-F79 PolarHBondContact O-N 3.23Å
76	P	50	Low	52	Low	6 Å²	6	67.1 Å²	67.1	4%	0.039	35%	0.346	C	S	.	.	H	α-helix	trans	-57.9	-37.4	-179.3	-21.9	30.5	0	0	0	113.3	F70 E74 F79 M80 L126	F70-P76 HydrophobicContact CE2-CB 4.15Å; F70-P76 HydrophobicContact CE2-CG 3.94Å; F70-P76 HydrophobicContact CZ-CB 4.44Å; F70-P76 HydrophobicContact CZ-CG 3.81Å; E74-P76 WeakPolarHBondContact O-CD 3.27Å; P76-F79 PolarHBondContact O-N 2.96Å; P76-M80 HydrophobicContact CB-CE 4.47Å; P76-M80 WeakPolarHBondContact O-CB 3.28Å; P76-M80 WeakPolarHBondContact O-CE 3.38Å; P76-M80 WeakPolarHBondContact O-CG 3.25Å; P76-M80 PolarHBondContact O-N 3.3Å; P76-L126 WeakPolarHBondContact CB-O 3.22Å; P76-L126 VanDerWaalsContact CG-O 3.29Å; P76-L126 WeakPolarHBondContact CG-O 3.25Å
77	L	45.2	Very low	51.6	Low	27 Å²	27	66.3 Å²	66.3	14%	0.141	34%	0.335	C	S	.	.	H	α-helix	trans	-66.3	-42.4	-179.3	-71.6	172.8	0	0	0	110.5	W16 V25 L29 D75 M80 S81	W16-L77 HydrophobicContact CH2-CD2 4.19Å; W16-L77 HydrophobicContact CZ2-CD2 4.41Å; V25-L77 HydrophobicContact CG1-CD1 4.35Å; L29-L77 HydrophobicContact CD1-CD1 3.87Å; D75-L77 VanDerWaalsContact C-N 3.26Å; D75-L77 PolarHBondContact O-N 3.27Å; D75-L77 PolarHBondContact OD1-N 3.12Å; D75-L77 VanDerWaalsContact OD1-N 3.08Å; L77-M80 HydrophobicContact CD2-CE 3.8Å; L77-M80 HydrophobicContact CG-CE 4.5Å; L77-M80 PolarHBondContact O-N 3.11Å; L77-S81 WeakPolarHBondContact O-CB 3.35Å; L77-S81 PolarHBondContact O-N 2.72Å; L77-S81 PolarHBondContact O-OG 3.29Å
78	R	52.6	Low	51.2	Low	159 Å²	159	63.5 Å²	63.5	60%	0.6	32%	0.315	S	S	*	.	H	α-helix	trans	-64.3	-45.1	174.2	-172.6	176.4	175.2	176.6	0.1	111.9	D75 M80 S81 E82	D75-R78 HydrophobicContact CB-CB 3.92Å; D75-R78 PolarHBondContact O-N 2.77Å; R78-M80 PolarHBondContact O-N 3.3Å; R78-S81 PolarHBondContact O-N 3.26Å; R78-S81 PolarHBondContact O-OG 3.02Å; R78-E82 HydrophobicContact CG-CG 4.33Å; R78-E82 WeakPolarHBondContact CG-OE1 3.47Å; R78-E82 IonicContact CZ-OE1 3.27Å; R78-E82 IonicContact NE-OE1 3.55Å; R78-E82 PolarHBondContact NE-OE1 3.26Å; R78-E82 IonicContact NH2-OE1 3.64Å; R78-E82 WeakPolarHBondContact O-CB 3.37Å; R78-E82 WeakPolarHBondContact O-CG 3Å; R78-E82 PolarHBondContact O-N 3.17Å
79	F	53.8	Low	50.7	Low	2 Å²	2	59.8 Å²	59.8	1%	0.009	30%	0.295	C	S	.	.	H	α-helix	trans	-55.2	-41.7	175.5	177.6	-96.3	0	0	0	112	M54 C56 F70 E74 D75 P76 R83 L88	M54-F79 HydrophobicContact CG-CE1 4.14Å; M54-F79 HydrophobicContact SD-CD1 3.76Å; M54-F79 HydrophobicContact SD-CE1 3.55Å; M54-F79 VanDerWaalsContact SD-CE1 3.55Å; C56-F79 HydrophobicContact CB-CE1 4.41Å; C56-F79 HydrophobicContact CB-CZ 4.2Å; F70-F79 HydrophobicContact CB-CD1 4.41Å; F70-F79 HydrophobicContact CB-CD2 4.38Å; F70-F79 HydrophobicContact CB-CE1 4.14Å; F70-F79 HydrophobicContact CB-CE2 4.08Å; F70-F79 HydrophobicContact CB-CZ 3.96Å; F70-F79 HydrophobicContact CD2-CB 4.03Å; F70-F79 HydrophobicContact CD2-CD1 4.14Å; F70-F79 HydrophobicContact CD2-CD2 4.12Å; F70-F79 AromaticContact CD2-CG 3.84Å; F70-F79 HydrophobicContact CD2-CG 3.84Å; F70-F79 HydrophobicContact CE2-CB 4.45Å; E74-F79 WeakPolarHBondContact OE2-CD2 3.44Å; D75-F79 PolarHBondContact O-N 3.23Å; P76-F79 PolarHBondContact O-N 2.96Å; F79-R83 VanDerWaalsContact CD2-CZ 3.45Å; F79-R83 PolarHBondContact O-NH1 3.42Å; F79-R83 VanDerWaalsContact O-NH1 3.07Å; F79-L88 HydrophobicContact CD1-CD2 4.43Å; F79-L88 HydrophobicContact CE1-CD2 3.94Å
80	M	48.6	Very low	50.1	Low	15 Å²	15	56.9 Å²	56.9	7%	0.074	28%	0.277	C	S	.	.	H	α-helix	trans	-77.4	-37.5	179.6	-67.6	-176	-61.1	0	0	113.6	I14 P76 L77 R78 R83 L88	I14-M80 HydrophobicContact CD1-CE 4.11Å; I14-M80 HydrophobicContact CD1-SD 3.4Å; I14-M80 WeakPolarHBondContact CD1-SD 3.29Å; P76-M80 HydrophobicContact CB-CE 4.47Å; P76-M80 WeakPolarHBondContact O-CB 3.28Å; P76-M80 WeakPolarHBondContact O-CE 3.38Å; P76-M80 WeakPolarHBondContact O-CG 3.25Å; P76-M80 PolarHBondContact O-N 3.3Å; L77-M80 HydrophobicContact CD2-CE 3.8Å; L77-M80 HydrophobicContact CG-CE 4.5Å; L77-M80 PolarHBondContact O-N 3.11Å; R78-M80 PolarHBondContact O-N 3.3Å; M80-R83 PolarHBondContact O-N 3.07Å; M80-L88 HydrophobicContact CG-CD1 3.62Å; M80-L88 HydrophobicContact CG-CD2 4.36Å; M80-L88 HydrophobicContact SD-CD1 3.43Å; M80-L88 WeakPolarHBondContact SD-CD1 3.29Å
81	S	48.6	Very low	50	Low	28 Å²	28	56.9 Å²	56.9	20%	0.196	28%	0.28	C	S	.	.	H	α-helix	trans	-72.2	-35	-178.6	66.6	0	0	0	0	112.6	E22 L77 R78 R83	E22-S81 VanDerWaalsContact OE1-CB 3.3Å; E22-S81 WeakPolarHBondContact OE1-CB 2.93Å; L77-S81 WeakPolarHBondContact O-CB 3.35Å; L77-S81 PolarHBondContact O-N 2.72Å; L77-S81 PolarHBondContact O-OG 3.29Å; R78-S81 PolarHBondContact O-N 3.26Å; R78-S81 PolarHBondContact O-OG 3.02Å; S81-R83 VanDerWaalsContact C-N 3.28Å; S81-R83 PolarHBondContact O-N 2.89Å
82	E	54.6	Low	49.4	Very low	113 Å²	113	55.3 Å²	55.3	53%	0.528	27%	0.269	S	S	.	.	H	α-helix	trans	-67.8	-26.9	176.5	-71.9	176	179.5	0	0	112.2	R78	R78-E82 HydrophobicContact CG-CG 4.33Å; R78-E82 WeakPolarHBondContact CG-OE1 3.47Å; R78-E82 IonicContact CZ-OE1 3.27Å; R78-E82 IonicContact NE-OE1 3.55Å; R78-E82 PolarHBondContact NE-OE1 3.26Å; R78-E82 IonicContact NH2-OE1 3.64Å; R78-E82 WeakPolarHBondContact O-CB 3.37Å; R78-E82 WeakPolarHBondContact O-CG 3Å; R78-E82 PolarHBondContact O-N 3.17Å
83	R	56.2	Low	49	Very low	31 Å²	31	50.7 Å²	50.7	12%	0.117	26%	0.256	C	S	.	.	S	Bend	trans	-107.5	57.7	-174.2	-61.6	-179.9	-178.6	69.1	-5.6	113.1	C56 S67 F79 M80 S81 N85 C86	C56-R83 WeakPolarHBondContact SG-CD 3.16Å; S67-R83 PolarHBondContact O-NH2 2.95Å; F79-R83 VanDerWaalsContact CD2-CZ 3.45Å; F79-R83 PolarHBondContact O-NH1 3.42Å; F79-R83 VanDerWaalsContact O-NH1 3.07Å; M80-R83 PolarHBondContact O-N 3.07Å; S81-R83 VanDerWaalsContact C-N 3.28Å; S81-R83 PolarHBondContact O-N 2.89Å; R83-N85 PolarHBondContact O-N 2.86Å; R83-C86 PolarHBondContact O-N 3.37Å
84	K	48.8	Very low	48.3	Very low	150 Å²	150	47.1 Å²	47.1	65%	0.652	24%	0.236	S	C	*	.	T	Hydrogen-bonded Turn	trans	-53.2	135.6	175.2	-62.7	-177.4	-178.4	177.1	0	110.3
85	N	48	Very low	47.4	Very low	118 Å²	118	52.4 Å²	52.4	63%	0.631	25%	0.253	S	S	*	.	T	Hydrogen-bonded Turn	trans	72.3	21.8	-179.7	-56.6	-44.2	0	0	0	117.6	R83	R83-N85 PolarHBondContact O-N 2.86Å
86	C	44.2	Very low	46.4	Very low	15 Å²	15	53.2 Å²	53.2	10%	0.101	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	160.9	169.6	85	0	0	0	0	115.2	C56 R83	C56-C86 HydrophobicContact CB-CB 4.18Å; C56-C86 WeakPolarHBondContact CB-SG 3.32Å; C56-C86 WeakPolarHBondContact SG-CB 3.41Å; C56-C86 CovalentContact SG-SG 2.03Å; C56-C86 PolarHBondContact SG-SG 3.18Å; R83-C86 PolarHBondContact O-N 3.37Å
87	W	45.5	Very low	45.7	Very low	40 Å²	40	54.2 Å²	54.2	15%	0.152	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.5	128.7	169	-65.4	88.2	0	0	0	109.2	L2 L4 L11 K13 V57 S89	L2-W87 HydrophobicContact CD2-CH2 3.33Å; L2-W87 HydrophobicContact CD2-CZ3 3.46Å; L2-W87 VanDerWaalsContact CD2-CZ3 3.46Å; L4-W87 HydrophobicContact CB-CE3 4.34Å; L4-W87 HydrophobicContact CB-CH2 4.47Å; L4-W87 HydrophobicContact CB-CZ3 3.88Å; L4-W87 HydrophobicContact CD1-CD2 4.45Å; L4-W87 HydrophobicContact CD1-CE3 4Å; L4-W87 HydrophobicContact CD1-CH2 3.05Å; L4-W87 HydrophobicContact CD1-CZ2 3.6Å; L4-W87 HydrophobicContact CD1-CZ3 3.29Å; L4-W87 HydrophobicContact CG-CE3 4.33Å; L4-W87 HydrophobicContact CG-CH2 3.6Å; L4-W87 HydrophobicContact CG-CZ3 3.45Å; L4-W87 VanDerWaalsContact CG-CZ3 3.45Å; L11-W87 HydrophobicContact CB-CB 4.16Å; L11-W87 HydrophobicContact CB-CD2 4.4Å; L11-W87 HydrophobicContact CB-CE3 3.81Å; L11-W87 HydrophobicContact CD1-CB 4.46Å; L11-W87 HydrophobicContact CD2-CB 4.03Å; L11-W87 HydrophobicContact CG-CB 4.46Å; K13-W87 HydrophobicContact CB-CD2 4.07Å; K13-W87 HydrophobicContact CB-CE3 3.57Å; K13-W87 HydrophobicContact CB-CH2 4.05Å; K13-W87 HydrophobicContact CB-CZ3 3.55Å; K13-W87 HydrophobicContact CD-CD2 4.4Å; K13-W87 HydrophobicContact CD-CH2 4.08Å; K13-W87 HydrophobicContact CD-CZ2 3.89Å; K13-W87 HydrophobicContact CD-CZ3 4.41Å; V57-W87 HydrophobicContact CB-CB 4.32Å; V57-W87 PolarHBondContact N-O 3.41Å; V57-W87 PolarHBondContact O-N 2.73Å; W87-S89 PolarHBondContact O-N 3.4Å
88	L	45.9	Very low	44.9	Very low	10 Å²	10	56.9 Å²	56.9	5%	0.052	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.4	105.7	176	-57.4	172	0	0	0	109.1	L11 V12 I14 M54 E55 C56 F79 M80 V90	L11-L88 CarbonylContact C-O 3.48Å; L11-L88 VanDerWaalsContact CA-O 3.25Å; L11-L88 WeakPolarHBondContact CA-O 3.35Å; V12-L88 HydrophobicContact CB-CB 4.29Å; V12-L88 PolarHBondContact N-O 2.91Å; V12-L88 WeakPolarHBondContact O-CB 3.5Å; V12-L88 PolarHBondContact O-N 2.96Å; I14-L88 HydrophobicContact CD1-CD1 4.41Å; M54-L88 HydrophobicContact CE-CD1 4.4Å; M54-L88 HydrophobicContact CG-CB 4.19Å; M54-L88 HydrophobicContact CG-CD2 4.21Å; M54-L88 HydrophobicContact SD-CB 4.24Å; M54-L88 HydrophobicContact SD-CD1 4.07Å; M54-L88 HydrophobicContact SD-CD2 3.71Å; M54-L88 HydrophobicContact SD-CG 4.21Å; E55-L88 CarbonylContact O-C 3.53Å; C56-L88 HydrophobicContact CB-CD2 4.47Å; F79-L88 HydrophobicContact CD1-CD2 4.43Å; F79-L88 HydrophobicContact CE1-CD2 3.94Å; M80-L88 HydrophobicContact CG-CD1 3.62Å; M80-L88 HydrophobicContact CG-CD2 4.36Å; M80-L88 HydrophobicContact SD-CD1 3.43Å; M80-L88 WeakPolarHBondContact SD-CD1 3.29Å; L88-V90 PolarHBondContact O-N 2.73Å
89	S	47.5	Very low	43.6	Very low	0 Å²	0	51.5 Å²	51.5	0%	0	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.5	113.6	167	167.6	0	0	0	0	109.4	K9 L10 M54 E55 W87	K9-S89 WeakPolarHBondContact CB-OG 3.25Å; K9-S89 WeakPolarHBondContact CD-OG 3.37Å; K9-S89 WeakPolarHBondContact CG-OG 3.41Å; L10-S89 CarbonylContact O-C 3.55Å; L10-S89 VanDerWaalsContact O-CA 3.31Å; L10-S89 WeakPolarHBondContact O-CA 3.45Å; M54-S89 CarbonylContact C-O 3.58Å; M54-S89 VanDerWaalsContact CA-O 3.23Å; M54-S89 WeakPolarHBondContact CA-O 3.34Å; E55-S89 PolarHBondContact N-O 2.73Å; E55-S89 WeakPolarHBondContact O-CB 3.3Å; E55-S89 PolarHBondContact O-N 2.65Å; W87-S89 PolarHBondContact O-N 3.4Å
90	V	45.9	Very low	42.2	Very low	3 Å²	3	53.4 Å²	53.4	2%	0.018	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.8	127.8	172.6	-175.6	0	0	0	0	109.1	L10 V12 M54 L88 L119 C122 L126	L10-V90 PolarHBondContact O-N 2.7Å; V12-V90 HydrophobicContact CG2-CG2 4.37Å; M54-V90 HydrophobicContact CE-CG2 4.42Å; L88-V90 PolarHBondContact O-N 2.73Å; V90-L119 HydrophobicContact CB-CD1 4.32Å; V90-L119 HydrophobicContact CG1-CD1 4.08Å; V90-C122 HydrophobicContact CG1-CB 3.9Å; V90-L126 HydrophobicContact CG1-CD1 3.96Å; V90-L126 HydrophobicContact CG2-CD1 4.04Å
91	S	47.3	Very low	41.2	Very low	26 Å²	26	59.2 Å²	59.2	18%	0.182	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	147.4	172.7	34.3	0	0	0	0	110.9	C52 T53	C52-S91 CarbonylContact C-O 3.46Å; C52-S91 WeakPolarHBondContact CA-O 3.4Å; T53-S91 PolarHBondContact N-O 3.47Å; T53-S91 PolarHBondContact O-N 2.67Å; T53-S91 PolarHBondContact O-OG 3Å; T53-S91 PolarHBondContact OG1-OG 3Å
92	V	45.6	Very low	39.9	Very low	6 Å²	6	61.4 Å²	61.4	4%	0.036	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	120.2	173.7	-176.2	0	0	0	0	106.5	S94 L97 E118 C122	V92-S94 VanDerWaalsContact C-N 3.33Å; V92-S94 PolarHBondContact O-N 3.28Å; V92-L97 HydrophobicContact CB-CD1 3.72Å; V92-L97 HydrophobicContact CB-CG 4.25Å; V92-L97 HydrophobicContact CG2-CD1 3.7Å; V92-E118 HydrophobicContact CG2-CB 4.48Å; V92-C122 HydrophobicContact CG2-CB 4.34Å
93	S	43	Very low	38.4	Very low	56 Å²	56	59.2 Å²	59.2	39%	0.392	35%	0.349	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.9	-6.2	-170.8	74.2	0	0	0	0	115	E51 R95	E51-S93 WeakPolarHBondContact CA-OG 3.3Å; E51-S93 WeakPolarHBondContact CB-OG 3.38Å; E51-S93 WeakPolarHBondContact CG-OG 3.43Å; E51-S93 PolarHBondContact N-OG 3.29Å; E51-S93 WeakPolarHBondContact O-CB 3.43Å; E51-S93 PolarHBondContact O-N 3.18Å; E51-S93 PolarHBondContact O-OG 3.48Å; S93-R95 PolarHBondContact O-N 2.96Å
94	S	39.5	Very low	37	Very low	57 Å²	57	66.7 Å²	66.7	40%	0.399	38%	0.383	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.7	-28.5	-178	46.9	0	0	0	0	112.2	V92	V92-S94 VanDerWaalsContact C-N 3.33Å; V92-S94 PolarHBondContact O-N 3.28Å
95	R	33.3	Very low	35.9	Very low	171 Å²	171	63.8 Å²	63.8	65%	0.645	38%	0.378	S	S	*	.	S	Bend	trans	-155	142.9	167.7	-63	-174	179.8	170.7	-2.2	105.2	S93 L97 E111	S93-R95 PolarHBondContact O-N 2.96Å; R95-L97 VanDerWaalsContact C-N 3.28Å; R95-L97 PolarHBondContact O-N 2.9Å; R95-E111 IonicContact NH1-OE1 2.78Å; R95-E111 PolarHBondContact NH1-OE1 3.47Å
