YE172_YEAST Loading...

Putative uncharacterized protein YER172C-A

AlphaFold DB , UniProt , Accession A0A023PYF7, Species YEAST (Saccharomyces cerevisiae (strain ATCC 204508 / S288c), Baker's yeast), Gene n/a, Length 126 aa.

						>YE172_YEAST|A0A023PYF7
MTVLLEHPLGPDSSRILCLALGKNMASKASCTSLSFLLCMATCSKQLGLNFSYHCSPPSSLILGRILDVSCLERKSFSVLLALRTGEVGLDELHFVICEPNELRLYCNKGRLFKFVLSISFRQEQT
					

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	23.1	Very low	29.3	Very low	203 Å²	203	99.9 Å²	99.9	100%	1	56%	0.56	S	S	*	*				0	105.2	0	-170.8	178.9	-148.2	0	0	106.3
2	T	24.5	Very low	30.1	Very low	129 Å²	129	104.7 Å²	104.7	79%	0.791	58%	0.583	S	S	*	*			trans	-108.5	119.6	-179.2	-46.5	0	0	0	0	106.2
3	V	25.2	Very low	30.8	Very low	23 Å²	23	97.8 Å²	97.8	14%	0.139	55%	0.547	C	S	.	.			trans	-94.9	114.9	178.4	169.6	0	0	0	0	106.4	L5 F51 S52	V3-L5 VanDerWaalsContact O-CD1 3.29Å; V3-L5 WeakPolarHBondContact O-CD1 3.47Å; V3-F51 HydrophobicContact CB-CD1 4.32Å; V3-F51 HydrophobicContact CG1-CB 4.2Å; V3-F51 HydrophobicContact CG1-CD1 3.79Å; V3-F51 HydrophobicContact CG1-CG 4.38Å; V3-S52 WeakPolarHBondContact CG1-O 3.24Å; V3-S52 WeakPolarHBondContact CG1-OG 3.06Å; V3-S52 VanDerWaalsContact CG2-O 3.28Å; V3-S52 WeakPolarHBondContact CG2-O 2.98Å
4	L	23.8	Very low	31.1	Very low	140 Å²	140	94.4 Å²	94.4	73%	0.733	53%	0.532	S	S	*	.			trans	-94.5	142.9	-177	-138.5	129.3	0	0	0	110.6	S52	L4-S52 PolarHBondContact O-OG 2.87Å
5	L	28.8	Very low	31.6	Very low	26 Å²	26	97.4 Å²	97.4	14%	0.136	53%	0.532	C	S	.	.			trans	-120.5	77	-152.4	-78.8	133.2	0	0	0	112.5	V3 H7 S44 L49 N50 F51 F121	V3-L5 VanDerWaalsContact O-CD1 3.29Å; V3-L5 WeakPolarHBondContact O-CD1 3.47Å; L5-H7 VanDerWaalsContact C-N 3.25Å; L5-H7 PolarHBondContact O-N 3.26Å; L5-S44 WeakPolarHBondContact CD2-OG 3.04Å; L5-L49 HydrophobicContact CB-CB 3.77Å; L5-L49 HydrophobicContact CD1-CB 3.97Å; L5-L49 HydrophobicContact CD1-CD2 4.41Å; L5-L49 HydrophobicContact CD2-CB 3.19Å; L5-L49 HydrophobicContact CD2-CG 4.37Å; L5-L49 HydrophobicContact CG-CB 3.78Å; L5-N50 VanDerWaalsContact C-CB 3.49Å; L5-N50 VanDerWaalsContact CA-N 3.29Å; L5-N50 WeakPolarHBondContact CA-O 3.28Å; L5-N50 HydrophobicContact CB-CB 4.27Å; L5-N50 VanDerWaalsContact CB-O 3.24Å; L5-N50 WeakPolarHBondContact CB-O 3.09Å; L5-N50 VanDerWaalsContact CD2-CA 3.47Å; L5-N50 WeakPolarHBondContact CD2-O 3.43Å; L5-N50 WeakPolarHBondContact CG-O 2.98Å; L5-N50 PolarHBondContact O-N 2.82Å; L5-F51 HydrophobicContact CD1-CE1 4.23Å; L5-F51 HydrophobicContact CD1-CZ 4.25Å; L5-F51 HydrophobicContact CD2-CB 4.04Å; L5-F51 HydrophobicContact CD2-CD1 3.83Å; L5-F51 HydrophobicContact CD2-CD2 3.08Å; L5-F51 HydrophobicContact CD2-CE1 3.9Å; L5-F51 HydrophobicContact CD2-CE2 3.33Å; L5-F51 HydrophobicContact CD2-CG 3.43Å; L5-F51 VanDerWaalsContact CD2-CG 3.43Å; L5-F51 HydrophobicContact CD2-CZ 3.71Å; L5-F51 HydrophobicContact CG-CD2 4.48Å; L5-F121 HydrophobicContact CD1-CD1 4.21Å; L5-F121 HydrophobicContact CD1-CE1 3.44Å; L5-F121 VanDerWaalsContact CD1-CE1 3.44Å; L5-F121 HydrophobicContact CD1-CZ 4.19Å
6	E	25.3	Very low	32.1	Very low	177 Å²	177	92.9 Å²	92.9	83%	0.827	51%	0.507	S	S	*	.			trans	-48.9	8.5	176.3	-78.2	-174.2	171.3	0	0	120.6	N50	E6-N50 WeakPolarHBondContact CA-ND2 3.24Å; E6-N50 HydrophobicContact CB-CB 4.21Å; E6-N50 WeakPolarHBondContact CB-ND2 3.47Å; E6-N50 VanDerWaalsContact N-CB 3.29Å; E6-N50 PolarHBondContact O-ND2 2.95Å
7	H	29.8	Very low	32.7	Very low	92 Å²	92	88.8 Å²	88.8	43%	0.426	48%	0.484	S	S	.	.	S	Bend	trans	-127	141.1	168	-83.5	-63.1	0	0	0	107.7	L5 G48 L49 N50	L5-H7 VanDerWaalsContact C-N 3.25Å; L5-H7 PolarHBondContact O-N 3.26Å; H7-G48 CarbonylContact C-O 2.76Å; H7-G48 CarbonylContact O-C 3.06Å; H7-G48 VanDerWaalsContact O-C 3.27Å; H7-L49 CarbonylContact O-C 3.55Å; H7-L49 WeakPolarHBondContact O-CA 3.37Å; H7-N50 WeakPolarHBondContact CB-OD1 3.46Å; H7-N50 PolarHBondContact CD2-ND2 3.18Å; H7-N50 VanDerWaalsContact CD2-ND2 3.33Å; H7-N50 PolarHBondContact CD2-OD1 3.46Å; H7-N50 VanDerWaalsContact CG-OD1 3.23Å; H7-N50 PolarHBondContact N-ND2 3.46Å; H7-N50 PolarHBondContact N-OD1 3.07Å
8	P	29.6	Very low	33.2	Very low	112 Å²	112	83.9 Å²	83.9	73%	0.727	46%	0.457	S	S	*	.			trans	-89.4	143.5	-171.4	33.5	-34.6	0	0	0	113.6	G10 G48	P8-G10 PolarHBondContact O-N 3.43Å; P8-G48 VanDerWaalsContact C-C 3.48Å; P8-G48 CarbonylContact C-O 3.34Å; P8-G48 VanDerWaalsContact CA-O 3.26Å; P8-G48 WeakPolarHBondContact CA-O 3.48Å; P8-G48 VanDerWaalsContact O-CA 3.25Å; P8-G48 WeakPolarHBondContact O-CA 3.49Å
9	L	36.9	Very low	33.6	Very low	33 Å²	33	80.6 Å²	80.6	17%	0.173	44%	0.439	C	S	.	.			trans	-78.6	110.6	-172.3	-80	169.5	0	0	0	106.7	L47 G48 L49 P100 F121	L9-L47 CarbonylContact C-O 3.51Å; L9-L47 WeakPolarHBondContact CA-O 3.34Å; L9-L47 WeakPolarHBondContact CB-O 2.84Å; L9-L47 HydrophobicContact CD2-CB 3.04Å; L9-L47 HydrophobicContact CD2-CG 4.47Å; L9-L47 WeakPolarHBondContact CD2-O 2.89Å; L9-L47 HydrophobicContact CG-CB 4.46Å; L9-L47 WeakPolarHBondContact CG-O 3.21Å; L9-G48 WeakPolarHBondContact CA-O 3.47Å; L9-G48 VanDerWaalsContact CB-O 3.31Å; L9-G48 WeakPolarHBondContact CB-O 3.33Å; L9-G48 WeakPolarHBondContact CG-O 3.49Å; L9-G48 PolarHBondContact N-O 3.01Å; L9-L49 HydrophobicContact CD1-CD1 4.3Å; L9-L49 HydrophobicContact CD1-CD2 3.34Å; L9-L49 HydrophobicContact CD1-CG 3.68Å; L9-L49 HydrophobicContact CD2-CB 4.39Å; L9-L49 HydrophobicContact CD2-CD1 3.9Å; L9-L49 HydrophobicContact CD2-CD2 4.02Å; L9-L49 HydrophobicContact CD2-CG 3.41Å; L9-L49 VanDerWaalsContact CD2-CG 3.41Å; L9-L49 HydrophobicContact CG-CB 4.42Å; L9-L49 HydrophobicContact CG-CD1 4.42Å; L9-L49 HydrophobicContact CG-CD2 3.57Å; L9-L49 HydrophobicContact CG-CG 3.5Å; L9-P100 WeakPolarHBondContact CD1-O 3.45Å; L9-F121 HydrophobicContact CD1-CD2 4.5Å
10	G	37.7	Very low	34	Very low	36 Å²	36	76.9 Å²	76.9	37%	0.371	42%	0.42	S	S	.	.			trans	-58	142.2	175.2	0	0	0	0	0	110.3	P8 D12 S13 L47	P8-G10 PolarHBondContact O-N 3.43Å; G10-D12 PolarHBondContact O-N 3.01Å; G10-S13 PolarHBondContact O-N 2.64Å; G10-S13 PolarHBondContact O-OG 2.8Å; G10-L47 PolarHBondContact N-O 2.81Å
11	P	38.1	Very low	34.3	Very low	128 Å²	128	75.5 Å²	75.5	83%	0.831	41%	0.412	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.8	-9.1	-175.1	24.2	-33.3	0	0	0	115	S13	P11-S13 VanDerWaalsContact C-N 3.33Å
12	D	38.1	Very low	34.9	Very low	157 Å²	157	67.4 Å²	67.4	84%	0.84	38%	0.38	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.4	18.5	177.8	-73.4	-39.4	0	0	0	114	G10 S14	G10-D12 PolarHBondContact O-N 3.01Å; D12-S14 PolarHBondContact O-N 3.07Å
13	S	39.2	Very low	35.4	Very low	16 Å²	16	69.7 Å²	69.7	11%	0.112	38%	0.379	C	S	.	.			trans	-65.2	89.8	-179.8	57.6	0	0	0	0	112.3	G10 P11 L47	G10-S13 PolarHBondContact O-N 2.64Å; G10-S13 PolarHBondContact O-OG 2.8Å; P11-S13 VanDerWaalsContact C-N 3.33Å; S13-L47 VanDerWaalsContact C-CD2 3.46Å; S13-L47 VanDerWaalsContact CB-CB 3.46Å
14	S	35.5	Very low	35.8	Very low	49 Å²	49	76.2 Å²	76.2	34%	0.343	41%	0.414	S	S	.	.			trans	-63.9	155	177.1	63.4	0	0	0	0	111	D12 I16 L47 E73	D12-S14 PolarHBondContact O-N 3.07Å; S14-I16 WeakPolarHBondContact O-CG1 3.18Å; S14-I16 PolarHBondContact O-N 2.77Å; S14-L47 WeakPolarHBondContact O-CD2 2.92Å; S14-E73 PolarHBondContact OG-OE1 2.84Å
15	R	38.9	Very low	36.4	Very low	140 Å²	140	71.4 Å²	71.4	53%	0.528	39%	0.388	S	S	.	.			trans	-67.8	105.5	-177.8	-67.4	171.5	179.4	173.5	-1.5	109.7	R74	R15-R74 HydrophobicContact CB-CB 3.69Å; R15-R74 WeakPolarHBondContact O-CB 3.14Å; R15-R74 PolarHBondContact O-N 2.82Å
16	I	39.3	Very low	36.4	Very low	26 Å²	26	74.9 Å²	74.9	13%	0.133	42%	0.42	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	120	-175	-63.9	175.3	0	0	0	109.9	S14 C18 L47 C71 C98	S14-I16 WeakPolarHBondContact O-CG1 3.18Å; S14-I16 PolarHBondContact O-N 2.77Å; I16-C18 VanDerWaalsContact CG2-SG 3.51Å; I16-L47 HydrophobicContact CD1-CD1 4.46Å; I16-L47 HydrophobicContact CD1-CD2 3.63Å; I16-L47 HydrophobicContact CD1-CG 4.11Å; I16-L47 HydrophobicContact CG1-CD2 4.08Å; I16-C71 HydrophobicContact CG2-CB 3.79Å; I16-C98 PolarHBondContact N-O 3.18Å; I16-C98 VanDerWaalsContact N-O 3.1Å; I16-C98 PolarHBondContact O-N 3.26Å
17	L	42	Very low	36.5	Very low	22 Å²	22	70 Å²	70	12%	0.115	41%	0.406	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.8	111.6	170.4	173	72.5	0	0	0	108.6	L19 C71 L72 A82 F95 V96 I97	L17-L19 HydrophobicContact CD1-CD2 4.33Å; L17-L19 HydrophobicContact CD2-CD1 4.32Å; L17-L19 HydrophobicContact CD2-CD2 4Å; L17-L19 HydrophobicContact CD2-CG 4.09Å; L17-L19 HydrophobicContact CG-CD2 4.14Å; L17-L19 HydrophobicContact CG-CG 4.09Å; L17-C71 CarbonylContact O-C 3.6Å; L17-C71 WeakPolarHBondContact O-CA 3.4Å; L17-L72 PolarHBondContact N-O 3.01Å; L17-L72 PolarHBondContact O-N 2.97Å; L17-A82 HydrophobicContact CD2-CB 4.27Å; L17-F95 HydrophobicContact CD1-CB 4.3Å; L17-F95 HydrophobicContact CD1-CD2 3.64Å; L17-F95 HydrophobicContact CD1-CE2 4.43Å; L17-F95 HydrophobicContact CD1-CG 4.36Å; L17-V96 CarbonylContact C-O 3.47Å; L17-V96 WeakPolarHBondContact CA-O 3.49Å; L17-I97 HydrophobicContact CD1-CG1 3.76Å
