A0A077ZLC1_TRITR Loading...

Uncharacterized protein

AlphaFold DB , UniProt , Accession A0A077ZLC1, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 143 aa.

						>A0A077ZLC1_TRITR|A0A077ZLC1
MMSTRMSKVQQGPSRSIDTSEEVASLLRFIDAIQKHGVIDDVSIALMVLDIFACFSSSSSSKTIVVKTLDSDTASGLLSSLSMIFRTMDEKLFEEMGVANLPVVAHVMSGSFRIAASKRGTSPVEFGRLPLFAVRNASIDDSL
					

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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	51.3	Low	40.7	Very low	242 Å²	242	164.5 Å²	164.5	100%	1.192	83%	0.83	S	S	*	*				0	107.4	0	-71.8	175.3	168.7	0	0	107.9	S3	M1-S3 PolarHBondContact O-N 2.63Å
2	M	38	Very low	42	Very low	195 Å²	195	152.1 Å²	152.1	96%	0.961	77%	0.774	S	S	*	*			trans	-74.3	102.6	173.8	-78.4	167.2	167.3	0	0	107.8	T4	M2-T4 PolarHBondContact O-N 2.79Å
3	S	36.1	Very low	43.1	Very low	112 Å²	112	144.9 Å²	144.9	78%	0.783	74%	0.744	S	S	*	*			trans	-76	103.1	171.9	-173.7	0	0	0	0	107.7	M1 R5	M1-S3 PolarHBondContact O-N 2.63Å; S3-R5 VanDerWaalsContact C-N 3.31Å; S3-R5 PolarHBondContact O-N 3.03Å
4	T	42.4	Very low	44.3	Very low	125 Å²	125	139.9 Å²	139.9	77%	0.767	73%	0.729	S	S	*	*			trans	-64.5	95.7	173.2	-35.2	0	0	0	0	107.3	M2 M6	M2-T4 PolarHBondContact O-N 2.79Å; T4-M6 VanDerWaalsContact C-N 3.28Å; T4-M6 PolarHBondContact O-N 2.74Å
5	R	37.5	Very low	45.7	Very low	228 Å²	228	135.8 Å²	135.8	86%	0.86	70%	0.7	S	S	*	*			trans	-61.4	93.8	175	-163.5	179.8	-172.3	-171.5	2.4	106.8	S3 S7	S3-R5 VanDerWaalsContact C-N 3.31Å; S3-R5 PolarHBondContact O-N 3.03Å; R5-S7 VanDerWaalsContact C-N 3.33Å; R5-S7 PolarHBondContact O-N 3.48Å
6	M	33.6	Very low	46.9	Very low	176 Å²	176	130.1 Å²	130.1	87%	0.867	68%	0.676	S	S	*	*			trans	-59.8	103	168.8	-73.6	-169.7	171.3	0	0	106	T4 K8	T4-M6 VanDerWaalsContact C-N 3.28Å; T4-M6 PolarHBondContact O-N 2.74Å; M6-K8 PolarHBondContact O-N 3.18Å
7	S	34.9	Very low	48.1	Very low	100 Å²	100	122.7 Å²	122.7	70%	0.699	64%	0.637	S	S	*	*			trans	-53.7	110.1	174.3	-64.7	0	0	0	0	106.6	R5 V9	R5-S7 VanDerWaalsContact C-N 3.33Å; R5-S7 PolarHBondContact O-N 3.48Å; S7-V9 VanDerWaalsContact C-N 3.28Å; S7-V9 PolarHBondContact O-N 2.93Å
8	K	37.8	Very low	49	Very low	204 Å²	204	119.9 Å²	119.9	89%	0.887	62%	0.623	S	S	*	*			trans	-55.6	103.1	171.1	-129.4	179.3	-175.6	-179.9	0	104.6	M6 Q10	M6-K8 PolarHBondContact O-N 3.18Å; K8-Q10 VanDerWaalsContact C-N 3.33Å; K8-Q10 PolarHBondContact O-N 2.83Å
9	V	41.5	Very low	49.9	Very low	84 Å²	84	116.9 Å²	116.9	51%	0.509	61%	0.611	S	S	.	*			trans	-59.1	103.8	179.2	179.8	0	0	0	0	104.6	S7 Q11	S7-V9 VanDerWaalsContact C-N 3.28Å; S7-V9 PolarHBondContact O-N 2.93Å; V9-Q11 PolarHBondContact O-N 3.21Å
10	Q	42.4	Very low	50.8	Low	169 Å²	169	116.1 Å²	116.1	79%	0.79	62%	0.615	S	S	*	*			trans	-56.7	107.4	178	-115.1	174.8	-15.8	0	0	105.9	K8 G12 R113	K8-Q10 VanDerWaalsContact C-N 3.33Å; K8-Q10 PolarHBondContact O-N 2.83Å; Q10-G12 PolarHBondContact O-N 2.89Å; Q10-R113 PolarHBondContact O-NH2 3.34Å
11	Q	51.9	Low	51.7	Low	174 Å²	174	117.4 Å²	117.4	81%	0.813	62%	0.618	S	S	*	*			trans	-72.7	100.2	177.2	-74.2	-177.8	-8.9	0	0	105.6	V9	V9-Q11 PolarHBondContact O-N 3.21Å
12	G	56.3	Low	52.3	Low	16 Å²	16	108 Å²	108	17%	0.165	57%	0.571	C	S	.	*			trans	-69.5	173.8	157.8	0	0	0	0	0	109.9	Q10 S14 S61	Q10-G12 PolarHBondContact O-N 2.89Å; G12-S14 PolarHBondContact O-N 3.44Å; G12-S61 VanDerWaalsContact CA-O 3.23Å; G12-S61 WeakPolarHBondContact CA-O 3.46Å
13	P	56.7	Low	53.5	Low	59 Å²	59	99.2 Å²	99.2	38%	0.383	53%	0.528	S	S	.	.			trans	-46.8	132.6	179.6	12.7	-26	0	0	0	111.5	S57 S59 K62 T63	P13-S57 WeakPolarHBondContact CG-OG 3.29Å; P13-S59 VanDerWaalsContact CD-OG 3.26Å; P13-S59 WeakPolarHBondContact CD-OG 3.27Å; P13-S59 WeakPolarHBondContact CG-OG 3.34Å; P13-K62 HydrophobicContact CG-CG 4.34Å; P13-T63 PolarHBondContact O-N 2.86Å
14	S	59.8	Low	55	Low	75 Å²	75	96 Å²	96	52%	0.524	51%	0.509	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	130.6	-178	61.5	0	0	0	0	110.5	G12 T63	G12-S14 PolarHBondContact O-N 3.44Å; S14-T63 WeakPolarHBondContact CA-O 3.3Å; S14-T63 WeakPolarHBondContact CB-O 2.91Å
15	R	64.7	Low	56.2	Low	78 Å²	78	90.4 Å²	90.4	29%	0.294	47%	0.474	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93	128.5	165.5	-173.6	88.6	-162	-174.7	-10.5	107.8	D50 C54 T63 I64 V65	R15-D50 IonicContact CZ-OD1 2.87Å; R15-D50 IonicContact CZ-OD2 3.33Å; R15-D50 IonicContact NE-OD2 2.73Å; R15-D50 PolarHBondContact NE-OD2 3.36Å; R15-D50 IonicContact NH1-OD1 2.67Å; R15-D50 PolarHBondContact NH1-OD1 2.87Å; R15-D50 IonicContact NH1-OD2 3.49Å; R15-D50 PolarHBondContact NH1-OD2 3.41Å; R15-D50 IonicContact NH2-OD1 3.93Å; R15-D50 IonicContact NH2-OD2 3.52Å; R15-D50 PolarHBondContact NH2-OD2 3.31Å; R15-C54 HydrophobicContact CB-CB 4.11Å; R15-C54 WeakPolarHBondContact CD-SG 3.05Å; R15-T63 PolarHBondContact N-O 2.98Å; R15-I64 WeakPolarHBondContact O-CA 3.2Å; R15-V65 PolarHBondContact O-N 3.24Å
16	S	65.2	Low	57.5	Low	45 Å²	45	79.6 Å²	79.6	32%	0.315	43%	0.434	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.6	137.8	165.1	52.5	0	0	0	0	110.6	D18 V65	S16-D18 VanDerWaalsContact CB-OD2 3.26Å; S16-D18 WeakPolarHBondContact CB-OD2 3.33Å; S16-D18 PolarHBondContact OG-OD2 3.18Å; S16-V65 CarbonylContact C-O 3.52Å; S16-V65 WeakPolarHBondContact CA-O 3.43Å
17	I	66.8	Low	59.2	Low	4 Å²	4	74.5 Å²	74.5	2%	0.021	41%	0.41	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104	110.1	166.4	-64.1	-178.8	0	0	0	105.1	E22 V23 L26 I51 I64 V65 V66 K67	I17-E22 HydrophobicContact CG2-CB 3.63Å; I17-V23 HydrophobicContact CG2-CG2 3.64Å; I17-L26 HydrophobicContact CD1-CD2 3.53Å; I17-I51 HydrophobicContact CD1-CD1 4.37Å; I17-I64 HydrophobicContact CD1-CG2 3.99Å; I17-I64 HydrophobicContact CG1-CG2 4.29Å; I17-V65 PolarHBondContact N-O 2.89Å; I17-V66 HydrophobicContact CB-CG1 4.22Å; I17-V66 HydrophobicContact CD1-CG2 4.27Å; I17-V66 HydrophobicContact CG2-CG1 4.17Å; I17-K67 PolarHBondContact O-N 3.04Å
18	D	65.4	Low	60.7	Low	72 Å²	72	75.6 Å²	75.6	39%	0.385	40%	0.398	S	S	.	.			trans	-114.4	-15.6	-164.8	-73.2	-50.3	0	0	0	113	S16 E22 K67	S16-D18 VanDerWaalsContact CB-OD2 3.26Å; S16-D18 WeakPolarHBondContact CB-OD2 3.33Å; S16-D18 PolarHBondContact OG-OD2 3.18Å; D18-E22 PolarHBondContact N-OE2 2.84Å; D18-K67 WeakPolarHBondContact OD1-CD 3.49Å; D18-K67 WeakPolarHBondContact OD1-CE 3.43Å; D18-K67 VanDerWaalsContact OD1-CG 3.31Å; D18-K67 WeakPolarHBondContact OD1-CG 3.12Å; D18-K67 IonicContact OD1-NZ 2.67Å; D18-K67 PolarHBondContact OD1-NZ 2.86Å; D18-K67 IonicContact OD2-NZ 3.03Å; D18-K67 PolarHBondContact OD2-NZ 2.74Å
19	T	66.2	Low	62.1	Low	64 Å²	64	65.9 Å²	65.9	39%	0.393	36%	0.356	S	S	.	.	S	Bend	trans	-111.8	147.6	-177.4	67.5	0	0	0	0	111.9	E21 E22 V23	T19-E21 PolarHBondContact O-N 2.86Å; T19-E22 PolarHBondContact N-OE2 3.22Å; T19-E22 PolarHBondContact O-N 3.06Å; T19-E22 WeakPolarHBondContact OG1-CB 3.4Å; T19-E22 WeakPolarHBondContact OG1-CG 3.06Å; T19-E22 PolarHBondContact OG1-N 3.39Å; T19-E22 VanDerWaalsContact OG1-N 3.13Å; T19-E22 PolarHBondContact OG1-OE2 2.93Å; T19-V23 WeakPolarHBondContact O-CG2 3.43Å; T19-V23 PolarHBondContact O-N 3.21Å
20	S	67.1	Low	63.3	Low	99 Å²	99	62.2 Å²	62.2	69%	0.692	33%	0.334	S	S	*	.	H	α-helix	trans	-61.3	-26.4	172.5	52.5	0	0	0	0	112.5	A24	S20-A24 VanDerWaalsContact O-CB 3.27Å; S20-A24 WeakPolarHBondContact O-CB 3.22Å; S20-A24 PolarHBondContact O-N 3.03Å
21	E	69.3	Low	64.4	Low	145 Å²	145	57.4 Å²	57.4	68%	0.678	31%	0.313	S	S	*	.	H	α-helix	trans	-72.3	-41.8	178.2	-173.3	174.4	-172.6	0	0	112.4	T19 V23 A24 S25	T19-E21 PolarHBondContact O-N 2.86Å; E21-V23 VanDerWaalsContact C-N 3.35Å; E21-A24 PolarHBondContact O-N 3.42Å; E21-S25 WeakPolarHBondContact O-CB 3.1Å; E21-S25 PolarHBondContact O-N 3.03Å; E21-S25 PolarHBondContact O-OG 3.08Å
22	E	64.7	Low	64.8	Low	45 Å²	45	49.8 Å²	49.8	21%	0.21	28%	0.28	C	S	.	.	H	α-helix	trans	-63	-43.5	172.7	-72.3	166.3	132.2	0	0	111	I17 D18 T19 S25 L26 M47	I17-E22 HydrophobicContact CG2-CB 3.63Å; D18-E22 PolarHBondContact N-OE2 2.84Å; T19-E22 PolarHBondContact N-OE2 3.22Å; T19-E22 PolarHBondContact O-N 3.06Å; T19-E22 WeakPolarHBondContact OG1-CB 3.4Å; T19-E22 WeakPolarHBondContact OG1-CG 3.06Å; T19-E22 PolarHBondContact OG1-N 3.39Å; T19-E22 VanDerWaalsContact OG1-N 3.13Å; T19-E22 PolarHBondContact OG1-OE2 2.93Å; E22-S25 PolarHBondContact O-N 2.95Å; E22-L26 WeakPolarHBondContact O-CB 3.31Å; E22-L26 PolarHBondContact O-N 3.11Å; E22-M47 HydrophobicContact CB-CE 4.23Å; E22-M47 HydrophobicContact CB-SD 4.27Å; E22-M47 HydrophobicContact CG-CE 4.05Å
23	V	64.1	Low	64.9	Low	9 Å²	9	49.9 Å²	49.9	6%	0.055	28%	0.277	C	S	.	.	H	α-helix	trans	-59.7	-48.2	174.4	172.9	0	0	0	0	110.9	I17 T19 E21 S25 L26 L27 V66 L69 L77	I17-V23 HydrophobicContact CG2-CG2 3.64Å; T19-V23 WeakPolarHBondContact O-CG2 3.43Å; T19-V23 PolarHBondContact O-N 3.21Å; E21-V23 VanDerWaalsContact C-N 3.35Å; V23-S25 VanDerWaalsContact C-N 3.29Å; V23-S25 PolarHBondContact O-N 3.05Å; V23-L26 PolarHBondContact O-N 2.94Å; V23-L27 HydrophobicContact CG1-CD1 4.2Å; V23-L27 WeakPolarHBondContact O-CG 3.4Å; V23-L27 PolarHBondContact O-N 3.03Å; V23-V66 HydrophobicContact CG2-CG1 3.87Å; V23-L69 HydrophobicContact CG1-CD1 4.04Å; V23-L69 HydrophobicContact CG1-CD2 3.73Å; V23-L69 HydrophobicContact CG1-CG 4.25Å; V23-L69 HydrophobicContact CG2-CD1 4.34Å; V23-L69 HydrophobicContact CG2-CD2 4.47Å; V23-L69 HydrophobicContact CG2-CG 4.33Å; V23-L77 HydrophobicContact CG1-CD1 4.19Å
24	A	67.3	Low	65.1	Low	45 Å²	45	52 Å²	52	37%	0.372	28%	0.282	S	S	.	.	H	α-helix	trans	-62	-38.8	178.9	0	0	0	0	0	111.7	S20 E21 L27 R28	S20-A24 VanDerWaalsContact O-CB 3.27Å; S20-A24 WeakPolarHBondContact O-CB 3.22Å; S20-A24 PolarHBondContact O-N 3.03Å; E21-A24 PolarHBondContact O-N 3.42Å; A24-L27 PolarHBondContact O-N 3.08Å; A24-R28 WeakPolarHBondContact O-CB 3.5Å; A24-R28 WeakPolarHBondContact O-CG 3.43Å; A24-R28 PolarHBondContact O-N 3.14Å