96	S	30.8	Very low	34.9	Very low	84 Å²	84	62.1 Å²	62.1	59%	0.587	37%	0.374	S	S	*	.			trans	-53.3	103.9	163.3	55.5	0	0	0	0	106.8	L98	S96-L98 WeakPolarHBondContact CB-O 3.4Å; S96-L98 CarbonylContact O-C 3.23Å; S96-L98 PolarHBondContact O-N 2.87Å
97	L	35.6	Very low	34.3	Very low	28 Å²	28	64.3 Å²	64.3	15%	0.147	38%	0.384	C	S	.	.	S	Bend	trans	-49.4	-27.9	-178.2	-79.6	160.2	0	0	0	110.7	V92 R95 S115 L119	V92-L97 HydrophobicContact CB-CD1 3.72Å; V92-L97 HydrophobicContact CB-CG 4.25Å; V92-L97 HydrophobicContact CG2-CD1 3.7Å; R95-L97 VanDerWaalsContact C-N 3.28Å; R95-L97 PolarHBondContact O-N 2.9Å; L97-S115 WeakPolarHBondContact CD2-OG 3.06Å; L97-L119 HydrophobicContact CD1-CD1 4.34Å
98	L	28.5	Very low	33.7	Very low	83 Å²	83	65.2 Å²	65.2	44%	0.435	40%	0.4	S	S	.	.	S	Bend	trans	-137.3	123.9	168.3	-67.8	164.4	0	0	0	106.5	G8 S96	G8-L98 VanDerWaalsContact CA-CB 3.49Å; G8-L98 VanDerWaalsContact CA-CD1 3.45Å; S96-L98 WeakPolarHBondContact CB-O 3.4Å; S96-L98 CarbonylContact O-C 3.23Å; S96-L98 PolarHBondContact O-N 2.87Å
99	P	25.4	Very low	33.3	Very low	45 Å²	45	71.9 Å²	71.9	29%	0.292	43%	0.428	S	S	.	.			trans	-55.8	153.3	169.4	9.5	-7.8	0	0	0	108.4	T105	P99-T105 WeakPolarHBondContact CG-OG1 3.43Å
100	G	24.6	Very low	32.7	Very low	43 Å²	43	74.2 Å²	74.2	44%	0.443	45%	0.452	S	S	.	.	S	Bend	trans	-57.4	-159.4	-173.9	0	0	0	0	0	114.2	A102	G100-A102 CarbonylContact O-C 3.49Å; G100-A102 VanDerWaalsContact O-C 3.23Å; G100-A102 PolarHBondContact O-N 3.4Å
101	P	25.8	Very low	32.3	Very low	137 Å²	137	77.5 Å²	77.5	89%	0.89	47%	0.468	S	S	*	.	S	Bend	trans	-56.5	-9.1	-177.7	20.5	-30.4	0	0	0	115	A103	P101-A103 PolarHBondContact O-N 3.38Å
102	A	22.6	Very low	31.9	Very low	74 Å²	74	77.6 Å²	77.6	61%	0.612	47%	0.469	S	S	*	.	S	Bend	trans	-69.3	76.7	156.8	0	0	0	0	0	111.9	G100	G100-A102 CarbonylContact O-C 3.49Å; G100-A102 VanDerWaalsContact O-C 3.23Å; G100-A102 PolarHBondContact O-N 3.4Å
103	A	23.6	Very low	31.6	Very low	66 Å²	66	82.9 Å²	82.9	55%	0.545	49%	0.494	S	S	.	.			trans	37.8	105.1	131.1	0	0	0	0	0	118.3	P101 T105	P101-A103 PolarHBondContact O-N 3.38Å; A103-T105 PolarHBondContact O-N 3.35Å
104	F	26.2	Very low	31.5	Very low	188 Å²	188	85.4 Å²	85.4	83%	0.825	50%	0.498	S	S	*	.			trans	54.6	58.5	142.7	-55.6	-83.5	0	0	0	117.6	P106	F104-P106 WeakPolarHBondContact O-CD 3.46Å
105	T	25.8	Very low	31.6	Very low	89 Å²	89	83.7 Å²	83.7	55%	0.546	49%	0.486	S	S	.	.	P	Polyproline II helix	trans	-85.8	116.9	162	-37.6	0	0	0	0	109.3	P99 A103 L107	P99-T105 WeakPolarHBondContact CG-OG1 3.43Å; A103-T105 PolarHBondContact O-N 3.35Å; T105-L107 PolarHBondContact O-N 2.87Å
106	P	27.3	Very low	32.1	Very low	84 Å²	84	80.3 Å²	80.3	55%	0.545	48%	0.479	S	S	.	.	P	Polyproline II helix	trans	-66.9	131.2	-178.2	26.6	-33.2	0	0	0	110.7	F104 Q159	F104-P106 WeakPolarHBondContact O-CD 3.46Å; P106-Q159 HydrophobicContact CB-CG 4.37Å
107	L	30.2	Very low	32.6	Very low	61 Å²	61	80.3 Å²	80.3	32%	0.319	47%	0.472	S	S	.	.	P	Polyproline II helix	trans	-87.3	137.3	168.3	-68.7	169.7	0	0	0	109	T105 E111 A112	T105-L107 PolarHBondContact O-N 2.87Å; L107-E111 HydrophobicContact CB-CB 4.35Å; L107-E111 HydrophobicContact CD2-CB 4.27Å; L107-A112 HydrophobicContact CB-CB 4.05Å; L107-A112 HydrophobicContact CD1-CB 4.31Å
108	A	32.6	Very low	33.1	Very low	58 Å²	58	80 Å²	80	48%	0.479	47%	0.47	S	S	.	.	P	Polyproline II helix	trans	-62.9	151	170.6	0	0	0	0	0	110.4	G110 E111 A112	A108-G110 PolarHBondContact O-N 3.09Å; A108-E111 HydrophobicContact CB-CG 4.25Å; A108-E111 WeakPolarHBondContact O-CA 3.47Å; A108-E111 WeakPolarHBondContact O-CB 3.05Å; A108-E111 PolarHBondContact O-N 3.48Å; A108-A112 PolarHBondContact O-N 3.36Å
109	K	37.5	Very low	33.9	Very low	150 Å²	150	76.9 Å²	76.9	65%	0.652	45%	0.454	S	S	*	.	H	α-helix	trans	-45.6	-42.7	-176.6	-175.7	178.1	177.9	179.5	0	113.5	E113	K109-E113 PolarHBondContact O-N 2.82Å
110	G	35.8	Very low	34.7	Very low	49 Å²	49	77.9 Å²	77.9	51%	0.505	45%	0.454	S	S	.	.	H	α-helix	trans	-76.2	-27.8	177.4	0	0	0	0	0	114.6	A108 K114	A108-G110 PolarHBondContact O-N 3.09Å; G110-K114 WeakPolarHBondContact O-CB 3.42Å; G110-K114 PolarHBondContact O-N 2.81Å
111	E	36.5	Very low	35.6	Very low	73 Å²	73	76.7 Å²	76.7	34%	0.341	44%	0.439	S	S	.	.	H	α-helix	trans	-75.4	-36.6	178	-68.2	-170.7	146.1	0	0	112	R95 L107 A108 K114 S115	R95-E111 IonicContact NH1-OE1 2.78Å; R95-E111 PolarHBondContact NH1-OE1 3.47Å; L107-E111 HydrophobicContact CB-CB 4.35Å; L107-E111 HydrophobicContact CD2-CB 4.27Å; A108-E111 HydrophobicContact CB-CG 4.25Å; A108-E111 WeakPolarHBondContact O-CA 3.47Å; A108-E111 WeakPolarHBondContact O-CB 3.05Å; A108-E111 PolarHBondContact O-N 3.48Å; E111-K114 PolarHBondContact O-N 2.78Å; E111-S115 WeakPolarHBondContact O-CB 3.37Å; E111-S115 PolarHBondContact O-N 2.82Å; E111-S115 PolarHBondContact O-OG 3.35Å
112	A	39	Very low	36.6	Very low	27 Å²	27	70.6 Å²	70.6	22%	0.223	40%	0.4	C	S	.	.	H	α-helix	trans	-67.4	-45	176.5	0	0	0	0	0	111.9	L107 A108 S115 I116	L107-A112 HydrophobicContact CB-CB 4.05Å; L107-A112 HydrophobicContact CD1-CB 4.31Å; A108-A112 PolarHBondContact O-N 3.36Å; A112-S115 WeakPolarHBondContact O-CB 3.34Å; A112-S115 PolarHBondContact O-N 3.49Å; A112-I116 WeakPolarHBondContact O-CG1 3.37Å; A112-I116 PolarHBondContact O-N 3.45Å
113	E	39.1	Very low	37.7	Very low	117 Å²	117	68.1 Å²	68.1	55%	0.547	38%	0.376	S	S	.	.	H	α-helix	trans	-61	-46.5	173.5	-74.4	-179.2	174.1	0	0	110.9	K109 S115 I116 I117	K109-E113 PolarHBondContact O-N 2.82Å; E113-S115 VanDerWaalsContact C-N 3.3Å; E113-S115 PolarHBondContact O-N 3.43Å; E113-I116 PolarHBondContact O-N 3.35Å; E113-I117 WeakPolarHBondContact O-CB 3.31Å; E113-I117 WeakPolarHBondContact O-CD1 3.21Å; E113-I117 VanDerWaalsContact O-CG1 3.23Å; E113-I117 WeakPolarHBondContact O-CG1 3.29Å; E113-I117 PolarHBondContact O-N 3.27Å
114	K	42.4	Very low	38.6	Very low	110 Å²	110	68.2 Å²	68.2	48%	0.478	37%	0.366	S	S	.	.	H	α-helix	trans	-59	-41.9	175.5	-171.6	178.1	-178.5	-178.5	0	111.9	G110 E111 I117 E118	G110-K114 WeakPolarHBondContact O-CB 3.42Å; G110-K114 PolarHBondContact O-N 2.81Å; E111-K114 PolarHBondContact O-N 2.78Å; K114-I117 PolarHBondContact O-N 2.98Å; K114-E118 VanDerWaalsContact CE-OE1 3.23Å; K114-E118 WeakPolarHBondContact CE-OE1 3.38Å; K114-E118 HydrophobicContact CG-CG 4.46Å; K114-E118 VanDerWaalsContact O-CB 3.28Å; K114-E118 WeakPolarHBondContact O-CB 3.37Å; K114-E118 VanDerWaalsContact O-CG 3.24Å; K114-E118 WeakPolarHBondContact O-CG 3.15Å; K114-E118 PolarHBondContact O-N 3.08Å
115	S	41.7	Very low	39.3	Very low	21 Å²	21	65.8 Å²	65.8	15%	0.147	35%	0.351	C	S	.	.	H	α-helix	trans	-63.9	-43	178	-71	0	0	0	0	113	L97 E111 A112 E113 E118 L119	L97-S115 WeakPolarHBondContact CD2-OG 3.06Å; E111-S115 WeakPolarHBondContact O-CB 3.37Å; E111-S115 PolarHBondContact O-N 2.82Å; E111-S115 PolarHBondContact O-OG 3.35Å; A112-S115 WeakPolarHBondContact O-CB 3.34Å; A112-S115 PolarHBondContact O-N 3.49Å; E113-S115 VanDerWaalsContact C-N 3.3Å; E113-S115 PolarHBondContact O-N 3.43Å; S115-E118 PolarHBondContact O-N 3.18Å; S115-L119 WeakPolarHBondContact O-CB 3.15Å; S115-L119 PolarHBondContact O-N 3.3Å
116	I	42.6	Very low	40.2	Very low	99 Å²	99	62 Å²	62	51%	0.508	33%	0.328	S	S	.	.	H	α-helix	trans	-66.1	-45.4	175.7	-68.5	167.1	0	0	0	109.9	A112 E113 E118 L119 E120	A112-I116 WeakPolarHBondContact O-CG1 3.37Å; A112-I116 PolarHBondContact O-N 3.45Å; E113-I116 PolarHBondContact O-N 3.35Å; I116-E118 VanDerWaalsContact C-N 3.34Å; I116-E118 PolarHBondContact O-N 2.94Å; I116-L119 WeakPolarHBondContact O-CB 3.28Å; I116-L119 PolarHBondContact O-N 3.28Å; I116-E120 HydrophobicContact CG2-CG 4.44Å; I116-E120 WeakPolarHBondContact O-CB 3.21Å; I116-E120 WeakPolarHBondContact O-CG 3.42Å; I116-E120 PolarHBondContact O-N 2.85Å
117	I	42.7	Very low	40.8	Very low	84 Å²	84	59.9 Å²	59.9	43%	0.431	31%	0.311	S	S	.	.	H	α-helix	trans	-62.8	-42	176.9	-67	165.9	0	0	0	110.7	E113 K114 L119 E120 C121	E113-I117 WeakPolarHBondContact O-CB 3.31Å; E113-I117 WeakPolarHBondContact O-CD1 3.21Å; E113-I117 VanDerWaalsContact O-CG1 3.23Å; E113-I117 WeakPolarHBondContact O-CG1 3.29Å; E113-I117 PolarHBondContact O-N 3.27Å; K114-I117 PolarHBondContact O-N 2.98Å; I117-L119 VanDerWaalsContact C-N 3.31Å; I117-L119 PolarHBondContact O-N 3.38Å; I117-E120 PolarHBondContact O-N 2.87Å; I117-C121 VanDerWaalsContact O-CB 3.25Å; I117-C121 WeakPolarHBondContact O-CB 3.23Å; I117-C121 PolarHBondContact O-N 2.83Å; I117-C121 PolarHBondContact O-SG 3.47Å
118	E	44.4	Very low	41.4	Very low	23 Å²	23	63.7 Å²	63.7	11%	0.107	32%	0.321	C	S	.	.	H	α-helix	trans	-59.4	-43.3	174.9	-83.6	179.5	-165.8	0	0	111.4	L47 V92 K114 S115 I116 C121 C122	L47-E118 HydrophobicContact CD2-CG 3.5Å; L47-E118 VanDerWaalsContact CD2-CG 3.5Å; V92-E118 HydrophobicContact CG2-CB 4.48Å; K114-E118 VanDerWaalsContact CE-OE1 3.23Å; K114-E118 WeakPolarHBondContact CE-OE1 3.38Å; K114-E118 HydrophobicContact CG-CG 4.46Å; K114-E118 VanDerWaalsContact O-CB 3.28Å; K114-E118 WeakPolarHBondContact O-CB 3.37Å; K114-E118 VanDerWaalsContact O-CG 3.24Å; K114-E118 WeakPolarHBondContact O-CG 3.15Å; K114-E118 PolarHBondContact O-N 3.08Å; S115-E118 PolarHBondContact O-N 3.18Å; I116-E118 VanDerWaalsContact C-N 3.34Å; I116-E118 PolarHBondContact O-N 2.94Å; E118-C121 PolarHBondContact O-N 3.39Å; E118-C122 WeakPolarHBondContact O-CB 3.26Å; E118-C122 PolarHBondContact O-N 3.07Å
119	L	45.8	Very low	41.6	Very low	17 Å²	17	65.7 Å²	65.7	9%	0.089	32%	0.316	C	S	.	.	H	α-helix	trans	-67	-46	177.3	-174.1	67.1	0	0	0	111.8	F5 L10 V90 L97 S115 I116 I117 C121 C122 I123	F5-L119 HydrophobicContact CE1-CD2 3.99Å; F5-L119 HydrophobicContact CZ-CD2 3.79Å; L10-L119 HydrophobicContact CB-CD1 4.09Å; L10-L119 HydrophobicContact CB-CD2 3.92Å; L10-L119 HydrophobicContact CB-CG 4.45Å; L10-L119 HydrophobicContact CD2-CD1 4.06Å; L10-L119 HydrophobicContact CD2-CD2 3.78Å; L10-L119 HydrophobicContact CD2-CG 3.87Å; L10-L119 HydrophobicContact CG-CD2 4.34Å; V90-L119 HydrophobicContact CB-CD1 4.32Å; V90-L119 HydrophobicContact CG1-CD1 4.08Å; L97-L119 HydrophobicContact CD1-CD1 4.34Å; S115-L119 WeakPolarHBondContact O-CB 3.15Å; S115-L119 PolarHBondContact O-N 3.3Å; I116-L119 WeakPolarHBondContact O-CB 3.28Å; I116-L119 PolarHBondContact O-N 3.28Å; I117-L119 VanDerWaalsContact C-N 3.31Å; I117-L119 PolarHBondContact O-N 3.38Å; L119-C121 VanDerWaalsContact C-N 3.33Å; L119-C121 PolarHBondContact O-N 3.37Å; L119-C122 VanDerWaalsContact O-CB 3.22Å; L119-C122 WeakPolarHBondContact O-CB 3.33Å; L119-C122 PolarHBondContact O-N 3.07Å; L119-I123 HydrophobicContact CG-CD1 4.33Å; L119-I123 WeakPolarHBondContact O-CD1 3.29Å; L119-I123 VanDerWaalsContact O-CG1 3.24Å; L119-I123 WeakPolarHBondContact O-CG1 3.37Å; L119-I123 PolarHBondContact O-N 3.35Å
120	E	43.1	Very low	41.4	Very low	65 Å²	65	62.1 Å²	62.1	30%	0.304	30%	0.301	S	S	.	.	H	α-helix	trans	-57.6	-47	173.7	-75.6	-177	167.6	0	0	110.7	I116 I117 C122 I123 M124	I116-E120 HydrophobicContact CG2-CG 4.44Å; I116-E120 WeakPolarHBondContact O-CB 3.21Å; I116-E120 WeakPolarHBondContact O-CG 3.42Å; I116-E120 PolarHBondContact O-N 2.85Å; I117-E120 PolarHBondContact O-N 2.87Å; E120-C122 PolarHBondContact O-N 3.36Å; E120-I123 PolarHBondContact O-N 3.26Å; E120-M124 WeakPolarHBondContact O-CB 3.37Å; E120-M124 VanDerWaalsContact O-CG 3.25Å; E120-M124 WeakPolarHBondContact O-CG 3.39Å; E120-M124 PolarHBondContact O-N 3.46Å
121	C	43.1	Very low	41.2	Very low	19 Å²	19	64.3 Å²	64.3	13%	0.128	30%	0.301	C	S	.	.	H	α-helix	trans	-62.1	-39.2	175.3	-76.2	0	0	0	0	112.7	I117 E118 L119 M124 R125	I117-C121 VanDerWaalsContact O-CB 3.25Å; I117-C121 WeakPolarHBondContact O-CB 3.23Å; I117-C121 PolarHBondContact O-N 2.83Å; I117-C121 PolarHBondContact O-SG 3.47Å; E118-C121 PolarHBondContact O-N 3.39Å; L119-C121 VanDerWaalsContact C-N 3.33Å; L119-C121 PolarHBondContact O-N 3.37Å; C121-M124 HydrophobicContact CB-CE 4.34Å; C121-M124 PolarHBondContact O-N 3.4Å; C121-R125 WeakPolarHBondContact O-CB 3.38Å; C121-R125 PolarHBondContact O-N 2.71Å
122	C	45.7	Very low	40.8	Very low	9 Å²	9	63.3 Å²	63.3	6%	0.061	30%	0.3	C	S	.	.	H	α-helix	trans	-56.6	-53.9	172.1	-125.4	0	0	0	0	110.2	C52 V90 V92 E118 L119 E120 M124 R125 L126	C52-C122 VanDerWaalsContact CA-SG 3.58Å; C52-C122 HydrophobicContact CB-CB 4.45Å; C52-C122 WeakPolarHBondContact CB-SG 3.46Å; C52-C122 WeakPolarHBondContact SG-CB 3.38Å; C52-C122 CovalentContact SG-SG 2.02Å; C52-C122 PolarHBondContact SG-SG 2.82Å; V90-C122 HydrophobicContact CG1-CB 3.9Å; V92-C122 HydrophobicContact CG2-CB 4.34Å; E118-C122 WeakPolarHBondContact O-CB 3.26Å; E118-C122 PolarHBondContact O-N 3.07Å; L119-C122 VanDerWaalsContact O-CB 3.22Å; L119-C122 WeakPolarHBondContact O-CB 3.33Å; L119-C122 PolarHBondContact O-N 3.07Å; E120-C122 PolarHBondContact O-N 3.36Å; C122-M124 VanDerWaalsContact C-N 3.3Å; C122-M124 PolarHBondContact O-N 2.74Å; C122-R125 WeakPolarHBondContact O-CB 3.15Å; C122-R125 PolarHBondContact O-N 2.84Å; C122-L126 WeakPolarHBondContact O-CB 3.48Å; C122-L126 WeakPolarHBondContact O-CD1 2.99Å; C122-L126 WeakPolarHBondContact O-CG 3.35Å; C122-L126 PolarHBondContact O-N 2.92Å