18	C	42.2	Very low	36.4	Very low	1 Å²	1	75.5 Å²	75.5	1%	0.007	43%	0.428	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.7	111.6	174.1	-66.5	0	0	0	0	110.3	I16 C43 V69 C71 V96	I16-C18 VanDerWaalsContact CG2-SG 3.51Å; C18-C43 PolarHBondContact SG-SG 2.91Å; C18-V69 HydrophobicContact CB-CG1 3.72Å; C18-C71 HydrophobicContact CB-CB 4.33Å; C18-C71 WeakPolarHBondContact CB-SG 3.09Å; C18-C71 WeakPolarHBondContact SG-CB 3.23Å; C18-C71 CovalentContact SG-SG 2.07Å; C18-C71 PolarHBondContact SG-SG 3.36Å; C18-V96 HydrophobicContact CB-CB 4.39Å; C18-V96 PolarHBondContact N-O 2.74Å; C18-V96 PolarHBondContact O-N 3.45Å
19	L	41.1	Very low	36.4	Very low	22 Å²	22	71.1 Å²	71.1	12%	0.115	40%	0.402	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.2	124.2	-177.7	-66.1	167.2	0	0	0	109.8	L17 V69 S70 L72 L93 F95	L17-L19 HydrophobicContact CD1-CD2 4.33Å; L17-L19 HydrophobicContact CD2-CD1 4.32Å; L17-L19 HydrophobicContact CD2-CD2 4Å; L17-L19 HydrophobicContact CD2-CG 4.09Å; L17-L19 HydrophobicContact CG-CD2 4.14Å; L17-L19 HydrophobicContact CG-CG 4.09Å; L19-V69 CarbonylContact O-C 3.1Å; L19-V69 WeakPolarHBondContact O-CA 3.25Å; L19-S70 PolarHBondContact N-O 2.79Å; L19-S70 PolarHBondContact O-N 3.42Å; L19-L72 HydrophobicContact CD1-CD1 4.02Å; L19-L93 HydrophobicContact CD2-CD1 4.45Å; L19-L93 HydrophobicContact CD2-CD2 4.31Å; L19-F95 HydrophobicContact CD2-CB 3.52Å; L19-F95 HydrophobicContact CD2-CG 4.2Å
20	A	41.5	Very low	36.1	Very low	6 Å²	6	71.5 Å²	71.5	5%	0.05	41%	0.407	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.3	115.9	171.5	0	0	0	0	0	111.6	L67 V69 H94	A20-L67 HydrophobicContact CB-CD2 3.01Å; A20-L67 HydrophobicContact CB-CG 4.47Å; A20-V69 HydrophobicContact CB-CG2 4.06Å; A20-H94 WeakPolarHBondContact CA-O 3.44Å; A20-H94 HydrophobicContact CB-CB 3.96Å; A20-H94 WeakPolarHBondContact CB-O 3.12Å; A20-H94 PolarHBondContact N-O 3.3Å
21	L	38.9	Very low	35.9	Very low	47 Å²	47	72.6 Å²	72.6	25%	0.246	41%	0.408	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101	112.1	173.8	-52.4	176.2	0	0	0	109.4	D68 V88 L90 L93	L21-D68 HydrophobicContact CB-CB 4.36Å; L21-D68 PolarHBondContact N-O 3.15Å; L21-D68 WeakPolarHBondContact O-CB 2.84Å; L21-V88 HydrophobicContact CD2-CG1 4.22Å; L21-L90 HydrophobicContact CD2-CD1 3.79Å; L21-L90 HydrophobicContact CD2-CD2 3.55Å; L21-L90 HydrophobicContact CD2-CG 4.23Å; L21-L93 HydrophobicContact CD2-CD1 3.69Å
22	G	37.7	Very low	36	Very low	33 Å²	33	66.9 Å²	66.9	34%	0.34	37%	0.371	S	S	.	.			trans	-104.3	101.4	172.5	0	0	0	0	0	110.7
23	K	33.4	Very low	36.3	Very low	177 Å²	177	61.6 Å²	61.6	77%	0.77	35%	0.346	S	S	*	.	S	Bend	trans	-90.4	119.3	161.7	-73.8	-177.2	178.7	176.7	0	107.5
24	N	34.6	Very low	36.4	Very low	161 Å²	161	63.1 Å²	63.1	86%	0.861	35%	0.353	S	S	*	.			trans	85.6	46.3	-179.5	-55.5	-29.7	0	0	0	118.3	A26	N24-A26 PolarHBondContact O-N 2.96Å
25	M	36.2	Very low	36.5	Very low	39 Å²	39	63 Å²	63	19%	0.192	35%	0.352	C	S	.	.			trans	-87.6	60.4	156.6	-70.1	-169.6	74.4	0	0	111.4	S27 A29 I66	M25-S27 VanDerWaalsContact C-N 3.26Å; M25-S27 PolarHBondContact O-N 3.25Å; M25-A29 HydrophobicContact CE-CB 3.29Å; M25-A29 WeakPolarHBondContact CE-O 3.11Å; M25-I66 HydrophobicContact CE-CD1 3.21Å; M25-I66 HydrophobicContact CE-CG1 3.85Å; M25-I66 HydrophobicContact CG-CD1 4.46Å; M25-I66 HydrophobicContact CG-CG1 4.18Å; M25-I66 HydrophobicContact SD-CB 4.41Å; M25-I66 HydrophobicContact SD-CD1 3.18Å; M25-I66 WeakPolarHBondContact SD-CD1 3.29Å; M25-I66 HydrophobicContact SD-CG1 3.44Å; M25-I66 WeakPolarHBondContact SD-CG1 3.28Å; M25-I66 HydrophobicContact SD-CG2 4.05Å
26	A	28.1	Very low	36.9	Very low	98 Å²	98	58.8 Å²	58.8	81%	0.81	34%	0.338	S	S	*	.			trans	-80.9	77.9	166.9	0	0	0	0	0	109.3	N24	N24-A26 PolarHBondContact O-N 2.96Å
27	S	27.9	Very low	37.3	Very low	76 Å²	76	58.9 Å²	58.9	53%	0.531	34%	0.338	S	S	.	.	S	Bend	trans	176	167.6	151.3	63.3	0	0	0	0	106.4	M25 A29	M25-S27 VanDerWaalsContact C-N 3.26Å; M25-S27 PolarHBondContact O-N 3.25Å; S27-A29 PolarHBondContact O-N 2.96Å
28	K	28.6	Very low	37.2	Very low	207 Å²	207	62.6 Å²	62.6	90%	0.9	36%	0.358	S	S	*	.			trans	-62.1	52.2	170.3	-63.1	170.1	176.9	174.7	0	111.8	S30	K28-S30 PolarHBondContact O-N 2.91Å
29	A	28.4	Very low	37.5	Very low	20 Å²	20	64 Å²	64	17%	0.165	37%	0.367	C	S	.	.			trans	-76	87.1	169.1	0	0	0	0	0	105.4	M25 S27 C31 I62	M25-A29 HydrophobicContact CE-CB 3.29Å; M25-A29 WeakPolarHBondContact CE-O 3.11Å; S27-A29 PolarHBondContact O-N 2.96Å; A29-C31 PolarHBondContact O-N 2.81Å; A29-I62 HydrophobicContact CB-CG2 4.5Å
30	S	31	Very low	37.8	Very low	41 Å²	41	63.1 Å²	63.1	29%	0.287	36%	0.362	S	S	.	.			trans	-19.6	125.5	137.8	54	0	0	0	0	111	K28 T32 L61	K28-S30 PolarHBondContact O-N 2.91Å; S30-T32 PolarHBondContact O-N 3.03Å; S30-L61 WeakPolarHBondContact OG-CD2 3.48Å; S30-L61 WeakPolarHBondContact OG-CG 3.21Å
31	C	33.2	Very low	38.1	Very low	58 Å²	58	63.7 Å²	63.7	39%	0.392	37%	0.367	S	S	.	.			trans	-45.5	108.7	162.7	-49.9	0	0	0	0	106.4	A29 S33	A29-C31 PolarHBondContact O-N 2.81Å; C31-S33 PolarHBondContact O-N 3.32Å
32	T	39.9	Very low	38.3	Very low	9 Å²	9	65 Å²	65	6%	0.055	38%	0.377	C	S	.	.			trans	-75.3	87.2	168.5	32.4	0	0	0	0	107.1	S30 L34 S35 L61 I62 L63 G64	S30-T32 PolarHBondContact O-N 3.03Å; T32-L34 PolarHBondContact O-N 3.12Å; T32-S35 PolarHBondContact O-N 3.45Å; T32-L61 HydrophobicContact CG2-CB 3.8Å; T32-L61 HydrophobicContact CG2-CD2 4.16Å; T32-I62 WeakPolarHBondContact CG2-O 3.48Å; T32-L63 HydrophobicContact CG2-CG 4.33Å; T32-L63 WeakPolarHBondContact OG1-CA 3.48Å; T32-G64 PolarHBondContact OG1-N 2.84Å
33	S	45.6	Very low	38.9	Very low	45 Å²	45	63.7 Å²	63.7	32%	0.315	36%	0.363	S	S	.	.	T	Hydrogen-bonded Turn	trans	19.5	-64.5	149.6	49.6	0	0	0	0	114.2	C31 S35 L37	C31-S33 PolarHBondContact O-N 3.32Å; S33-S35 PolarHBondContact O-N 2.92Å; S33-L37 WeakPolarHBondContact O-CB 3.29Å; S33-L37 WeakPolarHBondContact O-CD1 3.18Å; S33-L37 WeakPolarHBondContact O-CG 3.49Å; S33-L37 PolarHBondContact O-N 2.75Å
34	L	40.6	Very low	39.3	Very low	49 Å²	49	55.3 Å²	55.3	26%	0.257	33%	0.326	S	S	.	.	H	α-helix	trans	-59.5	-41.5	-166.4	-164.5	53	0	0	0	117	T32 L37 L38 Y53	T32-L34 PolarHBondContact O-N 3.12Å; L34-L37 CarbonylContact O-C 3.58Å; L34-L37 WeakPolarHBondContact O-CA 3.44Å; L34-L37 WeakPolarHBondContact O-CB 3.44Å; L34-L37 PolarHBondContact O-N 3.08Å; L34-L38 HydrophobicContact CG-CD1 4.24Å; L34-L38 WeakPolarHBondContact O-CG 3.2Å; L34-L38 PolarHBondContact O-N 3.29Å; L34-Y53 HydrophobicContact CB-CE1 4.4Å; L34-Y53 HydrophobicContact CB-CE2 4.14Å; L34-Y53 HydrophobicContact CD1-CD1 3.15Å; L34-Y53 HydrophobicContact CD1-CD2 3.77Å; L34-Y53 HydrophobicContact CD1-CE1 3.3Å; L34-Y53 HydrophobicContact CD1-CE2 3.87Å; L34-Y53 HydrophobicContact CD1-CG 3.33Å; L34-Y53 HydrophobicContact CD2-CE1 3.93Å; L34-Y53 HydrophobicContact CG-CD1 4.35Å; L34-Y53 HydrophobicContact CG-CE1 4.07Å
35	S	36.7	Very low	39.8	Very low	45 Å²	45	54 Å²	54	32%	0.315	31%	0.313	S	S	.	.	H	α-helix	trans	-82.4	-34	-175	-49.9	0	0	0	0	113	T32 S33 L37 L38 C39	T32-S35 PolarHBondContact O-N 3.45Å; S33-S35 PolarHBondContact O-N 2.92Å; S35-L37 PolarHBondContact O-N 3.26Å; S35-L38 PolarHBondContact O-N 2.95Å; S35-C39 WeakPolarHBondContact O-CB 3.41Å; S35-C39 PolarHBondContact O-N 3.33Å
36	F	48.1	Very low	40	Very low	53 Å²	53	59.2 Å²	59.2	23%	0.232	34%	0.337	C	S	.	.	H	α-helix	trans	-57	-40.2	161.1	174.5	-86.9	0	0	0	110	M40 L105	F36-M40 HydrophobicContact CD1-CE 4.33Å; F36-M40 HydrophobicContact CD1-CG 4.26Å; F36-M40 HydrophobicContact CE1-CE 3.95Å; F36-M40 HydrophobicContact CE1-CG 4.46Å; F36-M40 WeakPolarHBondContact O-CB 3.33Å; F36-M40 WeakPolarHBondContact O-CG 3.44Å; F36-M40 PolarHBondContact O-N 3.45Å; F36-L105 HydrophobicContact CD2-CD2 4.02Å; F36-L105 HydrophobicContact CE1-CD1 3.92Å; F36-L105 HydrophobicContact CE1-CD2 4.2Å; F36-L105 HydrophobicContact CE2-CB 4.23Å; F36-L105 HydrophobicContact CE2-CD1 4.24Å; F36-L105 HydrophobicContact CE2-CD2 3.32Å; F36-L105 HydrophobicContact CE2-CG 4.09Å; F36-L105 HydrophobicContact CZ-CB 4.07Å; F36-L105 HydrophobicContact CZ-CD1 3.44Å; F36-L105 VanDerWaalsContact CZ-CD1 3.44Å; F36-L105 HydrophobicContact CZ-CD2 3.43Å; F36-L105 VanDerWaalsContact CZ-CD2 3.43Å; F36-L105 HydrophobicContact CZ-CG 3.78Å