25	S	66.3	Low	65.2	Low	7 Å²	7	54.7 Å²	54.7	5%	0.049	28%	0.284	C	S	.	.	H	α-helix	trans	-66.7	-38.3	176.3	-59.7	0	0	0	0	111.9	E21 E22 V23 R28 F29	E21-S25 WeakPolarHBondContact O-CB 3.1Å; E21-S25 PolarHBondContact O-N 3.03Å; E21-S25 PolarHBondContact O-OG 3.08Å; E22-S25 PolarHBondContact O-N 2.95Å; V23-S25 VanDerWaalsContact C-N 3.29Å; V23-S25 PolarHBondContact O-N 3.05Å; S25-R28 PolarHBondContact O-N 3.05Å; S25-R28 PolarHBondContact OG-NH2 2.77Å; S25-F29 WeakPolarHBondContact O-CB 3.28Å; S25-F29 PolarHBondContact O-N 3.19Å
26	L	66.5	Low	64.8	Low	2 Å²	2	57.4 Å²	57.4	1%	0.01	30%	0.3	C	S	.	.	H	α-helix	trans	-69.9	-33.9	174.7	-163.8	59	0	0	0	112.8	I17 E22 V23 F29 I30 I51 L77 L81	I17-L26 HydrophobicContact CD1-CD2 3.53Å; E22-L26 WeakPolarHBondContact O-CB 3.31Å; E22-L26 PolarHBondContact O-N 3.11Å; V23-L26 PolarHBondContact O-N 2.94Å; L26-F29 HydrophobicContact CD1-CD1 4.15Å; L26-F29 WeakPolarHBondContact O-CB 3.45Å; L26-I30 WeakPolarHBondContact O-CD1 3.35Å; L26-I30 VanDerWaalsContact O-CG1 3.27Å; L26-I30 WeakPolarHBondContact O-CG1 2.96Å; L26-I30 PolarHBondContact O-N 3.31Å; L26-I51 HydrophobicContact CD1-CD1 3.84Å; L26-I51 HydrophobicContact CD2-CD1 4.33Å; L26-L77 HydrophobicContact CB-CD1 4.32Å; L26-L77 HydrophobicContact CD2-CD1 4.13Å; L26-L77 HydrophobicContact CD2-CD2 3.94Å; L26-L77 HydrophobicContact CD2-CG 4.38Å; L26-L77 HydrophobicContact CG-CD1 4.3Å; L26-L81 HydrophobicContact CD1-CD2 3.81Å; L26-L81 HydrophobicContact CD2-CD1 4Å; L26-L81 HydrophobicContact CD2-CD2 4.29Å; L26-L81 HydrophobicContact CG-CD2 4.06Å
27	L	69	Low	64.3	Low	69 Å²	69	56.2 Å²	56.2	36%	0.361	29%	0.294	S	S	.	.	H	α-helix	trans	-68.9	-41.6	170.9	-71.9	173.8	0	0	0	111.8	V23 A24 F29 I30 D31 L77	V23-L27 HydrophobicContact CG1-CD1 4.2Å; V23-L27 WeakPolarHBondContact O-CG 3.4Å; V23-L27 PolarHBondContact O-N 3.03Å; A24-L27 PolarHBondContact O-N 3.08Å; L27-F29 VanDerWaalsContact C-N 3.31Å; L27-F29 PolarHBondContact O-N 3.22Å; L27-I30 HydrophobicContact CD2-CD1 4.33Å; L27-I30 WeakPolarHBondContact O-CB 3.24Å; L27-I30 PolarHBondContact O-N 2.74Å; L27-D31 WeakPolarHBondContact O-CB 3.03Å; L27-D31 PolarHBondContact O-N 2.87Å; L27-L77 HydrophobicContact CD2-CB 4.13Å; L27-L77 HydrophobicContact CD2-CD1 3.76Å; L27-L77 HydrophobicContact CD2-CG 4.26Å; L27-L77 HydrophobicContact CG-CD1 3.89Å
28	R	65.6	Low	63.5	Low	122 Å²	122	59.6 Å²	59.6	46%	0.46	32%	0.315	S	S	.	.	H	α-helix	trans	-61.3	-41.1	174.3	-76.5	-171.7	-66.9	144.3	-0.8	111.5	A24 S25 D31 A32 D41 I44	A24-R28 WeakPolarHBondContact O-CB 3.5Å; A24-R28 WeakPolarHBondContact O-CG 3.43Å; A24-R28 PolarHBondContact O-N 3.14Å; S25-R28 PolarHBondContact O-N 3.05Å; S25-R28 PolarHBondContact OG-NH2 2.77Å; R28-D31 PolarHBondContact O-N 2.94Å; R28-A32 VanDerWaalsContact O-CB 3.26Å; R28-A32 WeakPolarHBondContact O-CB 3.26Å; R28-A32 PolarHBondContact O-N 3.37Å; R28-D41 IonicContact CZ-OD2 3.06Å; R28-D41 IonicContact NH1-OD2 2.92Å; R28-D41 PolarHBondContact NH1-OD2 3.43Å; R28-I44 HydrophobicContact CB-CD1 3.58Å
29	F	67.1	Low	62.8	Low	1 Å²	1	57.4 Å²	57.4	0%	0.004	30%	0.303	C	S	.	.	H	α-helix	trans	-56	-50.7	171	171.2	-109.1	0	0	0	112.1	S25 L26 L27 D31 A32 I33 I39 I44 V48 I84 M88	S25-F29 WeakPolarHBondContact O-CB 3.28Å; S25-F29 PolarHBondContact O-N 3.19Å; L26-F29 HydrophobicContact CD1-CD1 4.15Å; L26-F29 WeakPolarHBondContact O-CB 3.45Å; L27-F29 VanDerWaalsContact C-N 3.31Å; L27-F29 PolarHBondContact O-N 3.22Å; F29-D31 VanDerWaalsContact C-N 3.32Å; F29-D31 PolarHBondContact O-N 2.87Å; F29-A32 PolarHBondContact O-N 2.94Å; F29-I33 HydrophobicContact CD1-CD1 4.29Å; F29-I33 HydrophobicContact CD2-CD1 3.85Å; F29-I33 HydrophobicContact CD2-CG1 4.35Å; F29-I33 HydrophobicContact CE1-CD1 3.7Å; F29-I33 HydrophobicContact CE2-CD1 3.24Å; F29-I33 HydrophobicContact CE2-CG1 4.14Å; F29-I33 HydrophobicContact CG-CD1 4.37Å; F29-I33 HydrophobicContact CZ-CD1 3.14Å; F29-I33 HydrophobicContact CZ-CG1 4.38Å; F29-I33 PolarHBondContact O-N 2.79Å; F29-I39 HydrophobicContact CD2-CD1 3.54Å; F29-I39 HydrophobicContact CD2-CG1 4.17Å; F29-I39 HydrophobicContact CE2-CD1 3.25Å; F29-I39 HydrophobicContact CE2-CG1 4.23Å; F29-I39 HydrophobicContact CZ-CD1 4.47Å; F29-I44 HydrophobicContact CB-CG2 3.42Å; F29-I44 VanDerWaalsContact CB-CG2 3.42Å; F29-I44 HydrophobicContact CD2-CG2 3.58Å; F29-I44 HydrophobicContact CG-CG2 3.92Å; F29-V48 HydrophobicContact CB-CG2 4.46Å; F29-V48 HydrophobicContact CD1-CG2 3.91Å; F29-V48 HydrophobicContact CD2-CG2 3.43Å; F29-V48 VanDerWaalsContact CD2-CG2 3.43Å; F29-V48 HydrophobicContact CE1-CG1 4.41Å; F29-V48 HydrophobicContact CE1-CG2 3.87Å; F29-V48 HydrophobicContact CE2-CB 4.01Å; F29-V48 HydrophobicContact CE2-CG1 3.79Å; F29-V48 HydrophobicContact CE2-CG2 3.31Å; F29-V48 HydrophobicContact CG-CG2 3.68Å; F29-V48 HydrophobicContact CZ-CB 4.2Å; F29-V48 HydrophobicContact CZ-CG1 3.63Å; F29-V48 HydrophobicContact CZ-CG2 3.56Å; F29-I84 HydrophobicContact CD1-CD1 4.23Å; F29-I84 HydrophobicContact CE1-CD1 4Å; F29-I84 HydrophobicContact CE1-CG2 3.82Å; F29-I84 HydrophobicContact CZ-CG2 3.97Å; F29-M88 HydrophobicContact CZ-SD 4.18Å
30	I	66.8	Low	62.3	Low	6 Å²	6	61.4 Å²	61.4	3%	0.031	32%	0.322	C	S	.	.	H	α-helix	trans	-57.5	-49.1	179.5	-76.1	157.6	0	0	0	110.6	L26 L27 I33 Q34 L77 L81 I84	L26-I30 WeakPolarHBondContact O-CD1 3.35Å; L26-I30 VanDerWaalsContact O-CG1 3.27Å; L26-I30 WeakPolarHBondContact O-CG1 2.96Å; L26-I30 PolarHBondContact O-N 3.31Å; L27-I30 HydrophobicContact CD2-CD1 4.33Å; L27-I30 WeakPolarHBondContact O-CB 3.24Å; L27-I30 PolarHBondContact O-N 2.74Å; I30-I33 PolarHBondContact O-N 3.01Å; I30-Q34 HydrophobicContact CG2-CG 4.46Å; I30-Q34 WeakPolarHBondContact O-CB 3.47Å; I30-Q34 VanDerWaalsContact O-CG 3.29Å; I30-Q34 WeakPolarHBondContact O-CG 3.29Å; I30-Q34 PolarHBondContact O-N 2.95Å; I30-L77 HydrophobicContact CD1-CG 3.97Å; I30-L81 HydrophobicContact CD1-CD2 4.29Å; I30-L81 HydrophobicContact CD1-CG 4.23Å; I30-L81 HydrophobicContact CG1-CD2 4.4Å; I30-I84 HydrophobicContact CB-CD1 3.87Å; I30-I84 HydrophobicContact CG1-CD1 3.45Å; I30-I84 VanDerWaalsContact CG1-CD1 3.45Å; I30-I84 HydrophobicContact CG2-CD1 4.18Å
31	D	65.8	Low	61.7	Low	68 Å²	68	58.8 Å²	58.8	36%	0.364	30%	0.3	S	S	.	.	H	α-helix	trans	-63.5	-42.6	-179.1	-169.1	61.9	0	0	0	111.4	L27 R28 F29 Q34 K35	L27-D31 WeakPolarHBondContact O-CB 3.03Å; L27-D31 PolarHBondContact O-N 2.87Å; R28-D31 PolarHBondContact O-N 2.94Å; F29-D31 VanDerWaalsContact C-N 3.32Å; F29-D31 PolarHBondContact O-N 2.87Å; D31-Q34 PolarHBondContact O-N 3.31Å; D31-K35 VanDerWaalsContact O-CB 3.31Å; D31-K35 WeakPolarHBondContact O-CB 3.29Å; D31-K35 WeakPolarHBondContact O-CG 3.48Å; D31-K35 PolarHBondContact O-N 2.91Å; D31-K35 WeakPolarHBondContact OD1-CE 3.46Å; D31-K35 IonicContact OD1-NZ 2.74Å; D31-K35 PolarHBondContact OD1-NZ 3.2Å; D31-K35 IonicContact OD2-NZ 2.63Å; D31-K35 PolarHBondContact OD2-NZ 3.16Å
32	A	61	Low	60.9	Low	14 Å²	14	56.7 Å²	56.7	12%	0.116	30%	0.297	C	S	.	.	H	α-helix	trans	-63.1	-45.2	177.9	0	0	0	0	0	112.2	R28 F29 H36 G37	R28-A32 VanDerWaalsContact O-CB 3.26Å; R28-A32 WeakPolarHBondContact O-CB 3.26Å; R28-A32 PolarHBondContact O-N 3.37Å; F29-A32 PolarHBondContact O-N 2.94Å; A32-H36 WeakPolarHBondContact O-CA 3.48Å; A32-H36 WeakPolarHBondContact O-CB 3.26Å; A32-H36 PolarHBondContact O-N 3.4Å; A32-G37 PolarHBondContact O-N 3.45Å
33	I	57.6	Low	60.3	Low	18 Å²	18	58.4 Å²	58.4	9%	0.092	31%	0.314	C	S	.	.	H	α-helix	trans	-64.5	-46.2	175.3	-70.7	-178.8	0	0	0	110.9	F29 I30 K35 G37 I39 I84 M88 L92	F29-I33 HydrophobicContact CD1-CD1 4.29Å; F29-I33 HydrophobicContact CD2-CD1 3.85Å; F29-I33 HydrophobicContact CD2-CG1 4.35Å; F29-I33 HydrophobicContact CE1-CD1 3.7Å; F29-I33 HydrophobicContact CE2-CD1 3.24Å; F29-I33 HydrophobicContact CE2-CG1 4.14Å; F29-I33 HydrophobicContact CG-CD1 4.37Å; F29-I33 HydrophobicContact CZ-CD1 3.14Å; F29-I33 HydrophobicContact CZ-CG1 4.38Å; F29-I33 PolarHBondContact O-N 2.79Å; I30-I33 PolarHBondContact O-N 3.01Å; I33-K35 VanDerWaalsContact C-N 3.35Å; I33-K35 PolarHBondContact O-N 3.44Å; I33-G37 WeakPolarHBondContact O-CA 3.47Å; I33-G37 PolarHBondContact O-N 2.84Å; I33-I39 HydrophobicContact CD1-CD1 4.33Å; I33-I39 HydrophobicContact CG1-CD1 4.47Å; I33-I39 HydrophobicContact CG1-CG1 4.18Å; I33-I84 HydrophobicContact CB-CD1 4.32Å; I33-I84 HydrophobicContact CB-CG1 4.46Å; I33-I84 HydrophobicContact CD1-CD1 4.33Å; I33-I84 HydrophobicContact CD1-CG2 3.6Å; I33-I84 HydrophobicContact CG2-CD1 4.45Å; I33-I84 HydrophobicContact CG2-CG1 4.04Å; I33-I84 HydrophobicContact CG2-CG2 4.43Å; I33-M88 HydrophobicContact CD1-SD 4.46Å; I33-L92 HydrophobicContact CD1-CD2 3.55Å; I33-L92 HydrophobicContact CG1-CD2 4.05Å
34	Q	61	Low	59.8	Low	104 Å²	104	58.3 Å²	58.3	49%	0.486	31%	0.313	S	S	.	.	H	α-helix	trans	-64.7	-37.5	-177.7	-77	-178.6	-19.4	0	0	112.9	I30 D31	I30-Q34 HydrophobicContact CG2-CG 4.46Å; I30-Q34 WeakPolarHBondContact O-CB 3.47Å; I30-Q34 VanDerWaalsContact O-CG 3.29Å; I30-Q34 WeakPolarHBondContact O-CG 3.29Å; I30-Q34 PolarHBondContact O-N 2.95Å; D31-Q34 PolarHBondContact O-N 3.31Å
35	K	62.8	Low	59.1	Low	131 Å²	131	57.6 Å²	57.6	57%	0.57	31%	0.307	S	S	*	.	H	α-helix	trans	-88.3	-41.1	-177.5	-73.4	177.9	177.9	158.1	0	113.6	D31 I33	D31-K35 VanDerWaalsContact O-CB 3.31Å; D31-K35 WeakPolarHBondContact O-CB 3.29Å; D31-K35 WeakPolarHBondContact O-CG 3.48Å; D31-K35 PolarHBondContact O-N 2.91Å; D31-K35 WeakPolarHBondContact OD1-CE 3.46Å; D31-K35 IonicContact OD1-NZ 2.74Å; D31-K35 PolarHBondContact OD1-NZ 3.2Å; D31-K35 IonicContact OD2-NZ 2.63Å; D31-K35 PolarHBondContact OD2-NZ 3.16Å; I33-K35 VanDerWaalsContact C-N 3.35Å; I33-K35 PolarHBondContact O-N 3.44Å
36	H	56.1	Low	58.5	Low	136 Å²	136	62.2 Å²	62.2	63%	0.63	33%	0.331	S	S	*	.	H	α-helix	trans	-118.3	-21.2	-164.5	-56.5	-58.2	0	0	0	112.9	A32 V38	A32-H36 WeakPolarHBondContact O-CA 3.48Å; A32-H36 WeakPolarHBondContact O-CB 3.26Å; A32-H36 PolarHBondContact O-N 3.4Å; H36-V38 HydrophobicContact CB-CB 4.47Å; H36-V38 PolarHBondContact O-N 3.38Å