123	I	45.6	Very low	40	Very low	22 Å²	22	73.5 Å²	73.5	11%	0.113	33%	0.332	C	S	.	.	H	α-helix	trans	-60.1	-43	179.7	-61.6	160.6	0	0	0	110.2	L10 L119 E120 L126 I127	L10-I123 HydrophobicContact CD2-CD1 3.24Å; L10-I123 HydrophobicContact CD2-CG1 4.03Å; L119-I123 HydrophobicContact CG-CD1 4.33Å; L119-I123 WeakPolarHBondContact O-CD1 3.29Å; L119-I123 VanDerWaalsContact O-CG1 3.24Å; L119-I123 WeakPolarHBondContact O-CG1 3.37Å; L119-I123 PolarHBondContact O-N 3.35Å; E120-I123 PolarHBondContact O-N 3.26Å; I123-L126 PolarHBondContact O-N 3.06Å; I123-I127 HydrophobicContact CG2-CD1 3.59Å; I123-I127 HydrophobicContact CG2-CG1 4.36Å; I123-I127 WeakPolarHBondContact O-CG1 3.43Å; I123-I127 PolarHBondContact O-N 2.9Å
124	M	43.2	Very low	39.3	Very low	67 Å²	67	74 Å²	74	33%	0.33	34%	0.338	S	S	.	.	H	α-helix	trans	-63.7	-42.3	177.7	-73.5	-170	-66.1	0	0	112.5	E120 C121 C122 L126 R128 W129	E120-M124 WeakPolarHBondContact O-CB 3.37Å; E120-M124 VanDerWaalsContact O-CG 3.25Å; E120-M124 WeakPolarHBondContact O-CG 3.39Å; E120-M124 PolarHBondContact O-N 3.46Å; C121-M124 HydrophobicContact CB-CE 4.34Å; C121-M124 PolarHBondContact O-N 3.4Å; C122-M124 VanDerWaalsContact C-N 3.3Å; C122-M124 PolarHBondContact O-N 2.74Å; M124-L126 VanDerWaalsContact C-N 3.31Å; M124-L126 PolarHBondContact O-N 2.75Å; M124-R128 PolarHBondContact O-N 2.96Å; M124-W129 HydrophobicContact CG-CE3 4.27Å; M124-W129 HydrophobicContact SD-CE3 4.24Å; M124-W129 HydrophobicContact SD-CZ3 4.41Å
125	R	41.6	Very low	38.4	Very low	138 Å²	138	72.7 Å²	72.7	52%	0.521	34%	0.342	S	S	.	.	H	α-helix	trans	-57.3	-45.2	171.5	-104.2	-178.9	152.8	-177.8	-8	111.2	W40 C121 C122 R128	W40-R125 HydrophobicContact CH2-CG 4.37Å; W40-R125 HydrophobicContact CZ3-CG 4.01Å; C121-R125 WeakPolarHBondContact O-CB 3.38Å; C121-R125 PolarHBondContact O-N 2.71Å; C122-R125 WeakPolarHBondContact O-CB 3.15Å; C122-R125 PolarHBondContact O-N 2.84Å; R125-R128 PolarHBondContact O-N 3.1Å
126	L	44.8	Very low	37.5	Very low	10 Å²	10	81.8 Å²	81.8	5%	0.052	38%	0.379	C	S	.	.	H	α-helix	trans	-71.7	-37.4	-174.6	-70.9	163.2	0	0	0	112.5	C52 M54 F70 P76 V90 C122 I123 M124 R128	C52-L126 WeakPolarHBondContact SG-CD1 3.39Å; M54-L126 HydrophobicContact CE-CB 3.74Å; M54-L126 HydrophobicContact CE-CD1 3.24Å; M54-L126 HydrophobicContact CE-CD2 3.54Å; M54-L126 HydrophobicContact CE-CG 3.65Å; F70-L126 HydrophobicContact CD1-CD2 4.14Å; F70-L126 HydrophobicContact CE1-CD2 3.91Å; F70-L126 HydrophobicContact CZ-CD2 4.4Å; P76-L126 WeakPolarHBondContact CB-O 3.22Å; P76-L126 VanDerWaalsContact CG-O 3.29Å; P76-L126 WeakPolarHBondContact CG-O 3.25Å; V90-L126 HydrophobicContact CG1-CD1 3.96Å; V90-L126 HydrophobicContact CG2-CD1 4.04Å; C122-L126 WeakPolarHBondContact O-CB 3.48Å; C122-L126 WeakPolarHBondContact O-CD1 2.99Å; C122-L126 WeakPolarHBondContact O-CG 3.35Å; C122-L126 PolarHBondContact O-N 2.92Å; I123-L126 PolarHBondContact O-N 3.06Å; M124-L126 VanDerWaalsContact C-N 3.31Å; M124-L126 PolarHBondContact O-N 2.75Å; L126-R128 PolarHBondContact O-N 3.32Å
127	I	40	Very low	36.5	Very low	38 Å²	38	86 Å²	86	20%	0.195	39%	0.389	C	S	.	.	T	Hydrogen-bonded Turn	trans	-83.9	2.2	-179.1	-57.5	173.2	0	0	0	111.7	M1 I14 I123 W129	M1-I127 HydrophobicContact SD-CD1 3.95Å; I14-I127 HydrophobicContact CD1-CD1 4.34Å; I123-I127 HydrophobicContact CG2-CD1 3.59Å; I123-I127 HydrophobicContact CG2-CG1 4.36Å; I123-I127 WeakPolarHBondContact O-CG1 3.43Å; I123-I127 PolarHBondContact O-N 2.9Å; I127-W129 VanDerWaalsContact C-N 3.29Å; I127-W129 PolarHBondContact O-N 3.1Å
128	R	42.6	Very low	35.5	Very low	142 Å²	142	91.2 Å²	91.2	54%	0.536	41%	0.411	S	S	.	.	T	Hydrogen-bonded Turn	trans	41.9	56.9	-176.4	-69.5	-170.7	177.1	-169.4	1.7	111.5	M124 R125 L126 K130	M124-R128 PolarHBondContact O-N 2.96Å; R125-R128 PolarHBondContact O-N 3.1Å; L126-R128 PolarHBondContact O-N 3.32Å; R128-K130 PolarHBondContact O-N 3.24Å
129	W	36	Very low	34.4	Very low	99 Å²	99	96.9 Å²	96.9	38%	0.375	44%	0.437	S	S	.	.			trans	-68.4	59.1	-173	-124.3	40.2	0	0	0	113.1	M124 I127 D131 V132 F141	M124-W129 HydrophobicContact CG-CE3 4.27Å; M124-W129 HydrophobicContact SD-CE3 4.24Å; M124-W129 HydrophobicContact SD-CZ3 4.41Å; I127-W129 VanDerWaalsContact C-N 3.29Å; I127-W129 PolarHBondContact O-N 3.1Å; W129-D131 PolarHBondContact O-N 2.97Å; W129-V132 HydrophobicContact CD2-CB 3.67Å; W129-V132 HydrophobicContact CD2-CG2 3.56Å; W129-V132 HydrophobicContact CE3-CB 3.72Å; W129-V132 HydrophobicContact CE3-CG1 4.32Å; W129-V132 HydrophobicContact CE3-CG2 4.15Å; W129-V132 HydrophobicContact CG-CB 4.39Å; W129-V132 HydrophobicContact CG-CG2 4Å; W129-V132 HydrophobicContact CH2-CB 3.71Å; W129-V132 HydrophobicContact CH2-CG1 3.45Å; W129-V132 VanDerWaalsContact CH2-CG1 3.45Å; W129-V132 HydrophobicContact CH2-CG2 4Å; W129-V132 HydrophobicContact CZ2-CB 3.7Å; W129-V132 HydrophobicContact CZ2-CG1 3.71Å; W129-V132 HydrophobicContact CZ2-CG2 3.42Å; W129-V132 VanDerWaalsContact CZ2-CG2 3.42Å; W129-V132 HydrophobicContact CZ3-CB 3.73Å; W129-V132 HydrophobicContact CZ3-CG1 3.8Å; W129-V132 HydrophobicContact CZ3-CG2 4.34Å; W129-V132 VanDerWaalsContact NE1-CG2 3.31Å; W129-F141 AromaticContact CH2-CE1 3.48Å; W129-F141 HydrophobicContact CH2-CE1 3.48Å; W129-F141 VanDerWaalsContact CH2-CE1 3.48Å; W129-F141 AromaticContact CH2-CZ 3.52Å; W129-F141 HydrophobicContact CH2-CZ 3.52Å; W129-F141 HydrophobicContact CZ2-CE1 4.2Å; W129-F141 HydrophobicContact CZ3-CE1 4.17Å; W129-F141 AromaticContact CZ3-CZ 3.73Å; W129-F141 HydrophobicContact CZ3-CZ 3.73Å
130	K	34.7	Very low	33.4	Very low	76 Å²	76	106.9 Å²	106.9	33%	0.33	47%	0.474	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.9	-7.1	174.5	-85.8	176.7	163.2	-174.3	0	113	E33 R128	E33-K130 IonicContact OE1-NZ 2.7Å; E33-K130 PolarHBondContact OE1-NZ 2.98Å; R128-K130 PolarHBondContact O-N 3.24Å
131	D	29.6	Very low	32.5	Very low	95 Å²	95	108.5 Å²	108.5	51%	0.508	48%	0.48	S	S	.	.	T	Hydrogen-bonded Turn	trans	-136.1	19.6	-169.4	-88.8	-37.7	0	0	0	118.2	W129 R133	W129-D131 PolarHBondContact O-N 2.97Å; D131-R133 PolarHBondContact O-N 3.34Å
132	V	28.6	Very low	31.8	Very low	52 Å²	52	114.3 Å²	114.3	32%	0.315	50%	0.503	S	S	.	.			trans	-93.3	83.4	169	-176.6	0	0	0	0	111.2	W129 L134	W129-V132 HydrophobicContact CD2-CB 3.67Å; W129-V132 HydrophobicContact CD2-CG2 3.56Å; W129-V132 HydrophobicContact CE3-CB 3.72Å; W129-V132 HydrophobicContact CE3-CG1 4.32Å; W129-V132 HydrophobicContact CE3-CG2 4.15Å; W129-V132 HydrophobicContact CG-CB 4.39Å; W129-V132 HydrophobicContact CG-CG2 4Å; W129-V132 HydrophobicContact CH2-CB 3.71Å; W129-V132 HydrophobicContact CH2-CG1 3.45Å; W129-V132 VanDerWaalsContact CH2-CG1 3.45Å; W129-V132 HydrophobicContact CH2-CG2 4Å; W129-V132 HydrophobicContact CZ2-CB 3.7Å; W129-V132 HydrophobicContact CZ2-CG1 3.71Å; W129-V132 HydrophobicContact CZ2-CG2 3.42Å; W129-V132 VanDerWaalsContact CZ2-CG2 3.42Å; W129-V132 HydrophobicContact CZ3-CB 3.73Å; W129-V132 HydrophobicContact CZ3-CG1 3.8Å; W129-V132 HydrophobicContact CZ3-CG2 4.34Å; W129-V132 VanDerWaalsContact NE1-CG2 3.31Å; V132-L134 HydrophobicContact CG1-CB 3.71Å; V132-L134 HydrophobicContact CG1-CD1 4.17Å; V132-L134 HydrophobicContact CG1-CG 4.35Å; V132-L134 PolarHBondContact O-N 3.5Å
133	R	23.6	Very low	30.8	Very low	240 Å²	240	118.4 Å²	118.4	91%	0.906	52%	0.524	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.9	29.4	166.1	-69	-171.2	-173.2	-174.1	2.2	114.1	D131	D131-R133 PolarHBondContact O-N 3.34Å
134	L	24.4	Very low	29.8	Very low	128 Å²	128	124.8 Å²	124.8	67%	0.67	55%	0.546	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99.5	-9.3	178.6	-81.7	158.4	0	0	0	115	V132 K136	V132-L134 HydrophobicContact CG1-CB 3.71Å; V132-L134 HydrophobicContact CG1-CD1 4.17Å; V132-L134 HydrophobicContact CG1-CG 4.35Å; V132-L134 PolarHBondContact O-N 3.5Å; L134-K136 VanDerWaalsContact C-N 3.3Å; L134-K136 PolarHBondContact O-N 2.97Å; L134-K136 VanDerWaalsContact O-N 3.15Å
135	C	22.1	Very low	28.9	Very low	83 Å²	83	124.5 Å²	124.5	56%	0.561	55%	0.546	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.6	29.6	-178.7	-84.1	0	0	0	0	115.9
136	K	22.6	Very low	28	Very low	212 Å²	212	123.7 Å²	123.7	92%	0.922	55%	0.548	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.9	-13.3	159.8	-96.4	-168	178.4	-175.4	0	112.9	L134	L134-K136 VanDerWaalsContact C-N 3.3Å; L134-K136 PolarHBondContact O-N 2.97Å; L134-K136 VanDerWaalsContact O-N 3.15Å
137	R	22.5	Very low	27	Very low	188 Å²	188	126.7 Å²	126.7	71%	0.709	57%	0.57	S	S	*	*	S	Bend	trans	-112.1	127.5	165.6	-74.7	-178	174.7	178.9	-1.4	107.4	E139	R137-E139 HydrophobicContact CB-CG 4.24Å; R137-E139 PolarHBondContact O-N 3.22Å
138	Q	22.1	Very low	26.3	Very low	192 Å²	192	127.2 Å²	127.2	90%	0.897	59%	0.585	S	S	*	*			trans	-65.4	48.9	168.2	-71.2	-177.7	-23.7	0	0	111	R140	Q138-R140 PolarHBondContact O-N 3.41Å
139	E	21.3	Very low	25.5	Very low	142 Å²	142	122.6 Å²	122.6	66%	0.664	57%	0.57	S	S	*	*			trans	-72.3	83.1	163	-75	-178.7	-167.2	0	0	106.1	R137 F141	R137-E139 HydrophobicContact CB-CG 4.24Å; R137-E139 PolarHBondContact O-N 3.22Å; E139-F141 PolarHBondContact O-N 2.91Å
140	R	24.9	Very low	25.2	Very low	228 Å²	228	120.4 Å²	120.4	86%	0.86	57%	0.566	S	S	*	*			trans	-46	130.1	173.3	-71.2	-178.4	179.7	-177.2	-1.6	108.6	Q138 K142	Q138-R140 PolarHBondContact O-N 3.41Å; R140-K142 PolarHBondContact O-N 3.48Å
141	F	24.2	Very low	25.1	Very low	99 Å²	99	118.7 Å²	118.7	43%	0.434	56%	0.558	S	S	.	*			trans	-44.9	111.1	-175	-73.9	-92.9	0	0	0	112	W129 E139 I143	W129-F141 AromaticContact CH2-CE1 3.48Å; W129-F141 HydrophobicContact CH2-CE1 3.48Å; W129-F141 VanDerWaalsContact CH2-CE1 3.48Å; W129-F141 AromaticContact CH2-CZ 3.52Å; W129-F141 HydrophobicContact CH2-CZ 3.52Å; W129-F141 HydrophobicContact CZ2-CE1 4.2Å; W129-F141 HydrophobicContact CZ3-CE1 4.17Å; W129-F141 AromaticContact CZ3-CZ 3.73Å; W129-F141 HydrophobicContact CZ3-CZ 3.73Å; E139-F141 PolarHBondContact O-N 2.91Å; F141-I143 PolarHBondContact O-N 3.49Å; F141-I143 VanDerWaalsContact O-N 3.07Å
142	K	26.8	Very low	25.2	Very low	140 Å²	140	116.2 Å²	116.2	61%	0.609	54%	0.542	S	S	*	.			trans	-76.5	92.8	173.1	-170.1	174.8	-177.8	176.2	0	108.3	R140 R144	R140-K142 PolarHBondContact O-N 3.48Å; K142-R144 PolarHBondContact O-N 3.3Å
143	I	26.4	Very low	25.5	Very low	95 Å²	95	115.2 Å²	115.2	49%	0.487	54%	0.539	S	S	.	.			trans	-64.5	100.7	174	-58.9	175.7	0	0	0	108.1	L3 F141 L145	L3-I143 HydrophobicContact CB-CG2 4.36Å; L3-I143 HydrophobicContact CD1-CG1 4.39Å; L3-I143 HydrophobicContact CD1-CG2 4.18Å; F141-I143 PolarHBondContact O-N 3.49Å; F141-I143 VanDerWaalsContact O-N 3.07Å; I143-L145 HydrophobicContact CG2-CD2 3.91Å; I143-L145 HydrophobicContact CG2-CG 4.02Å; I143-L145 PolarHBondContact O-N 2.93Å
144	R	23.7	Very low	25.9	Very low	156 Å²	156	105 Å²	105	59%	0.589	50%	0.502	S	S	*	.			trans	-87.5	97.2	176.2	-162	174.2	-177	166.9	0.8	108.5	K142 E146 H199	K142-R144 PolarHBondContact O-N 3.3Å; R144-E146 PolarHBondContact O-N 3.42Å; R144-H199 PolarHBondContact NH2-CD2 2.82Å; R144-H199 PolarHBondContact NH2-NE2 2.58Å
145	L	25.4	Very low	26.1	Very low	62 Å²	62	101 Å²	101	33%	0.325	48%	0.48	S	S	.	.			trans	-78.3	93.8	175.3	-63.7	170	0	0	0	109.1	L3 I143 S147 F151	L3-L145 WeakPolarHBondContact O-CD2 3.33Å; I143-L145 HydrophobicContact CG2-CD2 3.91Å; I143-L145 HydrophobicContact CG2-CG 4.02Å; I143-L145 PolarHBondContact O-N 2.93Å; L145-S147 PolarHBondContact O-N 2.92Å; L145-F151 HydrophobicContact CB-CD2 4.49Å; L145-F151 HydrophobicContact CD1-CB 4.09Å; L145-F151 HydrophobicContact CD1-CD2 3.39Å; L145-F151 HydrophobicContact CD1-CE2 3.96Å; L145-F151 HydrophobicContact CD1-CG 3.89Å; L145-F151 HydrophobicContact CG-CD2 4.42Å
146	E	21.8	Very low	26.5	Very low	120 Å²	120	100.1 Å²	100.1	56%	0.561	47%	0.465	S	S	*	.			trans	-76.1	115.1	169	-93.3	-174.5	-178.4	0	0	109.9	L2 R144	L2-E146 HydrophobicContact CD1-CB 3.47Å; L2-E146 VanDerWaalsContact CD1-CB 3.47Å; L2-E146 HydrophobicContact CG-CB 4.17Å; R144-E146 PolarHBondContact O-N 3.42Å