37	L	46.6	Very low	40.5	Very low	27 Å²	27	54.7 Å²	54.7	14%	0.141	30%	0.299	C	S	.	.	H	α-helix	trans	-72.8	-28.1	178.7	-71.9	164.1	0	0	0	114.4	S33 L34 S35 M40 A41 F51 Y53	S33-L37 WeakPolarHBondContact O-CB 3.29Å; S33-L37 WeakPolarHBondContact O-CD1 3.18Å; S33-L37 WeakPolarHBondContact O-CG 3.49Å; S33-L37 PolarHBondContact O-N 2.75Å; L34-L37 CarbonylContact O-C 3.58Å; L34-L37 WeakPolarHBondContact O-CA 3.44Å; L34-L37 WeakPolarHBondContact O-CB 3.44Å; L34-L37 PolarHBondContact O-N 3.08Å; S35-L37 PolarHBondContact O-N 3.26Å; L37-M40 HydrophobicContact CD2-CE 4.25Å; L37-M40 WeakPolarHBondContact O-CB 2.93Å; L37-A41 WeakPolarHBondContact O-CB 3.33Å; L37-A41 PolarHBondContact O-N 3.1Å; L37-F51 WeakPolarHBondContact O-CB 3.17Å; L37-Y53 HydrophobicContact CD1-CD2 3.25Å; L37-Y53 HydrophobicContact CD1-CE2 3.84Å; L37-Y53 HydrophobicContact CD1-CG 4.16Å
38	L	41.7	Very low	41.1	Very low	101 Å²	101	51.2 Å²	51.2	53%	0.529	28%	0.275	S	S	.	.	H	α-helix	trans	-85.3	-33.1	176.2	-77.1	164.9	0	0	0	113.3	L34 S35 A41 T42	L34-L38 HydrophobicContact CG-CD1 4.24Å; L34-L38 WeakPolarHBondContact O-CG 3.2Å; L34-L38 PolarHBondContact O-N 3.29Å; S35-L38 PolarHBondContact O-N 2.95Å; L38-A41 VanDerWaalsContact C-N 3.34Å; L38-A41 HydrophobicContact CD2-CB 4.32Å; L38-A41 CarbonylContact O-C 3.02Å; L38-A41 VanDerWaalsContact O-CA 3.31Å; L38-A41 WeakPolarHBondContact O-CA 3.15Å; L38-A41 WeakPolarHBondContact O-CB 3.31Å; L38-A41 PolarHBondContact O-N 2.78Å; L38-T42 PolarHBondContact O-N 3.4Å; L38-T42 PolarHBondContact O-OG1 2.87Å
39	C	47.1	Very low	41.3	Very low	30 Å²	30	41.8 Å²	41.8	20%	0.203	24%	0.235	C	C	.	.	H	α-helix	trans	-72.1	-40.2	171.3	-179	0	0	0	0	110.6	S35 A41 T42 C43	S35-C39 WeakPolarHBondContact O-CB 3.41Å; S35-C39 PolarHBondContact O-N 3.33Å; C39-A41 VanDerWaalsContact C-N 3.35Å; C39-T42 PolarHBondContact O-N 3.48Å; C39-C43 PolarHBondContact O-N 2.76Å
40	M	48.6	Very low	41.5	Very low	3 Å²	3	42.3 Å²	42.3	2%	0.015	24%	0.235	C	C	.	.	H	α-helix	trans	-47.1	-58.2	155.5	-78.4	-113.4	-79.9	0	0	109.2	F36 L37 T42 C43 S44 F51 L103 L105 I119	F36-M40 HydrophobicContact CD1-CE 4.33Å; F36-M40 HydrophobicContact CD1-CG 4.26Å; F36-M40 HydrophobicContact CE1-CE 3.95Å; F36-M40 HydrophobicContact CE1-CG 4.46Å; F36-M40 WeakPolarHBondContact O-CB 3.33Å; F36-M40 WeakPolarHBondContact O-CG 3.44Å; F36-M40 PolarHBondContact O-N 3.45Å; L37-M40 HydrophobicContact CD2-CE 4.25Å; L37-M40 WeakPolarHBondContact O-CB 2.93Å; M40-T42 PolarHBondContact O-N 3.33Å; M40-C43 PolarHBondContact O-N 3.2Å; M40-S44 WeakPolarHBondContact O-CA 3.28Å; M40-S44 WeakPolarHBondContact O-CB 3.2Å; M40-S44 PolarHBondContact O-N 3.16Å; M40-F51 HydrophobicContact CB-CB 4.46Å; M40-F51 HydrophobicContact CB-CD1 3.67Å; M40-F51 HydrophobicContact CB-CD2 3.47Å; M40-F51 VanDerWaalsContact CB-CD2 3.47Å; M40-F51 HydrophobicContact CB-CE1 3.73Å; M40-F51 HydrophobicContact CB-CE2 3.43Å; M40-F51 VanDerWaalsContact CB-CE2 3.43Å; M40-F51 HydrophobicContact CB-CG 3.55Å; M40-F51 HydrophobicContact CB-CZ 3.6Å; M40-F51 HydrophobicContact CE-CD1 3.49Å; M40-F51 VanDerWaalsContact CE-CD1 3.49Å; M40-F51 HydrophobicContact CE-CE1 2.99Å; M40-F51 HydrophobicContact CE-CZ 3.66Å; M40-F51 HydrophobicContact CG-CD1 4.43Å; M40-F51 HydrophobicContact CG-CE1 4.13Å; M40-F51 HydrophobicContact CG-CE2 4.27Å; M40-F51 HydrophobicContact CG-CZ 4.01Å; M40-F51 WeakPolarHBondContact O-CD2 2.93Å; M40-F51 WeakPolarHBondContact O-CE2 3.09Å; M40-F51 HydrophobicContact SD-CD1 4.08Å; M40-F51 HydrophobicContact SD-CE1 3.28Å; M40-F51 WeakPolarHBondContact SD-CE1 2.82Å; M40-F51 HydrophobicContact SD-CE2 4Å; M40-F51 HydrophobicContact SD-CZ 3.2Å; M40-F51 WeakPolarHBondContact SD-CZ 3.1Å; M40-L103 HydrophobicContact CG-CD1 4.21Å; M40-L103 HydrophobicContact CG-CD2 4.42Å; M40-L103 HydrophobicContact SD-CD1 3.53Å; M40-L103 VanDerWaalsContact SD-CD1 3.53Å; M40-L103 HydrophobicContact SD-CD2 3.15Å; M40-L103 WeakPolarHBondContact SD-CD2 3.11Å; M40-L103 HydrophobicContact SD-CG 3.97Å; M40-L105 HydrophobicContact CE-CD1 4.22Å; M40-L105 HydrophobicContact SD-CD1 3.81Å; M40-L105 HydrophobicContact SD-CD2 4.46Å; M40-I119 HydrophobicContact CE-CD1 3.67Å; M40-I119 HydrophobicContact SD-CD1 4.16Å
41	A	47.7	Very low	41.7	Very low	19 Å²	19	41.6 Å²	41.6	16%	0.157	23%	0.226	C	C	.	.	H	α-helix	trans	-52.2	-21.5	-179.7	0	0	0	0	0	116.5	L37 L38 C39 S44 K45 F51	L37-A41 WeakPolarHBondContact O-CB 3.33Å; L37-A41 PolarHBondContact O-N 3.1Å; L38-A41 VanDerWaalsContact C-N 3.34Å; L38-A41 HydrophobicContact CD2-CB 4.32Å; L38-A41 CarbonylContact O-C 3.02Å; L38-A41 VanDerWaalsContact O-CA 3.31Å; L38-A41 WeakPolarHBondContact O-CA 3.15Å; L38-A41 WeakPolarHBondContact O-CB 3.31Å; L38-A41 PolarHBondContact O-N 2.78Å; C39-A41 VanDerWaalsContact C-N 3.35Å; A41-S44 VanDerWaalsContact C-OG 3.31Å; A41-S44 WeakPolarHBondContact CA-OG 3.19Å; A41-S44 WeakPolarHBondContact O-CB 3.45Å; A41-S44 PolarHBondContact O-OG 3.02Å; A41-K45 PolarHBondContact O-N 3.37Å; A41-F51 HydrophobicContact CB-CB 3.73Å; A41-F51 HydrophobicContact CB-CD2 4.46Å
42	T	43.4	Very low	41.5	Very low	73 Å²	73	41.8 Å²	41.8	45%	0.448	23%	0.229	S	C	.	.	H	α-helix	trans	-108.7	-36.1	-173.8	-50.5	0	0	0	0	112	L38 C39 M40 S44 K45 Q46	L38-T42 PolarHBondContact O-N 3.4Å; L38-T42 PolarHBondContact O-OG1 2.87Å; C39-T42 PolarHBondContact O-N 3.48Å; M40-T42 PolarHBondContact O-N 3.33Å; T42-S44 CarbonylContact O-C 3.5Å; T42-S44 PolarHBondContact O-N 3.48Å; T42-K45 PolarHBondContact O-N 2.85Å; T42-K45 VanDerWaalsContact O-N 3.15Å; T42-Q46 HydrophobicContact CG2-CG 4.44Å; T42-Q46 WeakPolarHBondContact O-CB 3.35Å; T42-Q46 PolarHBondContact O-N 3.22Å
43	C	48.8	Very low	41.2	Very low	7 Å²	7	45 Å²	45	5%	0.047	24%	0.24	C	C	.	.	H	α-helix	trans	-59.2	-38.3	160.7	-91.1	0	0	0	0	110.6	C18 C39 M40 L47 C98	C18-C43 PolarHBondContact SG-SG 2.91Å; C39-C43 PolarHBondContact O-N 2.76Å; M40-C43 PolarHBondContact O-N 3.2Å; C43-L47 WeakPolarHBondContact O-CB 3.44Å; C43-L47 WeakPolarHBondContact O-CD1 2.97Å; C43-L47 VanDerWaalsContact O-CG 3.23Å; C43-L47 WeakPolarHBondContact O-CG 3.33Å; C43-L47 PolarHBondContact O-N 2.07Å; C43-C98 HydrophobicContact CB-CB 4.16Å
44	S	43.2	Very low	40.2	Very low	0 Å²	0	50.2 Å²	50.2	0%	0	26%	0.259	C	S	.	.	H	α-helix	trans	-44.4	-86.2	153.1	148.6	0	0	0	0	110.2	L5 M40 A41 T42 Q46 L47 G48 L49 N50 F51	L5-S44 WeakPolarHBondContact CD2-OG 3.04Å; M40-S44 WeakPolarHBondContact O-CA 3.28Å; M40-S44 WeakPolarHBondContact O-CB 3.2Å; M40-S44 PolarHBondContact O-N 3.16Å; A41-S44 VanDerWaalsContact C-OG 3.31Å; A41-S44 WeakPolarHBondContact CA-OG 3.19Å; A41-S44 WeakPolarHBondContact O-CB 3.45Å; A41-S44 PolarHBondContact O-OG 3.02Å; T42-S44 CarbonylContact O-C 3.5Å; T42-S44 PolarHBondContact O-N 3.48Å; S44-Q46 VanDerWaalsContact C-N 3.25Å; S44-Q46 PolarHBondContact O-N 2.8Å; S44-L47 CarbonylContact O-C 3.55Å; S44-L47 PolarHBondContact O-N 3.32Å; S44-G48 CarbonylContact O-C 3.48Å; S44-G48 WeakPolarHBondContact O-CA 3.15Å; S44-G48 PolarHBondContact O-N 2.87Å; S44-L49 CarbonylContact C-O 3.43Å; S44-L49 VanDerWaalsContact CA-CB 3.46Å; S44-L49 VanDerWaalsContact CA-N 3.33Å; S44-L49 WeakPolarHBondContact CA-O 3.48Å; S44-L49 VanDerWaalsContact CB-CB 3.47Å; S44-L49 VanDerWaalsContact CB-O 3.24Å; S44-L49 WeakPolarHBondContact CB-O 3.41Å; S44-L49 PolarHBondContact O-N 3.15Å; S44-L49 PolarHBondContact OG-O 3Å; S44-N50 WeakPolarHBondContact OG-CA 3.45Å; S44-N50 PolarHBondContact OG-N 3.35Å; S44-N50 VanDerWaalsContact OG-N 3.15Å; S44-F51 WeakPolarHBondContact OG-CD2 2.99Å; S44-F51 PolarHBondContact OG-N 2.86Å; S44-F51 VanDerWaalsContact OG-N 3.1Å
45	K	44.3	Very low	39.4	Very low	134 Å²	134	52.1 Å²	52.1	58%	0.583	28%	0.276	S	S	*	.	H	α-helix	trans	-54.8	-30.8	-168	-159.7	174.7	-177.7	176.7	0	117.4	A41 T42 G48 L49	A41-K45 PolarHBondContact O-N 3.37Å; T42-K45 PolarHBondContact O-N 2.85Å; T42-K45 VanDerWaalsContact O-N 3.15Å; K45-G48 VanDerWaalsContact O-CA 3.29Å; K45-G48 WeakPolarHBondContact O-CA 3.2Å; K45-G48 PolarHBondContact O-N 2.85Å; K45-L49 WeakPolarHBondContact CA-O 3.47Å; K45-L49 PolarHBondContact N-O 3.35Å; K45-L49 VanDerWaalsContact N-O 3.08Å
46	Q	40.3	Very low	38.9	Very low	149 Å²	149	54.8 Å²	54.8	70%	0.696	29%	0.294	S	S	*	.	H	α-helix	trans	-88	-30.2	-174.9	-74.9	-171.7	-29.1	0	0	115.1	T42 S44	T42-Q46 HydrophobicContact CG2-CG 4.44Å; T42-Q46 WeakPolarHBondContact O-CB 3.35Å; T42-Q46 PolarHBondContact O-N 3.22Å; S44-Q46 VanDerWaalsContact C-N 3.25Å; S44-Q46 PolarHBondContact O-N 2.8Å