37	G	53.6	Low	58.3	Low	20 Å²	20	64.1 Å²	64.1	21%	0.206	34%	0.34	C	S	.	.	S	Bend	trans	61.3	16.3	-169.7	0	0	0	0	0	112.8	A32 I33 L92	A32-G37 PolarHBondContact O-N 3.45Å; I33-G37 WeakPolarHBondContact O-CA 3.47Å; I33-G37 PolarHBondContact O-N 2.84Å; G37-L92 WeakPolarHBondContact O-CD1 3.21Å
38	V	50	Low	58	Low	75 Å²	75	61.3 Å²	61.3	46%	0.455	33%	0.326	S	S	.	.			trans	-134.8	142	-176.5	-179.7	0	0	0	0	108.6	H36	H36-V38 HydrophobicContact CB-CB 4.47Å; H36-V38 PolarHBondContact O-N 3.38Å
39	I	51.7	Low	57.6	Low	25 Å²	25	56.8 Å²	56.8	13%	0.128	31%	0.311	C	S	.	.			trans	-114.1	112.9	170.6	-49.3	172.8	0	0	0	107.1	F29 I33 I44 A45 M96	F29-I39 HydrophobicContact CD2-CD1 3.54Å; F29-I39 HydrophobicContact CD2-CG1 4.17Å; F29-I39 HydrophobicContact CE2-CD1 3.25Å; F29-I39 HydrophobicContact CE2-CG1 4.23Å; F29-I39 HydrophobicContact CZ-CD1 4.47Å; I33-I39 HydrophobicContact CD1-CD1 4.33Å; I33-I39 HydrophobicContact CG1-CD1 4.47Å; I33-I39 HydrophobicContact CG1-CG1 4.18Å; I39-I44 HydrophobicContact CG2-CB 4.2Å; I39-I44 HydrophobicContact CG2-CG2 3.84Å; I39-A45 HydrophobicContact CG2-CB 4.26Å; I39-M96 HydrophobicContact CB-SD 4.25Å; I39-M96 HydrophobicContact CD1-SD 3.29Å; I39-M96 WeakPolarHBondContact CD1-SD 3.49Å; I39-M96 HydrophobicContact CG1-SD 3.83Å
40	D	55.9	Low	57.2	Low	148 Å²	148	59.2 Å²	59.2	79%	0.791	32%	0.324	S	S	*	.			trans	-99.8	-15.1	177	60.1	-13.4	0	0	0	112.9
41	D	53.1	Low	57.1	Low	44 Å²	44	59.1 Å²	59.1	24%	0.235	32%	0.323	C	S	.	.			trans	-88.6	109.8	176.8	-172.6	-35.2	0	0	0	111.2	R28 S43 I44 A45	R28-D41 IonicContact CZ-OD2 3.06Å; R28-D41 IonicContact NH1-OD2 2.92Å; R28-D41 PolarHBondContact NH1-OD2 3.43Å; D41-S43 VanDerWaalsContact C-N 3.29Å; D41-S43 PolarHBondContact O-N 3.44Å; D41-S43 WeakPolarHBondContact OD1-CA 3.02Å; D41-S43 VanDerWaalsContact OD1-CB 3.28Å; D41-S43 WeakPolarHBondContact OD1-CB 3.41Å; D41-S43 PolarHBondContact OD1-N 3.19Å; D41-I44 HydrophobicContact CB-CB 4.05Å; D41-I44 HydrophobicContact CB-CD1 3.79Å; D41-I44 HydrophobicContact CB-CG1 3.92Å; D41-I44 WeakPolarHBondContact O-CB 3.2Å; D41-I44 PolarHBondContact O-N 3.04Å; D41-I44 PolarHBondContact OD1-N 3.27Å; D41-A45 PolarHBondContact O-N 2.81Å
42	V	52.5	Low	56.8	Low	102 Å²	102	57.6 Å²	57.6	62%	0.618	31%	0.314	S	S	*	.	H	α-helix	trans	-60.3	-36	179.6	176.9	0	0	0	0	112.2	I44 A45 L46	V42-I44 VanDerWaalsContact C-N 3.29Å; V42-I44 PolarHBondContact O-N 2.86Å; V42-A45 PolarHBondContact O-N 3.26Å; V42-L46 HydrophobicContact CG1-CD1 3.95Å; V42-L46 HydrophobicContact CG1-CG 4.24Å; V42-L46 WeakPolarHBondContact O-CB 3.32Å; V42-L46 VanDerWaalsContact O-CG 3.32Å; V42-L46 WeakPolarHBondContact O-CG 3.44Å; V42-L46 PolarHBondContact O-N 3.02Å
43	S	51.7	Low	56.5	Low	80 Å²	80	58.9 Å²	58.9	56%	0.559	32%	0.324	S	S	*	.	H	α-helix	trans	-65.9	-37.3	179	-62.2	0	0	0	0	111.1	D41 M47	D41-S43 VanDerWaalsContact C-N 3.29Å; D41-S43 PolarHBondContact O-N 3.44Å; D41-S43 WeakPolarHBondContact OD1-CA 3.02Å; D41-S43 VanDerWaalsContact OD1-CB 3.28Å; D41-S43 WeakPolarHBondContact OD1-CB 3.41Å; D41-S43 PolarHBondContact OD1-N 3.19Å; S43-M47 WeakPolarHBondContact O-CB 3.29Å; S43-M47 PolarHBondContact O-N 3.32Å
44	I	55.3	Low	56.5	Low	8 Å²	8	59.6 Å²	59.6	4%	0.041	33%	0.33	C	S	.	.	H	α-helix	trans	-65	-48.5	173.5	-69.9	-178.9	0	0	0	111	R28 F29 I39 D41 V42 L46 M47 V48	R28-I44 HydrophobicContact CB-CD1 3.58Å; F29-I44 HydrophobicContact CB-CG2 3.42Å; F29-I44 VanDerWaalsContact CB-CG2 3.42Å; F29-I44 HydrophobicContact CD2-CG2 3.58Å; F29-I44 HydrophobicContact CG-CG2 3.92Å; I39-I44 HydrophobicContact CG2-CB 4.2Å; I39-I44 HydrophobicContact CG2-CG2 3.84Å; D41-I44 HydrophobicContact CB-CB 4.05Å; D41-I44 HydrophobicContact CB-CD1 3.79Å; D41-I44 HydrophobicContact CB-CG1 3.92Å; D41-I44 WeakPolarHBondContact O-CB 3.2Å; D41-I44 PolarHBondContact O-N 3.04Å; D41-I44 PolarHBondContact OD1-N 3.27Å; V42-I44 VanDerWaalsContact C-N 3.29Å; V42-I44 PolarHBondContact O-N 2.86Å; I44-L46 VanDerWaalsContact C-N 3.34Å; I44-L46 PolarHBondContact O-N 3.03Å; I44-M47 PolarHBondContact O-N 3.17Å; I44-V48 VanDerWaalsContact O-CG2 3.29Å; I44-V48 WeakPolarHBondContact O-CG2 3.46Å; I44-V48 PolarHBondContact O-N 2.97Å
45	A	52.4	Low	56.1	Low	30 Å²	30	54.9 Å²	54.9	25%	0.248	31%	0.308	C	S	.	.	H	α-helix	trans	-59.2	-44.5	179.6	0	0	0	0	0	111.9	I39 D41 V42 V48 L49	I39-A45 HydrophobicContact CG2-CB 4.26Å; D41-A45 PolarHBondContact O-N 2.81Å; V42-A45 PolarHBondContact O-N 3.26Å; A45-V48 PolarHBondContact O-N 2.9Å; A45-L49 WeakPolarHBondContact O-CG 3.22Å; A45-L49 PolarHBondContact O-N 3.34Å
46	L	53.9	Low	55.3	Low	104 Å²	104	51.7 Å²	51.7	55%	0.545	30%	0.302	S	S	.	.	H	α-helix	trans	-64.8	-39.6	177.3	-71.3	174.9	0	0	0	112.6	V42 I44 V48 L49 D50	V42-L46 HydrophobicContact CG1-CD1 3.95Å; V42-L46 HydrophobicContact CG1-CG 4.24Å; V42-L46 WeakPolarHBondContact O-CB 3.32Å; V42-L46 VanDerWaalsContact O-CG 3.32Å; V42-L46 WeakPolarHBondContact O-CG 3.44Å; V42-L46 PolarHBondContact O-N 3.02Å; I44-L46 VanDerWaalsContact C-N 3.34Å; I44-L46 PolarHBondContact O-N 3.03Å; L46-V48 VanDerWaalsContact C-N 3.31Å; L46-V48 PolarHBondContact O-N 3.21Å; L46-L49 HydrophobicContact CD2-CD1 4.45Å; L46-L49 PolarHBondContact O-N 2.9Å; L46-D50 VanDerWaalsContact O-CB 3.27Å; L46-D50 WeakPolarHBondContact O-CB 3.21Å; L46-D50 PolarHBondContact O-N 2.94Å
47	M	61.6	Low	55.2	Low	41 Å²	41	47 Å²	47	20%	0.202	29%	0.285	C	S	.	.	H	α-helix	trans	-62.4	-40.8	175.8	-175.8	-179.5	-61.9	0	0	111.6	E22 S43 I44 D50 I51	E22-M47 HydrophobicContact CB-CE 4.23Å; E22-M47 HydrophobicContact CB-SD 4.27Å; E22-M47 HydrophobicContact CG-CE 4.05Å; S43-M47 WeakPolarHBondContact O-CB 3.29Å; S43-M47 PolarHBondContact O-N 3.32Å; I44-M47 PolarHBondContact O-N 3.17Å; M47-D50 PolarHBondContact O-N 3.45Å; M47-I51 HydrophobicContact CG-CD1 4.48Å; M47-I51 WeakPolarHBondContact O-CG1 3.32Å; M47-I51 PolarHBondContact O-N 2.92Å
48	V	62.8	Low	55.2	Low	10 Å²	10	52.5 Å²	52.5	6%	0.061	32%	0.32	C	S	.	.	H	α-helix	trans	-68.6	-43.5	178.1	169.9	0	0	0	0	110.7	F29 I44 A45 L46 D50 I51 F52	F29-V48 HydrophobicContact CB-CG2 4.46Å; F29-V48 HydrophobicContact CD1-CG2 3.91Å; F29-V48 HydrophobicContact CD2-CG2 3.43Å; F29-V48 VanDerWaalsContact CD2-CG2 3.43Å; F29-V48 HydrophobicContact CE1-CG1 4.41Å; F29-V48 HydrophobicContact CE1-CG2 3.87Å; F29-V48 HydrophobicContact CE2-CB 4.01Å; F29-V48 HydrophobicContact CE2-CG1 3.79Å; F29-V48 HydrophobicContact CE2-CG2 3.31Å; F29-V48 HydrophobicContact CG-CG2 3.68Å; F29-V48 HydrophobicContact CZ-CB 4.2Å; F29-V48 HydrophobicContact CZ-CG1 3.63Å; F29-V48 HydrophobicContact CZ-CG2 3.56Å; I44-V48 VanDerWaalsContact O-CG2 3.29Å; I44-V48 WeakPolarHBondContact O-CG2 3.46Å; I44-V48 PolarHBondContact O-N 2.97Å; A45-V48 PolarHBondContact O-N 2.9Å; L46-V48 VanDerWaalsContact C-N 3.31Å; L46-V48 PolarHBondContact O-N 3.21Å; V48-D50 VanDerWaalsContact C-N 3.28Å; V48-D50 PolarHBondContact O-N 3.35Å; V48-I51 WeakPolarHBondContact O-CB 3.28Å; V48-I51 PolarHBondContact O-N 3.07Å; V48-F52 HydrophobicContact CG1-CD2 3.64Å; V48-F52 HydrophobicContact CG1-CE2 3.44Å; V48-F52 VanDerWaalsContact CG1-CE2 3.44Å; V48-F52 WeakPolarHBondContact O-CD2 3.46Å; V48-F52 PolarHBondContact O-N 3.17Å
49	L	56.7	Low	55.4	Low	27 Å²	27	50.2 Å²	50.2	14%	0.141	31%	0.307	C	S	.	.	H	α-helix	trans	-60.5	-37.7	172.8	-73.7	170.1	0	0	0	112.1	A45 L46 F52 A53 L101	A45-L49 WeakPolarHBondContact O-CG 3.22Å; A45-L49 PolarHBondContact O-N 3.34Å; L46-L49 HydrophobicContact CD2-CD1 4.45Å; L46-L49 PolarHBondContact O-N 2.9Å; L49-F52 CarbonylContact O-C 3.55Å; L49-F52 PolarHBondContact O-N 3.48Å; L49-A53 WeakPolarHBondContact O-CB 3.45Å; L49-A53 PolarHBondContact O-N 2.89Å; L49-L101 HydrophobicContact CD1-CD1 3.93Å; L49-L101 HydrophobicContact CD1-CD2 3.89Å
50	D	59.7	Low	55.5	Low	52 Å²	52	53 Å²	53	28%	0.278	33%	0.329	S	S	.	.	H	α-helix	trans	-68.3	-37.3	175.9	167.8	85.6	0	0	0	112.1	R15 L46 M47 V48 A53 C54	R15-D50 IonicContact CZ-OD1 2.87Å; R15-D50 IonicContact CZ-OD2 3.33Å; R15-D50 IonicContact NE-OD2 2.73Å; R15-D50 PolarHBondContact NE-OD2 3.36Å; R15-D50 IonicContact NH1-OD1 2.67Å; R15-D50 PolarHBondContact NH1-OD1 2.87Å; R15-D50 IonicContact NH1-OD2 3.49Å; R15-D50 PolarHBondContact NH1-OD2 3.41Å; R15-D50 IonicContact NH2-OD1 3.93Å; R15-D50 IonicContact NH2-OD2 3.52Å; R15-D50 PolarHBondContact NH2-OD2 3.31Å; L46-D50 VanDerWaalsContact O-CB 3.27Å; L46-D50 WeakPolarHBondContact O-CB 3.21Å; L46-D50 PolarHBondContact O-N 2.94Å; M47-D50 PolarHBondContact O-N 3.45Å; V48-D50 VanDerWaalsContact C-N 3.28Å; V48-D50 PolarHBondContact O-N 3.35Å; D50-A53 PolarHBondContact O-N 3.03Å; D50-C54 PolarHBondContact O-N 3.2Å; D50-C54 PolarHBondContact O-SG 3.39Å
51	I	64.1	Low	55.3	Low	5 Å²	5	46.3 Å²	46.3	3%	0.026	29%	0.294	C	S	.	.	H	α-helix	trans	-60.3	-47.9	168.4	-70.6	166.7	0	0	0	110.2	I17 L26 M47 V48 C54 F55 I64 F85	I17-I51 HydrophobicContact CD1-CD1 4.37Å; L26-I51 HydrophobicContact CD1-CD1 3.84Å; L26-I51 HydrophobicContact CD2-CD1 4.33Å; M47-I51 HydrophobicContact CG-CD1 4.48Å; M47-I51 WeakPolarHBondContact O-CG1 3.32Å; M47-I51 PolarHBondContact O-N 2.92Å; V48-I51 WeakPolarHBondContact O-CB 3.28Å; V48-I51 PolarHBondContact O-N 3.07Å; I51-C54 WeakPolarHBondContact O-CB 3.47Å; I51-C54 PolarHBondContact O-N 3.05Å; I51-F55 HydrophobicContact CG2-CD2 4.25Å; I51-F55 HydrophobicContact CG2-CE2 3.63Å; I51-F55 HydrophobicContact CG2-CZ 4.31Å; I51-F55 WeakPolarHBondContact O-CD2 3.41Å; I51-F55 WeakPolarHBondContact O-CG 3.32Å; I51-F55 PolarHBondContact O-N 3.21Å; I51-I64 HydrophobicContact CG2-CD1 3.43Å; I51-I64 VanDerWaalsContact CG2-CD1 3.43Å; I51-I64 HydrophobicContact CG2-CG1 4.26Å; I51-F85 HydrophobicContact CG2-CZ 4.39Å