147	S	23.6	Very low	26.8	Very low	74 Å²	74	98.2 Å²	98.2	52%	0.517	45%	0.453	S	S	.	.	S	Bend	trans	143.9	90.8	143.5	56.8	0	0	0	0	110.2	L145 N149	L145-S147 PolarHBondContact O-N 2.92Å; S147-N149 WeakPolarHBondContact O-CB 3.16Å; S147-N149 PolarHBondContact O-N 2.98Å; S147-N149 PolarHBondContact O-ND2 3.14Å
148	G	26	Very low	27.1	Very low	49 Å²	49	93.2 Å²	93.2	51%	0.505	45%	0.446	S	S	.	.	S	Bend	trans	44.3	26.5	156.8	0	0	0	0	0	117.1	S167	G148-S167 WeakPolarHBondContact O-CA 3.42Å; G148-S167 WeakPolarHBondContact O-CB 3.49Å; G148-S167 PolarHBondContact O-N 2.66Å
149	N	25.6	Very low	27.3	Very low	44 Å²	44	88.9 Å²	88.9	24%	0.235	43%	0.426	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138	116.5	-176.4	-70.2	-59.3	0	0	0	105.4	S147 F151 F165	S147-N149 WeakPolarHBondContact O-CB 3.16Å; S147-N149 PolarHBondContact O-N 2.98Å; S147-N149 PolarHBondContact O-ND2 3.14Å; N149-F151 HydrophobicContact CB-CE2 3.96Å; N149-F165 CarbonylContact C-O 3.57Å; N149-F165 WeakPolarHBondContact CA-O 3.45Å
150	I	29.9	Very low	27.8	Very low	53 Å²	53	87.1 Å²	87.1	27%	0.272	42%	0.42	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.2	122	175.2	-53	174.6	0	0	0	105.6	W152 F165 F274	I150-W152 HydrophobicContact CG2-CD2 4.42Å; I150-W152 HydrophobicContact CG2-CG 4.44Å; I150-W152 HydrophobicContact CG2-CZ2 4.13Å; I150-F165 PolarHBondContact N-O 3.34Å; I150-F165 PolarHBondContact O-N 3.29Å; I150-F274 HydrophobicContact CG2-CD1 4.43Å; I150-F274 HydrophobicContact CG2-CE1 3.92Å; I150-F274 HydrophobicContact CG2-CZ 4.34Å
151	F	31.3	Very low	28.1	Very low	40 Å²	40	77.8 Å²	77.8	18%	0.175	39%	0.39	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.8	121.8	171.9	-68.4	-96.3	0	0	0	107.9	L145 N149 F163 K164	L145-F151 HydrophobicContact CB-CD2 4.49Å; L145-F151 HydrophobicContact CD1-CB 4.09Å; L145-F151 HydrophobicContact CD1-CD2 3.39Å; L145-F151 HydrophobicContact CD1-CE2 3.96Å; L145-F151 HydrophobicContact CD1-CG 3.89Å; L145-F151 HydrophobicContact CG-CD2 4.42Å; N149-F151 HydrophobicContact CB-CE2 3.96Å; F151-F163 WeakPolarHBondContact CA-O 3.18Å; F151-K164 HydrophobicContact CD1-CB 4.12Å; F151-K164 HydrophobicContact CD1-CG 4.34Å; F151-K164 HydrophobicContact CE1-CB 3.85Å; F151-K164 HydrophobicContact CE1-CD 4.02Å; F151-K164 HydrophobicContact CE1-CG 3.77Å; F151-K164 HydrophobicContact CZ-CD 4.09Å; F151-K164 HydrophobicContact CZ-CG 4Å
152	W	33.4	Very low	28.5	Very low	43 Å²	43	79 Å²	79	16%	0.163	40%	0.4	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105	128.5	175.9	-67.5	82.4	0	0	0	108.5	I150 L162 F163 F165 V176 C275	I150-W152 HydrophobicContact CG2-CD2 4.42Å; I150-W152 HydrophobicContact CG2-CG 4.44Å; I150-W152 HydrophobicContact CG2-CZ2 4.13Å; W152-L162 CarbonylContact O-C 3.53Å; W152-L162 WeakPolarHBondContact O-CA 3.23Å; W152-F163 HydrophobicContact CB-CB 4.48Å; W152-F163 PolarHBondContact N-O 3.01Å; W152-F163 PolarHBondContact O-N 3.44Å; W152-F165 AromaticContact CD1-CD2 3.73Å; W152-V176 HydrophobicContact CB-CG2 4.25Å; W152-V176 HydrophobicContact CD2-CG2 3.99Å; W152-V176 HydrophobicContact CE3-CG1 4.33Å; W152-V176 HydrophobicContact CE3-CG2 4.39Å; W152-V176 HydrophobicContact CG-CG2 3.92Å; W152-C275 HydrophobicContact CH2-CB 4.38Å; W152-C275 HydrophobicContact CZ3-CB 3.77Å; W152-C275 VanDerWaalsContact CZ3-O 3.29Å; W152-C275 WeakPolarHBondContact CZ3-O 3.38Å
153	A	34.1	Very low	28.8	Very low	31 Å²	31	74.8 Å²	74.8	26%	0.256	38%	0.382	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	121.4	171.2	0	0	0	0	0	108.2	I160 S161 L162	A153-I160 HydrophobicContact CB-CG2 4.04Å; A153-S161 WeakPolarHBondContact CA-O 3.48Å; A153-L162 HydrophobicContact CB-CD2 3.76Å
154	L	31	Very low	29.1	Very low	25 Å²	25	76.7 Å²	76.7	13%	0.131	39%	0.387	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105	122.9	171.2	-174.7	87.9	0	0	0	108.8	I160 S161 F163 V179	L154-I160 CarbonylContact O-C 3.53Å; L154-I160 WeakPolarHBondContact O-CA 3.37Å; L154-S161 PolarHBondContact N-O 3.36Å; L154-S161 PolarHBondContact O-N 3.07Å; L154-F163 HydrophobicContact CB-CE2 3.99Å; L154-V179 HydrophobicContact CD1-CG1 3.93Å; L154-V179 HydrophobicContact CD2-CG1 3.38Å; L154-V179 HydrophobicContact CG-CG1 4.24Å
155	E	30.2	Very low	29.5	Very low	44 Å²	44	71 Å²	71	21%	0.206	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.9	116.7	171.3	-171.8	-172.3	-174.9	0	0	110.3	Q159 I160 Y276 V277 S278 A279	E155-Q159 CarbonylContact C-O 3.55Å; E155-Q159 VanDerWaalsContact CA-O 3.26Å; E155-Q159 WeakPolarHBondContact CA-O 3.22Å; E155-I160 HydrophobicContact CB-CG1 4.46Å; E155-I160 HydrophobicContact CG-CG1 4.32Å; E155-Y276 PolarHBondContact OE2-OH 3.24Å; E155-V277 PolarHBondContact N-O 2.89Å; E155-S278 WeakPolarHBondContact OE2-CB 3.44Å; E155-S278 PolarHBondContact OE2-OG 2.78Å; E155-A279 PolarHBondContact O-N 3.43Å
156	Y	28.8	Very low	29.9	Very low	65 Å²	65	75.9 Å²	75.9	26%	0.255	39%	0.385	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	123.9	174	-179.6	-98.6	0	0	0	110.4	S158 Q159 T183 V187 A279	Y156-S158 VanDerWaalsContact C-N 3.27Å; Y156-S158 PolarHBondContact O-N 2.7Å; Y156-Q159 PolarHBondContact N-O 3.24Å; Y156-Q159 WeakPolarHBondContact O-CB 3.5Å; Y156-Q159 PolarHBondContact O-N 3.23Å; Y156-T183 HydrophobicContact CD2-CG2 4.13Å; Y156-T183 HydrophobicContact CE2-CG2 4.45Å; Y156-V187 HydrophobicContact CD2-CG2 4.21Å; Y156-V187 HydrophobicContact CE2-CG2 3.59Å; Y156-A279 HydrophobicContact CD2-CB 4.34Å
157	R	29.8	Very low	30.6	Very low	173 Å²	173	73.6 Å²	73.6	65%	0.653	38%	0.382	S	S	*	.	T	Hydrogen-bonded Turn	trans	41.4	53.4	179.6	-67.9	-171.5	175.4	-169.5	-4.7	112.9	Q159	R157-Q159 VanDerWaalsContact C-N 3.27Å; R157-Q159 PolarHBondContact O-N 3.38Å
158	S	29	Very low	31.2	Very low	83 Å²	83	73.3 Å²	73.3	58%	0.58	39%	0.391	S	S	*	.	T	Hydrogen-bonded Turn	trans	71.7	9.9	178.5	-41.5	0	0	0	0	115.9	Y156	Y156-S158 VanDerWaalsContact C-N 3.27Å; Y156-S158 PolarHBondContact O-N 2.7Å
159	Q	25.8	Very low	31.6	Very low	101 Å²	101	72.8 Å²	72.8	47%	0.472	38%	0.379	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	131.1	173.8	-61	-176	-13.6	0	0	110.5	P106 E155 Y156 R157	P106-Q159 HydrophobicContact CB-CG 4.37Å; E155-Q159 CarbonylContact C-O 3.55Å; E155-Q159 VanDerWaalsContact CA-O 3.26Å; E155-Q159 WeakPolarHBondContact CA-O 3.22Å; Y156-Q159 PolarHBondContact N-O 3.24Å; Y156-Q159 WeakPolarHBondContact O-CB 3.5Å; Y156-Q159 PolarHBondContact O-N 3.23Å; R157-Q159 VanDerWaalsContact C-N 3.27Å; R157-Q159 PolarHBondContact O-N 3.38Å
160	I	32.8	Very low	32.2	Very low	104 Å²	104	81.6 Å²	81.6	53%	0.533	41%	0.409	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	112.1	173.2	-58.7	175.1	0	0	0	108.8	A153 L154 E155	A153-I160 HydrophobicContact CB-CG2 4.04Å; L154-I160 CarbonylContact O-C 3.53Å; L154-I160 WeakPolarHBondContact O-CA 3.37Å; E155-I160 HydrophobicContact CB-CG1 4.46Å; E155-I160 HydrophobicContact CG-CG1 4.32Å
161	S	30.1	Very low	32.3	Very low	33 Å²	33	86.6 Å²	86.6	23%	0.231	43%	0.429	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98	121.9	172.3	-71.2	0	0	0	0	110	A153 L154	A153-S161 WeakPolarHBondContact CA-O 3.48Å; L154-S161 PolarHBondContact N-O 3.36Å; L154-S161 PolarHBondContact O-N 3.07Å
162	L	32.8	Very low	32.8	Very low	125 Å²	125	84.7 Å²	84.7	65%	0.654	42%	0.422	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-97.5	120.3	176.4	-77.6	163.3	0	0	0	110.6	W152 A153	W152-L162 CarbonylContact O-C 3.53Å; W152-L162 WeakPolarHBondContact O-CA 3.23Å; A153-L162 HydrophobicContact CB-CD2 3.76Å
163	F	33	Very low	33.3	Very low	50 Å²	50	85.8 Å²	85.8	22%	0.219	43%	0.433	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	127.2	176.6	-56.4	-81.4	0	0	0	110.3	F151 W152 L154 F165 F175	F151-F163 WeakPolarHBondContact CA-O 3.18Å; W152-F163 HydrophobicContact CB-CB 4.48Å; W152-F163 PolarHBondContact N-O 3.01Å; W152-F163 PolarHBondContact O-N 3.44Å; L154-F163 HydrophobicContact CB-CE2 3.99Å; F163-F165 HydrophobicContact CB-CD2 4.12Å; F163-F165 HydrophobicContact CB-CE2 3.38Å; F163-F165 HydrophobicContact CB-CZ 3.82Å; F163-F165 HydrophobicContact CG-CE2 4.23Å; F163-F165 HydrophobicContact CG-CZ 4.41Å; F163-F175 HydrophobicContact CD1-CD1 4.35Å; F163-F175 AromaticContact CD1-CE1 3.4Å; F163-F175 HydrophobicContact CD1-CE1 3.4Å; F163-F175 AromaticContact CD1-CZ 3.83Å; F163-F175 HydrophobicContact CD1-CZ 3.83Å; F163-F175 HydrophobicContact CD2-CE1 4.23Å; F163-F175 AromaticContact CE1-CE1 3.34Å; F163-F175 HydrophobicContact CE1-CE1 3.34Å; F163-F175 AromaticContact CE1-CZ 3.47Å; F163-F175 HydrophobicContact CE1-CZ 3.47Å; F163-F175 VanDerWaalsContact CE1-CZ 3.47Å; F163-F175 HydrophobicContact CE2-CE1 4.16Å; F163-F175 AromaticContact CG-CE1 3.87Å; F163-F175 HydrophobicContact CG-CE1 3.87Å; F163-F175 AromaticContact CZ-CE1 3.73Å; F163-F175 HydrophobicContact CZ-CE1 3.73Å; F163-F175 HydrophobicContact CZ-CZ 4.07Å
164	K	34.1	Very low	33.6	Very low	136 Å²	136	88.6 Å²	88.6	59%	0.591	44%	0.443	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-96.2	115.8	173.8	-178.5	-177.3	178.3	-177.6	0	109.1	F151	F151-K164 HydrophobicContact CD1-CB 4.12Å; F151-K164 HydrophobicContact CD1-CG 4.34Å; F151-K164 HydrophobicContact CE1-CB 3.85Å; F151-K164 HydrophobicContact CE1-CD 4.02Å; F151-K164 HydrophobicContact CE1-CG 3.77Å; F151-K164 HydrophobicContact CZ-CD 4.09Å; F151-K164 HydrophobicContact CZ-CG 4Å
165	F	32.3	Very low	34	Very low	36 Å²	36	90.9 Å²	90.9	16%	0.158	45%	0.452	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	143.5	170.2	-62.2	-68.3	0	0	0	111.2	N149 I150 W152 F163 S167 F175 V176	N149-F165 CarbonylContact C-O 3.57Å; N149-F165 WeakPolarHBondContact CA-O 3.45Å; I150-F165 PolarHBondContact N-O 3.34Å; I150-F165 PolarHBondContact O-N 3.29Å; W152-F165 AromaticContact CD1-CD2 3.73Å; F163-F165 HydrophobicContact CB-CD2 4.12Å; F163-F165 HydrophobicContact CB-CE2 3.38Å; F163-F165 HydrophobicContact CB-CZ 3.82Å; F163-F165 HydrophobicContact CG-CE2 4.23Å; F163-F165 HydrophobicContact CG-CZ 4.41Å; F165-S167 PolarHBondContact O-N 2.65Å; F165-F175 HydrophobicContact CE1-CB 4.2Å; F165-F175 HydrophobicContact CE1-CD1 4.39Å; F165-F175 HydrophobicContact CE1-CG 4.32Å; F165-F175 AromaticContact CE2-CD1 3.99Å; F165-F175 HydrophobicContact CE2-CD1 3.99Å; F165-F175 HydrophobicContact CZ-CB 3.82Å; F165-F175 AromaticContact CZ-CD1 3.37Å; F165-F175 HydrophobicContact CZ-CD1 3.37Å; F165-F175 HydrophobicContact CZ-CE1 4.06Å; F165-F175 AromaticContact CZ-CG 3.69Å; F165-F175 HydrophobicContact CZ-CG 3.69Å; F165-V176 HydrophobicContact CE2-CG2 4.13Å
166	K	33.3	Very low	34.7	Very low	164 Å²	164	89.9 Å²	89.9	71%	0.713	45%	0.449	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-64.1	133	168.5	-149.3	175.7	-176.2	-178.6	0	108.4	G168 S169	K166-G168 PolarHBondContact O-N 3.49Å; K166-S169 WeakPolarHBondContact O-CB 3.47Å; K166-S169 PolarHBondContact O-N 3.4Å
167	S	36.5	Very low	35.4	Very low	73 Å²	73	88.7 Å²	88.7	51%	0.51	45%	0.447	S	S	.	.	T	Hydrogen-bonded Turn	trans	-48.7	124.5	173.2	165.5	0	0	0	0	110	G148 F165	G148-S167 WeakPolarHBondContact O-CA 3.42Å; G148-S167 WeakPolarHBondContact O-CB 3.49Å; G148-S167 PolarHBondContact O-N 2.66Å; F165-S167 PolarHBondContact O-N 2.65Å
168	G	36	Very low	35.9	Very low	68 Å²	68	84.8 Å²	84.8	70%	0.701	44%	0.438	S	S	*	.	T	Hydrogen-bonded Turn	trans	84	2.6	-178.2	0	0	0	0	0	115.5	K166 R170	K166-G168 PolarHBondContact O-N 3.49Å; G168-R170 PolarHBondContact O-N 2.97Å; G168-R170 VanDerWaalsContact O-N 3.09Å
169	S	33.6	Very low	36.5	Very low	37 Å²	37	81.9 Å²	81.9	26%	0.259	42%	0.417	S	S	.	.			trans	-65.8	110.3	173.1	176.6	0	0	0	0	110.5	K166 F171 G172 T173	K166-S169 WeakPolarHBondContact O-CB 3.47Å; K166-S169 PolarHBondContact O-N 3.4Å; S169-F171 PolarHBondContact O-N 3.24Å; S169-F171 VanDerWaalsContact O-N 3.14Å; S169-F171 VanDerWaalsContact OG-CB 3.26Å; S169-F171 WeakPolarHBondContact OG-CB 3.32Å; S169-F171 PolarHBondContact OG-N 2.94Å; S169-G172 PolarHBondContact O-N 2.83Å; S169-G172 PolarHBondContact OG-N 3.24Å; S169-G172 VanDerWaalsContact OG-N 3.1Å; S169-T173 PolarHBondContact O-N 3.46Å
170	R	37.8	Very low	37.3	Very low	229 Å²	229	77.3 Å²	77.3	86%	0.864	40%	0.396	S	S	*	.	H	α-helix	trans	-51.7	-32.6	167.1	-67.5	-177.8	-179.6	175	-0.3	111.2	G168 L174	G168-R170 PolarHBondContact O-N 2.97Å; G168-R170 VanDerWaalsContact O-N 3.09Å; R170-L174 VanDerWaalsContact O-CB 3.23Å; R170-L174 WeakPolarHBondContact O-CB 3.49Å; R170-L174 PolarHBondContact O-N 2.82Å