47	L	39.3	Very low	37.7	Very low	2 Å²	2	57.7 Å²	57.7	1%	0.01	32%	0.318	C	S	.	.	H	α-helix	trans	-78.7	-25.3	159.9	-55.8	168.1	0	0	0	107.4	L9 G10 S13 S14 I16 C43 S44 C98	L9-L47 CarbonylContact C-O 3.51Å; L9-L47 WeakPolarHBondContact CA-O 3.34Å; L9-L47 WeakPolarHBondContact CB-O 2.84Å; L9-L47 HydrophobicContact CD2-CB 3.04Å; L9-L47 HydrophobicContact CD2-CG 4.47Å; L9-L47 WeakPolarHBondContact CD2-O 2.89Å; L9-L47 HydrophobicContact CG-CB 4.46Å; L9-L47 WeakPolarHBondContact CG-O 3.21Å; G10-L47 PolarHBondContact N-O 2.81Å; S13-L47 VanDerWaalsContact C-CD2 3.46Å; S13-L47 VanDerWaalsContact CB-CB 3.46Å; S14-L47 WeakPolarHBondContact O-CD2 2.92Å; I16-L47 HydrophobicContact CD1-CD1 4.46Å; I16-L47 HydrophobicContact CD1-CD2 3.63Å; I16-L47 HydrophobicContact CD1-CG 4.11Å; I16-L47 HydrophobicContact CG1-CD2 4.08Å; C43-L47 WeakPolarHBondContact O-CB 3.44Å; C43-L47 WeakPolarHBondContact O-CD1 2.97Å; C43-L47 VanDerWaalsContact O-CG 3.23Å; C43-L47 WeakPolarHBondContact O-CG 3.33Å; C43-L47 PolarHBondContact O-N 2.07Å; S44-L47 CarbonylContact O-C 3.55Å; S44-L47 PolarHBondContact O-N 3.32Å; L47-C98 HydrophobicContact CD1-CB 3.36Å; L47-C98 WeakPolarHBondContact CD1-SG 3.22Å
48	G	39.5	Very low	36.9	Very low	3 Å²	3	62.6 Å²	62.6	3%	0.031	35%	0.352	C	S	.	.	T	Hydrogen-bonded Turn	trans	82.1	61.9	-167.5	0	0	0	0	0	122.8	H7 P8 L9 S44 K45	H7-G48 CarbonylContact C-O 2.76Å; H7-G48 CarbonylContact O-C 3.06Å; H7-G48 VanDerWaalsContact O-C 3.27Å; P8-G48 VanDerWaalsContact C-C 3.48Å; P8-G48 CarbonylContact C-O 3.34Å; P8-G48 VanDerWaalsContact CA-O 3.26Å; P8-G48 WeakPolarHBondContact CA-O 3.48Å; P8-G48 VanDerWaalsContact O-CA 3.25Å; P8-G48 WeakPolarHBondContact O-CA 3.49Å; L9-G48 WeakPolarHBondContact CA-O 3.47Å; L9-G48 VanDerWaalsContact CB-O 3.31Å; L9-G48 WeakPolarHBondContact CB-O 3.33Å; L9-G48 WeakPolarHBondContact CG-O 3.49Å; L9-G48 PolarHBondContact N-O 3.01Å; S44-G48 CarbonylContact O-C 3.48Å; S44-G48 WeakPolarHBondContact O-CA 3.15Å; S44-G48 PolarHBondContact O-N 2.87Å; K45-G48 VanDerWaalsContact O-CA 3.29Å; K45-G48 WeakPolarHBondContact O-CA 3.2Å; K45-G48 PolarHBondContact O-N 2.85Å
49	L	33.3	Very low	36	Very low	9 Å²	9	63.1 Å²	63.1	5%	0.047	36%	0.364	C	S	.	.			trans	-98.1	171.1	156.7	-44.3	145.2	0	0	0	107.3	L5 H7 L9 S44 K45 F51 F121	L5-L49 HydrophobicContact CB-CB 3.77Å; L5-L49 HydrophobicContact CD1-CB 3.97Å; L5-L49 HydrophobicContact CD1-CD2 4.41Å; L5-L49 HydrophobicContact CD2-CB 3.19Å; L5-L49 HydrophobicContact CD2-CG 4.37Å; L5-L49 HydrophobicContact CG-CB 3.78Å; H7-L49 CarbonylContact O-C 3.55Å; H7-L49 WeakPolarHBondContact O-CA 3.37Å; L9-L49 HydrophobicContact CD1-CD1 4.3Å; L9-L49 HydrophobicContact CD1-CD2 3.34Å; L9-L49 HydrophobicContact CD1-CG 3.68Å; L9-L49 HydrophobicContact CD2-CB 4.39Å; L9-L49 HydrophobicContact CD2-CD1 3.9Å; L9-L49 HydrophobicContact CD2-CD2 4.02Å; L9-L49 HydrophobicContact CD2-CG 3.41Å; L9-L49 VanDerWaalsContact CD2-CG 3.41Å; L9-L49 HydrophobicContact CG-CB 4.42Å; L9-L49 HydrophobicContact CG-CD1 4.42Å; L9-L49 HydrophobicContact CG-CD2 3.57Å; L9-L49 HydrophobicContact CG-CG 3.5Å; S44-L49 CarbonylContact C-O 3.43Å; S44-L49 VanDerWaalsContact CA-CB 3.46Å; S44-L49 VanDerWaalsContact CA-N 3.33Å; S44-L49 WeakPolarHBondContact CA-O 3.48Å; S44-L49 VanDerWaalsContact CB-CB 3.47Å; S44-L49 VanDerWaalsContact CB-O 3.24Å; S44-L49 WeakPolarHBondContact CB-O 3.41Å; S44-L49 PolarHBondContact O-N 3.15Å; S44-L49 PolarHBondContact OG-O 3Å; K45-L49 WeakPolarHBondContact CA-O 3.47Å; K45-L49 PolarHBondContact N-O 3.35Å; K45-L49 VanDerWaalsContact N-O 3.08Å; L49-F51 HydrophobicContact CD1-CE2 4.38Å; L49-F121 HydrophobicContact CD1-CD2 3.97Å; L49-F121 HydrophobicContact CD1-CE1 4.11Å; L49-F121 HydrophobicContact CD1-CE2 3.31Å; L49-F121 HydrophobicContact CD1-CZ 3.39Å; L49-F121 HydrophobicContact CD2-CB 4.07Å; L49-F121 HydrophobicContact CD2-CD1 3.34Å; L49-F121 HydrophobicContact CD2-CD2 3.42Å; L49-F121 VanDerWaalsContact CD2-CD2 3.42Å; L49-F121 HydrophobicContact CD2-CE1 3.51Å; L49-F121 HydrophobicContact CD2-CE2 3.59Å; L49-F121 HydrophobicContact CD2-CG 3.29Å; L49-F121 HydrophobicContact CD2-CZ 3.63Å; L49-F121 HydrophobicContact CG-CD2 4.3Å; L49-F121 HydrophobicContact CG-CE1 4.3Å; L49-F121 HydrophobicContact CG-CE2 4.07Å; L49-F121 HydrophobicContact CG-CZ 4.06Å
50	N	33.1	Very low	34.7	Very low	31 Å²	31	65.9 Å²	65.9	17%	0.166	38%	0.384	C	S	.	.			trans	-113.5	110.9	152	-72	-19.8	0	0	0	119.5	L5 E6 H7 S44 S52	L5-N50 VanDerWaalsContact C-CB 3.49Å; L5-N50 VanDerWaalsContact CA-N 3.29Å; L5-N50 WeakPolarHBondContact CA-O 3.28Å; L5-N50 HydrophobicContact CB-CB 4.27Å; L5-N50 VanDerWaalsContact CB-O 3.24Å; L5-N50 WeakPolarHBondContact CB-O 3.09Å; L5-N50 VanDerWaalsContact CD2-CA 3.47Å; L5-N50 WeakPolarHBondContact CD2-O 3.43Å; L5-N50 WeakPolarHBondContact CG-O 2.98Å; L5-N50 PolarHBondContact O-N 2.82Å; E6-N50 WeakPolarHBondContact CA-ND2 3.24Å; E6-N50 HydrophobicContact CB-CB 4.21Å; E6-N50 WeakPolarHBondContact CB-ND2 3.47Å; E6-N50 VanDerWaalsContact N-CB 3.29Å; E6-N50 PolarHBondContact O-ND2 2.95Å; H7-N50 WeakPolarHBondContact CB-OD1 3.46Å; H7-N50 PolarHBondContact CD2-ND2 3.18Å; H7-N50 VanDerWaalsContact CD2-ND2 3.33Å; H7-N50 PolarHBondContact CD2-OD1 3.46Å; H7-N50 VanDerWaalsContact CG-OD1 3.23Å; H7-N50 PolarHBondContact N-ND2 3.46Å; H7-N50 PolarHBondContact N-OD1 3.07Å; S44-N50 WeakPolarHBondContact OG-CA 3.45Å; S44-N50 PolarHBondContact OG-N 3.35Å; S44-N50 VanDerWaalsContact OG-N 3.15Å; N50-S52 PolarHBondContact O-N 3.3Å
51	F	35.4	Very low	33.5	Very low	26 Å²	26	69.9 Å²	69.9	11%	0.114	41%	0.405	C	S	.	.			trans	-75.3	129.8	174.7	-74.7	-89.8	0	0	0	111.5	V3 L5 L37 M40 A41 S44 L49 L103 I119	V3-F51 HydrophobicContact CB-CD1 4.32Å; V3-F51 HydrophobicContact CG1-CB 4.2Å; V3-F51 HydrophobicContact CG1-CD1 3.79Å; V3-F51 HydrophobicContact CG1-CG 4.38Å; L5-F51 HydrophobicContact CD1-CE1 4.23Å; L5-F51 HydrophobicContact CD1-CZ 4.25Å; L5-F51 HydrophobicContact CD2-CB 4.04Å; L5-F51 HydrophobicContact CD2-CD1 3.83Å; L5-F51 HydrophobicContact CD2-CD2 3.08Å; L5-F51 HydrophobicContact CD2-CE1 3.9Å; L5-F51 HydrophobicContact CD2-CE2 3.33Å; L5-F51 HydrophobicContact CD2-CG 3.43Å; L5-F51 VanDerWaalsContact CD2-CG 3.43Å; L5-F51 HydrophobicContact CD2-CZ 3.71Å; L5-F51 HydrophobicContact CG-CD2 4.48Å; L37-F51 WeakPolarHBondContact O-CB 3.17Å; M40-F51 HydrophobicContact CB-CB 4.46Å; M40-F51 HydrophobicContact CB-CD1 3.67Å; M40-F51 HydrophobicContact CB-CD2 3.47Å; M40-F51 VanDerWaalsContact CB-CD2 3.47Å; M40-F51 HydrophobicContact CB-CE1 3.73Å; M40-F51 HydrophobicContact CB-CE2 3.43Å; M40-F51 VanDerWaalsContact CB-CE2 3.43Å; M40-F51 HydrophobicContact CB-CG 3.55Å; M40-F51 HydrophobicContact CB-CZ 3.6Å; M40-F51 HydrophobicContact CE-CD1 3.49Å; M40-F51 VanDerWaalsContact CE-CD1 3.49Å; M40-F51 HydrophobicContact CE-CE1 2.99Å; M40-F51 HydrophobicContact CE-CZ 3.66Å; M40-F51 HydrophobicContact CG-CD1 4.43Å; M40-F51 HydrophobicContact CG-CE1 4.13Å; M40-F51 HydrophobicContact CG-CE2 4.27Å; M40-F51 HydrophobicContact CG-CZ 4.01Å; M40-F51 WeakPolarHBondContact O-CD2 2.93Å; M40-F51 WeakPolarHBondContact O-CE2 3.09Å; M40-F51 HydrophobicContact SD-CD1 4.08Å; M40-F51 HydrophobicContact SD-CE1 3.28Å; M40-F51 WeakPolarHBondContact SD-CE1 2.82Å; M40-F51 HydrophobicContact SD-CE2 4Å; M40-F51 HydrophobicContact SD-CZ 3.2Å; M40-F51 WeakPolarHBondContact SD-CZ 3.1Å; A41-F51 HydrophobicContact CB-CB 3.73Å; A41-F51 HydrophobicContact CB-CD2 4.46Å; S44-F51 WeakPolarHBondContact OG-CD2 2.99Å; S44-F51 PolarHBondContact OG-N 2.86Å; S44-F51 VanDerWaalsContact OG-N 3.1Å; L49-F51 HydrophobicContact CD1-CE2 4.38Å; F51-L103 HydrophobicContact CE2-CD1 4.14Å; F51-L103 HydrophobicContact CZ-CD1 3.87Å; F51-I119 HydrophobicContact CE1-CD1 3.96Å; F51-I119 HydrophobicContact CZ-CD1 4.43Å
52	S	29	Very low	32.4	Very low	63 Å²	63	74.4 Å²	74.4	44%	0.441	43%	0.425	S	S	.	.			trans	-104.1	134.8	165.8	53	0	0	0	0	111.9	V3 L4 N50	V3-S52 WeakPolarHBondContact CG1-O 3.24Å; V3-S52 WeakPolarHBondContact CG1-OG 3.06Å; V3-S52 VanDerWaalsContact CG2-O 3.28Å; V3-S52 WeakPolarHBondContact CG2-O 2.98Å; L4-S52 PolarHBondContact O-OG 2.87Å; N50-S52 PolarHBondContact O-N 3.3Å
53	Y	31.7	Very low	31.5	Very low	75 Å²	75	77 Å²	77	29%	0.294	44%	0.435	S	S	.	.			trans	-114.4	140.4	-178.2	164.9	-112.7	0	0	0	110.8	L34 L37 C55	L34-Y53 HydrophobicContact CB-CE1 4.4Å; L34-Y53 HydrophobicContact CB-CE2 4.14Å; L34-Y53 HydrophobicContact CD1-CD1 3.15Å; L34-Y53 HydrophobicContact CD1-CD2 3.77Å; L34-Y53 HydrophobicContact CD1-CE1 3.3Å; L34-Y53 HydrophobicContact CD1-CE2 3.87Å; L34-Y53 HydrophobicContact CD1-CG 3.33Å; L34-Y53 HydrophobicContact CD2-CE1 3.93Å; L34-Y53 HydrophobicContact CG-CD1 4.35Å; L34-Y53 HydrophobicContact CG-CE1 4.07Å; L37-Y53 HydrophobicContact CD1-CD2 3.25Å; L37-Y53 HydrophobicContact CD1-CE2 3.84Å; L37-Y53 HydrophobicContact CD1-CG 4.16Å; Y53-C55 HydrophobicContact CE1-CB 3.75Å; Y53-C55 PolarHBondContact OH-SG 2.83Å
54	H	25.8	Very low	30.3	Very low	156 Å²	156	77.3 Å²	77.3	72%	0.722	44%	0.44	S	S	*	.			trans	-127.4	131.3	168.4	-100.1	-72.6	0	0	0	111.3
55	C	24.5	Very low	29.5	Very low	88 Å²	88	89.2 Å²	89.2	60%	0.595	49%	0.485	S	S	*	.			trans	-106.7	135.8	178.1	-148	0	0	0	0	109.1	Y53	Y53-C55 HydrophobicContact CE1-CB 3.75Å; Y53-C55 PolarHBondContact OH-SG 2.83Å