52	F	60.2	Low	55.4	Low	36 Å²	36	44.4 Å²	44.4	16%	0.158	28%	0.284	C	S	.	.	H	α-helix	trans	-63.4	-38.8	175.5	-79.3	-66.5	0	0	0	113	V48 L49 C54 F55 S56 F85 M88 F93 V104	V48-F52 HydrophobicContact CG1-CD2 3.64Å; V48-F52 HydrophobicContact CG1-CE2 3.44Å; V48-F52 VanDerWaalsContact CG1-CE2 3.44Å; V48-F52 WeakPolarHBondContact O-CD2 3.46Å; V48-F52 PolarHBondContact O-N 3.17Å; L49-F52 CarbonylContact O-C 3.55Å; L49-F52 PolarHBondContact O-N 3.48Å; F52-C54 VanDerWaalsContact C-N 3.34Å; F52-C54 PolarHBondContact O-N 2.88Å; F52-F55 HydrophobicContact CD1-CD2 4.49Å; F52-F55 CarbonylContact O-C 3.45Å; F52-F55 VanDerWaalsContact O-CA 3.24Å; F52-F55 WeakPolarHBondContact O-CA 3.33Å; F52-F55 WeakPolarHBondContact O-CB 3.46Å; F52-F55 PolarHBondContact O-N 3.41Å; F52-S56 PolarHBondContact O-N 3.24Å; F52-S56 VanDerWaalsContact O-N 3.11Å; F52-F85 HydrophobicContact CD1-CE1 4.36Å; F52-F85 AromaticContact CE1-CD1 3.69Å; F52-F85 HydrophobicContact CE1-CD1 3.69Å; F52-F85 AromaticContact CE1-CE1 3.54Å; F52-F85 HydrophobicContact CE1-CE1 3.54Å; F52-F85 HydrophobicContact CE2-CD1 4.41Å; F52-F85 AromaticContact CE2-CE1 3.86Å; F52-F85 HydrophobicContact CE2-CE1 3.86Å; F52-F85 AromaticContact CZ-CD1 3.45Å; F52-F85 HydrophobicContact CZ-CD1 3.45Å; F52-F85 VanDerWaalsContact CZ-CD1 3.45Å; F52-F85 AromaticContact CZ-CE1 3.26Å; F52-F85 HydrophobicContact CZ-CE1 3.26Å; F52-M88 HydrophobicContact CE2-CE 3.6Å; F52-M88 HydrophobicContact CE2-SD 4.21Å; F52-M88 HydrophobicContact CZ-CE 3.58Å; F52-M88 HydrophobicContact CZ-SD 4Å; F52-F93 HydrophobicContact CE2-CZ 4.24Å; F52-F93 HydrophobicContact CZ-CZ 4.27Å; F52-V104 HydrophobicContact CB-CG1 4.4Å
53	A	54.2	Low	55.5	Low	40 Å²	40	40.3 Å²	40.3	33%	0.331	26%	0.259	S	S	.	.	H	α-helix	trans	-68.6	-35	179.1	0	0	0	0	0	111.2	L49 D50 F55 S56 V104	L49-A53 WeakPolarHBondContact O-CB 3.45Å; L49-A53 PolarHBondContact O-N 2.89Å; D50-A53 PolarHBondContact O-N 3.03Å; A53-F55 PolarHBondContact O-N 2.86Å; A53-S56 VanDerWaalsContact O-CB 3.26Å; A53-S56 WeakPolarHBondContact O-CB 3.33Å; A53-S56 PolarHBondContact O-N 2.98Å; A53-S56 PolarHBondContact O-OG 3.18Å; A53-V104 HydrophobicContact CB-CG1 4.34Å
54	C	56.7	Low	55.9	Low	34 Å²	34	36.6 Å²	36.6	23%	0.23	23%	0.233	C	C	.	.	H	α-helix	trans	-59.7	-26.6	168.6	-74.1	0	0	0	0	111.9	R15 D50 I51 F52	R15-C54 HydrophobicContact CB-CB 4.11Å; R15-C54 WeakPolarHBondContact CD-SG 3.05Å; D50-C54 PolarHBondContact O-N 3.2Å; D50-C54 PolarHBondContact O-SG 3.39Å; I51-C54 WeakPolarHBondContact O-CB 3.47Å; I51-C54 PolarHBondContact O-N 3.05Å; F52-C54 VanDerWaalsContact C-N 3.34Å; F52-C54 PolarHBondContact O-N 2.88Å
55	F	53	Low	56	Low	5 Å²	5	37 Å²	37	2%	0.022	24%	0.235	C	C	.	.	H	α-helix	trans	-82.5	-16.2	172.2	-55.9	-47.1	0	0	0	113.6	I51 F52 A53 S57 K62 I64 M108 F112	I51-F55 HydrophobicContact CG2-CD2 4.25Å; I51-F55 HydrophobicContact CG2-CE2 3.63Å; I51-F55 HydrophobicContact CG2-CZ 4.31Å; I51-F55 WeakPolarHBondContact O-CD2 3.41Å; I51-F55 WeakPolarHBondContact O-CG 3.32Å; I51-F55 PolarHBondContact O-N 3.21Å; F52-F55 HydrophobicContact CD1-CD2 4.49Å; F52-F55 CarbonylContact O-C 3.45Å; F52-F55 VanDerWaalsContact O-CA 3.24Å; F52-F55 WeakPolarHBondContact O-CA 3.33Å; F52-F55 WeakPolarHBondContact O-CB 3.46Å; F52-F55 PolarHBondContact O-N 3.41Å; A53-F55 PolarHBondContact O-N 2.86Å; F55-S57 PolarHBondContact O-N 2.71Å; F55-K62 HydrophobicContact CB-CD 3.94Å; F55-K62 HydrophobicContact CD1-CB 3.22Å; F55-K62 HydrophobicContact CD1-CD 3.78Å; F55-K62 HydrophobicContact CD1-CG 3.73Å; F55-K62 HydrophobicContact CE1-CB 3.46Å; F55-K62 VanDerWaalsContact CE1-CB 3.46Å; F55-K62 HydrophobicContact CE1-CG 4.45Å; F55-K62 HydrophobicContact CG-CB 4.43Å; F55-K62 HydrophobicContact CG-CD 4.32Å; F55-K62 WeakPolarHBondContact O-CD 3.37Å; F55-K62 WeakPolarHBondContact O-CE 3.4Å; F55-K62 PolarHBondContact O-NZ 3.46Å; F55-I64 HydrophobicContact CE1-CD1 4.46Å; F55-I64 HydrophobicContact CE1-CG1 4.06Å; F55-I64 HydrophobicContact CE2-CD1 3.86Å; F55-I64 HydrophobicContact CE2-CG1 4.31Å; F55-I64 HydrophobicContact CZ-CD1 3.44Å; F55-I64 VanDerWaalsContact CZ-CD1 3.44Å; F55-I64 HydrophobicContact CZ-CG1 3.49Å; F55-I64 VanDerWaalsContact CZ-CG1 3.49Å; F55-M108 VanDerWaalsContact C-SD 3.58Å; F55-M108 HydrophobicContact CB-CE 3.45Å; F55-M108 VanDerWaalsContact CB-CE 3.45Å; F55-M108 HydrophobicContact CB-SD 3.43Å; F55-M108 WeakPolarHBondContact CB-SD 3.32Å; F55-M108 WeakPolarHBondContact O-CE 3.23Å; F55-F112 HydrophobicContact CE1-CB 4.23Å; F55-F112 HydrophobicContact CZ-CB 4.14Å
56	S	46.6	Very low	56.3	Low	63 Å²	63	35.6 Å²	35.6	44%	0.441	22%	0.224	S	C	.	.			trans	-60.2	-14.3	-177.2	69.7	0	0	0	0	115.6	F52 A53	F52-S56 PolarHBondContact O-N 3.24Å; F52-S56 VanDerWaalsContact O-N 3.11Å; A53-S56 VanDerWaalsContact O-CB 3.26Å; A53-S56 WeakPolarHBondContact O-CB 3.33Å; A53-S56 PolarHBondContact O-N 2.98Å; A53-S56 PolarHBondContact O-OG 3.18Å
57	S	53.9	Low	56.2	Low	38 Å²	38	34 Å²	34	27%	0.266	21%	0.212	S	C	.	.	S	Bend	trans	-63	148.9	175.3	68.5	0	0	0	0	112.7	P13 F55 S59 K62	P13-S57 WeakPolarHBondContact CG-OG 3.29Å; F55-S57 PolarHBondContact O-N 2.71Å; S57-S59 PolarHBondContact O-N 3.27Å; S57-S59 PolarHBondContact OG-OG 3.31Å; S57-K62 WeakPolarHBondContact O-CE 3.13Å; S57-K62 PolarHBondContact O-NZ 2.84Å; S57-K62 WeakPolarHBondContact OG-CE 3.21Å
58	S	53.6	Low	55.8	Low	135 Å²	135	35.6 Å²	35.6	94%	0.944	23%	0.225	S	C	*	.	S	Bend	trans	-67	7.8	175.8	56	0	0	0	0	114.8
59	S	54.5	Low	55.3	Low	27 Å²	27	36.4 Å²	36.4	19%	0.189	23%	0.229	C	C	.	.			trans	-70.3	134.9	-179.9	64.5	0	0	0	0	111.7	P13 S57 S61 K62	P13-S59 VanDerWaalsContact CD-OG 3.26Å; P13-S59 WeakPolarHBondContact CD-OG 3.27Å; P13-S59 WeakPolarHBondContact CG-OG 3.34Å; S57-S59 PolarHBondContact O-N 3.27Å; S57-S59 PolarHBondContact OG-OG 3.31Å; S59-S61 PolarHBondContact O-N 2.88Å; S59-K62 WeakPolarHBondContact O-CE 3.34Å; S59-K62 PolarHBondContact O-NZ 3.2Å; S59-K62 WeakPolarHBondContact OG-CE 3.31Å; S59-K62 WeakPolarHBondContact OG-CG 3.33Å
60	S	53.7	Low	55.5	Low	83 Å²	83	39.1 Å²	39.1	58%	0.58	24%	0.243	S	C	*	.	S	Bend	trans	-68.6	-19.6	179.9	57.8	0	0	0	0	113.3	G110 S111	S60-G110 WeakPolarHBondContact O-CA 3.48Å; S60-S111 PolarHBondContact O-N 3Å
61	S	50.6	Low	55.3	Low	9 Å²	9	39.7 Å²	39.7	6%	0.063	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.6	116.9	-177.6	-163.9	0	0	0	0	111.2	G12 S59 S111 R113	G12-S61 VanDerWaalsContact CA-O 3.23Å; G12-S61 WeakPolarHBondContact CA-O 3.46Å; S59-S61 PolarHBondContact O-N 2.88Å; S61-S111 WeakPolarHBondContact CA-O 3.39Å; S61-R113 PolarHBondContact OG-NE 3.17Å; S61-R113 VanDerWaalsContact OG-NE 3.08Å; S61-R113 PolarHBondContact OG-NH1 3.47Å; S61-R113 PolarHBondContact OG-NH2 2.9Å
62	K	55.2	Low	55.2	Low	3 Å²	3	45.4 Å²	45.4	1%	0.013	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	154.4	173.9	-63.9	120.5	-177.4	175	0	110.9	P13 F55 S57 S59 M108 S111 R113	P13-K62 HydrophobicContact CG-CG 4.34Å; F55-K62 HydrophobicContact CB-CD 3.94Å; F55-K62 HydrophobicContact CD1-CB 3.22Å; F55-K62 HydrophobicContact CD1-CD 3.78Å; F55-K62 HydrophobicContact CD1-CG 3.73Å; F55-K62 HydrophobicContact CE1-CB 3.46Å; F55-K62 VanDerWaalsContact CE1-CB 3.46Å; F55-K62 HydrophobicContact CE1-CG 4.45Å; F55-K62 HydrophobicContact CG-CB 4.43Å; F55-K62 HydrophobicContact CG-CD 4.32Å; F55-K62 WeakPolarHBondContact O-CD 3.37Å; F55-K62 WeakPolarHBondContact O-CE 3.4Å; F55-K62 PolarHBondContact O-NZ 3.46Å; S57-K62 WeakPolarHBondContact O-CE 3.13Å; S57-K62 PolarHBondContact O-NZ 2.84Å; S57-K62 WeakPolarHBondContact OG-CE 3.21Å; S59-K62 WeakPolarHBondContact O-CE 3.34Å; S59-K62 PolarHBondContact O-NZ 3.2Å; S59-K62 WeakPolarHBondContact OG-CE 3.31Å; S59-K62 WeakPolarHBondContact OG-CG 3.33Å; K62-M108 HydrophobicContact CD-SD 4.25Å; K62-M108 PolarHBondContact NZ-SD 3.28Å; K62-S111 PolarHBondContact N-O 3.11Å; K62-R113 PolarHBondContact O-N 3.04Å
63	T	55.6	Low	55.1	Low	17 Å²	17	46 Å²	46	10%	0.104	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.6	124.3	-175	-44.2	0	0	0	0	111.7	P13 S14 R15 V65 R113 A115	P13-T63 PolarHBondContact O-N 2.86Å; S14-T63 WeakPolarHBondContact CA-O 3.3Å; S14-T63 WeakPolarHBondContact CB-O 2.91Å; R15-T63 PolarHBondContact N-O 2.98Å; T63-V65 HydrophobicContact CG2-CG2 4.09Å; T63-R113 VanDerWaalsContact CA-O 3.26Å; T63-R113 WeakPolarHBondContact CA-O 3.34Å; T63-R113 HydrophobicContact CG2-CB 4.23Å; T63-R113 PolarHBondContact OG1-NE 2.88Å; T63-A115 HydrophobicContact CG2-CB 4.14Å
64	I	59.1	Low	55	Low	1 Å²	1	44.1 Å²	44.1	1%	0.005	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.2	128.7	162.7	-61.9	167.1	0	0	0	107.2	R15 I17 I51 F55 V66 R113 I114 A115	R15-I64 WeakPolarHBondContact O-CA 3.2Å; I17-I64 HydrophobicContact CD1-CG2 3.99Å; I17-I64 HydrophobicContact CG1-CG2 4.29Å; I51-I64 HydrophobicContact CG2-CD1 3.43Å; I51-I64 VanDerWaalsContact CG2-CD1 3.43Å; I51-I64 HydrophobicContact CG2-CG1 4.26Å; F55-I64 HydrophobicContact CE1-CD1 4.46Å; F55-I64 HydrophobicContact CE1-CG1 4.06Å; F55-I64 HydrophobicContact CE2-CD1 3.86Å; F55-I64 HydrophobicContact CE2-CG1 4.31Å; F55-I64 HydrophobicContact CZ-CD1 3.44Å; F55-I64 VanDerWaalsContact CZ-CD1 3.44Å; F55-I64 HydrophobicContact CZ-CG1 3.49Å; F55-I64 VanDerWaalsContact CZ-CG1 3.49Å; I64-V66 HydrophobicContact CG2-CG2 4.08Å; I64-R113 PolarHBondContact N-O 3.26Å; I64-I114 HydrophobicContact CB-CG2 4.13Å; I64-I114 WeakPolarHBondContact O-CG2 3.47Å; I64-A115 PolarHBondContact O-N 2.84Å
65	V	57.8	Low	54.9	Low	16 Å²	16	44.7 Å²	44.7	10%	0.097	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	109.1	174.6	-176.6	0	0	0	0	108.4	R15 S16 I17 T63 K67 A115 P123	R15-V65 PolarHBondContact O-N 3.24Å; S16-V65 CarbonylContact C-O 3.52Å; S16-V65 WeakPolarHBondContact CA-O 3.43Å; I17-V65 PolarHBondContact N-O 2.89Å; T63-V65 HydrophobicContact CG2-CG2 4.09Å; V65-K67 HydrophobicContact CG1-CG 4.06Å; V65-A115 WeakPolarHBondContact CA-O 3.14Å; V65-P123 HydrophobicContact CG1-CB 4.34Å; V65-P123 HydrophobicContact CG1-CG 4.14Å; V65-P123 HydrophobicContact CG2-CG 4.49Å