171	F	33.8	Very low	37.6	Very low	158 Å²	158	77.5 Å²	77.5	69%	0.693	39%	0.393	S	S	*	.	H	α-helix	trans	-67.2	-37.6	177.2	-125.6	-85.5	0	0	0	112.9	S169 F175	S169-F171 PolarHBondContact O-N 3.24Å; S169-F171 VanDerWaalsContact O-N 3.14Å; S169-F171 VanDerWaalsContact OG-CB 3.26Å; S169-F171 WeakPolarHBondContact OG-CB 3.32Å; S169-F171 PolarHBondContact OG-N 2.94Å; F171-F175 WeakPolarHBondContact O-CB 3.25Å; F171-F175 PolarHBondContact O-N 3.38Å
172	G	41	Very low	37.9	Very low	1 Å²	1	79.5 Å²	79.5	1%	0.01	40%	0.403	C	S	.	.	H	α-helix	trans	-68.6	-44.3	178.6	0	0	0	0	0	112.4	S169 V176	S169-G172 PolarHBondContact O-N 2.83Å; S169-G172 PolarHBondContact OG-N 3.24Å; S169-G172 VanDerWaalsContact OG-N 3.1Å; G172-V176 WeakPolarHBondContact O-CG2 3.24Å; G172-V176 PolarHBondContact O-N 3.3Å; G172-V176 VanDerWaalsContact O-N 3.1Å
173	T	44.3	Very low	38.2	Very low	66 Å²	66	74.9 Å²	74.9	41%	0.405	38%	0.381	S	S	.	.	H	α-helix	trans	-63.4	-48.1	173.2	-49.3	0	0	0	0	110.9	S169 F175 V176 L177 I251	S169-T173 PolarHBondContact O-N 3.46Å; T173-F175 PolarHBondContact O-N 2.82Å; T173-V176 PolarHBondContact O-N 3.45Å; T173-L177 HydrophobicContact CG2-CD1 4.17Å; T173-L177 WeakPolarHBondContact O-CG 3.46Å; T173-L177 PolarHBondContact O-N 3.47Å; T173-I251 HydrophobicContact CG2-CG1 4.41Å
174	L	39.5	Very low	38.3	Very low	89 Å²	89	73.1 Å²	73.1	47%	0.466	37%	0.374	S	S	.	.	H	α-helix	trans	-61.1	-41.2	178.4	-170.4	74.6	0	0	0	112.4	R170 L177 I178	R170-L174 VanDerWaalsContact O-CB 3.23Å; R170-L174 WeakPolarHBondContact O-CB 3.49Å; R170-L174 PolarHBondContact O-N 2.82Å; L174-L177 WeakPolarHBondContact O-CB 3.31Å; L174-L177 PolarHBondContact O-N 3.2Å; L174-I178 HydrophobicContact CD2-CD1 4.27Å; L174-I178 HydrophobicContact CG-CD1 3.94Å; L174-I178 HydrophobicContact CG-CG1 4.42Å; L174-I178 VanDerWaalsContact O-CG1 3.27Å; L174-I178 WeakPolarHBondContact O-CG1 3.17Å; L174-I178 PolarHBondContact O-N 3.39Å
175	F	38.9	Very low	38.3	Very low	74 Å²	74	71 Å²	71	33%	0.325	37%	0.366	S	S	.	.	H	α-helix	trans	-62.4	-46.4	177.2	-179.9	-86.3	0	0	0	111.6	F163 F165 F171 T173 L177 I178 V179	F163-F175 HydrophobicContact CD1-CD1 4.35Å; F163-F175 AromaticContact CD1-CE1 3.4Å; F163-F175 HydrophobicContact CD1-CE1 3.4Å; F163-F175 AromaticContact CD1-CZ 3.83Å; F163-F175 HydrophobicContact CD1-CZ 3.83Å; F163-F175 HydrophobicContact CD2-CE1 4.23Å; F163-F175 AromaticContact CE1-CE1 3.34Å; F163-F175 HydrophobicContact CE1-CE1 3.34Å; F163-F175 AromaticContact CE1-CZ 3.47Å; F163-F175 HydrophobicContact CE1-CZ 3.47Å; F163-F175 VanDerWaalsContact CE1-CZ 3.47Å; F163-F175 HydrophobicContact CE2-CE1 4.16Å; F163-F175 AromaticContact CG-CE1 3.87Å; F163-F175 HydrophobicContact CG-CE1 3.87Å; F163-F175 AromaticContact CZ-CE1 3.73Å; F163-F175 HydrophobicContact CZ-CE1 3.73Å; F163-F175 HydrophobicContact CZ-CZ 4.07Å; F165-F175 HydrophobicContact CE1-CB 4.2Å; F165-F175 HydrophobicContact CE1-CD1 4.39Å; F165-F175 HydrophobicContact CE1-CG 4.32Å; F165-F175 AromaticContact CE2-CD1 3.99Å; F165-F175 HydrophobicContact CE2-CD1 3.99Å; F165-F175 HydrophobicContact CZ-CB 3.82Å; F165-F175 AromaticContact CZ-CD1 3.37Å; F165-F175 HydrophobicContact CZ-CD1 3.37Å; F165-F175 HydrophobicContact CZ-CE1 4.06Å; F165-F175 AromaticContact CZ-CG 3.69Å; F165-F175 HydrophobicContact CZ-CG 3.69Å; F171-F175 WeakPolarHBondContact O-CB 3.25Å; F171-F175 PolarHBondContact O-N 3.38Å; T173-F175 PolarHBondContact O-N 2.82Å; F175-L177 VanDerWaalsContact C-N 3.29Å; F175-L177 PolarHBondContact O-N 2.75Å; F175-I178 PolarHBondContact O-N 2.94Å; F175-V179 HydrophobicContact CD1-CG2 3.97Å; F175-V179 HydrophobicContact CE1-CG2 3.62Å; F175-V179 HydrophobicContact CE2-CG2 4.42Å; F175-V179 HydrophobicContact CZ-CG2 3.87Å; F175-V179 WeakPolarHBondContact O-CB 3.33Å; F175-V179 VanDerWaalsContact O-CG2 3.27Å; F175-V179 WeakPolarHBondContact O-CG2 3.45Å; F175-V179 PolarHBondContact O-N 2.83Å
176	V	45.4	Very low	38.4	Very low	23 Å²	23	79.4 Å²	79.4	14%	0.139	40%	0.397	C	S	.	.	H	α-helix	trans	-61.4	-40.1	174.4	174.6	0	0	0	0	110.7	W152 F165 G172 T173 V179 M180	W152-V176 HydrophobicContact CB-CG2 4.25Å; W152-V176 HydrophobicContact CD2-CG2 3.99Å; W152-V176 HydrophobicContact CE3-CG1 4.33Å; W152-V176 HydrophobicContact CE3-CG2 4.39Å; W152-V176 HydrophobicContact CG-CG2 3.92Å; F165-V176 HydrophobicContact CE2-CG2 4.13Å; G172-V176 WeakPolarHBondContact O-CG2 3.24Å; G172-V176 PolarHBondContact O-N 3.3Å; G172-V176 VanDerWaalsContact O-N 3.1Å; T173-V176 PolarHBondContact O-N 3.45Å; V176-V179 PolarHBondContact O-N 2.94Å; V176-M180 HydrophobicContact CG1-CG 4.27Å; V176-M180 HydrophobicContact CG1-SD 4.02Å; V176-M180 WeakPolarHBondContact O-CB 3.22Å; V176-M180 VanDerWaalsContact O-CG 3.27Å; V176-M180 WeakPolarHBondContact O-CG 3.37Å; V176-M180 PolarHBondContact O-N 3.49Å
177	L	43.3	Very low	38.4	Very low	39 Å²	39	72.3 Å²	72.3	20%	0.204	37%	0.367	C	S	.	.	H	α-helix	trans	-62.2	-45.2	175.3	-69.2	168.9	0	0	0	112.4	T173 L174 F175 M180 F181 L247 I251	T173-L177 HydrophobicContact CG2-CD1 4.17Å; T173-L177 WeakPolarHBondContact O-CG 3.46Å; T173-L177 PolarHBondContact O-N 3.47Å; L174-L177 WeakPolarHBondContact O-CB 3.31Å; L174-L177 PolarHBondContact O-N 3.2Å; F175-L177 VanDerWaalsContact C-N 3.29Å; F175-L177 PolarHBondContact O-N 2.75Å; L177-M180 PolarHBondContact O-N 3.44Å; L177-F181 VanDerWaalsContact O-CB 3.27Å; L177-F181 WeakPolarHBondContact O-CB 3.41Å; L177-F181 PolarHBondContact O-N 2.74Å; L177-L247 HydrophobicContact CD2-CB 3.83Å; L177-L247 HydrophobicContact CD2-CD1 3.74Å; L177-L247 HydrophobicContact CD2-CD2 3.59Å; L177-L247 HydrophobicContact CD2-CG 3.91Å; L177-I251 HydrophobicContact CD1-CD1 3.76Å; L177-I251 HydrophobicContact CD1-CG1 4.44Å; L177-I251 HydrophobicContact CD2-CD1 4.32Å
178	I	40.1	Very low	38	Very low	91 Å²	91	74 Å²	74	47%	0.467	37%	0.367	S	S	.	.	H	α-helix	trans	-63.1	-45.7	176.9	-69.3	165.9	0	0	0	109.8	L174 F175 F181 T182	L174-I178 HydrophobicContact CD2-CD1 4.27Å; L174-I178 HydrophobicContact CG-CD1 3.94Å; L174-I178 HydrophobicContact CG-CG1 4.42Å; L174-I178 VanDerWaalsContact O-CG1 3.27Å; L174-I178 WeakPolarHBondContact O-CG1 3.17Å; L174-I178 PolarHBondContact O-N 3.39Å; F175-I178 PolarHBondContact O-N 2.94Å; I178-F181 PolarHBondContact O-N 2.75Å; I178-T182 HydrophobicContact CG2-CG2 4.23Å; I178-T182 WeakPolarHBondContact O-CB 3.03Å; I178-T182 VanDerWaalsContact O-CG2 3.25Å; I178-T182 WeakPolarHBondContact O-CG2 3.27Å; I178-T182 PolarHBondContact O-N 2.03Å; I178-T182 PolarHBondContact O-OG1 3.18Å
179	V	41.9	Very low	37.6	Very low	23 Å²	23	72.2 Å²	72.2	14%	0.139	34%	0.343	C	S	.	.	H	α-helix	trans	-64.2	-42.8	178	171.8	0	0	0	0	111.2	L154 F175 V176 T182 T183	L154-V179 HydrophobicContact CD1-CG1 3.93Å; L154-V179 HydrophobicContact CD2-CG1 3.38Å; L154-V179 HydrophobicContact CG-CG1 4.24Å; F175-V179 HydrophobicContact CD1-CG2 3.97Å; F175-V179 HydrophobicContact CE1-CG2 3.62Å; F175-V179 HydrophobicContact CE2-CG2 4.42Å; F175-V179 HydrophobicContact CZ-CG2 3.87Å; F175-V179 WeakPolarHBondContact O-CB 3.33Å; F175-V179 VanDerWaalsContact O-CG2 3.27Å; F175-V179 WeakPolarHBondContact O-CG2 3.45Å; F175-V179 PolarHBondContact O-N 2.83Å; V176-V179 PolarHBondContact O-N 2.94Å; V179-T182 WeakPolarHBondContact CA-OG1 2.72Å; V179-T182 PolarHBondContact O-OG1 3.23Å; V179-T182 VanDerWaalsContact O-OG1 3.13Å; V179-T183 HydrophobicContact CG1-CG2 4.42Å; V179-T183 VanDerWaalsContact O-CB 3.31Å; V179-T183 WeakPolarHBondContact O-CB 3.33Å; V179-T183 VanDerWaalsContact O-CG2 3.32Å; V179-T183 WeakPolarHBondContact O-CG2 3.48Å; V179-T183 PolarHBondContact O-N 2.95Å; V179-T183 PolarHBondContact O-OG1 2.94Å
180	M	43.6	Very low	37.5	Very low	5 Å²	5	71.1 Å²	71.1	3%	0.025	33%	0.334	C	S	.	.	H	α-helix	trans	-61.7	-50.8	173.2	-75.2	-175.2	72.4	0	0	111.1	V176 L177 T182 T183 V184 I192 V243 L247 V277	V176-M180 HydrophobicContact CG1-CG 4.27Å; V176-M180 HydrophobicContact CG1-SD 4.02Å; V176-M180 WeakPolarHBondContact O-CB 3.22Å; V176-M180 VanDerWaalsContact O-CG 3.27Å; V176-M180 WeakPolarHBondContact O-CG 3.37Å; V176-M180 PolarHBondContact O-N 3.49Å; L177-M180 PolarHBondContact O-N 3.44Å; M180-T182 PolarHBondContact O-N 2.84Å; M180-T183 WeakPolarHBondContact CA-OG1 3.41Å; M180-T183 PolarHBondContact O-N 2.77Å; M180-T183 PolarHBondContact O-OG1 2.67Å; M180-T183 VanDerWaalsContact O-OG1 3.09Å; M180-V184 WeakPolarHBondContact O-CB 3.14Å; M180-V184 WeakPolarHBondContact O-CG2 3.46Å; M180-V184 PolarHBondContact O-N 3.39Å; M180-I192 HydrophobicContact CE-CD1 3.61Å; M180-I192 HydrophobicContact CE-CG1 4.16Å; M180-V243 HydrophobicContact CE-CG1 4.33Å; M180-L247 HydrophobicContact CE-CD1 4.36Å; M180-L247 HydrophobicContact CE-CD2 3.85Å; M180-L247 HydrophobicContact CE-CG 4.35Å; M180-L247 HydrophobicContact SD-CD2 3.66Å; M180-V277 HydrophobicContact CE-CG1 4.46Å; M180-V277 HydrophobicContact CE-CG2 3.88Å; M180-V277 HydrophobicContact SD-CG2 4.09Å
181	F	38.2	Very low	37.1	Very low	107 Å²	107	64.2 Å²	64.2	47%	0.469	31%	0.309	S	S	.	.	H	α-helix	trans	-59	-47	179.9	-172.4	-98.7	0	0	0	111.9	L177 I178 V184 H185	L177-F181 VanDerWaalsContact O-CB 3.27Å; L177-F181 WeakPolarHBondContact O-CB 3.41Å; L177-F181 PolarHBondContact O-N 2.74Å; I178-F181 PolarHBondContact O-N 2.75Å; F181-V184 PolarHBondContact O-N 2.7Å; F181-H185 AromaticContact CD1-CD2 3.92Å; F181-H185 AromaticContact CD1-NE2 3.92Å; F181-H185 AromaticContact CE1-CD2 3.7Å; F181-H185 AromaticContact CE1-NE2 3.21Å; F181-H185 WeakPolarHBondContact CE1-NE2 3.32Å; F181-H185 AromaticContact CZ-NE2 3.41Å; F181-H185 WeakPolarHBondContact CZ-NE2 3.36Å; F181-H185 PolarHBondContact O-CD2 3.43Å; F181-H185 VanDerWaalsContact O-CD2 3.23Å; F181-H185 PolarHBondContact O-N 3.26Å
182	T	35.7	Very low	37	Very low	75 Å²	75	57.2 Å²	57.2	46%	0.46	28%	0.278	S	S	.	.	H	α-helix	trans	-68.6	-34.7	179.2	53.4	0	0	0	0	113.3	I178 V179 M180	I178-T182 HydrophobicContact CG2-CG2 4.23Å; I178-T182 WeakPolarHBondContact O-CB 3.03Å; I178-T182 VanDerWaalsContact O-CG2 3.25Å; I178-T182 WeakPolarHBondContact O-CG2 3.27Å; I178-T182 PolarHBondContact O-N 2.03Å; I178-T182 PolarHBondContact O-OG1 3.18Å; V179-T182 WeakPolarHBondContact CA-OG1 2.72Å; V179-T182 PolarHBondContact O-OG1 3.23Å; V179-T182 VanDerWaalsContact O-OG1 3.13Å; M180-T182 PolarHBondContact O-N 2.84Å
183	T	39.2	Very low	36.6	Very low	29 Å²	29	57.8 Å²	57.8	18%	0.178	28%	0.282	C	S	.	.	H	α-helix	trans	-74.2	-37.7	174.5	50.1	0	0	0	0	112	Y156 V179 M180 H185 R186 V187	Y156-T183 HydrophobicContact CD2-CG2 4.13Å; Y156-T183 HydrophobicContact CE2-CG2 4.45Å; V179-T183 HydrophobicContact CG1-CG2 4.42Å; V179-T183 VanDerWaalsContact O-CB 3.31Å; V179-T183 WeakPolarHBondContact O-CB 3.33Å; V179-T183 VanDerWaalsContact O-CG2 3.32Å; V179-T183 WeakPolarHBondContact O-CG2 3.48Å; V179-T183 PolarHBondContact O-N 2.95Å; V179-T183 PolarHBondContact O-OG1 2.94Å; M180-T183 WeakPolarHBondContact CA-OG1 3.41Å; M180-T183 PolarHBondContact O-N 2.77Å; M180-T183 PolarHBondContact O-OG1 2.67Å; M180-T183 VanDerWaalsContact O-OG1 3.09Å; T183-H185 PolarHBondContact O-N 2.66Å; T183-R186 PolarHBondContact O-N 3.49Å; T183-V187 VanDerWaalsContact O-CB 3.31Å; T183-V187 WeakPolarHBondContact O-CB 2.9Å; T183-V187 WeakPolarHBondContact O-CG2 3.27Å; T183-V187 PolarHBondContact O-N 3.11Å
184	V	35.3	Very low	35.9	Very low	12 Å²	12	55.7 Å²	55.7	7%	0.073	27%	0.268	C	S	.	.	H	α-helix	trans	-57.1	-36.4	174.2	-179.1	0	0	0	0	111.7	M180 F181 R186 V187 I190 R240 V243	M180-V184 WeakPolarHBondContact O-CB 3.14Å; M180-V184 WeakPolarHBondContact O-CG2 3.46Å; M180-V184 PolarHBondContact O-N 3.39Å; F181-V184 PolarHBondContact O-N 2.7Å; V184-R186 PolarHBondContact O-N 2.88Å; V184-V187 PolarHBondContact O-N 3.42Å; V184-I190 HydrophobicContact CB-CD1 3.82Å; V184-I190 HydrophobicContact CG1-CD1 4.09Å; V184-I190 HydrophobicContact CG2-CD1 3.1Å; V184-R240 HydrophobicContact CG1-CG 4.32Å; V184-V243 HydrophobicContact CG2-CG1 4.34Å
185	H	34.9	Very low	35.4	Very low	92 Å²	92	54.9 Å²	54.9	43%	0.426	26%	0.26	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.4	-23.3	177.5	-91.1	-78.3	0	0	0	114.1	F181 T183	F181-H185 AromaticContact CD1-CD2 3.92Å; F181-H185 AromaticContact CD1-NE2 3.92Å; F181-H185 AromaticContact CE1-CD2 3.7Å; F181-H185 AromaticContact CE1-NE2 3.21Å; F181-H185 WeakPolarHBondContact CE1-NE2 3.32Å; F181-H185 AromaticContact CZ-NE2 3.41Å; F181-H185 WeakPolarHBondContact CZ-NE2 3.36Å; F181-H185 PolarHBondContact O-CD2 3.43Å; F181-H185 VanDerWaalsContact O-CD2 3.23Å; F181-H185 PolarHBondContact O-N 3.26Å; T183-H185 PolarHBondContact O-N 2.66Å
186	R	34	Very low	34.8	Very low	213 Å²	213	53.7 Å²	53.7	80%	0.804	26%	0.256	S	S	*	.	T	Hydrogen-bonded Turn	trans	-119.2	2.4	-177.8	-64.8	-162.1	177.6	-177	1	114.6	T183 V184	T183-R186 PolarHBondContact O-N 3.49Å; V184-R186 PolarHBondContact O-N 2.88Å