56	S	24.6	Very low	28.9	Very low	102 Å²	102	84.5 Å²	84.5	71%	0.713	47%	0.466	S	S	*	.			trans	-125.2	140.2	172.4	-53.8	0	0	0	0	109.6
57	P	24.1	Very low	28.9	Very low	113 Å²	113	80.6 Å²	80.6	73%	0.734	45%	0.45	S	S	*	.			trans	-88.6	-173.9	-161.6	38.6	-36.7	0	0	0	112.1
58	P	29.3	Very low	28.9	Very low	131 Å²	131	86.5 Å²	86.5	85%	0.851	48%	0.481	S	S	*	.	S	Bend		-110.5	17.3	-54.3	31.1	-15.3	0	0	0	111.6
59	S	22.2	Very low	29	Very low	112 Å²	112	88.5 Å²	88.5	78%	0.783	49%	0.493	S	S	*	.	S	Bend	trans	-106	8.7	-169.5	55.8	0	0	0	0	115.5
60	S	21.5	Very low	29.2	Very low	87 Å²	87	90.9 Å²	90.9	61%	0.608	51%	0.51	S	S	*	.	S	Bend	trans	-153	132.5	-177.2	71.2	0	0	0	0	113
61	L	23.5	Very low	29.8	Very low	88 Å²	88	93 Å²	93	46%	0.461	53%	0.526	S	S	.	.			trans	86	90.7	164.9	-70.4	83.8	0	0	0	119.5	S30 T32 L63	S30-L61 WeakPolarHBondContact OG-CD2 3.48Å; S30-L61 WeakPolarHBondContact OG-CG 3.21Å; T32-L61 HydrophobicContact CG2-CB 3.8Å; T32-L61 HydrophobicContact CG2-CD2 4.16Å; L61-L63 PolarHBondContact O-N 2.92Å
62	I	23	Very low	30.1	Very low	113 Å²	113	96.1 Å²	96.1	58%	0.579	54%	0.544	S	S	*	.			trans	-22.9	103.2	139.1	-63.9	162.5	0	0	0	112.5	A29 T32 G64	A29-I62 HydrophobicContact CB-CG2 4.5Å; T32-I62 WeakPolarHBondContact CG2-O 3.48Å; I62-G64 VanDerWaalsContact C-N 3.35Å; I62-G64 PolarHBondContact O-N 2.97Å
63	L	24.6	Very low	30.8	Very low	127 Å²	127	98.6 Å²	98.6	67%	0.665	55%	0.548	S	S	*	.			trans	-58.9	94.1	164.1	-100.8	99.7	0	0	0	109.9	T32 L61 R65	T32-L63 HydrophobicContact CG2-CG 4.33Å; T32-L63 WeakPolarHBondContact OG1-CA 3.48Å; L61-L63 PolarHBondContact O-N 2.92Å; L63-R65 PolarHBondContact O-N 3.07Å
64	G	24.8	Very low	31.4	Very low	15 Å²	15	98.6 Å²	98.6	16%	0.155	55%	0.548	C	S	.	.			trans	-63.3	124.8	171.8	0	0	0	0	0	111.2	T32 I62 I66	T32-G64 PolarHBondContact OG1-N 2.84Å; I62-G64 VanDerWaalsContact C-N 3.35Å; I62-G64 PolarHBondContact O-N 2.97Å; G64-I66 VanDerWaalsContact C-N 3.34Å; G64-I66 PolarHBondContact O-N 2.91Å
65	R	25.8	Very low	32	Very low	250 Å²	250	99.4 Å²	99.4	94%	0.943	55%	0.549	S	S	*	.			trans	-55.4	98.1	150.7	-77	-180	177.2	170.1	-1.9	108.6	L63	L63-R65 PolarHBondContact O-N 3.07Å
66	I	32	Very low	32.5	Very low	34 Å²	34	100.3 Å²	100.3	17%	0.174	56%	0.557	C	S	.	*			trans	-152.7	118.1	170.2	-30.8	159.5	0	0	0	102.5	M25 G64	M25-I66 HydrophobicContact CE-CD1 3.21Å; M25-I66 HydrophobicContact CE-CG1 3.85Å; M25-I66 HydrophobicContact CG-CD1 4.46Å; M25-I66 HydrophobicContact CG-CG1 4.18Å; M25-I66 HydrophobicContact SD-CB 4.41Å; M25-I66 HydrophobicContact SD-CD1 3.18Å; M25-I66 WeakPolarHBondContact SD-CD1 3.29Å; M25-I66 HydrophobicContact SD-CG1 3.44Å; M25-I66 WeakPolarHBondContact SD-CG1 3.28Å; M25-I66 HydrophobicContact SD-CG2 4.05Å; G64-I66 VanDerWaalsContact C-N 3.34Å; G64-I66 PolarHBondContact O-N 2.91Å
67	L	40.9	Very low	33	Very low	68 Å²	68	101.2 Å²	101.2	36%	0.356	55%	0.548	S	S	.	.				-178.9	105.2	100.5	-87.6	178.8	0	0	0	108.2	A20 V69	A20-L67 HydrophobicContact CB-CD2 3.01Å; A20-L67 HydrophobicContact CB-CG 4.47Å; L67-V69 HydrophobicContact CB-CG2 3.57Å; L67-V69 HydrophobicContact CD1-CG2 4.11Å; L67-V69 HydrophobicContact CD2-CG2 3.71Å; L67-V69 HydrophobicContact CG-CG2 3.99Å; L67-V69 PolarHBondContact O-N 2.84Å
68	D	38	Very low	33.6	Very low	125 Å²	125	99 Å²	99	67%	0.668	54%	0.535	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-82.5	88.4	162.5	-147.9	7	0	0	0	105.8	L21	L21-D68 HydrophobicContact CB-CB 4.36Å; L21-D68 PolarHBondContact N-O 3.15Å; L21-D68 WeakPolarHBondContact O-CB 2.84Å
69	V	42.9	Very low	34	Very low	46 Å²	46	95 Å²	95	28%	0.279	51%	0.508	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.8	113.9	-169.1	170.8	0	0	0	0	112.9	C18 L19 A20 L67	C18-V69 HydrophobicContact CB-CG1 3.72Å; L19-V69 CarbonylContact O-C 3.1Å; L19-V69 WeakPolarHBondContact O-CA 3.25Å; A20-V69 HydrophobicContact CB-CG2 4.06Å; L67-V69 HydrophobicContact CB-CG2 3.57Å; L67-V69 HydrophobicContact CD1-CG2 4.11Å; L67-V69 HydrophobicContact CD2-CG2 3.71Å; L67-V69 HydrophobicContact CG-CG2 3.99Å; L67-V69 PolarHBondContact O-N 2.84Å
70	S	37.7	Very low	34.5	Very low	59 Å²	59	94.8 Å²	94.8	41%	0.413	50%	0.497	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.9	116.6	173.1	-65.6	0	0	0	0	110.1	L19	L19-S70 PolarHBondContact N-O 2.79Å; L19-S70 PolarHBondContact O-N 3.42Å
71	C	44.2	Very low	35.1	Very low	74 Å²	74	95 Å²	95	50%	0.5	49%	0.491	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.3	120.3	174.7	-62.2	0	0	0	0	110.5	I16 L17 C18	I16-C71 HydrophobicContact CG2-CB 3.79Å; L17-C71 CarbonylContact O-C 3.6Å; L17-C71 WeakPolarHBondContact O-CA 3.4Å; C18-C71 HydrophobicContact CB-CB 4.33Å; C18-C71 WeakPolarHBondContact CB-SG 3.09Å; C18-C71 WeakPolarHBondContact SG-CB 3.23Å; C18-C71 CovalentContact SG-SG 2.07Å; C18-C71 PolarHBondContact SG-SG 3.36Å
72	L	43	Very low	35.7	Very low	93 Å²	93	92.3 Å²	92.3	49%	0.487	48%	0.482	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	129.2	-177.7	-66.2	171.6	0	0	0	110.6	L17 L19 R74	L17-L72 PolarHBondContact N-O 3.01Å; L17-L72 PolarHBondContact O-N 2.97Å; L19-L72 HydrophobicContact CD1-CD1 4.02Å; L72-R74 PolarHBondContact O-N 3.3Å
73	E	42	Very low	36.4	Very low	115 Å²	115	89 Å²	89	54%	0.537	47%	0.465	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.3	119.9	168.2	-73.6	-164.1	150.1	0	0	110	S14 K75	S14-E73 PolarHBondContact OG-OE1 2.84Å; E73-K75 PolarHBondContact O-N 2.81Å
74	R	44.4	Very low	36.8	Very low	74 Å²	74	92.2 Å²	92.2	28%	0.279	47%	0.469	S	S	.	.			trans	-79	86.4	-178.7	-173.7	179.4	178.3	-163.9	-3.8	110.2	R15 L72 F77 E99	R15-R74 HydrophobicContact CB-CB 3.69Å; R15-R74 WeakPolarHBondContact O-CB 3.14Å; R15-R74 PolarHBondContact O-N 2.82Å; L72-R74 PolarHBondContact O-N 3.3Å; R74-F77 PolarHBondContact NE-O 2.77Å; R74-E99 IonicContact NH1-OE1 3.39Å; R74-E99 PolarHBondContact NH1-OE1 3.3Å
75	K	39.1	Very low	37.5	Very low	174 Å²	174	96.1 Å²	96.1	76%	0.757	49%	0.49	S	S	*	.	S	Bend	trans	-75.2	-31	171.6	-72.1	-171.5	177.5	178.7	0	113.5	E73	E73-K75 PolarHBondContact O-N 2.81Å
76	S	34.2	Very low	37.9	Very low	107 Å²	107	87.7 Å²	87.7	75%	0.748	48%	0.48	S	S	*	.	S	Bend	trans	-177.5	31.2	176.6	39.9	0	0	0	0	115.5
77	F	36.1	Very low	38	Very low	121 Å²	121	95 Å²	95	53%	0.531	51%	0.513	S	S	.	.			trans	-94.1	133.9	-179.4	-61.5	-73.1	0	0	0	112.7	R74 L81	R74-F77 PolarHBondContact NE-O 2.77Å; F77-L81 HydrophobicContact CD1-CD2 4.18Å
78	S	37.2	Very low	37.9	Very low	66 Å²	66	94.2 Å²	94.2	46%	0.462	51%	0.512	S	S	.	.			trans	-70.1	138.3	164	82.2	0	0	0	0	107.8	L80 L81 A82	S78-L80 PolarHBondContact O-N 2.95Å; S78-L81 PolarHBondContact O-N 2.84Å; S78-L81 PolarHBondContact OG-N 2.79Å; S78-A82 PolarHBondContact O-N 3.32Å
79	V	36.7	Very low	37.8	Very low	47 Å²	47	91.9 Å²	91.9	29%	0.285	52%	0.517	S	S	.	.	H	α-helix	trans	-52.3	-34.4	179.6	176.3	0	0	0	0	110.6	L81 L83 F95 I97	V79-L81 PolarHBondContact O-N 3.41Å; V79-L83 HydrophobicContact CG1-CD1 3.93Å; V79-L83 WeakPolarHBondContact O-CD1 3.04Å; V79-L83 WeakPolarHBondContact O-CG 3.08Å; V79-F95 HydrophobicContact CG1-CE2 3.66Å; V79-F95 HydrophobicContact CG1-CZ 3.73Å; V79-I97 HydrophobicContact CG1-CD1 4.19Å; V79-I97 HydrophobicContact CG2-CD1 3.52Å
80	L	33.8	Very low	38	Very low	107 Å²	107	91.4 Å²	91.4	56%	0.56	51%	0.512	S	S	*	.	H	α-helix	trans	-64.3	-31.7	175	-93.4	148.5	0	0	0	114.9	S78 R84	S78-L80 PolarHBondContact O-N 2.95Å; L80-R84 WeakPolarHBondContact O-CG 3.16Å; L80-R84 PolarHBondContact O-N 3.1Å
81	L	33.9	Very low	38.3	Very low	92 Å²	92	94.5 Å²	94.5	48%	0.482	52%	0.524	S	S	.	.	H	α-helix	trans	-79.9	-38.8	-176.4	-168.4	64.1	0	0	0	112.1	F77 S78 V79 L83 R84	F77-L81 HydrophobicContact CD1-CD2 4.18Å; S78-L81 PolarHBondContact O-N 2.84Å; S78-L81 PolarHBondContact OG-N 2.79Å; V79-L81 PolarHBondContact O-N 3.41Å; L81-L83 PolarHBondContact O-N 3.39Å; L81-R84 PolarHBondContact O-N 3.04Å; L81-R84 VanDerWaalsContact O-N 3.16Å
82	A	35.3	Very low	38.2	Very low	31 Å²	31	95 Å²	95	26%	0.256	52%	0.519	S	S	.	.	H	α-helix	trans	-61.8	-22.8	173.3	0	0	0	0	0	112.7	L17 S78 T85	L17-A82 HydrophobicContact CD2-CB 4.27Å; S78-A82 PolarHBondContact O-N 3.32Å; A82-T85 PolarHBondContact O-OG1 2.86Å
83	L	37.8	Very low	38.3	Very low	45 Å²	45	91 Å²	91	24%	0.236	50%	0.498	C	S	.	.	T	Hydrogen-bonded Turn	trans	-94	-13.7	-179	-61.5	168.9	0	0	0	113.3	V79 L81 L93 F95 F113	V79-L83 HydrophobicContact CG1-CD1 3.93Å; V79-L83 WeakPolarHBondContact O-CD1 3.04Å; V79-L83 WeakPolarHBondContact O-CG 3.08Å; L81-L83 PolarHBondContact O-N 3.39Å; L83-L93 HydrophobicContact CD2-CD2 3.13Å; L83-F95 HydrophobicContact CD1-CE1 3.71Å; L83-F95 HydrophobicContact CD1-CZ 3.62Å; L83-F95 HydrophobicContact CD2-CD1 3.76Å; L83-F95 HydrophobicContact CD2-CE1 3.44Å; L83-F95 VanDerWaalsContact CD2-CE1 3.44Å; L83-F95 HydrophobicContact CD2-CZ 4.06Å; L83-F95 HydrophobicContact CG-CE1 4.18Å; L83-F95 HydrophobicContact CG-CZ 4.36Å; L83-F113 HydrophobicContact CD1-CD1 4.43Å; L83-F113 HydrophobicContact CD1-CE1 3.73Å; L83-F113 HydrophobicContact CD1-CZ 4.16Å