66	V	58.4	Low	55.3	Low	2 Å²	2	46.3 Å²	46.3	1%	0.012	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.6	111.4	172.7	-164.9	0	0	0	0	108.2	I17 V23 I64 L69 L77 A115 A116 S117	I17-V66 HydrophobicContact CB-CG1 4.22Å; I17-V66 HydrophobicContact CD1-CG2 4.27Å; I17-V66 HydrophobicContact CG2-CG1 4.17Å; V23-V66 HydrophobicContact CG2-CG1 3.87Å; I64-V66 HydrophobicContact CG2-CG2 4.08Å; V66-L69 HydrophobicContact CB-CD1 4.29Å; V66-L69 HydrophobicContact CG1-CD1 3.38Å; V66-L69 HydrophobicContact CG1-CG 3.95Å; V66-L77 HydrophobicContact CG2-CD2 4.26Å; V66-A115 PolarHBondContact N-O 3.32Å; V66-A115 VanDerWaalsContact N-O 3.11Å; V66-A116 WeakPolarHBondContact O-CA 3.26Å; V66-S117 PolarHBondContact O-N 3.38Å
67	K	52.8	Low	55.8	Low	69 Å²	69	43.4 Å²	43.4	30%	0.3	28%	0.275	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.6	153.4	177.1	-57.1	-155.6	-163.6	107.9	0	109.1	I17 D18 V65 L69 S117	I17-K67 PolarHBondContact O-N 3.04Å; D18-K67 WeakPolarHBondContact OD1-CD 3.49Å; D18-K67 WeakPolarHBondContact OD1-CE 3.43Å; D18-K67 VanDerWaalsContact OD1-CG 3.31Å; D18-K67 WeakPolarHBondContact OD1-CG 3.12Å; D18-K67 IonicContact OD1-NZ 2.67Å; D18-K67 PolarHBondContact OD1-NZ 2.86Å; D18-K67 IonicContact OD2-NZ 3.03Å; D18-K67 PolarHBondContact OD2-NZ 2.74Å; V65-K67 HydrophobicContact CG1-CG 4.06Å; K67-L69 PolarHBondContact O-N 2.85Å; K67-S117 WeakPolarHBondContact CA-O 3.32Å
68	T	53.7	Low	55.9	Low	76 Å²	76	42.2 Å²	42.2	47%	0.466	27%	0.266	S	S	.	.	S	Bend	trans	73	13	169.1	70.6	0	0	0	0	118	S117	T68-S117 PolarHBondContact N-O 3.05Å
69	L	52.2	Low	56.2	Low	27 Å²	27	39.5 Å²	39.5	14%	0.141	25%	0.247	C	C	.	.			trans	-91.7	147.4	170.6	-75.4	178.4	0	0	0	112.8	V23 V66 K67 T73 A74	V23-L69 HydrophobicContact CG1-CD1 4.04Å; V23-L69 HydrophobicContact CG1-CD2 3.73Å; V23-L69 HydrophobicContact CG1-CG 4.25Å; V23-L69 HydrophobicContact CG2-CD1 4.34Å; V23-L69 HydrophobicContact CG2-CD2 4.47Å; V23-L69 HydrophobicContact CG2-CG 4.33Å; V66-L69 HydrophobicContact CB-CD1 4.29Å; V66-L69 HydrophobicContact CG1-CD1 3.38Å; V66-L69 HydrophobicContact CG1-CG 3.95Å; K67-L69 PolarHBondContact O-N 2.85Å; L69-T73 HydrophobicContact CD1-CG2 4.23Å; L69-T73 HydrophobicContact CD2-CG2 3.5Å; L69-T73 HydrophobicContact CG-CG2 4.41Å; L69-A74 HydrophobicContact CB-CB 4.05Å; L69-A74 HydrophobicContact CD1-CB 4.26Å
70	D	60.4	Low	56.6	Low	83 Å²	83	39.3 Å²	39.3	44%	0.444	25%	0.246	S	C	.	.			trans	-64	156.4	157.6	60.2	68.3	0	0	0	110.3	D72 T73 A74	D70-D72 PolarHBondContact O-N 3.3Å; D70-D72 PolarHBondContact OD1-N 3.41Å; D70-T73 VanDerWaalsContact CG-OG1 3.27Å; D70-T73 PolarHBondContact O-N 3.37Å; D70-T73 WeakPolarHBondContact OD1-CB 3.47Å; D70-T73 PolarHBondContact OD1-N 2.81Å; D70-T73 PolarHBondContact OD1-OG1 3.47Å; D70-T73 PolarHBondContact OD2-OG1 3.39Å; D70-T73 VanDerWaalsContact OD2-OG1 3.11Å; D70-A74 WeakPolarHBondContact O-CB 3.34Å; D70-A74 PolarHBondContact O-N 2.85Å
71	S	55.5	Low	57	Low	64 Å²	64	35.4 Å²	35.4	45%	0.448	22%	0.218	S	C	.	.	H	α-helix	trans	-59.8	-31.3	-173.1	46.2	0	0	0	0	113.2	S75	S71-S75 VanDerWaalsContact O-CB 3.31Å; S71-S75 WeakPolarHBondContact O-CB 3.43Å; S71-S75 PolarHBondContact O-N 3.21Å; S71-S75 PolarHBondContact O-OG 3.33Å
72	D	61.2	Low	57.3	Low	125 Å²	125	35.9 Å²	35.9	67%	0.668	22%	0.222	S	C	*	.	H	α-helix	trans	-79.4	-44.8	-172.5	-60	-12.2	0	0	0	109.6	D70 S75 G76	D70-D72 PolarHBondContact O-N 3.3Å; D70-D72 PolarHBondContact OD1-N 3.41Å; D72-S75 PolarHBondContact O-N 2.9Å; D72-G76 PolarHBondContact O-N 2.69Å
73	T	58	Low	57.4	Low	49 Å²	49	41 Å²	41	30%	0.301	25%	0.247	S	C	.	.	H	α-helix	trans	-63.9	-42.1	174.2	-55.3	0	0	0	0	111.2	L69 D70 G76 L77	L69-T73 HydrophobicContact CD1-CG2 4.23Å; L69-T73 HydrophobicContact CD2-CG2 3.5Å; L69-T73 HydrophobicContact CG-CG2 4.41Å; D70-T73 VanDerWaalsContact CG-OG1 3.27Å; D70-T73 PolarHBondContact O-N 3.37Å; D70-T73 WeakPolarHBondContact OD1-CB 3.47Å; D70-T73 PolarHBondContact OD1-N 2.81Å; D70-T73 PolarHBondContact OD1-OG1 3.47Å; D70-T73 PolarHBondContact OD2-OG1 3.39Å; D70-T73 VanDerWaalsContact OD2-OG1 3.11Å; T73-G76 PolarHBondContact O-N 3.07Å; T73-L77 VanDerWaalsContact O-CB 3.3Å; T73-L77 WeakPolarHBondContact O-CB 3.27Å; T73-L77 PolarHBondContact O-N 2.79Å
74	A	53.6	Low	57.5	Low	1 Å²	1	40.2 Å²	40.2	1%	0.008	24%	0.242	C	C	.	.	H	α-helix	trans	-56.7	-57.1	171.3	0	0	0	0	0	109.4	L69 D70 G76 L77 L78 A116	L69-A74 HydrophobicContact CB-CB 4.05Å; L69-A74 HydrophobicContact CD1-CB 4.26Å; D70-A74 WeakPolarHBondContact O-CB 3.34Å; D70-A74 PolarHBondContact O-N 2.85Å; A74-G76 VanDerWaalsContact C-N 3.29Å; A74-G76 PolarHBondContact O-N 3.28Å; A74-L77 PolarHBondContact O-N 3.46Å; A74-L78 HydrophobicContact CB-CD1 4.47Å; A74-L78 WeakPolarHBondContact O-CB 3.32Å; A74-L78 WeakPolarHBondContact O-CD1 3.27Å; A74-L78 WeakPolarHBondContact O-CG 3.41Å; A74-L78 PolarHBondContact O-N 3.34Å; A74-A116 HydrophobicContact CB-CB 3.88Å
75	S	53.8	Low	57.4	Low	45 Å²	45	42 Å²	42	32%	0.315	25%	0.25	S	C	.	.	H	α-helix	trans	-56.7	-38.8	-177.9	-59.2	0	0	0	0	113.8	S71 D72 S79	S71-S75 VanDerWaalsContact O-CB 3.31Å; S71-S75 WeakPolarHBondContact O-CB 3.43Å; S71-S75 PolarHBondContact O-N 3.21Å; S71-S75 PolarHBondContact O-OG 3.33Å; D72-S75 PolarHBondContact O-N 2.9Å; S75-S79 WeakPolarHBondContact O-CB 3.22Å; S75-S79 PolarHBondContact O-N 2.93Å; S75-S79 PolarHBondContact O-OG 3.47Å
76	G	60.5	Low	57.1	Low	39 Å²	39	49.1 Å²	49.1	40%	0.402	28%	0.275	S	S	.	.	H	α-helix	trans	-64.9	-51.6	175.6	0	0	0	0	0	112.5	D72 T73 A74 L78 S79 S80	D72-G76 PolarHBondContact O-N 2.69Å; T73-G76 PolarHBondContact O-N 3.07Å; A74-G76 VanDerWaalsContact C-N 3.29Å; A74-G76 PolarHBondContact O-N 3.28Å; G76-L78 PolarHBondContact O-N 2.75Å; G76-S79 PolarHBondContact O-N 3.11Å; G76-S80 PolarHBondContact O-N 2.92Å; G76-S80 PolarHBondContact O-OG 3.35Å
77	L	57.8	Low	56.8	Low	2 Å²	2	53.3 Å²	53.3	1%	0.01	30%	0.301	C	S	.	.	H	α-helix	trans	-57.8	-41.1	176.6	-177.7	141.4	0	0	0	111.3	V23 L26 L27 I30 V66 T73 A74 S80 L81	V23-L77 HydrophobicContact CG1-CD1 4.19Å; L26-L77 HydrophobicContact CB-CD1 4.32Å; L26-L77 HydrophobicContact CD2-CD1 4.13Å; L26-L77 HydrophobicContact CD2-CD2 3.94Å; L26-L77 HydrophobicContact CD2-CG 4.38Å; L26-L77 HydrophobicContact CG-CD1 4.3Å; L27-L77 HydrophobicContact CD2-CB 4.13Å; L27-L77 HydrophobicContact CD2-CD1 3.76Å; L27-L77 HydrophobicContact CD2-CG 4.26Å; L27-L77 HydrophobicContact CG-CD1 3.89Å; I30-L77 HydrophobicContact CD1-CG 3.97Å; V66-L77 HydrophobicContact CG2-CD2 4.26Å; T73-L77 VanDerWaalsContact O-CB 3.3Å; T73-L77 WeakPolarHBondContact O-CB 3.27Å; T73-L77 PolarHBondContact O-N 2.79Å; A74-L77 PolarHBondContact O-N 3.46Å; L77-S80 PolarHBondContact O-N 3.37Å; L77-L81 HydrophobicContact CD2-CD1 3.58Å; L77-L81 HydrophobicContact CD2-CG 4.26Å; L77-L81 HydrophobicContact CG-CD1 4.43Å; L77-L81 WeakPolarHBondContact O-CG 3.4Å; L77-L81 PolarHBondContact O-N 3.11Å
78	L	56.3	Low	56.8	Low	14 Å²	14	50.6 Å²	50.6	7%	0.073	29%	0.289	C	S	.	.	H	α-helix	trans	-65.4	-44.7	179.2	-65.9	174.1	0	0	0	113	A74 G76 S80 L81 S82 I114 F126	A74-L78 HydrophobicContact CB-CD1 4.47Å; A74-L78 WeakPolarHBondContact O-CB 3.32Å; A74-L78 WeakPolarHBondContact O-CD1 3.27Å; A74-L78 WeakPolarHBondContact O-CG 3.41Å; A74-L78 PolarHBondContact O-N 3.34Å; G76-L78 PolarHBondContact O-N 2.75Å; L78-S80 VanDerWaalsContact C-N 3.27Å; L78-S80 PolarHBondContact O-N 3.18Å; L78-L81 PolarHBondContact O-N 3.28Å; L78-S82 VanDerWaalsContact O-CB 3.29Å; L78-S82 WeakPolarHBondContact O-CB 3.11Å; L78-S82 PolarHBondContact O-N 2.87Å; L78-I114 HydrophobicContact CD2-CB 3.51Å; L78-I114 HydrophobicContact CD2-CD1 3.68Å; L78-I114 HydrophobicContact CD2-CG1 4.18Å; L78-I114 HydrophobicContact CD2-CG2 2.98Å; L78-I114 HydrophobicContact CG-CG2 4.39Å; L78-F126 HydrophobicContact CD1-CB 3.48Å; L78-F126 VanDerWaalsContact CD1-CB 3.48Å; L78-F126 HydrophobicContact CD1-CD1 4.07Å; L78-F126 HydrophobicContact CD1-CD2 3.85Å; L78-F126 HydrophobicContact CD1-CG 3.51Å
79	S	60.4	Low	56.6	Low	78 Å²	78	51.8 Å²	51.8	55%	0.545	29%	0.292	S	S	.	.	H	α-helix	trans	-63	-38.9	177.4	-60.4	0	0	0	0	110.9	S75 G76 S82 M83	S75-S79 WeakPolarHBondContact O-CB 3.22Å; S75-S79 PolarHBondContact O-N 2.93Å; S75-S79 PolarHBondContact O-OG 3.47Å; G76-S79 PolarHBondContact O-N 3.11Å; S79-S82 WeakPolarHBondContact O-CB 3.21Å; S79-M83 WeakPolarHBondContact O-CB 2.97Å; S79-M83 PolarHBondContact O-N 3.01Å
80	S	62.9	Low	56.2	Low	23 Å²	23	55.3 Å²	55.3	16%	0.161	31%	0.308	C	S	.	.	H	α-helix	trans	-70.2	-45.5	177.4	-65.8	0	0	0	0	113.1	G76 L77 L78 S82 M83 I84	G76-S80 PolarHBondContact O-N 2.92Å; G76-S80 PolarHBondContact O-OG 3.35Å; L77-S80 PolarHBondContact O-N 3.37Å; L78-S80 VanDerWaalsContact C-N 3.27Å; L78-S80 PolarHBondContact O-N 3.18Å; S80-S82 VanDerWaalsContact C-N 3.3Å; S80-S82 PolarHBondContact O-N 3.49Å; S80-M83 WeakPolarHBondContact O-CB 3.44Å; S80-M83 PolarHBondContact O-N 3.38Å; S80-M83 VanDerWaalsContact O-N 3.16Å; S80-I84 WeakPolarHBondContact O-CB 3.3Å; S80-I84 VanDerWaalsContact O-CG1 3.26Å; S80-I84 WeakPolarHBondContact O-CG1 3.18Å; S80-I84 PolarHBondContact O-N 2.92Å
81	L	61	Low	55.5	Low	1 Å²	1	57.6 Å²	57.6	1%	0.005	31%	0.314	C	S	.	.	H	α-helix	trans	-58.8	-44.1	174.1	-74.3	175.5	0	0	0	111.6	L26 I30 L77 L78 M83 I84 F85	L26-L81 HydrophobicContact CD1-CD2 3.81Å; L26-L81 HydrophobicContact CD2-CD1 4Å; L26-L81 HydrophobicContact CD2-CD2 4.29Å; L26-L81 HydrophobicContact CG-CD2 4.06Å; I30-L81 HydrophobicContact CD1-CD2 4.29Å; I30-L81 HydrophobicContact CD1-CG 4.23Å; I30-L81 HydrophobicContact CG1-CD2 4.4Å; L77-L81 HydrophobicContact CD2-CD1 3.58Å; L77-L81 HydrophobicContact CD2-CG 4.26Å; L77-L81 HydrophobicContact CG-CD1 4.43Å; L77-L81 WeakPolarHBondContact O-CG 3.4Å; L77-L81 PolarHBondContact O-N 3.11Å; L78-L81 PolarHBondContact O-N 3.28Å; L81-M83 VanDerWaalsContact C-N 3.31Å; L81-M83 PolarHBondContact O-N 2.63Å; L81-I84 PolarHBondContact O-N 2.72Å; L81-F85 HydrophobicContact CB-CD2 4.16Å; L81-F85 HydrophobicContact CB-CE2 3.9Å; L81-F85 HydrophobicContact CD2-CE2 4.21Å; L81-F85 HydrophobicContact CD2-CZ 4.34Å; L81-F85 HydrophobicContact CG-CE2 4.48Å; L81-F85 WeakPolarHBondContact O-CB 3.24Å; L81-F85 WeakPolarHBondContact O-CD2 3.44Å; L81-F85 WeakPolarHBondContact O-CG 3.45Å; L81-F85 PolarHBondContact O-N 2.94Å