187	V	32.5	Very low	33.8	Very low	14 Å²	14	55.9 Å²	55.9	9%	0.085	26%	0.262	C	S	.	.			trans	-120.4	127.2	-168.9	173.2	0	0	0	0	110.7	Y156 T183 V184 C189 I190 A279	Y156-V187 HydrophobicContact CD2-CG2 4.21Å; Y156-V187 HydrophobicContact CE2-CG2 3.59Å; T183-V187 VanDerWaalsContact O-CB 3.31Å; T183-V187 WeakPolarHBondContact O-CB 2.9Å; T183-V187 WeakPolarHBondContact O-CG2 3.27Å; T183-V187 PolarHBondContact O-N 3.11Å; V184-V187 PolarHBondContact O-N 3.42Å; V187-C189 WeakPolarHBondContact CG1-O 3.27Å; V187-I190 HydrophobicContact CB-CG1 4.4Å; V187-I190 HydrophobicContact CG1-CG1 3.75Å; V187-A279 HydrophobicContact CG1-CB 3.59Å; V187-A279 HydrophobicContact CG2-CB 4.11Å
188	Q	29.4	Very low	32.9	Very low	110 Å²	110	57.2 Å²	57.2	51%	0.514	28%	0.279	S	S	.	.	S	Bend	trans	-81.5	-15.6	179.6	-69	-178.6	-13.7	0	0	113.9
189	C	27.3	Very low	32.2	Very low	30 Å²	30	57.4 Å²	57.4	20%	0.203	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.3	127.6	-178.3	-77.2	0	0	0	0	110.8	V187 A279 C280	V187-C189 WeakPolarHBondContact CG1-O 3.27Å; C189-A279 WeakPolarHBondContact O-CA 2.99Å; C189-C280 HydrophobicContact CB-CB 4.05Å; C189-C280 PolarHBondContact O-N 2.75Å; C189-C280 VanDerWaalsContact O-N 3.11Å
190	I	31.5	Very low	31.3	Very low	13 Å²	13	60.2 Å²	60.2	7%	0.067	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	120.4	177.9	-60.4	175.4	0	0	0	108.3	V184 V187 I192 V277	V184-I190 HydrophobicContact CB-CD1 3.82Å; V184-I190 HydrophobicContact CG1-CD1 4.09Å; V184-I190 HydrophobicContact CG2-CD1 3.1Å; V187-I190 HydrophobicContact CB-CG1 4.4Å; V187-I190 HydrophobicContact CG1-CG1 3.75Å; I190-I192 HydrophobicContact CG2-CD1 4.39Å; I190-I192 HydrophobicContact CG2-CG1 3.86Å; I190-V277 HydrophobicContact CG2-CG1 3.25Å
191	Y	29.5	Very low	30.3	Very low	85 Å²	85	66 Å²	66	33%	0.333	33%	0.332	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.1	128	167.2	-69.7	-91.5	0	0	0	108	Y230 V277 S278 C280	Y191-Y230 HydrophobicContact CD1-CD2 4.12Å; Y191-Y230 AromaticContact CE1-CD2 3.54Å; Y191-Y230 HydrophobicContact CE1-CD2 3.54Å; Y191-Y230 AromaticContact CE1-CE2 3.67Å; Y191-Y230 HydrophobicContact CE1-CE2 3.67Å; Y191-Y230 HydrophobicContact CE2-CE2 4.41Å; Y191-Y230 AromaticContact CZ-CD2 3.96Å; Y191-Y230 AromaticContact CZ-CE2 3.59Å; Y191-Y230 WeakPolarHBondContact OH-CE2 3.24Å; Y191-V277 CarbonylContact O-C 3.55Å; Y191-V277 WeakPolarHBondContact O-CA 3.44Å; Y191-V277 VanDerWaalsContact O-CG1 3.31Å; Y191-V277 WeakPolarHBondContact O-CG1 3.21Å; Y191-S278 WeakPolarHBondContact CB-O 3.41Å; Y191-S278 WeakPolarHBondContact CD2-O 3.39Å; Y191-S278 PolarHBondContact N-O 2.79Å; Y191-S278 PolarHBondContact O-N 3.39Å; Y191-C280 HydrophobicContact CE2-CB 4.18Å; Y191-C280 VanDerWaalsContact CE2-SG 3.54Å
192	I	32	Very low	29.6	Very low	10 Å²	10	66.8 Å²	66.8	5%	0.051	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	115.8	169.8	-52.8	174.9	0	0	0	106.5	M180 I190 I194 I229 C275 Y276 V277	M180-I192 HydrophobicContact CE-CD1 3.61Å; M180-I192 HydrophobicContact CE-CG1 4.16Å; I190-I192 HydrophobicContact CG2-CD1 4.39Å; I190-I192 HydrophobicContact CG2-CG1 3.86Å; I192-I194 HydrophobicContact CG2-CD1 4.22Å; I192-I194 HydrophobicContact CG2-CG1 3.8Å; I192-I229 PolarHBondContact O-N 3.11Å; I192-C275 HydrophobicContact CG2-CB 3.92Å; I192-Y276 CarbonylContact C-O 3.56Å; I192-Y276 WeakPolarHBondContact CA-O 3.48Å; I192-V277 HydrophobicContact CB-CG2 4.35Å; I192-V277 HydrophobicContact CG1-CG1 4.25Å; I192-V277 HydrophobicContact CG1-CG2 3.99Å; I192-V277 HydrophobicContact CG2-CG2 4.09Å
193	S	31.3	Very low	29	Very low	13 Å²	13	74.6 Å²	74.6	9%	0.091	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.5	108.5	173.8	-57	0	0	0	0	108.7	F274 C275 Y276	S193-F274 VanDerWaalsContact O-O 3.05Å; S193-C275 CarbonylContact O-C 3.46Å; S193-C275 VanDerWaalsContact O-CA 3.3Å; S193-C275 WeakPolarHBondContact O-CA 3.39Å; S193-Y276 PolarHBondContact N-O 2.79Å; S193-Y276 PolarHBondContact O-N 3.42Å
194	I	30.4	Very low	28.4	Very low	22 Å²	22	79.2 Å²	79.2	11%	0.113	39%	0.39	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.3	112.2	-178.9	-50.7	-174.7	0	0	0	108.7	I192 I196 F274 C275	I192-I194 HydrophobicContact CG2-CD1 4.22Å; I192-I194 HydrophobicContact CG2-CG1 3.8Å; I194-I196 HydrophobicContact CG2-CG1 4.11Å; I194-F274 CarbonylContact C-O 3.48Å; I194-F274 VanDerWaalsContact CA-O 3.27Å; I194-F274 WeakPolarHBondContact CA-O 3.34Å; I194-C275 HydrophobicContact CG1-CB 4.16Å
195	Y	28.3	Very low	28	Very low	73 Å²	73	81.9 Å²	81.9	29%	0.286	42%	0.42	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.5	104	173.6	-58.1	-91.5	0	0	0	109.5	T272 S273 F274	Y195-T272 VanDerWaalsContact O-O 3.09Å; Y195-S273 CarbonylContact O-C 3.49Å; Y195-S273 WeakPolarHBondContact O-CA 3.24Å; Y195-F274 HydrophobicContact CD2-CB 4.11Å; Y195-F274 WeakPolarHBondContact CD2-O 3.28Å; Y195-F274 PolarHBondContact N-O 3.39Å; Y195-F274 PolarHBondContact O-N 3.31Å
196	I	26.4	Very low	27.5	Very low	49 Å²	49	87 Å²	87	25%	0.251	44%	0.444	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.4	109.8	174.3	-57.5	-175.9	0	0	0	108.3	I194 F271	I194-I196 HydrophobicContact CG2-CG1 4.11Å; I196-F271 HydrophobicContact CG2-CB 4.3Å; I196-F271 HydrophobicContact CG2-CD1 3.11Å; I196-F271 HydrophobicContact CG2-CE1 3.57Å; I196-F271 HydrophobicContact CG2-CG 4Å
197	Y	25.2	Very low	27.1	Very low	69 Å²	69	80.2 Å²	80.2	27%	0.271	44%	0.44	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95	112.4	174.6	-72.6	-72.3	0	0	0	111.3	T272 F274	Y197-T272 PolarHBondContact N-O 3.26Å; Y197-T272 VanDerWaalsContact N-O 3.14Å; Y197-F274 HydrophobicContact CD2-CD2 4.13Å; Y197-F274 HydrophobicContact CE2-CD2 4.06Å
198	A	24.2	Very low	26.7	Very low	66 Å²	66	91.3 Å²	91.3	55%	0.545	48%	0.481	S	S	.	.			trans	-86.1	112.2	166.5	0	0	0	0	0	109.5
199	H	24.8	Very low	26.6	Very low	96 Å²	96	96.6 Å²	96.6	44%	0.444	50%	0.502	S	S	.	.			trans	-113.4	100.2	175.7	-167.8	-71.7	0	0	0	110.5	R144 M201	R144-H199 PolarHBondContact NH2-CD2 2.82Å; R144-H199 PolarHBondContact NH2-NE2 2.58Å; H199-M201 WeakPolarHBondContact ND1-CG 2.93Å; H199-M201 PolarHBondContact O-N 2.8Å
200	A	22.9	Very low	26.6	Very low	82 Å²	82	100.5 Å²	100.5	68%	0.678	53%	0.529	S	S	*	.			trans	-77.4	98.5	169.7	0	0	0	0	0	109.6	N202	A200-N202 PolarHBondContact O-N 3.38Å
201	M	23.5	Very low	26.4	Very low	127 Å²	127	109.9 Å²	109.9	63%	0.626	57%	0.57	S	S	*	*			trans	-74.1	110.4	162.5	-79.3	-164	176.4	0	0	109	H199 R203 R269	H199-M201 WeakPolarHBondContact ND1-CG 2.93Å; H199-M201 PolarHBondContact O-N 2.8Å; M201-R203 PolarHBondContact O-N 2.86Å; M201-R269 PolarHBondContact O-NH1 3.48Å
202	N	23.4	Very low	26.2	Very low	123 Å²	123	109.2 Å²	109.2	66%	0.658	59%	0.588	S	S	*	*			trans	-74.6	100.6	157.2	-84.7	-11.8	0	0	0	107.2	A200 T204	A200-N202 PolarHBondContact O-N 3.38Å; N202-T204 VanDerWaalsContact C-N 3.26Å; N202-T204 PolarHBondContact O-N 3.31Å
203	R	23.3	Very low	25.8	Very low	239 Å²	239	118.1 Å²	118.1	90%	0.902	63%	0.627	S	S	*	*			trans	-68	97.3	153.9	-79	-171.8	178	176.8	-0.1	105.5	M201 G205	M201-R203 PolarHBondContact O-N 2.86Å; R203-G205 PolarHBondContact O-N 3.41Å
204	T	26.9	Very low	25.4	Very low	126 Å²	126	127.6 Å²	127.6	77%	0.773	67%	0.666	S	S	*	*			trans	-65.8	86.8	158.1	45.3	0	0	0	0	106.2	N202 E206	N202-T204 VanDerWaalsContact C-N 3.26Å; N202-T204 PolarHBondContact O-N 3.31Å; T204-E206 PolarHBondContact O-N 3.29Å
205	G	26.3	Very low	24.9	Very low	68 Å²	68	132.5 Å²	132.5	70%	0.701	70%	0.698	S	S	*	*			trans	-61.5	105.1	162	0	0	0	0	0	107.1	R203 G207	R203-G205 PolarHBondContact O-N 3.41Å; G205-G207 PolarHBondContact O-N 2.87Å
206	E	25.5	Very low	24.5	Very low	200 Å²	200	135 Å²	135	94%	0.935	72%	0.724	S	S	*	*			trans	-56.5	128.8	153.1	-72.1	-178.5	143.7	0	0	107.5	T204	T204-E206 PolarHBondContact O-N 3.29Å
207	G	25	Very low	24.2	Very low	70 Å²	70	140.2 Å²	140.2	72%	0.722	75%	0.749	S	S	*	*			trans	109.2	65.7	164.6	0	0	0	0	0	116.3	G205	G205-G207 PolarHBondContact O-N 2.87Å
208	R	24.4	Very low	24	Very low	247 Å²	247	144.7 Å²	144.7	93%	0.932	78%	0.777	S	S	*	*				-167.3	108.9	119.7	-102.9	167.7	-173.3	-175.6	2.2	109.3	S210	R208-S210 VanDerWaalsContact C-N 3.27Å; R208-S210 PolarHBondContact O-N 2.81Å
209	K	26.2	Very low	23.7	Very low	221 Å²	221	149 Å²	149	96%	0.961	79%	0.789	S	S	*	*			trans	-63.5	86.4	169.9	-71.7	178.8	176.5	176.1	0	108.8
210	S	26.8	Very low	23.6	Very low	111 Å²	111	149.9 Å²	149.9	78%	0.776	80%	0.804	S	S	*	*			trans	-82.4	113.1	165.2	174.3	0	0	0	0	108.2	R208 G212	R208-S210 VanDerWaalsContact C-N 3.27Å; R208-S210 PolarHBondContact O-N 2.81Å; S210-G212 PolarHBondContact O-N 3.43Å
211	K	29	Very low	23.5	Very low	211 Å²	211	148.3 Å²	148.3	92%	0.917	80%	0.795	S	S	*	*			trans	-60.4	121.1	172.1	-75.7	178.3	174.4	177.9	0	108.8
212	G	25.2	Very low	23.6	Very low	70 Å²	70	147.8 Å²	147.8	72%	0.722	80%	0.802	S	S	*	*	S	Bend	trans	86.9	81.5	155.2	0	0	0	0	0	117.1	S210	S210-G212 PolarHBondContact O-N 3.43Å
213	K	23.2	Very low	23.6	Very low	197 Å²	197	145 Å²	145	86%	0.857	80%	0.801	S	S	*	*				178.8	110.9	127.8	-104.8	174.6	177.6	176.8	0	108.3	T215	K213-T215 PolarHBondContact O-N 3.23Å; K213-T215 VanDerWaalsContact O-N 3.09Å
214	K	22.1	Very low	23.8	Very low	213 Å²	213	136.2 Å²	136.2	93%	0.926	77%	0.774	S	S	*	*			trans	-74.4	89.7	170.7	-71	179.6	177.8	178.4	0	108.1
215	T	21.3	Very low	23.7	Very low	125 Å²	125	133 Å²	133	77%	0.767	76%	0.76	S	S	*	*			trans	-88.2	111.9	161.6	34.3	0	0	0	0	108.6	K213 M217	K213-T215 PolarHBondContact O-N 3.23Å; K213-T215 VanDerWaalsContact O-N 3.09Å; T215-M217 PolarHBondContact O-N 2.83Å
216	C	19.3	Very low	23.8	Very low	126 Å²	126	134.5 Å²	134.5	85%	0.851	75%	0.749	S	S	*	*	P	Polyproline II helix	trans	-52.2	117.9	167.5	-63.8	0	0	0	0	109.4
217	M	19.8	Very low	23.9	Very low	157 Å²	157	128.4 Å²	128.4	77%	0.773	73%	0.725	S	S	*	*	P	Polyproline II helix	trans	-76.9	121	167.5	-93	-176.9	172.5	0	0	108.6	T215 I219	T215-M217 PolarHBondContact O-N 2.83Å; M217-I219 PolarHBondContact O-N 3.12Å
218	L	20.1	Very low	24	Very low	163 Å²	163	132.4 Å²	132.4	85%	0.853	72%	0.72	S	S	*	*	P	Polyproline II helix	trans	-53.4	127.5	158	-100.6	97.6	0	0	0	108.3	P220	L218-P220 WeakPolarHBondContact O-CD 3.42Å
219	I	19.4	Very low	24.2	Very low	157 Å²	157	122.5 Å²	122.5	81%	0.805	69%	0.685	S	S	*	*			trans	-90.5	96	167.1	-56.7	168.5	0	0	0	105.7	M217 G221	M217-I219 PolarHBondContact O-N 3.12Å; I219-G221 VanDerWaalsContact C-N 3.33Å; I219-G221 PolarHBondContact O-N 3.18Å
220	P	21.9	Very low	24.2	Very low	115 Å²	115	118.7 Å²	118.7	75%	0.747	67%	0.666	S	S	*	*			trans	-65.8	105	160.3	26	-28.7	0	0	0	106.3	L218	L218-P220 WeakPolarHBondContact O-CD 3.42Å
221	G	21.3	Very low	24.3	Very low	48 Å²	48	114.2 Å²	114.2	50%	0.495	63%	0.633	S	S	.	*			trans	-54.9	161	169	0	0	0	0	0	110.4	I219 G223	I219-G221 VanDerWaalsContact C-N 3.33Å; I219-G221 PolarHBondContact O-N 3.18Å; G221-G223 VanDerWaalsContact C-N 3.29Å; G221-G223 PolarHBondContact O-N 3.25Å
222	P	25.9	Very low	24.3	Very low	117 Å²	117	106.7 Å²	106.7	76%	0.76	61%	0.61	S	S	*	*			trans	-65	89	-179.3	28	-33.8	0	0	0	110.1	V224	P222-V224 PolarHBondContact O-N 2.98Å
223	G	22.6	Very low	24.5	Very low	63 Å²	63	104.3 Å²	104.3	65%	0.649	59%	0.586	S	S	*	*			trans	-70.5	96.1	164.9	0	0	0	0	0	107.7	G221 A225	G221-G223 VanDerWaalsContact C-N 3.29Å; G221-G223 PolarHBondContact O-N 3.25Å; G223-A225 PolarHBondContact O-N 3.07Å; G223-A225 VanDerWaalsContact O-N 3.15Å
224	V	28.1	Very low	25	Very low	55 Å²	55	99.3 Å²	99.3	33%	0.333	57%	0.574	S	S	.	*			trans	-74.3	101.1	167.5	-174	0	0	0	0	106.3	P222 H226	P222-V224 PolarHBondContact O-N 2.98Å; V224-H226 VanDerWaalsContact CG1-NE2 3.26Å; V224-H226 WeakPolarHBondContact CG1-NE2 3.35Å; V224-H226 PolarHBondContact O-CD2 2.69Å; V224-H226 PolarHBondContact O-N 3.01Å
225	A	25.1	Very low	25.8	Very low	58 Å²	58	90.7 Å²	90.7	48%	0.479	55%	0.546	S	S	.	.			trans	-74.7	105.3	168.1	0	0	0	0	0	107.7	G223	G223-A225 PolarHBondContact O-N 3.07Å; G223-A225 VanDerWaalsContact O-N 3.15Å
226	H	26.9	Very low	26.8	Very low	101 Å²	101	87.8 Å²	87.8	47%	0.468	53%	0.528	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.4	106.4	170.9	-67.3	-90.2	0	0	0	108.3	V224 Y228	V224-H226 VanDerWaalsContact CG1-NE2 3.26Å; V224-H226 WeakPolarHBondContact CG1-NE2 3.35Å; V224-H226 PolarHBondContact O-CD2 2.69Å; V224-H226 PolarHBondContact O-N 3.01Å; H226-Y228 HydrophobicContact CB-CD2 4.39Å; H226-Y228 HydrophobicContact CB-CE2 3.83Å