84	R	34.1	Very low	38.8	Very low	194 Å²	194	87.2 Å²	87.2	73%	0.732	48%	0.481	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.7	-10.9	-177.2	-90.7	-174.3	-178.7	-175.2	1.6	114.2	L80 L81 G86	L80-R84 WeakPolarHBondContact O-CG 3.16Å; L80-R84 PolarHBondContact O-N 3.1Å; L81-R84 PolarHBondContact O-N 3.04Å; L81-R84 VanDerWaalsContact O-N 3.16Å; R84-G86 PolarHBondContact O-N 3.19Å
85	T	38.3	Very low	39.2	Very low	97 Å²	97	83.9 Å²	83.9	60%	0.595	47%	0.468	S	S	*	.			trans	-70.7	77.1	168.5	51.2	0	0	0	0	108	A82 E87	A82-T85 PolarHBondContact O-OG1 2.86Å; T85-E87 PolarHBondContact O-N 3.47Å
86	G	34.1	Very low	39.8	Very low	72 Å²	72	76.3 Å²	76.3	74%	0.742	44%	0.436	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.1	36.1	-175.5	0	0	0	0	0	114.5	R84 V88	R84-G86 PolarHBondContact O-N 3.19Å; G86-V88 VanDerWaalsContact C-N 3.35Å
87	E	34.7	Very low	40.7	Very low	188 Å²	188	71.5 Å²	71.5	88%	0.879	40%	0.402	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.4	-5.5	171.2	-71	-166.6	146.6	0	0	112.6	T85	T85-E87 PolarHBondContact O-N 3.47Å
88	V	38.4	Very low	41.5	Very low	52 Å²	52	65.8 Å²	65.8	32%	0.315	38%	0.377	S	S	.	.	S	Bend	trans	-118.7	111.2	175	-157.2	0	0	0	0	108.1	L21 G86 L90	L21-V88 HydrophobicContact CD2-CG1 4.22Å; G86-V88 VanDerWaalsContact C-N 3.35Å; V88-L90 VanDerWaalsContact C-N 3.26Å; V88-L90 HydrophobicContact CB-CD1 3.63Å; V88-L90 HydrophobicContact CB-CD2 4.38Å; V88-L90 HydrophobicContact CB-CG 3.71Å; V88-L90 HydrophobicContact CG1-CD1 3.9Å; V88-L90 HydrophobicContact CG1-CD2 3.71Å; V88-L90 HydrophobicContact CG1-CG 3.59Å; V88-L90 WeakPolarHBondContact O-CG 3.26Å; V88-L90 PolarHBondContact O-N 3.33Å
89	G	37.2	Very low	42.2	Very low	75 Å²	75	64.6 Å²	64.6	77%	0.773	36%	0.364	S	S	*	.			trans	-63.3	86.4	173.9	0	0	0	0	0	110.4
90	L	45.3	Very low	42.8	Very low	37 Å²	37	64.9 Å²	64.9	19%	0.194	37%	0.367	C	S	.	.			trans	-113.9	68.5	-172.5	-63.5	161.4	0	0	0	110.6	L21 V88 E92 L93 N108	L21-L90 HydrophobicContact CD2-CD1 3.79Å; L21-L90 HydrophobicContact CD2-CD2 3.55Å; L21-L90 HydrophobicContact CD2-CG 4.23Å; V88-L90 VanDerWaalsContact C-N 3.26Å; V88-L90 HydrophobicContact CB-CD1 3.63Å; V88-L90 HydrophobicContact CB-CD2 4.38Å; V88-L90 HydrophobicContact CB-CG 3.71Å; V88-L90 HydrophobicContact CG1-CD1 3.9Å; V88-L90 HydrophobicContact CG1-CD2 3.71Å; V88-L90 HydrophobicContact CG1-CG 3.59Å; V88-L90 WeakPolarHBondContact O-CG 3.26Å; V88-L90 PolarHBondContact O-N 3.33Å; L90-E92 PolarHBondContact O-N 3.34Å; L90-E92 VanDerWaalsContact O-N 3.12Å; L90-L93 HydrophobicContact CB-CB 3.77Å; L90-L93 HydrophobicContact CD1-CB 4.09Å; L90-L93 HydrophobicContact CD1-CD1 3.43Å; L90-L93 VanDerWaalsContact CD1-CD1 3.43Å; L90-L93 HydrophobicContact CD1-CD2 4.2Å; L90-L93 HydrophobicContact CD1-CG 4.06Å; L90-L93 HydrophobicContact CD2-CD1 3.97Å; L90-L93 HydrophobicContact CG-CB 4.35Å; L90-L93 HydrophobicContact CG-CD1 4.16Å; L90-N108 PolarHBondContact O-ND2 3.33Å
91	D	44	Very low	43.3	Very low	124 Å²	124	64 Å²	64	66%	0.663	36%	0.363	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.4	-16.4	168.8	-68.9	-42	0	0	0	111.9	K109 G110	D91-K109 WeakPolarHBondContact O-CA 3.48Å; D91-G110 PolarHBondContact O-N 2.96Å; D91-G110 VanDerWaalsContact O-N 3.08Å
92	E	43.8	Very low	43.9	Very low	85 Å²	85	61.5 Å²	61.5	40%	0.397	35%	0.349	S	S	.	.	T	Hydrogen-bonded Turn	trans	-138.3	52.5	177.2	-60.2	-169.7	159.9	0	0	112.8	L90 H94 N108	L90-E92 PolarHBondContact O-N 3.34Å; L90-E92 VanDerWaalsContact O-N 3.12Å; E92-H94 PolarHBondContact O-N 2.45Å; E92-H94 PolarHBondContact O-ND1 3.1Å; E92-N108 VanDerWaalsContact CA-O 3.29Å; E92-N108 WeakPolarHBondContact CA-O 3.45Å
93	L	44.5	Very low	44.6	Very low	7 Å²	7	60 Å²	60	4%	0.037	34%	0.337	C	S	.	.			trans	-66.1	125.1	172.5	-173.2	68.1	0	0	0	110.3	L19 L21 L83 L90 F95 C107 N108	L19-L93 HydrophobicContact CD2-CD1 4.45Å; L19-L93 HydrophobicContact CD2-CD2 4.31Å; L21-L93 HydrophobicContact CD2-CD1 3.69Å; L83-L93 HydrophobicContact CD2-CD2 3.13Å; L90-L93 HydrophobicContact CB-CB 3.77Å; L90-L93 HydrophobicContact CD1-CB 4.09Å; L90-L93 HydrophobicContact CD1-CD1 3.43Å; L90-L93 VanDerWaalsContact CD1-CD1 3.43Å; L90-L93 HydrophobicContact CD1-CD2 4.2Å; L90-L93 HydrophobicContact CD1-CG 4.06Å; L90-L93 HydrophobicContact CD2-CD1 3.97Å; L90-L93 HydrophobicContact CG-CB 4.35Å; L90-L93 HydrophobicContact CG-CD1 4.16Å; L93-F95 HydrophobicContact CD2-CD1 3.62Å; L93-F95 HydrophobicContact CD2-CE1 4.27Å; L93-F95 HydrophobicContact CD2-CG 4.45Å; L93-F95 HydrophobicContact CG-CD1 4.1Å; L93-C107 CarbonylContact O-C 3.51Å; L93-C107 WeakPolarHBondContact O-CA 3.46Å; L93-N108 HydrophobicContact CB-CB 4.03Å; L93-N108 PolarHBondContact O-N 3.08Å
94	H	51.7	Low	45.2	Very low	37 Å²	37	61.3 Å²	61.3	17%	0.171	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	129	165.3	-62.3	72	0	0	0	108	A20 E92 Y106 C107	A20-H94 WeakPolarHBondContact CA-O 3.44Å; A20-H94 HydrophobicContact CB-CB 3.96Å; A20-H94 WeakPolarHBondContact CB-O 3.12Å; A20-H94 PolarHBondContact N-O 3.3Å; E92-H94 PolarHBondContact O-N 2.45Å; E92-H94 PolarHBondContact O-ND1 3.1Å; H94-Y106 CarbonylContact C-O 3.45Å; H94-Y106 VanDerWaalsContact CA-O 3.28Å; H94-Y106 WeakPolarHBondContact CA-O 2.99Å; H94-C107 PolarHBondContact NE2-SG 3.15Å
95	F	53.3	Low	46	Very low	4 Å²	4	52.2 Å²	52.2	2%	0.018	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.8	145.7	174.4	67.6	-89	0	0	0	112.9	L17 L19 V79 L83 L93 I97 L105 Y106	L17-F95 HydrophobicContact CD1-CB 4.3Å; L17-F95 HydrophobicContact CD1-CD2 3.64Å; L17-F95 HydrophobicContact CD1-CE2 4.43Å; L17-F95 HydrophobicContact CD1-CG 4.36Å; L19-F95 HydrophobicContact CD2-CB 3.52Å; L19-F95 HydrophobicContact CD2-CG 4.2Å; V79-F95 HydrophobicContact CG1-CE2 3.66Å; V79-F95 HydrophobicContact CG1-CZ 3.73Å; L83-F95 HydrophobicContact CD1-CE1 3.71Å; L83-F95 HydrophobicContact CD1-CZ 3.62Å; L83-F95 HydrophobicContact CD2-CD1 3.76Å; L83-F95 HydrophobicContact CD2-CE1 3.44Å; L83-F95 VanDerWaalsContact CD2-CE1 3.44Å; L83-F95 HydrophobicContact CD2-CZ 4.06Å; L83-F95 HydrophobicContact CG-CE1 4.18Å; L83-F95 HydrophobicContact CG-CZ 4.36Å; L93-F95 HydrophobicContact CD2-CD1 3.62Å; L93-F95 HydrophobicContact CD2-CE1 4.27Å; L93-F95 HydrophobicContact CD2-CG 4.45Å; L93-F95 HydrophobicContact CG-CD1 4.1Å; F95-I97 HydrophobicContact CD2-CG1 4.09Å; F95-I97 HydrophobicContact CE2-CD1 4.14Å; F95-I97 HydrophobicContact CE2-CG1 4.1Å; F95-L105 WeakPolarHBondContact O-CA 3.31Å; F95-Y106 AromaticContact CD2-CD2 3.73Å; F95-Y106 HydrophobicContact CD2-CD2 3.73Å; F95-Y106 HydrophobicContact CD2-CG 4.22Å; F95-Y106 HydrophobicContact CE1-CD2 4.47Å; F95-Y106 HydrophobicContact CE1-CG 4.02Å; F95-Y106 HydrophobicContact CE2-CD1 4.49Å; F95-Y106 AromaticContact CE2-CD2 3.18Å; F95-Y106 HydrophobicContact CE2-CD2 3.18Å; F95-Y106 AromaticContact CE2-CE2 3.89Å; F95-Y106 HydrophobicContact CE2-CE2 3.89Å; F95-Y106 AromaticContact CE2-CG 3.54Å; F95-Y106 HydrophobicContact CE2-CG 3.54Å; F95-Y106 HydrophobicContact CZ-CD1 4.13Å; F95-Y106 AromaticContact CZ-CD2 3.62Å; F95-Y106 HydrophobicContact CZ-CD2 3.62Å; F95-Y106 HydrophobicContact CZ-CE2 4.44Å; F95-Y106 AromaticContact CZ-CG 3.41Å; F95-Y106 HydrophobicContact CZ-CG 3.41Å; F95-Y106 VanDerWaalsContact CZ-CG 3.41Å; F95-Y106 PolarHBondContact N-O 2.99Å; F95-Y106 PolarHBondContact O-N 2.7Å
96	V	51	Low	46.8	Very low	15 Å²	15	49.7 Å²	49.7	9%	0.091	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116	115.6	-175	-166.4	0	0	0	0	107.4	L17 C18 L103 R104 L105	L17-V96 CarbonylContact C-O 3.47Å; L17-V96 WeakPolarHBondContact CA-O 3.49Å; C18-V96 HydrophobicContact CB-CB 4.39Å; C18-V96 PolarHBondContact N-O 2.74Å; C18-V96 PolarHBondContact O-N 3.45Å; V96-L103 HydrophobicContact CG1-CD1 3.81Å; V96-L103 HydrophobicContact CG1-CD2 3.77Å; V96-L103 HydrophobicContact CG1-CG 3.68Å; V96-R104 CarbonylContact C-O 3.47Å; V96-R104 WeakPolarHBondContact CA-O 3.27Å; V96-L105 HydrophobicContact CB-CD2 3.83Å; V96-L105 HydrophobicContact CG1-CD2 3.48Å; V96-L105 VanDerWaalsContact CG1-CD2 3.48Å; V96-L105 HydrophobicContact CG1-CG 4.16Å; V96-L105 HydrophobicContact CG2-CD2 3.39Å
97	I	54.4	Low	47.5	Very low	6 Å²	6	47.4 Å²	47.4	3%	0.031	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.3	123.7	167	-53.7	-176.3	0	0	0	106.6	L17 V79 F95 E99 L103 R104 Y106	L17-I97 HydrophobicContact CD1-CG1 3.76Å; V79-I97 HydrophobicContact CG1-CD1 4.19Å; V79-I97 HydrophobicContact CG2-CD1 3.52Å; F95-I97 HydrophobicContact CD2-CG1 4.09Å; F95-I97 HydrophobicContact CE2-CD1 4.14Å; F95-I97 HydrophobicContact CE2-CG1 4.1Å; I97-E99 HydrophobicContact CG2-CG 3.75Å; I97-L103 CarbonylContact O-C 3.52Å; I97-L103 VanDerWaalsContact O-CA 3.26Å; I97-L103 WeakPolarHBondContact O-CA 3.29Å; I97-R104 HydrophobicContact CB-CB 4.32Å; I97-R104 PolarHBondContact N-O 2.64Å; I97-R104 PolarHBondContact O-N 2.86Å; I97-Y106 HydrophobicContact CD1-CD2 4.37Å; I97-Y106 HydrophobicContact CD1-CE2 3.68Å; I97-Y106 HydrophobicContact CG1-CD2 4.35Å; I97-Y106 HydrophobicContact CG1-CE2 4Å