82	S	57.2	Low	55.1	Low	19 Å²	19	55.2 Å²	55.2	13%	0.133	30%	0.297	C	S	.	.	H	α-helix	trans	-56.4	-46.1	175	177.7	0	0	0	0	111.9	L78 S79 S80 R86 L129	L78-S82 VanDerWaalsContact O-CB 3.29Å; L78-S82 WeakPolarHBondContact O-CB 3.11Å; L78-S82 PolarHBondContact O-N 2.87Å; S79-S82 WeakPolarHBondContact O-CB 3.21Å; S80-S82 VanDerWaalsContact C-N 3.3Å; S80-S82 PolarHBondContact O-N 3.49Å; S82-R86 VanDerWaalsContact O-CG 3.24Å; S82-R86 WeakPolarHBondContact O-CG 3.05Å; S82-R86 PolarHBondContact O-N 3.27Å; S82-R86 VanDerWaalsContact O-N 3.17Å; S82-L129 VanDerWaalsContact CB-CD1 3.4Å; S82-L129 VanDerWaalsContact OG-CD1 3.22Å; S82-L129 WeakPolarHBondContact OG-CD1 3.26Å; S82-L129 WeakPolarHBondContact OG-CD2 3.44Å
83	M	57.7	Low	54.3	Low	109 Å²	109	52.5 Å²	52.5	54%	0.537	28%	0.279	S	S	.	.	H	α-helix	trans	-62.8	-47.7	176.8	-172.6	-179.8	-68.4	0	0	111.1	S79 S80 L81 R86 T87	S79-M83 WeakPolarHBondContact O-CB 2.97Å; S79-M83 PolarHBondContact O-N 3.01Å; S80-M83 WeakPolarHBondContact O-CB 3.44Å; S80-M83 PolarHBondContact O-N 3.38Å; S80-M83 VanDerWaalsContact O-N 3.16Å; L81-M83 VanDerWaalsContact C-N 3.31Å; L81-M83 PolarHBondContact O-N 2.63Å; M83-R86 WeakPolarHBondContact O-CB 3.39Å; M83-R86 PolarHBondContact O-N 3.2Å; M83-R86 VanDerWaalsContact O-N 3.14Å; M83-T87 WeakPolarHBondContact O-CG2 3.35Å; M83-T87 PolarHBondContact O-N 2.69Å; M83-T87 PolarHBondContact O-OG1 2.71Å; M83-T87 VanDerWaalsContact O-OG1 3.08Å
84	I	58.1	Low	53.6	Low	2 Å²	2	56.8 Å²	56.8	1%	0.01	30%	0.296	C	S	.	.	H	α-helix	trans	-61.7	-49.3	-179.6	-70.3	168.9	0	0	0	111.2	F29 I30 I33 S80 L81 R86 T87 M88	F29-I84 HydrophobicContact CD1-CD1 4.23Å; F29-I84 HydrophobicContact CE1-CD1 4Å; F29-I84 HydrophobicContact CE1-CG2 3.82Å; F29-I84 HydrophobicContact CZ-CG2 3.97Å; I30-I84 HydrophobicContact CB-CD1 3.87Å; I30-I84 HydrophobicContact CG1-CD1 3.45Å; I30-I84 VanDerWaalsContact CG1-CD1 3.45Å; I30-I84 HydrophobicContact CG2-CD1 4.18Å; I33-I84 HydrophobicContact CB-CD1 4.32Å; I33-I84 HydrophobicContact CB-CG1 4.46Å; I33-I84 HydrophobicContact CD1-CD1 4.33Å; I33-I84 HydrophobicContact CD1-CG2 3.6Å; I33-I84 HydrophobicContact CG2-CD1 4.45Å; I33-I84 HydrophobicContact CG2-CG1 4.04Å; I33-I84 HydrophobicContact CG2-CG2 4.43Å; S80-I84 WeakPolarHBondContact O-CB 3.3Å; S80-I84 VanDerWaalsContact O-CG1 3.26Å; S80-I84 WeakPolarHBondContact O-CG1 3.18Å; S80-I84 PolarHBondContact O-N 2.92Å; L81-I84 PolarHBondContact O-N 2.72Å; I84-R86 PolarHBondContact O-N 3.24Å; I84-T87 WeakPolarHBondContact CA-OG1 2.99Å; I84-T87 CarbonylContact O-C 3.42Å; I84-T87 PolarHBondContact O-N 3.06Å; I84-T87 PolarHBondContact O-OG1 2.95Å; I84-T87 VanDerWaalsContact O-OG1 3.11Å; I84-M88 HydrophobicContact CG2-CG 3.72Å; I84-M88 HydrophobicContact CG2-SD 3.48Å; I84-M88 WeakPolarHBondContact CG2-SD 3.5Å; I84-M88 WeakPolarHBondContact O-CB 2.82Å; I84-M88 WeakPolarHBondContact O-CG 3.15Å; I84-M88 PolarHBondContact O-N 2.85Å
85	F	55.7	Low	53.2	Low	38 Å²	38	61.7 Å²	61.7	17%	0.167	32%	0.318	C	S	.	.	H	α-helix	trans	-62.6	-25.6	178.2	-68.4	-48.5	0	0	0	112.6	I51 F52 L81 F112	I51-F85 HydrophobicContact CG2-CZ 4.39Å; F52-F85 HydrophobicContact CD1-CE1 4.36Å; F52-F85 AromaticContact CE1-CD1 3.69Å; F52-F85 HydrophobicContact CE1-CD1 3.69Å; F52-F85 AromaticContact CE1-CE1 3.54Å; F52-F85 HydrophobicContact CE1-CE1 3.54Å; F52-F85 HydrophobicContact CE2-CD1 4.41Å; F52-F85 AromaticContact CE2-CE1 3.86Å; F52-F85 HydrophobicContact CE2-CE1 3.86Å; F52-F85 AromaticContact CZ-CD1 3.45Å; F52-F85 HydrophobicContact CZ-CD1 3.45Å; F52-F85 VanDerWaalsContact CZ-CD1 3.45Å; F52-F85 AromaticContact CZ-CE1 3.26Å; F52-F85 HydrophobicContact CZ-CE1 3.26Å; L81-F85 HydrophobicContact CB-CD2 4.16Å; L81-F85 HydrophobicContact CB-CE2 3.9Å; L81-F85 HydrophobicContact CD2-CE2 4.21Å; L81-F85 HydrophobicContact CD2-CZ 4.34Å; L81-F85 HydrophobicContact CG-CE2 4.48Å; L81-F85 WeakPolarHBondContact O-CB 3.24Å; L81-F85 WeakPolarHBondContact O-CD2 3.44Å; L81-F85 WeakPolarHBondContact O-CG 3.45Å; L81-F85 PolarHBondContact O-N 2.94Å; F85-F112 HydrophobicContact CB-CE1 4.47Å; F85-F112 HydrophobicContact CB-CZ 4.17Å; F85-F112 HydrophobicContact CD2-CE1 4.37Å; F85-F112 AromaticContact CD2-CE2 3.89Å; F85-F112 HydrophobicContact CD2-CE2 3.89Å; F85-F112 AromaticContact CD2-CZ 3.61Å; F85-F112 HydrophobicContact CD2-CZ 3.61Å; F85-F112 HydrophobicContact CE2-CE2 4.31Å; F85-F112 HydrophobicContact CE2-CZ 4.43Å; F85-F112 HydrophobicContact CG-CZ 4.25Å
86	R	52.7	Low	52.6	Low	166 Å²	166	61.6 Å²	61.6	63%	0.626	31%	0.313	S	S	*	.	H	α-helix	trans	-79	-33	172.1	-72.3	173.1	-176.8	-170.5	1.9	113.1	S82 M83 I84 L129	S82-R86 VanDerWaalsContact O-CG 3.24Å; S82-R86 WeakPolarHBondContact O-CG 3.05Å; S82-R86 PolarHBondContact O-N 3.27Å; S82-R86 VanDerWaalsContact O-N 3.17Å; M83-R86 WeakPolarHBondContact O-CB 3.39Å; M83-R86 PolarHBondContact O-N 3.2Å; M83-R86 VanDerWaalsContact O-N 3.14Å; I84-R86 PolarHBondContact O-N 3.24Å; R86-L129 VanDerWaalsContact NH2-CD2 3.28Å
87	T	51.7	Low	51.5	Low	90 Å²	90	62.7 Å²	62.7	55%	0.552	33%	0.325	S	S	*	.	H	α-helix	trans	-90.3	-16.7	-179	52.8	0	0	0	0	113.6	M83 I84 D89	M83-T87 WeakPolarHBondContact O-CG2 3.35Å; M83-T87 PolarHBondContact O-N 2.69Å; M83-T87 PolarHBondContact O-OG1 2.71Å; M83-T87 VanDerWaalsContact O-OG1 3.08Å; I84-T87 WeakPolarHBondContact CA-OG1 2.99Å; I84-T87 CarbonylContact O-C 3.42Å; I84-T87 PolarHBondContact O-N 3.06Å; I84-T87 PolarHBondContact O-OG1 2.95Å; I84-T87 VanDerWaalsContact O-OG1 3.11Å; T87-D89 PolarHBondContact O-N 2.83Å
88	M	52.1	Low	50.3	Low	11 Å²	11	64 Å²	64	5%	0.054	33%	0.333	C	S	.	.			trans	-70.3	9	179.7	-89	-171.3	62.9	0	0	114.5	F29 I33 F52 I84 E90 L92 F93	F29-M88 HydrophobicContact CZ-SD 4.18Å; I33-M88 HydrophobicContact CD1-SD 4.46Å; F52-M88 HydrophobicContact CE2-CE 3.6Å; F52-M88 HydrophobicContact CE2-SD 4.21Å; F52-M88 HydrophobicContact CZ-CE 3.58Å; F52-M88 HydrophobicContact CZ-SD 4Å; I84-M88 HydrophobicContact CG2-CG 3.72Å; I84-M88 HydrophobicContact CG2-SD 3.48Å; I84-M88 WeakPolarHBondContact CG2-SD 3.5Å; I84-M88 WeakPolarHBondContact O-CB 2.82Å; I84-M88 WeakPolarHBondContact O-CG 3.15Å; I84-M88 PolarHBondContact O-N 2.85Å; M88-E90 PolarHBondContact O-N 2.89Å; M88-L92 HydrophobicContact CE-CD2 4.23Å; M88-L92 HydrophobicContact CG-CB 4.41Å; M88-L92 HydrophobicContact CG-CD2 3.55Å; M88-L92 HydrophobicContact SD-CD2 4.01Å; M88-F93 HydrophobicContact CB-CE2 4.43Å; M88-F93 HydrophobicContact CE-CD2 4.17Å; M88-F93 HydrophobicContact CE-CE1 3.75Å; M88-F93 HydrophobicContact CE-CE2 3.31Å; M88-F93 HydrophobicContact CE-CZ 3.07Å
89	D	48.9	Very low	49.3	Very low	101 Å²	101	67 Å²	67	54%	0.54	36%	0.359	S	S	.	.	S	Bend	trans	-59.3	104.1	174.6	-126.7	3.2	0	0	0	108.7	T87 K91 V134	T87-D89 PolarHBondContact O-N 2.83Å; D89-K91 VanDerWaalsContact C-N 3.28Å; D89-K91 PolarHBondContact O-N 2.92Å; D89-V134 WeakPolarHBondContact OD1-CG2 3.44Å
90	E	44.2	Very low	47.7	Very low	102 Å²	102	70.7 Å²	70.7	48%	0.477	37%	0.373	S	S	.	.	S	Bend	trans	61.4	-58.7	170.3	-63	177.2	162	0	0	117.8	M88 L92 F93 E94 V134	M88-E90 PolarHBondContact O-N 2.89Å; E90-L92 VanDerWaalsContact C-N 3.31Å; E90-L92 PolarHBondContact O-N 3.46Å; E90-F93 PolarHBondContact O-N 3.25Å; E90-E94 PolarHBondContact O-N 3.33Å; E90-E94 VanDerWaalsContact O-N 3.08Å; E90-V134 HydrophobicContact CG-CG1 3.63Å; E90-V134 HydrophobicContact CG-CG2 4.34Å; E90-V134 WeakPolarHBondContact OE1-CG1 3.38Å
91	K	46.3	Very low	46	Very low	131 Å²	131	73.1 Å²	73.1	57%	0.57	38%	0.384	S	S	*	.	H	α-helix	trans	-60.8	-37.7	-166.6	-166.9	168.1	-172	-85.6	0	113	D89 E94 E95	D89-K91 VanDerWaalsContact C-N 3.28Å; D89-K91 PolarHBondContact O-N 2.92Å; K91-E94 PolarHBondContact O-N 2.79Å; K91-E95 WeakPolarHBondContact CE-OE1 3.26Å; K91-E95 HydrophobicContact CG-CG 4.27Å; K91-E95 IonicContact NZ-OE1 2.88Å; K91-E95 PolarHBondContact NZ-OE1 3.26Å; K91-E95 VanDerWaalsContact O-CB 3.22Å; K91-E95 WeakPolarHBondContact O-CB 3.44Å; K91-E95 WeakPolarHBondContact O-CG 3.23Å; K91-E95 PolarHBondContact O-N 3.13Å
92	L	46	Very low	44.3	Very low	14 Å²	14	78.1 Å²	78.1	7%	0.073	42%	0.417	C	S	.	.	H	α-helix	trans	-67.6	-39.9	177.9	-165.7	78.8	0	0	0	111.5	I33 G37 M88 E90 E94 E95 M96	I33-L92 HydrophobicContact CD1-CD2 3.55Å; I33-L92 HydrophobicContact CG1-CD2 4.05Å; G37-L92 WeakPolarHBondContact O-CD1 3.21Å; M88-L92 HydrophobicContact CE-CD2 4.23Å; M88-L92 HydrophobicContact CG-CB 4.41Å; M88-L92 HydrophobicContact CG-CD2 3.55Å; M88-L92 HydrophobicContact SD-CD2 4.01Å; E90-L92 VanDerWaalsContact C-N 3.31Å; E90-L92 PolarHBondContact O-N 3.46Å; L92-E94 VanDerWaalsContact C-N 3.35Å; L92-E95 PolarHBondContact O-N 3.29Å; L92-M96 HydrophobicContact CD2-CE 4.33Å; L92-M96 HydrophobicContact CD2-SD 4.22Å; L92-M96 HydrophobicContact CG-CE 4.23Å; L92-M96 HydrophobicContact CG-CG 4.25Å; L92-M96 HydrophobicContact CG-SD 4.13Å; L92-M96 VanDerWaalsContact O-CB 3.28Å; L92-M96 WeakPolarHBondContact O-CB 2.96Å; L92-M96 WeakPolarHBondContact O-CG 3.02Å; L92-M96 PolarHBondContact O-N 3.08Å
93	F	44.9	Very low	42.9	Very low	67 Å²	67	80.8 Å²	80.8	29%	0.294	43%	0.432	S	S	.	.	H	α-helix	trans	-67.9	-38.1	178.8	-71.8	-77.6	0	0	0	111.8	F52 M88 E90 M96 V98	F52-F93 HydrophobicContact CE2-CZ 4.24Å; F52-F93 HydrophobicContact CZ-CZ 4.27Å; M88-F93 HydrophobicContact CB-CE2 4.43Å; M88-F93 HydrophobicContact CE-CD2 4.17Å; M88-F93 HydrophobicContact CE-CE1 3.75Å; M88-F93 HydrophobicContact CE-CE2 3.31Å; M88-F93 HydrophobicContact CE-CZ 3.07Å; E90-F93 PolarHBondContact O-N 3.25Å; F93-M96 HydrophobicContact CD1-CE 3.69Å; F93-M96 HydrophobicContact CE1-CE 4.18Å; F93-M96 HydrophobicContact CG-CE 4.22Å; F93-V98 HydrophobicContact CD1-CG1 3.96Å; F93-V98 WeakPolarHBondContact O-CB 3.4Å; F93-V98 PolarHBondContact O-N 3.06Å