227	T	27.9	Very low	28	Very low	72 Å²	72	85.7 Å²	85.7	44%	0.442	52%	0.519	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	105.7	169.7	-47.9	0	0	0	0	108.4	I229	T227-I229 HydrophobicContact CG2-CG1 4Å
228	Y	27.2	Very low	29.2	Very low	153 Å²	153	81.6 Å²	81.6	60%	0.6	51%	0.506	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-86.5	116.4	167.2	-63.2	-82.6	0	0	0	107.6	H226	H226-Y228 HydrophobicContact CB-CD2 4.39Å; H226-Y228 HydrophobicContact CB-CE2 3.83Å
229	I	28.5	Very low	30.4	Very low	40 Å²	40	74.8 Å²	74.8	21%	0.205	47%	0.471	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	107	170.3	-54.7	179.7	0	0	0	106.6	I192 T227 V231 L246	I192-I229 PolarHBondContact O-N 3.11Å; T227-I229 HydrophobicContact CG2-CG1 4Å; I229-V231 HydrophobicContact CG2-CG2 3.72Å; I229-L246 HydrophobicContact CB-CD1 4.26Å; I229-L246 HydrophobicContact CD1-CD1 3.57Å; I229-L246 HydrophobicContact CD1-CD2 3.36Å; I229-L246 HydrophobicContact CD1-CG 4.05Å; I229-L246 HydrophobicContact CG1-CD1 4.49Å; I229-L246 HydrophobicContact CG2-CD1 3.51Å
230	Y	26.2	Very low	31.6	Very low	141 Å²	141	71.9 Å²	71.9	55%	0.553	45%	0.45	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-89.3	111.7	172.5	-174.6	-109.1	0	0	0	108.4	Y191 A232	Y191-Y230 HydrophobicContact CD1-CD2 4.12Å; Y191-Y230 AromaticContact CE1-CD2 3.54Å; Y191-Y230 HydrophobicContact CE1-CD2 3.54Å; Y191-Y230 AromaticContact CE1-CE2 3.67Å; Y191-Y230 HydrophobicContact CE1-CE2 3.67Å; Y191-Y230 HydrophobicContact CE2-CE2 4.41Å; Y191-Y230 AromaticContact CZ-CD2 3.96Å; Y191-Y230 AromaticContact CZ-CE2 3.59Å; Y191-Y230 WeakPolarHBondContact OH-CE2 3.24Å; Y230-A232 HydrophobicContact CD1-CB 3.98Å; Y230-A232 HydrophobicContact CE1-CB 3.22Å; Y230-A232 HydrophobicContact CE2-CB 4.43Å
231	V	30.2	Very low	32.9	Very low	16 Å²	16	71.3 Å²	71.3	10%	0.097	44%	0.44	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	93.8	171.2	-166.1	0	0	0	0	107.7	I229 V239 I242	I229-V231 HydrophobicContact CG2-CG2 3.72Å; V231-V239 HydrophobicContact CG1-CB 4.17Å; V231-V239 HydrophobicContact CG1-CG1 3.62Å; V231-V239 HydrophobicContact CG1-CG2 3.94Å; V231-I242 HydrophobicContact CG2-CG2 4.13Å
232	A	27.9	Very low	34.3	Very low	53 Å²	53	72.7 Å²	72.7	44%	0.438	44%	0.435	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.5	126.6	168.9	0	0	0	0	0	109.8	Y230	Y230-A232 HydrophobicContact CD1-CB 3.98Å; Y230-A232 HydrophobicContact CE1-CB 3.22Å; Y230-A232 HydrophobicContact CE2-CB 4.43Å
233	G	29.5	Very low	35.5	Very low	20 Å²	20	67.4 Å²	67.4	21%	0.206	40%	0.401	C	S	.	.	S	Bend	trans	174	149.9	170	0	0	0	0	0	108.7	G235	G233-G235 PolarHBondContact O-N 2.73Å
234	P	34.3	Very low	36.9	Very low	93 Å²	93	68.1 Å²	68.1	60%	0.604	39%	0.39	S	S	*	.	S	Bend	trans	-48.6	143.9	164.5	23.7	-30.9	0	0	0	107.4	T236	P234-T236 HydrophobicContact CB-CG2 4.45Å; P234-T236 HydrophobicContact CG-CG2 4.06Å; P234-T236 PolarHBondContact O-N 2.02Å; P234-T236 PolarHBondContact O-OG1 2.82Å
235	G	39.5	Very low	38	Very low	32 Å²	32	70.2 Å²	70.2	33%	0.33	40%	0.398	S	S	.	.	S	Bend	trans	-64.2	57	-173.7	0	0	0	0	0	114.2	G233	G233-G235 PolarHBondContact O-N 2.73Å
236	T	40.7	Very low	39.3	Very low	64 Å²	64	69.2 Å²	69.2	39%	0.393	39%	0.385	S	S	.	.			trans	-70.9	155	175.7	55	0	0	0	0	108.4	P234 S238 V239 R240	P234-T236 HydrophobicContact CB-CG2 4.45Å; P234-T236 HydrophobicContact CG-CG2 4.06Å; P234-T236 PolarHBondContact O-N 2.02Å; P234-T236 PolarHBondContact O-OG1 2.82Å; T236-S238 PolarHBondContact O-N 3.32Å; T236-S238 PolarHBondContact OG1-OG 3.49Å; T236-V239 PolarHBondContact O-N 3.39Å; T236-R240 PolarHBondContact O-N 3.21Å
237	A	45.7	Very low	40.4	Very low	81 Å²	81	65.7 Å²	65.7	67%	0.669	37%	0.369	S	S	*	.	H	α-helix	trans	-51	-31.2	179.7	0	0	0	0	0	112.8	R240 L241	A237-R240 PolarHBondContact O-N 2.95Å; A237-L241 WeakPolarHBondContact O-CB 3.23Å; A237-L241 PolarHBondContact O-N 2.87Å
238	S	44.1	Very low	41.5	Very low	72 Å²	72	66.7 Å²	66.7	50%	0.503	37%	0.371	S	S	.	.	H	α-helix	trans	-63.7	-44.9	175.2	40.2	0	0	0	0	113.8	T236 R240 L241 I242	T236-S238 PolarHBondContact O-N 3.32Å; T236-S238 PolarHBondContact OG1-OG 3.49Å; S238-R240 VanDerWaalsContact C-N 3.34Å; S238-L241 PolarHBondContact O-N 2.83Å; S238-I242 VanDerWaalsContact O-CG1 3.27Å; S238-I242 WeakPolarHBondContact O-CG1 3.37Å; S238-I242 PolarHBondContact O-N 3.38Å
239	V	45.2	Very low	42.6	Very low	19 Å²	19	64.9 Å²	64.9	12%	0.115	37%	0.371	C	S	.	.	H	α-helix	trans	-64.8	-41.2	175.1	169.6	0	0	0	0	110.6	V231 T236 L241 I242 V243	V231-V239 HydrophobicContact CG1-CB 4.17Å; V231-V239 HydrophobicContact CG1-CG1 3.62Å; V231-V239 HydrophobicContact CG1-CG2 3.94Å; T236-V239 PolarHBondContact O-N 3.39Å; V239-L241 VanDerWaalsContact C-N 3.35Å; V239-L241 PolarHBondContact O-N 2.8Å; V239-I242 PolarHBondContact O-N 3.29Å; V239-V243 WeakPolarHBondContact O-CG2 3.48Å; V239-V243 PolarHBondContact O-N 3.31Å
240	R	44.3	Very low	43.5	Very low	96 Å²	96	64.4 Å²	64.4	36%	0.362	37%	0.371	S	S	.	.	H	α-helix	trans	-61.1	-43.8	176	-64.2	-176.8	-175.1	176.5	2.4	111.6	V184 T236 A237 S238 V243 L244	V184-R240 HydrophobicContact CG1-CG 4.32Å; T236-R240 PolarHBondContact O-N 3.21Å; A237-R240 PolarHBondContact O-N 2.95Å; S238-R240 VanDerWaalsContact C-N 3.34Å; R240-V243 PolarHBondContact O-N 3.47Å; R240-L244 WeakPolarHBondContact O-CB 3.27Å; R240-L244 PolarHBondContact O-N 2.68Å
241	L	50.6	Low	44.3	Very low	103 Å²	103	60.2 Å²	60.2	54%	0.539	36%	0.358	S	S	.	.	H	α-helix	trans	-64.3	-43.5	177.4	-174.1	67.8	0	0	0	111.5	A237 S238 V239 L244 L245	A237-L241 WeakPolarHBondContact O-CB 3.23Å; A237-L241 PolarHBondContact O-N 2.87Å; S238-L241 PolarHBondContact O-N 2.83Å; V239-L241 VanDerWaalsContact C-N 3.35Å; V239-L241 PolarHBondContact O-N 2.8Å; L241-L244 PolarHBondContact O-N 2.86Å; L241-L245 HydrophobicContact CD1-CG 4.5Å; L241-L245 HydrophobicContact CG-CD1 4Å; L241-L245 HydrophobicContact CG-CG 4.4Å; L241-L245 WeakPolarHBondContact O-CB 3.42Å; L241-L245 VanDerWaalsContact O-CG 3.25Å; L241-L245 WeakPolarHBondContact O-CG 3.11Å; L241-L245 PolarHBondContact O-N 3.05Å
242	I	50.6	Low	45	Very low	77 Å²	77	63 Å²	63	40%	0.395	38%	0.375	S	S	.	.	H	α-helix	trans	-62.5	-46.9	177.7	-68.1	163.8	0	0	0	110.8	V231 S238 V239 L244 L245 L246	V231-I242 HydrophobicContact CG2-CG2 4.13Å; S238-I242 VanDerWaalsContact O-CG1 3.27Å; S238-I242 WeakPolarHBondContact O-CG1 3.37Å; S238-I242 PolarHBondContact O-N 3.38Å; V239-I242 PolarHBondContact O-N 3.29Å; I242-L244 VanDerWaalsContact C-N 3.35Å; I242-L244 PolarHBondContact O-N 2.8Å; I242-L245 PolarHBondContact O-N 2.77Å; I242-L246 HydrophobicContact CG2-CD1 3.88Å; I242-L246 HydrophobicContact CG2-CG 4.4Å; I242-L246 WeakPolarHBondContact O-CB 3.17Å; I242-L246 VanDerWaalsContact O-CG 3.26Å; I242-L246 WeakPolarHBondContact O-CG 3.36Å; I242-L246 PolarHBondContact O-N 3.48Å
243	V	49.9	Very low	45.7	Very low	6 Å²	6	62.8 Å²	62.8	4%	0.036	37%	0.368	C	S	.	.	H	α-helix	trans	-62.3	-42.9	176.3	175	0	0	0	0	110.6	M180 V184 V239 R240 L245 L246 L247	M180-V243 HydrophobicContact CE-CG1 4.33Å; V184-V243 HydrophobicContact CG2-CG1 4.34Å; V239-V243 WeakPolarHBondContact O-CG2 3.48Å; V239-V243 PolarHBondContact O-N 3.31Å; R240-V243 PolarHBondContact O-N 3.47Å; V243-L245 PolarHBondContact O-N 2.93Å; V243-L246 PolarHBondContact O-N 3.49Å; V243-L247 HydrophobicContact CG1-CD1 3.83Å; V243-L247 HydrophobicContact CG1-CG 4.28Å; V243-L247 VanDerWaalsContact O-CB 3.28Å; V243-L247 WeakPolarHBondContact O-CB 3.21Å; V243-L247 WeakPolarHBondContact O-CG 3.43Å; V243-L247 PolarHBondContact O-N 3.06Å
244	L	51.7	Low	46.2	Very low	79 Å²	79	64.2 Å²	64.2	41%	0.414	38%	0.378	S	S	.	.	H	α-helix	trans	-59.9	-43.6	174.4	-103.4	149.3	0	0	0	112.8	R240 L241 I242 L247 L248	R240-L244 WeakPolarHBondContact O-CB 3.27Å; R240-L244 PolarHBondContact O-N 2.68Å; L241-L244 PolarHBondContact O-N 2.86Å; I242-L244 VanDerWaalsContact C-N 3.35Å; I242-L244 PolarHBondContact O-N 2.8Å; L244-L247 PolarHBondContact O-N 2.92Å; L244-L248 WeakPolarHBondContact O-CB 3.43Å; L244-L248 PolarHBondContact O-N 3.23Å
245	L	52.7	Low	46.4	Very low	98 Å²	98	63.6 Å²	63.6	51%	0.513	37%	0.372	S	S	.	.	H	α-helix	trans	-66.6	-41.7	178.2	-74.1	170.2	0	0	0	111.6	L241 I242 V243 L247 L248 L249	L241-L245 HydrophobicContact CD1-CG 4.5Å; L241-L245 HydrophobicContact CG-CD1 4Å; L241-L245 HydrophobicContact CG-CG 4.4Å; L241-L245 WeakPolarHBondContact O-CB 3.42Å; L241-L245 VanDerWaalsContact O-CG 3.25Å; L241-L245 WeakPolarHBondContact O-CG 3.11Å; L241-L245 PolarHBondContact O-N 3.05Å; I242-L245 PolarHBondContact O-N 2.77Å; V243-L245 PolarHBondContact O-N 2.93Å; L245-L247 VanDerWaalsContact C-N 3.34Å; L245-L248 PolarHBondContact O-N 3.04Å; L245-L249 WeakPolarHBondContact O-CB 3.35Å; L245-L249 PolarHBondContact O-N 3.23Å
246	L	52.1	Low	46.2	Very low	38 Å²	38	67.7 Å²	67.7	20%	0.199	39%	0.386	C	S	.	.	H	α-helix	trans	-66.3	-37.7	175.5	-70.2	171.9	0	0	0	112.1	I229 I242 V243 L249 C250	I229-L246 HydrophobicContact CB-CD1 4.26Å; I229-L246 HydrophobicContact CD1-CD1 3.57Å; I229-L246 HydrophobicContact CD1-CD2 3.36Å; I229-L246 HydrophobicContact CD1-CG 4.05Å; I229-L246 HydrophobicContact CG1-CD1 4.49Å; I229-L246 HydrophobicContact CG2-CD1 3.51Å; I242-L246 HydrophobicContact CG2-CD1 3.88Å; I242-L246 HydrophobicContact CG2-CG 4.4Å; I242-L246 WeakPolarHBondContact O-CB 3.17Å; I242-L246 VanDerWaalsContact O-CG 3.26Å; I242-L246 WeakPolarHBondContact O-CG 3.36Å; I242-L246 PolarHBondContact O-N 3.48Å; V243-L246 PolarHBondContact O-N 3.49Å; L246-L249 PolarHBondContact O-N 2.89Å; L246-C250 PolarHBondContact O-N 2.85Å; L246-C250 PolarHBondContact O-SG 3.09Å
247	L	50.1	Low	46.1	Very low	27 Å²	27	66.2 Å²	66.2	14%	0.141	38%	0.377	C	S	.	.	H	α-helix	trans	-64.8	-46.1	172.6	-76.2	173	0	0	0	111.5	L177 M180 V243 L244 L245 L249 C250 I251	L177-L247 HydrophobicContact CD2-CB 3.83Å; L177-L247 HydrophobicContact CD2-CD1 3.74Å; L177-L247 HydrophobicContact CD2-CD2 3.59Å; L177-L247 HydrophobicContact CD2-CG 3.91Å; M180-L247 HydrophobicContact CE-CD1 4.36Å; M180-L247 HydrophobicContact CE-CD2 3.85Å; M180-L247 HydrophobicContact CE-CG 4.35Å; M180-L247 HydrophobicContact SD-CD2 3.66Å; V243-L247 HydrophobicContact CG1-CD1 3.83Å; V243-L247 HydrophobicContact CG1-CG 4.28Å; V243-L247 VanDerWaalsContact O-CB 3.28Å; V243-L247 WeakPolarHBondContact O-CB 3.21Å; V243-L247 WeakPolarHBondContact O-CG 3.43Å; V243-L247 PolarHBondContact O-N 3.06Å; L244-L247 PolarHBondContact O-N 2.92Å; L245-L247 VanDerWaalsContact C-N 3.34Å; L247-L249 VanDerWaalsContact C-N 3.3Å; L247-L249 PolarHBondContact O-N 3.34Å; L247-C250 WeakPolarHBondContact O-CB 3.09Å; L247-C250 PolarHBondContact O-N 2.9Å; L247-I251 VanDerWaalsContact O-CG1 3.28Å; L247-I251 WeakPolarHBondContact O-CG1 3.31Å; L247-I251 PolarHBondContact O-N 2.64Å
248	L	50.8	Low	45.3	Very low	92 Å²	92	66.6 Å²	66.6	48%	0.482	38%	0.375	S	S	.	.	H	α-helix	trans	-57.9	-43.1	173.1	-90	157.9	0	0	0	111.3	L244 L245 C250 I251 V252	L244-L248 WeakPolarHBondContact O-CB 3.43Å; L244-L248 PolarHBondContact O-N 3.23Å; L245-L248 PolarHBondContact O-N 3.04Å; L248-C250 PolarHBondContact O-N 3.29Å; L248-I251 WeakPolarHBondContact O-CB 3.38Å; L248-I251 PolarHBondContact O-N 2.94Å; L248-V252 WeakPolarHBondContact O-CG2 3.26Å; L248-V252 PolarHBondContact O-N 3.04Å
249	L	49.9	Very low	44.5	Very low	115 Å²	115	65.4 Å²	65.4	60%	0.602	37%	0.374	S	S	*	.	H	α-helix	trans	-63	-42.4	176.6	-157.2	113.9	0	0	0	111.4	L245 L246 L247 I251 V252 V253	L245-L249 WeakPolarHBondContact O-CB 3.35Å; L245-L249 PolarHBondContact O-N 3.23Å; L246-L249 PolarHBondContact O-N 2.89Å; L247-L249 VanDerWaalsContact C-N 3.3Å; L247-L249 PolarHBondContact O-N 3.34Å; L249-I251 VanDerWaalsContact C-N 3.34Å; L249-I251 PolarHBondContact O-N 3.17Å; L249-V252 PolarHBondContact O-N 3.25Å; L249-V253 WeakPolarHBondContact O-CG2 3.32Å; L249-V253 PolarHBondContact O-N 3.13Å
250	C	47	Very low	43.6	Very low	30 Å²	30	68.6 Å²	68.6	20%	0.203	40%	0.397	C	S	.	.	H	α-helix	trans	-62	-39.9	173.3	-68.4	0	0	0	0	112.1	L246 L247 L248 A254	L246-C250 PolarHBondContact O-N 2.85Å; L246-C250 PolarHBondContact O-SG 3.09Å; L247-C250 WeakPolarHBondContact O-CB 3.09Å; L247-C250 PolarHBondContact O-N 2.9Å; L248-C250 PolarHBondContact O-N 3.29Å; C250-A254 WeakPolarHBondContact O-CB 3.31Å; C250-A254 PolarHBondContact O-N 3.21Å