98	C	51.4	Low	48.2	Very low	0 Å²	0	39.3 Å²	39.3	0%	0	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	109.4	168.6	-148.9	0	0	0	0	109.3	I16 C43 L47	I16-C98 PolarHBondContact N-O 3.18Å; I16-C98 VanDerWaalsContact N-O 3.1Å; I16-C98 PolarHBondContact O-N 3.26Å; C43-C98 HydrophobicContact CB-CB 4.16Å; L47-C98 HydrophobicContact CD1-CB 3.36Å; L47-C98 WeakPolarHBondContact CD1-SG 3.22Å
99	E	52	Low	48.7	Very low	42 Å²	42	44.1 Å²	44.1	20%	0.196	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100	158.4	170.7	-53.9	-163.9	153.3	0	0	108.7	R74 I97 N101 E102	R74-E99 IonicContact NH1-OE1 3.39Å; R74-E99 PolarHBondContact NH1-OE1 3.3Å; I97-E99 HydrophobicContact CG2-CG 3.75Å; E99-N101 PolarHBondContact O-N 2.59Å; E99-E102 WeakPolarHBondContact CA-O 3.06Å; E99-E102 HydrophobicContact CB-CB 4.37Å; E99-E102 WeakPolarHBondContact CB-O 3.2Å; E99-E102 PolarHBondContact N-O 3.06Å; E99-E102 PolarHBondContact O-N 2.94Å
100	P	49.4	Very low	49.2	Very low	52 Å²	52	42.3 Å²	42.3	34%	0.338	22%	0.217	S	C	.	.	T	Hydrogen-bonded Turn	trans	-51.8	-23.4	-174.2	-29.1	34.6	0	0	0	115.5	L9	L9-P100 WeakPolarHBondContact CD1-O 3.45Å
101	N	45.3	Very low	49.2	Very low	90 Å²	90	52.1 Å²	52.1	48%	0.481	25%	0.252	S	S	.	.	T	Hydrogen-bonded Turn	trans	-130.7	8.6	179.3	-65.1	-52	0	0	0	112.8	E99 S120 F121	E99-N101 PolarHBondContact O-N 2.59Å; N101-S120 CarbonylContact O-C 3.5Å; N101-S120 VanDerWaalsContact O-CA 3.26Å; N101-S120 WeakPolarHBondContact O-CA 3.35Å; N101-F121 PolarHBondContact O-N 3.39Å
102	E	46.2	Very low	49	Very low	39 Å²	39	52.8 Å²	52.8	18%	0.182	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.6	126.4	-173.6	-162.4	178.3	171.6	0	0	112.7	E99 R104 S118 I119	E99-E102 WeakPolarHBondContact CA-O 3.06Å; E99-E102 HydrophobicContact CB-CB 4.37Å; E99-E102 WeakPolarHBondContact CB-O 3.2Å; E99-E102 PolarHBondContact N-O 3.06Å; E99-E102 PolarHBondContact O-N 2.94Å; E102-R104 VanDerWaalsContact CD-NH2 3.33Å; E102-R104 HydrophobicContact CG-CG 3.95Å; E102-R104 WeakPolarHBondContact OE1-CG 3.03Å; E102-R104 IonicContact OE1-CZ 3.46Å; E102-R104 IonicContact OE1-NE 2.7Å; E102-R104 PolarHBondContact OE1-NE 3.01Å; E102-R104 IonicContact OE1-NH2 2.65Å; E102-R104 PolarHBondContact OE1-NH2 2.81Å; E102-R104 IonicContact OE2-CZ 3.29Å; E102-R104 VanDerWaalsContact OE2-CZ 3.29Å; E102-R104 IonicContact OE2-NE 3.24Å; E102-R104 PolarHBondContact OE2-NE 2.77Å; E102-R104 IonicContact OE2-NH2 2.99Å; E102-R104 PolarHBondContact OE2-NH2 2.75Å; E102-S118 WeakPolarHBondContact CG-OG 3.33Å; E102-S118 PolarHBondContact OE1-OG 2.66Å; E102-I119 CarbonylContact C-O 3.27Å; E102-I119 WeakPolarHBondContact CA-O 3.26Å
103	L	50.5	Low	49.3	Very low	0 Å²	0	54.1 Å²	54.1	0%	0	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	121.5	170.5	-174.9	148.4	0	0	0	109.3	M40 F51 V96 I97 L105 S118 I119 F121	M40-L103 HydrophobicContact CG-CD1 4.21Å; M40-L103 HydrophobicContact CG-CD2 4.42Å; M40-L103 HydrophobicContact SD-CD1 3.53Å; M40-L103 VanDerWaalsContact SD-CD1 3.53Å; M40-L103 HydrophobicContact SD-CD2 3.15Å; M40-L103 WeakPolarHBondContact SD-CD2 3.11Å; M40-L103 HydrophobicContact SD-CG 3.97Å; F51-L103 HydrophobicContact CE2-CD1 4.14Å; F51-L103 HydrophobicContact CZ-CD1 3.87Å; V96-L103 HydrophobicContact CG1-CD1 3.81Å; V96-L103 HydrophobicContact CG1-CD2 3.77Å; V96-L103 HydrophobicContact CG1-CG 3.68Å; I97-L103 CarbonylContact O-C 3.52Å; I97-L103 VanDerWaalsContact O-CA 3.26Å; I97-L103 WeakPolarHBondContact O-CA 3.29Å; L103-L105 HydrophobicContact CD2-CD1 3.27Å; L103-L105 HydrophobicContact CD2-CD2 4.01Å; L103-L105 HydrophobicContact CD2-CG 3.51Å; L103-S118 CarbonylContact O-C 3.35Å; L103-S118 VanDerWaalsContact O-CA 3.27Å; L103-S118 WeakPolarHBondContact O-CA 3.18Å; L103-I119 HydrophobicContact CB-CB 4.5Å; L103-I119 PolarHBondContact N-O 2.79Å; L103-I119 PolarHBondContact O-N 2.65Å; L103-F121 HydrophobicContact CB-CE2 3.96Å; L103-F121 HydrophobicContact CB-CZ 4.1Å
104	R	50.1	Low	49.4	Very low	71 Å²	71	60.9 Å²	60.9	27%	0.268	29%	0.288	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	129.6	-179.4	-58.6	-174.4	-177.9	149.7	7.5	111.5	V96 I97 E102 Y106 L117	V96-R104 CarbonylContact C-O 3.47Å; V96-R104 WeakPolarHBondContact CA-O 3.27Å; I97-R104 HydrophobicContact CB-CB 4.32Å; I97-R104 PolarHBondContact N-O 2.64Å; I97-R104 PolarHBondContact O-N 2.86Å; E102-R104 VanDerWaalsContact CD-NH2 3.33Å; E102-R104 HydrophobicContact CG-CG 3.95Å; E102-R104 WeakPolarHBondContact OE1-CG 3.03Å; E102-R104 IonicContact OE1-CZ 3.46Å; E102-R104 IonicContact OE1-NE 2.7Å; E102-R104 PolarHBondContact OE1-NE 3.01Å; E102-R104 IonicContact OE1-NH2 2.65Å; E102-R104 PolarHBondContact OE1-NH2 2.81Å; E102-R104 IonicContact OE2-CZ 3.29Å; E102-R104 VanDerWaalsContact OE2-CZ 3.29Å; E102-R104 IonicContact OE2-NE 3.24Å; E102-R104 PolarHBondContact OE2-NE 2.77Å; E102-R104 IonicContact OE2-NH2 2.99Å; E102-R104 PolarHBondContact OE2-NH2 2.75Å; R104-Y106 HydrophobicContact CB-CD2 4.29Å; R104-Y106 HydrophobicContact CB-CE2 3.46Å; R104-Y106 VanDerWaalsContact CB-CE2 3.46Å; R104-Y106 WeakPolarHBondContact CD-OH 3.26Å; R104-L117 WeakPolarHBondContact CA-O 3.38Å
105	L	51.2	Low	49.2	Very low	3 Å²	3	64.4 Å²	64.4	2%	0.016	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	121.4	-174.5	-64.3	141.9	0	0	0	108.9	F36 M40 F95 V96 L103 V116 L117	F36-L105 HydrophobicContact CD2-CD2 4.02Å; F36-L105 HydrophobicContact CE1-CD1 3.92Å; F36-L105 HydrophobicContact CE1-CD2 4.2Å; F36-L105 HydrophobicContact CE2-CB 4.23Å; F36-L105 HydrophobicContact CE2-CD1 4.24Å; F36-L105 HydrophobicContact CE2-CD2 3.32Å; F36-L105 HydrophobicContact CE2-CG 4.09Å; F36-L105 HydrophobicContact CZ-CB 4.07Å; F36-L105 HydrophobicContact CZ-CD1 3.44Å; F36-L105 VanDerWaalsContact CZ-CD1 3.44Å; F36-L105 HydrophobicContact CZ-CD2 3.43Å; F36-L105 VanDerWaalsContact CZ-CD2 3.43Å; F36-L105 HydrophobicContact CZ-CG 3.78Å; M40-L105 HydrophobicContact CE-CD1 4.22Å; M40-L105 HydrophobicContact SD-CD1 3.81Å; M40-L105 HydrophobicContact SD-CD2 4.46Å; F95-L105 WeakPolarHBondContact O-CA 3.31Å; V96-L105 HydrophobicContact CB-CD2 3.83Å; V96-L105 HydrophobicContact CG1-CD2 3.48Å; V96-L105 VanDerWaalsContact CG1-CD2 3.48Å; V96-L105 HydrophobicContact CG1-CG 4.16Å; V96-L105 HydrophobicContact CG2-CD2 3.39Å; L103-L105 HydrophobicContact CD2-CD1 3.27Å; L103-L105 HydrophobicContact CD2-CD2 4.01Å; L103-L105 HydrophobicContact CD2-CG 3.51Å; L105-V116 HydrophobicContact CB-CB 4.5Å; L105-V116 WeakPolarHBondContact O-CB 2.96Å; L105-V116 PolarHBondContact O-N 2.82Å; L105-L117 HydrophobicContact CB-CB 4.13Å; L105-L117 HydrophobicContact CD1-CB 3.65Å; L105-L117 HydrophobicContact CD1-CD2 3.63Å; L105-L117 HydrophobicContact CD1-CG 3.9Å; L105-L117 HydrophobicContact CG-CB 4.49Å; L105-L117 PolarHBondContact N-O 2.83Å; L105-L117 PolarHBondContact O-N 3.24Å
106	Y	54.2	Low	49	Very low	45 Å²	45	67.7 Å²	67.7	18%	0.176	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	133.1	-178.7	-63	-89.2	0	0	0	108.5	H94 F95 I97 R104 F115	H94-Y106 CarbonylContact C-O 3.45Å; H94-Y106 VanDerWaalsContact CA-O 3.28Å; H94-Y106 WeakPolarHBondContact CA-O 2.99Å; F95-Y106 AromaticContact CD2-CD2 3.73Å; F95-Y106 HydrophobicContact CD2-CD2 3.73Å; F95-Y106 HydrophobicContact CD2-CG 4.22Å; F95-Y106 HydrophobicContact CE1-CD2 4.47Å; F95-Y106 HydrophobicContact CE1-CG 4.02Å; F95-Y106 HydrophobicContact CE2-CD1 4.49Å; F95-Y106 AromaticContact CE2-CD2 3.18Å; F95-Y106 HydrophobicContact CE2-CD2 3.18Å; F95-Y106 AromaticContact CE2-CE2 3.89Å; F95-Y106 HydrophobicContact CE2-CE2 3.89Å; F95-Y106 AromaticContact CE2-CG 3.54Å; F95-Y106 HydrophobicContact CE2-CG 3.54Å; F95-Y106 HydrophobicContact CZ-CD1 4.13Å; F95-Y106 AromaticContact CZ-CD2 3.62Å; F95-Y106 HydrophobicContact CZ-CD2 3.62Å; F95-Y106 HydrophobicContact CZ-CE2 4.44Å; F95-Y106 AromaticContact CZ-CG 3.41Å; F95-Y106 HydrophobicContact CZ-CG 3.41Å; F95-Y106 VanDerWaalsContact CZ-CG 3.41Å; F95-Y106 PolarHBondContact N-O 2.99Å; F95-Y106 PolarHBondContact O-N 2.7Å; I97-Y106 HydrophobicContact CD1-CD2 4.37Å; I97-Y106 HydrophobicContact CD1-CE2 3.68Å; I97-Y106 HydrophobicContact CG1-CD2 4.35Å; I97-Y106 HydrophobicContact CG1-CE2 4Å; R104-Y106 HydrophobicContact CB-CD2 4.29Å; R104-Y106 HydrophobicContact CB-CE2 3.46Å; R104-Y106 VanDerWaalsContact CB-CE2 3.46Å; R104-Y106 WeakPolarHBondContact CD-OH 3.26Å; Y106-F115 HydrophobicContact CE1-CD2 4.08Å