94	E	44.5	Very low	41.5	Very low	140 Å²	140	77.9 Å²	77.9	65%	0.654	42%	0.42	S	S	*	.	H	α-helix	trans	-64.4	-49.1	172.1	-67.6	-177	168.2	0	0	111.5	E90 K91 L92 M96 G97	E90-E94 PolarHBondContact O-N 3.33Å; E90-E94 VanDerWaalsContact O-N 3.08Å; K91-E94 PolarHBondContact O-N 2.79Å; L92-E94 VanDerWaalsContact C-N 3.35Å; E94-M96 VanDerWaalsContact C-N 3.32Å; E94-M96 PolarHBondContact O-N 2.9Å; E94-G97 PolarHBondContact O-N 2.9Å
95	E	44.6	Very low	40.1	Very low	103 Å²	103	81 Å²	81	48%	0.481	45%	0.446	S	S	.	.	H	α-helix	trans	-66.1	-30.4	-179.3	-75.7	177	170.4	0	0	113.2	K91 L92 G97	K91-E95 WeakPolarHBondContact CE-OE1 3.26Å; K91-E95 HydrophobicContact CG-CG 4.27Å; K91-E95 IonicContact NZ-OE1 2.88Å; K91-E95 PolarHBondContact NZ-OE1 3.26Å; K91-E95 VanDerWaalsContact O-CB 3.22Å; K91-E95 WeakPolarHBondContact O-CB 3.44Å; K91-E95 WeakPolarHBondContact O-CG 3.23Å; K91-E95 PolarHBondContact O-N 3.13Å; L92-E95 PolarHBondContact O-N 3.29Å; E95-G97 PolarHBondContact O-N 3.35Å
96	M	41.7	Very low	38.8	Very low	43 Å²	43	85.5 Å²	85.5	21%	0.212	47%	0.467	C	S	.	.	T	Hydrogen-bonded Turn	trans	-71.7	-2.8	174	-72.9	-174.9	-52.4	0	0	113.3	I39 L92 F93 E94 V98	I39-M96 HydrophobicContact CB-SD 4.25Å; I39-M96 HydrophobicContact CD1-SD 3.29Å; I39-M96 WeakPolarHBondContact CD1-SD 3.49Å; I39-M96 HydrophobicContact CG1-SD 3.83Å; L92-M96 HydrophobicContact CD2-CE 4.33Å; L92-M96 HydrophobicContact CD2-SD 4.22Å; L92-M96 HydrophobicContact CG-CE 4.23Å; L92-M96 HydrophobicContact CG-CG 4.25Å; L92-M96 HydrophobicContact CG-SD 4.13Å; L92-M96 VanDerWaalsContact O-CB 3.28Å; L92-M96 WeakPolarHBondContact O-CB 2.96Å; L92-M96 WeakPolarHBondContact O-CG 3.02Å; L92-M96 PolarHBondContact O-N 3.08Å; F93-M96 HydrophobicContact CD1-CE 3.69Å; F93-M96 HydrophobicContact CE1-CE 4.18Å; F93-M96 HydrophobicContact CG-CE 4.22Å; E94-M96 VanDerWaalsContact C-N 3.32Å; E94-M96 PolarHBondContact O-N 2.9Å; M96-V98 HydrophobicContact CB-CB 4.09Å; M96-V98 HydrophobicContact CB-CG2 3.51Å; M96-V98 HydrophobicContact CE-CB 4.49Å; M96-V98 HydrophobicContact CE-CG2 4.2Å; M96-V98 PolarHBondContact O-N 3.22Å
97	G	36	Very low	38	Very low	62 Å²	62	82.9 Å²	82.9	64%	0.639	47%	0.469	S	S	*	.	T	Hydrogen-bonded Turn	trans	65.6	19	-174.6	0	0	0	0	0	112.7	E94 E95 A99	E94-G97 PolarHBondContact O-N 2.9Å; E95-G97 PolarHBondContact O-N 3.35Å; G97-A99 PolarHBondContact O-N 2.99Å
98	V	34.2	Very low	37.2	Very low	30 Å²	30	79.7 Å²	79.7	18%	0.182	45%	0.449	C	S	.	.	G	3₁₀ helix	trans	-85	10	-173.7	164.1	0	0	0	0	111.4	F93 M96 N100 L101	F93-V98 HydrophobicContact CD1-CG1 3.96Å; F93-V98 WeakPolarHBondContact O-CB 3.4Å; F93-V98 PolarHBondContact O-N 3.06Å; M96-V98 HydrophobicContact CB-CB 4.09Å; M96-V98 HydrophobicContact CB-CG2 3.51Å; M96-V98 HydrophobicContact CE-CB 4.49Å; M96-V98 HydrophobicContact CE-CG2 4.2Å; M96-V98 PolarHBondContact O-N 3.22Å; V98-N100 PolarHBondContact O-N 3.02Å; V98-L101 HydrophobicContact CB-CD1 4.07Å; V98-L101 HydrophobicContact CG1-CB 3.93Å; V98-L101 HydrophobicContact CG1-CD1 3.52Å; V98-L101 HydrophobicContact CG1-CG 4.32Å; V98-L101 HydrophobicContact CG2-CD1 3.81Å; V98-L101 PolarHBondContact O-N 2.88Å
99	A	33.9	Very low	36.5	Very low	77 Å²	77	84.2 Å²	84.2	64%	0.636	48%	0.481	S	S	*	.	G	3₁₀ helix	trans	-53.3	-22.7	179.5	0	0	0	0	0	114.6	G97	G97-A99 PolarHBondContact O-N 2.99Å
100	N	26.5	Very low	36.5	Very low	156 Å²	156	80.6 Å²	80.6	83%	0.834	47%	0.468	S	S	*	.	G	3₁₀ helix	trans	-107.8	2.8	-179.4	-71.6	-29.5	0	0	0	114.9	V98	V98-N100 PolarHBondContact O-N 3.02Å
101	L	27	Very low	36.7	Very low	74 Å²	74	76.1 Å²	76.1	39%	0.387	45%	0.448	S	S	.	.	S	Bend	trans	-71.2	124.5	166.6	-90.7	144.9	0	0	0	106.8	L49 V98 V103	L49-L101 HydrophobicContact CD1-CD1 3.93Å; L49-L101 HydrophobicContact CD1-CD2 3.89Å; V98-L101 HydrophobicContact CB-CD1 4.07Å; V98-L101 HydrophobicContact CG1-CB 3.93Å; V98-L101 HydrophobicContact CG1-CD1 3.52Å; V98-L101 HydrophobicContact CG1-CG 4.32Å; V98-L101 HydrophobicContact CG2-CD1 3.81Å; V98-L101 PolarHBondContact O-N 2.88Å; L101-V103 PolarHBondContact O-N 3.06Å
102	P	26.3	Very low	36.9	Very low	106 Å²	106	70.1 Å²	70.1	69%	0.688	42%	0.422	S	S	*	.			trans	-54.1	107.4	-175.5	20.2	-31.5	0	0	0	108.3	V104	P102-V104 VanDerWaalsContact C-N 3.27Å; P102-V104 WeakPolarHBondContact O-CG2 3.14Å; P102-V104 PolarHBondContact O-N 2.92Å
103	V	27.4	Very low	37.1	Very low	75 Å²	75	70.9 Å²	70.9	46%	0.455	42%	0.424	S	S	.	.			trans	-11.9	78.9	176.7	-174.1	0	0	0	0	112.2	L101 A105 H106	L101-V103 PolarHBondContact O-N 3.06Å; V103-A105 HydrophobicContact CG1-CB 3.98Å; V103-A105 PolarHBondContact O-N 2.73Å; V103-H106 PolarHBondContact O-N 2.89Å
104	V	27.7	Very low	37.2	Very low	48 Å²	48	67.9 Å²	67.9	29%	0.291	41%	0.411	S	S	.	.			trans	-76	-0.3	170	-170.2	0	0	0	0	109.4	F52 A53 P102 H106	F52-V104 HydrophobicContact CB-CG1 4.4Å; A53-V104 HydrophobicContact CB-CG1 4.34Å; P102-V104 VanDerWaalsContact C-N 3.27Å; P102-V104 WeakPolarHBondContact O-CG2 3.14Å; P102-V104 PolarHBondContact O-N 2.92Å; V104-H106 PolarHBondContact O-N 2.89Å
105	A	29.2	Very low	37.4	Very low	67 Å²	67	61.5 Å²	61.5	55%	0.554	38%	0.382	S	S	*	.			trans	-71	41.5	157.2	0	0	0	0	0	111.6	V103 V107	V103-A105 HydrophobicContact CG1-CB 3.98Å; V103-A105 PolarHBondContact O-N 2.73Å; A105-V107 PolarHBondContact O-N 3.39Å
106	H	29.3	Very low	37.4	Very low	132 Å²	132	57.2 Å²	57.2	61%	0.611	36%	0.364	S	S	*	.			trans	-72.2	87.8	163.8	-139.8	-72.5	0	0	0	107.6	V103 V104	V103-H106 PolarHBondContact O-N 2.89Å; V104-H106 PolarHBondContact O-N 2.89Å
107	V	35.2	Very low	37.3	Very low	111 Å²	111	55.7 Å²	55.7	67%	0.673	36%	0.358	S	S	*	.			trans	44.1	100.6	142.5	-168.9	0	0	0	0	115.2	A105	A105-V107 PolarHBondContact O-N 3.39Å
108	M	35.8	Very low	37.7	Very low	23 Å²	23	59.2 Å²	59.2	11%	0.113	36%	0.356	C	S	.	.			trans	-128.2	93.8	169.8	-60.4	-173.6	-148.2	0	0	112.3	F55 K62 G110 L131	F55-M108 VanDerWaalsContact C-SD 3.58Å; F55-M108 HydrophobicContact CB-CE 3.45Å; F55-M108 VanDerWaalsContact CB-CE 3.45Å; F55-M108 HydrophobicContact CB-SD 3.43Å; F55-M108 WeakPolarHBondContact CB-SD 3.32Å; F55-M108 WeakPolarHBondContact O-CE 3.23Å; K62-M108 HydrophobicContact CD-SD 4.25Å; K62-M108 PolarHBondContact NZ-SD 3.28Å; M108-G110 PolarHBondContact O-N 2.87Å; M108-L131 HydrophobicContact CB-CB 3.89Å; M108-L131 HydrophobicContact CB-CD1 3.68Å; M108-L131 HydrophobicContact CB-CG 4.26Å; M108-L131 HydrophobicContact CG-CD1 4.32Å; M108-L131 WeakPolarHBondContact O-CB 3.41Å; M108-L131 HydrophobicContact SD-CD1 3.72Å
109	S	37.5	Very low	38.4	Very low	106 Å²	106	68.9 Å²	68.9	74%	0.741	39%	0.389	S	S	*	.			trans	-72.2	108.2	149.4	56.9	0	0	0	0	107.6
110	G	47.6	Very low	38.9	Very low	26 Å²	26	69.4 Å²	69.4	27%	0.268	40%	0.402	S	S	.	.	E	Extended strand (participates in β ladder)	trans	171.6	-165.4	178.6	0	0	0	0	0	113.4	S60 M108 L131	S60-G110 WeakPolarHBondContact O-CA 3.48Å; M108-G110 PolarHBondContact O-N 2.87Å; G110-L131 PolarHBondContact O-N 3.02Å
111	S	48.7	Very low	39.8	Very low	7 Å²	7	65.6 Å²	65.6	5%	0.049	39%	0.385	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.8	135.3	176.2	57.4	0	0	0	0	110.1	S60 S61 K62 R128 L129	S60-S111 PolarHBondContact O-N 3Å; S61-S111 WeakPolarHBondContact CA-O 3.39Å; K62-S111 PolarHBondContact N-O 3.11Å; S111-R128 VanDerWaalsContact OG-CZ 3.23Å; S111-R128 PolarHBondContact OG-NE 2.66Å; S111-R128 PolarHBondContact OG-NH2 2.68Å; S111-L129 CarbonylContact C-O 3.57Å; S111-L129 WeakPolarHBondContact CA-O 3.26Å; S111-L129 WeakPolarHBondContact CB-O 3.35Å
112	F	51.4	Low	41	Very low	6 Å²	6	67 Å²	67	3%	0.026	40%	0.4	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.1	133.5	165.9	66.3	-85.1	0	0	0	109.4	F55 F85 I114 R128 L129 L131	F55-F112 HydrophobicContact CE1-CB 4.23Å; F55-F112 HydrophobicContact CZ-CB 4.14Å; F85-F112 HydrophobicContact CB-CE1 4.47Å; F85-F112 HydrophobicContact CB-CZ 4.17Å; F85-F112 HydrophobicContact CD2-CE1 4.37Å; F85-F112 AromaticContact CD2-CE2 3.89Å; F85-F112 HydrophobicContact CD2-CE2 3.89Å; F85-F112 AromaticContact CD2-CZ 3.61Å; F85-F112 HydrophobicContact CD2-CZ 3.61Å; F85-F112 HydrophobicContact CE2-CE2 4.31Å; F85-F112 HydrophobicContact CE2-CZ 4.43Å; F85-F112 HydrophobicContact CG-CZ 4.25Å; F112-I114 HydrophobicContact CD2-CD1 3.88Å; F112-I114 HydrophobicContact CD2-CG1 3.65Å; F112-I114 HydrophobicContact CE2-CD1 3.6Å; F112-I114 HydrophobicContact CE2-CG1 3.94Å; F112-R128 CarbonylContact O-C 3.6Å; F112-R128 VanDerWaalsContact O-CA 3.32Å; F112-R128 WeakPolarHBondContact O-CA 3.49Å; F112-L129 HydrophobicContact CD1-CB 3.54Å; F112-L129 VanDerWaalsContact CD1-O 3.3Å; F112-L129 WeakPolarHBondContact CD1-O 3.33Å; F112-L129 HydrophobicContact CD2-CB 3.98Å; F112-L129 HydrophobicContact CD2-CD1 4.11Å; F112-L129 HydrophobicContact CE1-CB 3.08Å; F112-L129 HydrophobicContact CE1-CD1 4.12Å; F112-L129 HydrophobicContact CE1-CG 4.15Å; F112-L129 HydrophobicContact CE2-CB 3.57Å; F112-L129 HydrophobicContact CE2-CD1 3.15Å; F112-L129 HydrophobicContact CE2-CG 3.93Å; F112-L129 HydrophobicContact CG-CB 4Å; F112-L129 HydrophobicContact CZ-CB 3.12Å; F112-L129 HydrophobicContact CZ-CD1 3.18Å; F112-L129 HydrophobicContact CZ-CG 3.68Å; F112-L129 PolarHBondContact N-O 2.88Å; F112-L129 PolarHBondContact O-N 3.16Å; F112-L131 HydrophobicContact CD1-CD2 3.83Å; F112-L131 HydrophobicContact CD1-CG 3.97Å; F112-L131 HydrophobicContact CE1-CD2 4.32Å
113	R	50.5	Low	42.3	Very low	29 Å²	29	65.2 Å²	65.2	11%	0.109	39%	0.389	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.6	142.7	167.9	-66	-175.9	-63.5	-133.9	-0.5	107.3	Q10 S61 K62 T63 I64 G127 R128	Q10-R113 PolarHBondContact O-NH2 3.34Å; S61-R113 PolarHBondContact OG-NE 3.17Å; S61-R113 VanDerWaalsContact OG-NE 3.08Å; S61-R113 PolarHBondContact OG-NH1 3.47Å; S61-R113 PolarHBondContact OG-NH2 2.9Å; K62-R113 PolarHBondContact O-N 3.04Å; T63-R113 VanDerWaalsContact CA-O 3.26Å; T63-R113 WeakPolarHBondContact CA-O 3.34Å; T63-R113 HydrophobicContact CG2-CB 4.23Å; T63-R113 PolarHBondContact OG1-NE 2.88Å; I64-R113 PolarHBondContact N-O 3.26Å; R113-G127 WeakPolarHBondContact CA-O 3.31Å; R113-R128 HydrophobicContact CG-CG 4.26Å