251	I	44.4	Very low	42.9	Very low	53 Å²	53	68.3 Å²	68.3	27%	0.272	41%	0.409	S	S	.	.	H	α-helix	trans	-63.6	-48.1	174.3	-66	164.5	0	0	0	109.9	T173 L177 L247 L248 L249 V253 A254 V255	T173-I251 HydrophobicContact CG2-CG1 4.41Å; L177-I251 HydrophobicContact CD1-CD1 3.76Å; L177-I251 HydrophobicContact CD1-CG1 4.44Å; L177-I251 HydrophobicContact CD2-CD1 4.32Å; L247-I251 VanDerWaalsContact O-CG1 3.28Å; L247-I251 WeakPolarHBondContact O-CG1 3.31Å; L247-I251 PolarHBondContact O-N 2.64Å; L248-I251 WeakPolarHBondContact O-CB 3.38Å; L248-I251 PolarHBondContact O-N 2.94Å; L249-I251 VanDerWaalsContact C-N 3.34Å; L249-I251 PolarHBondContact O-N 3.17Å; I251-V253 VanDerWaalsContact C-N 3.32Å; I251-V253 PolarHBondContact O-N 2.9Å; I251-A254 PolarHBondContact O-N 3.28Å; I251-V255 HydrophobicContact CG2-CG2 3.77Å; I251-V255 WeakPolarHBondContact O-CB 3.4Å; I251-V255 WeakPolarHBondContact O-CG2 3.27Å; I251-V255 PolarHBondContact O-N 3.44Å
252	V	43.3	Very low	41.9	Very low	76 Å²	76	68.8 Å²	68.8	46%	0.461	42%	0.416	S	S	.	.	H	α-helix	trans	-59.6	-44.1	179	171.5	0	0	0	0	110.5	L248 L249 N256	L248-V252 WeakPolarHBondContact O-CG2 3.26Å; L248-V252 PolarHBondContact O-N 3.04Å; L249-V252 PolarHBondContact O-N 3.25Å; V252-N256 WeakPolarHBondContact O-CB 3.25Å; V252-N256 PolarHBondContact O-N 2.85Å
253	V	43.6	Very low	40.7	Very low	48 Å²	48	68.4 Å²	68.4	29%	0.291	43%	0.431	S	S	.	.	H	α-helix	trans	-64.2	-46.5	175.6	173.4	0	0	0	0	111.4	L249 I251 T257 F271	L249-V253 WeakPolarHBondContact O-CG2 3.32Å; L249-V253 PolarHBondContact O-N 3.13Å; I251-V253 VanDerWaalsContact C-N 3.32Å; I251-V253 PolarHBondContact O-N 2.9Å; V253-T257 VanDerWaalsContact O-CB 3.31Å; V253-T257 WeakPolarHBondContact O-CB 3.33Å; V253-T257 WeakPolarHBondContact O-CG2 3.38Å; V253-T257 PolarHBondContact O-N 3.03Å; V253-T257 PolarHBondContact O-OG1 2.7Å; V253-F271 HydrophobicContact CG1-CB 4.21Å
254	A	40.9	Very low	39.7	Very low	49 Å²	49	74.5 Å²	74.5	41%	0.405	47%	0.468	S	S	.	.	H	α-helix	trans	-67.6	-38.6	179.9	0	0	0	0	0	112.9	C250 I251 T257 S258	C250-A254 WeakPolarHBondContact O-CB 3.31Å; C250-A254 PolarHBondContact O-N 3.21Å; I251-A254 PolarHBondContact O-N 3.28Å; A254-T257 WeakPolarHBondContact CA-OG1 3.34Å; A254-T257 PolarHBondContact O-OG1 3.48Å; A254-S258 WeakPolarHBondContact O-CB 3.06Å; A254-S258 PolarHBondContact O-N 3.3Å; A254-S258 PolarHBondContact O-OG 3.29Å
255	V	37.4	Very low	38.3	Very low	80 Å²	80	77.5 Å²	77.5	49%	0.485	49%	0.485	S	S	.	.	H	α-helix	trans	-71.4	-48	178.6	172.9	0	0	0	0	110.1	I251 T257 S258 G259	I251-V255 HydrophobicContact CG2-CG2 3.77Å; I251-V255 WeakPolarHBondContact O-CB 3.4Å; I251-V255 WeakPolarHBondContact O-CG2 3.27Å; I251-V255 PolarHBondContact O-N 3.44Å; V255-T257 PolarHBondContact O-N 3.23Å; V255-S258 WeakPolarHBondContact CA-OG 3.42Å; V255-S258 PolarHBondContact O-N 3.08Å; V255-S258 VanDerWaalsContact O-N 3.12Å; V255-S258 PolarHBondContact O-OG 3.24Å; V255-G259 PolarHBondContact O-N 2.84Å
256	N	35.9	Very low	36.9	Very low	119 Å²	119	79.3 Å²	79.3	64%	0.636	50%	0.5	S	S	*	.	H	α-helix	trans	-65.4	-25.6	176.7	-75.9	-14.9	0	0	0	112.9	V252	V252-N256 WeakPolarHBondContact O-CB 3.25Å; V252-N256 PolarHBondContact O-N 2.85Å
257	T	37.2	Very low	35.5	Very low	33 Å²	33	86.6 Å²	86.6	20%	0.202	54%	0.536	C	S	.	.	H	α-helix	trans	-83.6	-25.7	173.6	51.4	0	0	0	0	113	V253 A254 V255 C270 F271	V253-T257 VanDerWaalsContact O-CB 3.31Å; V253-T257 WeakPolarHBondContact O-CB 3.33Å; V253-T257 WeakPolarHBondContact O-CG2 3.38Å; V253-T257 PolarHBondContact O-N 3.03Å; V253-T257 PolarHBondContact O-OG1 2.7Å; A254-T257 WeakPolarHBondContact CA-OG1 3.34Å; A254-T257 PolarHBondContact O-OG1 3.48Å; V255-T257 PolarHBondContact O-N 3.23Å; T257-C270 PolarHBondContact O-SG 3.33Å; T257-C270 VanDerWaalsContact O-SG 3.37Å; T257-F271 HydrophobicContact CG2-CB 4.23Å
258	S	30.7	Very low	34.1	Very low	89 Å²	89	92 Å²	92	62%	0.622	56%	0.564	S	S	*	*	H	α-helix	trans	-78.4	-21.8	170.5	69.4	0	0	0	0	113.4	A254 V255 S260	A254-S258 WeakPolarHBondContact O-CB 3.06Å; A254-S258 PolarHBondContact O-N 3.3Å; A254-S258 PolarHBondContact O-OG 3.29Å; V255-S258 WeakPolarHBondContact CA-OG 3.42Å; V255-S258 PolarHBondContact O-N 3.08Å; V255-S258 VanDerWaalsContact O-N 3.12Å; V255-S258 PolarHBondContact O-OG 3.24Å; S258-S260 PolarHBondContact O-N 3.43Å; S258-S260 VanDerWaalsContact O-N 3.12Å
259	G	27.1	Very low	32.8	Very low	47 Å²	47	94.7 Å²	94.7	49%	0.485	57%	0.568	S	S	.	*	S	Bend	trans	-72.9	95.7	174.2	0	0	0	0	0	111.5	V255 C261	V255-G259 PolarHBondContact O-N 2.84Å; G259-C261 PolarHBondContact O-N 3.27Å
260	S	26.3	Very low	31.5	Very low	85 Å²	85	92 Å²	92	59%	0.594	56%	0.558	S	S	*	*			trans	45.2	74.7	156.5	-162.7	0	0	0	0	115.6	S258 T262	S258-S260 PolarHBondContact O-N 3.43Å; S258-S260 VanDerWaalsContact O-N 3.12Å; S260-T262 PolarHBondContact O-N 2.8Å; S260-T262 PolarHBondContact OG-OG1 2.67Å
261	C	29.2	Very low	30.5	Very low	91 Å²	91	94 Å²	94	62%	0.615	56%	0.563	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66.1	57.3	164	-88.7	0	0	0	0	109.7	G259 C270	G259-C261 PolarHBondContact O-N 3.27Å; C261-C270 WeakPolarHBondContact CB-SG 3.23Å; C261-C270 VanDerWaalsContact SG-CB 3.52Å; C261-C270 CovalentContact SG-SG 2.14Å; C261-C270 PolarHBondContact SG-SG 3.01Å
262	T	30	Very low	29.9	Very low	113 Å²	113	95.4 Å²	95.4	69%	0.693	57%	0.574	S	S	*	*	T	Hydrogen-bonded Turn	trans	-117.5	-7.1	177.3	57.5	0	0	0	0	115	S260	S260-T262 PolarHBondContact O-N 2.8Å; S260-T262 PolarHBondContact OG-OG1 2.67Å
263	G	24.9	Very low	29.2	Very low	68 Å²	68	93.3 Å²	93.3	70%	0.701	56%	0.563	S	S	*	*			trans	-83	123.4	178.7	0	0	0	0	0	113.2	N265	G263-N265 PolarHBondContact O-N 2.72Å
264	T	27.9	Very low	28.6	Very low	134 Å²	134	94.7 Å²	94.7	82%	0.822	57%	0.566	S	S	*	*	S	Bend	trans	-76.2	-1.1	-167.9	30.7	0	0	0	0	117.2
265	N	23.4	Very low	28	Very low	143 Å²	143	93.2 Å²	93.2	77%	0.765	55%	0.552	S	S	*	*	S	Bend	trans	-145.6	77.9	-174.3	-79.2	-48.5	0	0	0	112.6	G263	G263-N265 PolarHBondContact O-N 2.72Å
266	T	22.9	Very low	27.7	Very low	136 Å²	136	93.2 Å²	93.2	83%	0.834	54%	0.544	S	S	*	.			trans	-179.1	129.3	144.6	17.5	0	0	0	0	109.8	L268	T266-L268 PolarHBondContact O-N 2.72Å
267	M	22.2	Very low	27.4	Very low	190 Å²	190	88 Å²	88	94%	0.936	52%	0.516	S	S	*	.			trans	-75.6	42.1	-170.9	-73.4	-165.8	-97.9	0	0	115
268	L	21.5	Very low	27	Very low	140 Å²	140	87.3 Å²	87.3	73%	0.733	51%	0.512	S	S	*	.			trans	-108.9	80	171.9	-111.6	85.7	0	0	0	109.9	T266 C270 F271	T266-L268 PolarHBondContact O-N 2.72Å; L268-C270 PolarHBondContact O-N 2.79Å; L268-F271 HydrophobicContact CD2-CE2 4.04Å; L268-F271 HydrophobicContact CG-CE2 4.27Å
269	R	22.4	Very low	26.9	Very low	150 Å²	150	84 Å²	84	57%	0.566	49%	0.49	S	S	*	.			trans	-83.8	112.3	-174.2	-75.9	179.1	173.5	178.8	-3.9	111.5	M201 F271	M201-R269 PolarHBondContact O-NH1 3.48Å; R269-F271 PolarHBondContact O-N 2.88Å
270	C	24.2	Very low	26.8	Very low	58 Å²	58	84.6 Å²	84.6	39%	0.392	49%	0.487	S	S	.	.			trans	37.5	73.9	147	-87.4	0	0	0	0	113.2	T257 C261 L268	T257-C270 PolarHBondContact O-SG 3.33Å; T257-C270 VanDerWaalsContact O-SG 3.37Å; C261-C270 WeakPolarHBondContact CB-SG 3.23Å; C261-C270 VanDerWaalsContact SG-CB 3.52Å; C261-C270 CovalentContact SG-SG 2.14Å; C261-C270 PolarHBondContact SG-SG 3.01Å; L268-C270 PolarHBondContact O-N 2.79Å
271	F	26	Very low	26.7	Very low	71 Å²	71	83.1 Å²	83.1	31%	0.311	49%	0.485	S	S	.	.			trans	-69.4	123.5	174.9	-71.1	-73.7	0	0	0	111.4	I196 V253 T257 L268 R269	I196-F271 HydrophobicContact CG2-CB 4.3Å; I196-F271 HydrophobicContact CG2-CD1 3.11Å; I196-F271 HydrophobicContact CG2-CE1 3.57Å; I196-F271 HydrophobicContact CG2-CG 4Å; V253-F271 HydrophobicContact CG1-CB 4.21Å; T257-F271 HydrophobicContact CG2-CB 4.23Å; L268-F271 HydrophobicContact CD2-CE2 4.04Å; L268-F271 HydrophobicContact CG-CE2 4.27Å; R269-F271 PolarHBondContact O-N 2.88Å
272	T	30.5	Very low	26.5	Very low	83 Å²	83	89.4 Å²	89.4	51%	0.509	50%	0.496	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.7	105.9	164.1	38.1	0	0	0	0	108.4	Y195 Y197	Y195-T272 VanDerWaalsContact O-O 3.09Å; Y197-T272 PolarHBondContact N-O 3.26Å; Y197-T272 VanDerWaalsContact N-O 3.14Å
273	S	29.8	Very low	26.3	Very low	33 Å²	33	90.5 Å²	90.5	23%	0.231	50%	0.503	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.2	116.2	173.7	-68.2	0	0	0	0	109.5	Y195	Y195-S273 CarbonylContact O-C 3.49Å; Y195-S273 WeakPolarHBondContact O-CA 3.24Å
274	F	29.5	Very low	26.3	Very low	77 Å²	77	99.8 Å²	99.8	34%	0.338	53%	0.528	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.2	115	165.5	-84.1	-95.3	0	0	0	108.8	I150 S193 I194 Y195 Y197	I150-F274 HydrophobicContact CG2-CD1 4.43Å; I150-F274 HydrophobicContact CG2-CE1 3.92Å; I150-F274 HydrophobicContact CG2-CZ 4.34Å; S193-F274 VanDerWaalsContact O-O 3.05Å; I194-F274 CarbonylContact C-O 3.48Å; I194-F274 VanDerWaalsContact CA-O 3.27Å; I194-F274 WeakPolarHBondContact CA-O 3.34Å; Y195-F274 HydrophobicContact CD2-CB 4.11Å; Y195-F274 WeakPolarHBondContact CD2-O 3.28Å; Y195-F274 PolarHBondContact N-O 3.39Å; Y195-F274 PolarHBondContact O-N 3.31Å; Y197-F274 HydrophobicContact CD2-CD2 4.13Å; Y197-F274 HydrophobicContact CE2-CD2 4.06Å
275	C	30	Very low	26.2	Very low	17 Å²	17	98.1 Å²	98.1	12%	0.115	51%	0.513	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.4	113.5	170.9	-43.7	0	0	0	0	109.8	W152 I192 S193 I194	W152-C275 HydrophobicContact CH2-CB 4.38Å; W152-C275 HydrophobicContact CZ3-CB 3.77Å; W152-C275 VanDerWaalsContact CZ3-O 3.29Å; W152-C275 WeakPolarHBondContact CZ3-O 3.38Å; I192-C275 HydrophobicContact CG2-CB 3.92Å; S193-C275 CarbonylContact O-C 3.46Å; S193-C275 VanDerWaalsContact O-CA 3.3Å; S193-C275 WeakPolarHBondContact O-CA 3.39Å; I194-C275 HydrophobicContact CG1-CB 4.16Å
276	Y	29.6	Very low	26.3	Very low	80 Å²	80	95.7 Å²	95.7	31%	0.314	50%	0.5	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.6	123.3	168	169.7	-92.7	0	0	0	108.7	E155 I192 S193	E155-Y276 PolarHBondContact OE2-OH 3.24Å; I192-Y276 CarbonylContact C-O 3.56Å; I192-Y276 WeakPolarHBondContact CA-O 3.48Å; S193-Y276 PolarHBondContact N-O 2.79Å; S193-Y276 PolarHBondContact O-N 3.42Å
277	V	31.1	Very low	26.5	Very low	11 Å²	11	93.5 Å²	93.5	7%	0.067	48%	0.481	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	122.4	-177.3	-174.1	0	0	0	0	110.9	E155 M180 I190 Y191 I192	E155-V277 PolarHBondContact N-O 2.89Å; M180-V277 HydrophobicContact CE-CG1 4.46Å; M180-V277 HydrophobicContact CE-CG2 3.88Å; M180-V277 HydrophobicContact SD-CG2 4.09Å; I190-V277 HydrophobicContact CG2-CG1 3.25Å; Y191-V277 CarbonylContact O-C 3.55Å; Y191-V277 WeakPolarHBondContact O-CA 3.44Å; Y191-V277 VanDerWaalsContact O-CG1 3.31Å; Y191-V277 WeakPolarHBondContact O-CG1 3.21Å; I192-V277 HydrophobicContact CB-CG2 4.35Å; I192-V277 HydrophobicContact CG1-CG1 4.25Å; I192-V277 HydrophobicContact CG1-CG2 3.99Å; I192-V277 HydrophobicContact CG2-CG2 4.09Å
278	S	28.8	Very low	26.8	Very low	17 Å²	17	87.8 Å²	87.8	12%	0.119	46%	0.455	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118	126	175.7	-176.3	0	0	0	0	110.2	E155 Y191	E155-S278 WeakPolarHBondContact OE2-CB 3.44Å; E155-S278 PolarHBondContact OE2-OG 2.78Å; Y191-S278 WeakPolarHBondContact CB-O 3.41Å; Y191-S278 WeakPolarHBondContact CD2-O 3.39Å; Y191-S278 PolarHBondContact N-O 2.79Å; Y191-S278 PolarHBondContact O-N 3.39Å
279	A	27.2	Very low	27.1	Very low	19 Å²	19	84.6 Å²	84.6	16%	0.157	44%	0.437	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.1	119.3	176.8	0	0	0	0	0	110.6	E155 Y156 V187 C189	E155-A279 PolarHBondContact O-N 3.43Å; Y156-A279 HydrophobicContact CD2-CB 4.34Å; V187-A279 HydrophobicContact CG1-CB 3.59Å; V187-A279 HydrophobicContact CG2-CB 4.11Å; C189-A279 WeakPolarHBondContact O-CA 2.99Å
280	C	26.4	Very low	27.4	Very low	61 Å²	61	80.2 Å²	80.2	41%	0.412	43%	0.429	S	S	.	.			trans	-87	110.7	168.3	-82.3	0	0	0	0	109.4	C189 Y191	C189-C280 HydrophobicContact CB-CB 4.05Å; C189-C280 PolarHBondContact O-N 2.75Å; C189-C280 VanDerWaalsContact O-N 3.11Å; Y191-C280 HydrophobicContact CE2-CB 4.18Å; Y191-C280 VanDerWaalsContact CE2-SG 3.54Å
281	G	24.2	Very low	27.6	Very low	54 Å²	54	81.8 Å²	81.8	56%	0.557	43%	0.431	S	S	*	.			trans	-83	123.6	164.8	0	0	0	0	0	110.1
282	R	24.1	Very low	27.8	Very low	222 Å²	222	82.6 Å²	82.6	84%	0.838	44%	0.44	S	S	*	.			trans	-76.2	119.9	153.3	-98	-178	174	169.3	-1.9	107.1	Q284	R282-Q284 PolarHBondContact O-N 2.94Å
283	T	24.9	Very low	27.5	Very low	137 Å²	137	82.6 Å²	82.6	84%	0.84	44%	0.435	S	S	*	.			trans	-66.1	113	160.6	43.1	0	0	0	0	107.7
284	Q	24.9	Very low	27.3	Very low	263 Å²	263	87.1 Å²	87.1	100%	1.229	45%	0.453	S	S	*	.			trans	-99.5	0	140.5	-82.7	-171.9	-19.1	0	0	106.6	R282	R282-Q284 PolarHBondContact O-N 2.94Å

Retrieved 284 of 284 residues in 237.3 ms (Link to these results)

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