107	C	49.4	Very low	48.6	Very low	23 Å²	23	70.2 Å²	70.2	16%	0.155	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	123.4	167.4	175.4	0	0	0	0	106.4	L93 H94 K114 V116	L93-C107 CarbonylContact O-C 3.51Å; L93-C107 WeakPolarHBondContact O-CA 3.46Å; H94-C107 PolarHBondContact NE2-SG 3.15Å; C107-K114 PolarHBondContact N-O 2.93Å; C107-K114 VanDerWaalsContact N-O 3.15Å; C107-K114 PolarHBondContact O-N 3.19Å; C107-V116 HydrophobicContact CB-CG2 3.36Å
108	N	48.9	Very low	48.3	Very low	19 Å²	19	71.7 Å²	71.7	10%	0.102	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.3	131.2	164.4	-171.8	26.1	0	0	0	108	L90 E92 L93 G110 L112 F113	L90-N108 PolarHBondContact O-ND2 3.33Å; E92-N108 VanDerWaalsContact CA-O 3.29Å; E92-N108 WeakPolarHBondContact CA-O 3.45Å; L93-N108 HydrophobicContact CB-CB 4.03Å; L93-N108 PolarHBondContact O-N 3.08Å; N108-G110 VanDerWaalsContact CG-O 3.32Å; N108-G110 PolarHBondContact ND2-O 2.93Å; N108-G110 PolarHBondContact OD1-O 2.58Å; N108-L112 PolarHBondContact OD1-O 3.27Å; N108-F113 HydrophobicContact CB-CD1 4.49Å; N108-F113 HydrophobicContact CB-CE1 4.44Å
109	K	48	Very low	48	Very low	153 Å²	153	73 Å²	73	67%	0.665	35%	0.354	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-127	94.7	165.8	-167.4	174.6	-175.8	175.3	0	107.9	D91 R111 L112	D91-K109 WeakPolarHBondContact O-CA 3.48Å; K109-R111 PolarHBondContact O-N 3.23Å; K109-L112 PolarHBondContact N-O 3.49Å
110	G	49.3	Very low	47.6	Very low	37 Å²	37	75.1 Å²	75.1	38%	0.381	37%	0.373	S	S	.	.	T	Hydrogen-bonded Turn	trans	72.3	-116.1	-171.9	0	0	0	0	0	113.4	D91 N108	D91-G110 PolarHBondContact O-N 2.96Å; D91-G110 VanDerWaalsContact O-N 3.08Å; N108-G110 VanDerWaalsContact CG-O 3.32Å; N108-G110 PolarHBondContact ND2-O 2.93Å; N108-G110 PolarHBondContact OD1-O 2.58Å
111	R	44.4	Very low	47.5	Very low	242 Å²	242	74.2 Å²	74.2	91%	0.913	36%	0.364	S	S	*	.	T	Hydrogen-bonded Turn	trans	-102	-1.3	178.8	-66.2	-173.2	-178.7	-177.6	1	114	K109	K109-R111 PolarHBondContact O-N 3.23Å
112	L	39.9	Very low	47.3	Very low	139 Å²	139	81.8 Å²	81.8	73%	0.728	39%	0.386	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-103.8	113.6	-176.8	-71.1	168.7	0	0	0	108.9	N108 K109 K114	N108-L112 PolarHBondContact OD1-O 3.27Å; K109-L112 PolarHBondContact N-O 3.49Å; L112-K114 PolarHBondContact O-N 2.99Å
113	F	50.1	Low	47.1	Very low	112 Å²	112	87.2 Å²	87.2	49%	0.491	41%	0.411	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.3	115.2	169.5	-63.5	-76.4	0	0	0	108.4	L83 N108	L83-F113 HydrophobicContact CD1-CD1 4.43Å; L83-F113 HydrophobicContact CD1-CE1 3.73Å; L83-F113 HydrophobicContact CD1-CZ 4.16Å; N108-F113 HydrophobicContact CB-CD1 4.49Å; N108-F113 HydrophobicContact CB-CE1 4.44Å
114	K	46.2	Very low	46.6	Very low	150 Å²	150	96.3 Å²	96.3	65%	0.652	45%	0.454	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-100.6	119.5	169.7	-167.4	174.1	179.8	-178.4	0	108.1	C107 L112 V116	C107-K114 PolarHBondContact N-O 2.93Å; C107-K114 VanDerWaalsContact N-O 3.15Å; C107-K114 PolarHBondContact O-N 3.19Å; L112-K114 PolarHBondContact O-N 2.99Å; K114-V116 WeakPolarHBondContact O-CG2 2.82Å; K114-V116 PolarHBondContact O-N 2.8Å
115	F	49.1	Very low	45.9	Very low	110 Å²	110	102 Å²	102	48%	0.482	48%	0.483	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.6	120.6	163.1	174.6	-96.2	0	0	0	108.3	Y106	Y106-F115 HydrophobicContact CE1-CD2 4.08Å
116	V	47.9	Very low	45.1	Very low	74 Å²	74	111.9 Å²	111.9	45%	0.448	54%	0.544	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.9	-43	-173.6	-177.5	0	0	0	0	110.6	L105 C107 K114	L105-V116 HydrophobicContact CB-CB 4.5Å; L105-V116 WeakPolarHBondContact O-CB 2.96Å; L105-V116 PolarHBondContact O-N 2.82Å; C107-V116 HydrophobicContact CB-CG2 3.36Å; K114-V116 WeakPolarHBondContact O-CG2 2.82Å; K114-V116 PolarHBondContact O-N 2.8Å
117	L	42.4	Very low	44.7	Very low	68 Å²	68	115.2 Å²	115.2	36%	0.356	56%	0.562	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-163.7	131.4	-175	-172.4	63.9	0	0	0	110.4	R104 L105 I119	R104-L117 WeakPolarHBondContact CA-O 3.38Å; L105-L117 HydrophobicContact CB-CB 4.13Å; L105-L117 HydrophobicContact CD1-CB 3.65Å; L105-L117 HydrophobicContact CD1-CD2 3.63Å; L105-L117 HydrophobicContact CD1-CG 3.9Å; L105-L117 HydrophobicContact CG-CB 4.49Å; L105-L117 PolarHBondContact N-O 2.83Å; L105-L117 PolarHBondContact O-N 3.24Å; L117-I119 HydrophobicContact CD2-CD1 3.89Å; L117-I119 HydrophobicContact CD2-CG1 4.13Å; L117-I119 HydrophobicContact CG-CD1 4.28Å; L117-I119 HydrophobicContact CG-CG1 3.95Å
118	S	48.5	Very low	44.4	Very low	37 Å²	37	120.1 Å²	120.1	26%	0.259	58%	0.584	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-114.9	138.2	159.7	176.8	0	0	0	0	109	E102 L103	E102-S118 WeakPolarHBondContact CG-OG 3.33Å; E102-S118 PolarHBondContact OE1-OG 2.66Å; L103-S118 CarbonylContact O-C 3.35Å; L103-S118 VanDerWaalsContact O-CA 3.27Å; L103-S118 WeakPolarHBondContact O-CA 3.18Å
119	I	45.2	Very low	44.2	Very low	28 Å²	28	125.7 Å²	125.7	14%	0.144	61%	0.611	C	S	.	*	E	Extended strand (participates in β ladder)	trans	-124.9	110.2	175.3	-50.3	-179.7	0	0	0	106.4	M40 F51 E102 L103 L117 F121	M40-I119 HydrophobicContact CE-CD1 3.67Å; M40-I119 HydrophobicContact SD-CD1 4.16Å; F51-I119 HydrophobicContact CE1-CD1 3.96Å; F51-I119 HydrophobicContact CZ-CD1 4.43Å; E102-I119 CarbonylContact C-O 3.27Å; E102-I119 WeakPolarHBondContact CA-O 3.26Å; L103-I119 HydrophobicContact CB-CB 4.5Å; L103-I119 PolarHBondContact N-O 2.79Å; L103-I119 PolarHBondContact O-N 2.65Å; L117-I119 HydrophobicContact CD2-CD1 3.89Å; L117-I119 HydrophobicContact CD2-CG1 4.13Å; L117-I119 HydrophobicContact CG-CD1 4.28Å; L117-I119 HydrophobicContact CG-CG1 3.95Å; I119-F121 HydrophobicContact CB-CE1 4.22Å; I119-F121 HydrophobicContact CB-CZ 3.92Å; I119-F121 HydrophobicContact CG2-CD1 4.21Å; I119-F121 HydrophobicContact CG2-CE1 3.32Å; I119-F121 HydrophobicContact CG2-CZ 3.54Å; I119-F121 WeakPolarHBondContact O-CE2 3.33Å
120	S	44.1	Very low	44	Very low	86 Å²	86	124.1 Å²	124.1	60%	0.601	61%	0.607	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-96.1	142.4	175.7	-50.7	0	0	0	0	110.8	N101	N101-S120 CarbonylContact O-C 3.5Å; N101-S120 VanDerWaalsContact O-CA 3.26Å; N101-S120 WeakPolarHBondContact O-CA 3.35Å
121	F	47.5	Very low	43.6	Very low	33 Å²	33	129.5 Å²	129.5	15%	0.145	62%	0.622	C	S	.	*			trans	-116.3	141.2	179.9	-44.1	-71.9	0	0	0	109.1	L5 L9 L49 N101 L103 I119	L5-F121 HydrophobicContact CD1-CD1 4.21Å; L5-F121 HydrophobicContact CD1-CE1 3.44Å; L5-F121 VanDerWaalsContact CD1-CE1 3.44Å; L5-F121 HydrophobicContact CD1-CZ 4.19Å; L9-F121 HydrophobicContact CD1-CD2 4.5Å; L49-F121 HydrophobicContact CD1-CD2 3.97Å; L49-F121 HydrophobicContact CD1-CE1 4.11Å; L49-F121 HydrophobicContact CD1-CE2 3.31Å; L49-F121 HydrophobicContact CD1-CZ 3.39Å; L49-F121 HydrophobicContact CD2-CB 4.07Å; L49-F121 HydrophobicContact CD2-CD1 3.34Å; L49-F121 HydrophobicContact CD2-CD2 3.42Å; L49-F121 VanDerWaalsContact CD2-CD2 3.42Å; L49-F121 HydrophobicContact CD2-CE1 3.51Å; L49-F121 HydrophobicContact CD2-CE2 3.59Å; L49-F121 HydrophobicContact CD2-CG 3.29Å; L49-F121 HydrophobicContact CD2-CZ 3.63Å; L49-F121 HydrophobicContact CG-CD2 4.3Å; L49-F121 HydrophobicContact CG-CE1 4.3Å; L49-F121 HydrophobicContact CG-CE2 4.07Å; L49-F121 HydrophobicContact CG-CZ 4.06Å; N101-F121 PolarHBondContact O-N 3.39Å; L103-F121 HydrophobicContact CB-CE2 3.96Å; L103-F121 HydrophobicContact CB-CZ 4.1Å; I119-F121 HydrophobicContact CB-CE1 4.22Å; I119-F121 HydrophobicContact CB-CZ 3.92Å; I119-F121 HydrophobicContact CG2-CD1 4.21Å; I119-F121 HydrophobicContact CG2-CE1 3.32Å; I119-F121 HydrophobicContact CG2-CZ 3.54Å; I119-F121 WeakPolarHBondContact O-CE2 3.33Å
122	R	40.3	Very low	43.6	Very low	249 Å²	249	122 Å²	122	94%	0.94	60%	0.602	S	S	*	*			trans	-117	124.9	170.1	-69.8	-174.7	179.2	-172.7	-0.3	107.3	E124	R122-E124 PolarHBondContact O-N 3.46Å
123	Q	42.5	Very low	43.9	Very low	153 Å²	153	120.8 Å²	120.8	72%	0.715	59%	0.593	S	S	*	*			trans	-73.5	121.2	173.7	-167.2	174.5	13.5	0	0	108.5	Q125	Q123-Q125 PolarHBondContact O-N 3.38Å
124	E	40.3	Very low	43.4	Very low	191 Å²	191	121.5 Å²	121.5	89%	0.893	60%	0.601	S	S	*	*			trans	-72.1	118.2	167.5	-107.4	176.1	170.8	0	0	108.1	R122 T126	R122-E124 PolarHBondContact O-N 3.46Å; E124-T126 PolarHBondContact O-N 3.37Å
125	Q	34.7	Very low	43.2	Very low	189 Å²	189	119.1 Å²	119.1	88%	0.883	60%	0.597	S	S	*	*			trans	-77	111.1	172.3	-74.6	-179.6	-15.2	0	0	108.1	Q123	Q123-Q125 PolarHBondContact O-N 3.38Å
126	T	35.4	Very low	42.6	Very low	211 Å²	211	119.9 Å²	119.9	100%	1.294	61%	0.607	S	S	*	*			trans	-66.5	0	161.3	44.9	0	0	0	0	111.1	E124	E124-T126 PolarHBondContact O-N 3.37Å

Retrieved 126 of 126 residues in 103.5 ms (Link to these results)

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