114	I	46.7	Very low	43.4	Very low	4 Å²	4	65.9 Å²	65.9	2%	0.021	39%	0.393	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	130.9	168.9	-38.6	171.2	0	0	0	109.8	I64 L78 F112 F126 G127 L129	I64-I114 HydrophobicContact CB-CG2 4.13Å; I64-I114 WeakPolarHBondContact O-CG2 3.47Å; L78-I114 HydrophobicContact CD2-CB 3.51Å; L78-I114 HydrophobicContact CD2-CD1 3.68Å; L78-I114 HydrophobicContact CD2-CG1 4.18Å; L78-I114 HydrophobicContact CD2-CG2 2.98Å; L78-I114 HydrophobicContact CG-CG2 4.39Å; F112-I114 HydrophobicContact CD2-CD1 3.88Å; F112-I114 HydrophobicContact CD2-CG1 3.65Å; F112-I114 HydrophobicContact CE2-CD1 3.6Å; F112-I114 HydrophobicContact CE2-CG1 3.94Å; I114-F126 PolarHBondContact O-N 3.49Å; I114-G127 PolarHBondContact N-O 2.67Å; I114-L129 HydrophobicContact CD1-CD1 4.41Å
115	A	48.5	Very low	44.6	Very low	6 Å²	6	68.1 Å²	68.1	5%	0.05	40%	0.4	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	148.5	-179	0	0	0	0	0	110.7	T63 I64 V65 V66 P123 V124	T63-A115 HydrophobicContact CG2-CB 4.14Å; I64-A115 PolarHBondContact O-N 2.84Å; V65-A115 WeakPolarHBondContact CA-O 3.14Å; V66-A115 PolarHBondContact N-O 3.32Å; V66-A115 VanDerWaalsContact N-O 3.11Å; A115-P123 HydrophobicContact CB-CB 3.64Å; A115-V124 CarbonylContact C-O 3.52Å; A115-V124 WeakPolarHBondContact CA-O 3.07Å; A115-V124 VanDerWaalsContact CB-O 3.29Å; A115-V124 WeakPolarHBondContact CB-O 3.29Å
116	A	43.7	Very low	45.5	Very low	13 Å²	13	69.2 Å²	69.2	11%	0.107	39%	0.393	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	146	170.1	0	0	0	0	0	109.8	V66 A74 P123 V124 F126	V66-A116 WeakPolarHBondContact O-CA 3.26Å; A74-A116 HydrophobicContact CB-CB 3.88Å; A116-P123 WeakPolarHBondContact O-CA 3.46Å; A116-V124 PolarHBondContact N-O 2.85Å; A116-V124 PolarHBondContact O-N 2.89Å; A116-F126 HydrophobicContact CB-CD2 3.98Å; A116-F126 HydrophobicContact CB-CE2 3.31Å; A116-F126 HydrophobicContact CB-CZ 4.01Å
117	S	41.1	Very low	46.2	Very low	12 Å²	12	64.3 Å²	64.3	8%	0.084	38%	0.378	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.4	133	-179.2	141.4	0	0	0	0	109.7	V66 K67 T68 T121	V66-S117 PolarHBondContact O-N 3.38Å; K67-S117 WeakPolarHBondContact CA-O 3.32Å; T68-S117 PolarHBondContact N-O 3.05Å; S117-T121 PolarHBondContact OG-O 3.47Å
118	K	43.6	Very low	46.9	Very low	135 Å²	135	66.9 Å²	66.9	59%	0.587	38%	0.375	S	S	*	.			trans	-76	149.6	162.8	-71.2	-175.2	178.6	-179.6	0	108.7	G120 T121	K118-G120 PolarHBondContact O-N 2.86Å; K118-G120 VanDerWaalsContact O-N 3.16Å; K118-T121 WeakPolarHBondContact CA-OG1 3.15Å; K118-T121 HydrophobicContact CB-CG2 4.24Å; K118-T121 PolarHBondContact N-OG1 3.06Å; K118-T121 PolarHBondContact O-N 2.84Å; K118-T121 PolarHBondContact O-OG1 2.79Å
119	R	48.1	Very low	47.5	Very low	233 Å²	233	66.6 Å²	66.6	88%	0.879	37%	0.374	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52	123.6	179	-143	-178.3	-155	-159.6	6.3	110
120	G	44.9	Very low	47.7	Very low	89 Å²	89	64.7 Å²	64.7	92%	0.918	36%	0.36	S	S	*	.	T	Hydrogen-bonded Turn	trans	83.3	7.4	-177.5	0	0	0	0	0	115.9	K118	K118-G120 PolarHBondContact O-N 2.86Å; K118-G120 VanDerWaalsContact O-N 3.16Å
121	T	46.4	Very low	47.6	Very low	76 Å²	76	65.2 Å²	65.2	47%	0.466	36%	0.356	S	S	.	.	S	Bend	trans	-120.3	152.1	178.4	66.6	0	0	0	0	112.3	S117 K118	S117-T121 PolarHBondContact OG-O 3.47Å; K118-T121 WeakPolarHBondContact CA-OG1 3.15Å; K118-T121 HydrophobicContact CB-CG2 4.24Å; K118-T121 PolarHBondContact N-OG1 3.06Å; K118-T121 PolarHBondContact O-N 2.84Å; K118-T121 PolarHBondContact O-OG1 2.79Å
122	S	52	Low	47	Very low	102 Å²	102	72.8 Å²	72.8	71%	0.713	39%	0.388	S	S	*	.	P	Polyproline II helix	trans	-62.1	139.3	172.7	-60.7	0	0	0	0	110.9	V124	S122-V124 PolarHBondContact O-N 3.32Å
123	P	52.5	Low	46.2	Very low	70 Å²	70	76.1 Å²	76.1	46%	0.455	42%	0.417	S	S	.	.	P	Polyproline II helix	trans	-58	130.6	173.6	-20.7	31.3	0	0	0	111.6	V65 A115 A116	V65-P123 HydrophobicContact CG1-CB 4.34Å; V65-P123 HydrophobicContact CG1-CG 4.14Å; V65-P123 HydrophobicContact CG2-CG 4.49Å; A115-P123 HydrophobicContact CB-CB 3.64Å; A116-P123 WeakPolarHBondContact O-CA 3.46Å
124	V	51.1	Low	45.2	Very low	88 Å²	88	77.7 Å²	77.7	53%	0.533	43%	0.429	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.1	124.1	171.4	179.7	0	0	0	0	107.4	A115 A116 S122 F126	A115-V124 CarbonylContact C-O 3.52Å; A115-V124 WeakPolarHBondContact CA-O 3.07Å; A115-V124 VanDerWaalsContact CB-O 3.29Å; A115-V124 WeakPolarHBondContact CB-O 3.29Å; A116-V124 PolarHBondContact N-O 2.85Å; A116-V124 PolarHBondContact O-N 2.89Å; S122-V124 PolarHBondContact O-N 3.32Å; V124-F126 HydrophobicContact CB-CE2 4.04Å; V124-F126 HydrophobicContact CB-CZ 4.45Å; V124-F126 HydrophobicContact CG1-CE2 4.34Å; V124-F126 HydrophobicContact CG1-CZ 4.5Å; V124-F126 WeakPolarHBondContact O-CD2 3.43Å; V124-F126 WeakPolarHBondContact O-CE2 3.1Å
125	E	52.9	Low	44.3	Very low	96 Å²	96	88.6 Å²	88.6	45%	0.449	47%	0.47	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.4	126.6	174.2	-174.8	175.6	163.3	0	0	109.6
126	F	47.9	Very low	43.4	Very low	90 Å²	90	94.6 Å²	94.6	40%	0.395	50%	0.502	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.6	-23.2	179.8	-74.2	-92.1	0	0	0	112.3	L78 I114 A116 V124	L78-F126 HydrophobicContact CD1-CB 3.48Å; L78-F126 VanDerWaalsContact CD1-CB 3.48Å; L78-F126 HydrophobicContact CD1-CD1 4.07Å; L78-F126 HydrophobicContact CD1-CD2 3.85Å; L78-F126 HydrophobicContact CD1-CG 3.51Å; I114-F126 PolarHBondContact O-N 3.49Å; A116-F126 HydrophobicContact CB-CD2 3.98Å; A116-F126 HydrophobicContact CB-CE2 3.31Å; A116-F126 HydrophobicContact CB-CZ 4.01Å; V124-F126 HydrophobicContact CB-CE2 4.04Å; V124-F126 HydrophobicContact CB-CZ 4.45Å; V124-F126 HydrophobicContact CG1-CE2 4.34Å; V124-F126 HydrophobicContact CG1-CZ 4.5Å; V124-F126 WeakPolarHBondContact O-CD2 3.43Å; V124-F126 WeakPolarHBondContact O-CE2 3.1Å
127	G	45.2	Very low	42.8	Very low	29 Å²	29	98 Å²	98	30%	0.299	53%	0.53	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-177.5	158.8	-179.7	0	0	0	0	0	113.5	R113 I114	R113-G127 WeakPolarHBondContact CA-O 3.31Å; I114-G127 PolarHBondContact N-O 2.67Å
128	R	49.4	Very low	42.2	Very low	164 Å²	164	102.1 Å²	102.1	62%	0.619	56%	0.559	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-126.1	129.1	175.3	-174	177.4	-175.6	-167.5	-2.2	108.4	S111 F112 R113	S111-R128 VanDerWaalsContact OG-CZ 3.23Å; S111-R128 PolarHBondContact OG-NE 2.66Å; S111-R128 PolarHBondContact OG-NH2 2.68Å; F112-R128 CarbonylContact O-C 3.6Å; F112-R128 VanDerWaalsContact O-CA 3.32Å; F112-R128 WeakPolarHBondContact O-CA 3.49Å; R113-R128 HydrophobicContact CG-CG 4.26Å
129	L	47.7	Very low	41.6	Very low	17 Å²	17	101.7 Å²	101.7	9%	0.089	56%	0.562	C	S	.	*	E	Extended strand (participates in β ladder)	trans	-126.7	131.3	-174.1	-75.7	154.3	0	0	0	109.9	S82 R86 S111 F112 I114	S82-L129 VanDerWaalsContact CB-CD1 3.4Å; S82-L129 VanDerWaalsContact OG-CD1 3.22Å; S82-L129 WeakPolarHBondContact OG-CD1 3.26Å; S82-L129 WeakPolarHBondContact OG-CD2 3.44Å; R86-L129 VanDerWaalsContact NH2-CD2 3.28Å; S111-L129 CarbonylContact C-O 3.57Å; S111-L129 WeakPolarHBondContact CA-O 3.26Å; S111-L129 WeakPolarHBondContact CB-O 3.35Å; F112-L129 HydrophobicContact CD1-CB 3.54Å; F112-L129 VanDerWaalsContact CD1-O 3.3Å; F112-L129 WeakPolarHBondContact CD1-O 3.33Å; F112-L129 HydrophobicContact CD2-CB 3.98Å; F112-L129 HydrophobicContact CD2-CD1 4.11Å; F112-L129 HydrophobicContact CE1-CB 3.08Å; F112-L129 HydrophobicContact CE1-CD1 4.12Å; F112-L129 HydrophobicContact CE1-CG 4.15Å; F112-L129 HydrophobicContact CE2-CB 3.57Å; F112-L129 HydrophobicContact CE2-CD1 3.15Å; F112-L129 HydrophobicContact CE2-CG 3.93Å; F112-L129 HydrophobicContact CG-CB 4Å; F112-L129 HydrophobicContact CZ-CB 3.12Å; F112-L129 HydrophobicContact CZ-CD1 3.18Å; F112-L129 HydrophobicContact CZ-CG 3.68Å; F112-L129 PolarHBondContact N-O 2.88Å; F112-L129 PolarHBondContact O-N 3.16Å; I114-L129 HydrophobicContact CD1-CD1 4.41Å
130	P	42.8	Very low	40.8	Very low	67 Å²	67	96.6 Å²	96.6	44%	0.435	55%	0.552	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-67	133.5	176.4	27.8	-32.9	0	0	0	109.6	F132	P130-F132 HydrophobicContact CB-CD2 4.48Å; P130-F132 HydrophobicContact CB-CE1 4.36Å; P130-F132 HydrophobicContact CB-CE2 3.96Å; P130-F132 HydrophobicContact CB-CZ 3.88Å; P130-F132 HydrophobicContact CG-CD2 4.29Å; P130-F132 HydrophobicContact CG-CE1 4.49Å; P130-F132 HydrophobicContact CG-CE2 3.44Å; P130-F132 VanDerWaalsContact CG-CE2 3.44Å; P130-F132 HydrophobicContact CG-CZ 3.56Å
131	L	44.9	Very low	40.4	Very low	37 Å²	37	99.6 Å²	99.6	19%	0.194	55%	0.547	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.1	113.3	165.2	-69.2	157.9	0	0	0	105.9	M108 G110 F112	M108-L131 HydrophobicContact CB-CB 3.89Å; M108-L131 HydrophobicContact CB-CD1 3.68Å; M108-L131 HydrophobicContact CB-CG 4.26Å; M108-L131 HydrophobicContact CG-CD1 4.32Å; M108-L131 WeakPolarHBondContact O-CB 3.41Å; M108-L131 HydrophobicContact SD-CD1 3.72Å; G110-L131 PolarHBondContact O-N 3.02Å; F112-L131 HydrophobicContact CD1-CD2 3.83Å; F112-L131 HydrophobicContact CD1-CG 3.97Å; F112-L131 HydrophobicContact CE1-CD2 4.32Å
132	F	36.2	Very low	39.9	Very low	165 Å²	165	100.6 Å²	100.6	72%	0.724	56%	0.557	S	S	*	*	P	Polyproline II helix	trans	-88.1	137.5	171.1	-64.1	-75.5	0	0	0	108.5	P130	P130-F132 HydrophobicContact CB-CD2 4.48Å; P130-F132 HydrophobicContact CB-CE1 4.36Å; P130-F132 HydrophobicContact CB-CE2 3.96Å; P130-F132 HydrophobicContact CB-CZ 3.88Å; P130-F132 HydrophobicContact CG-CD2 4.29Å; P130-F132 HydrophobicContact CG-CE1 4.49Å; P130-F132 HydrophobicContact CG-CE2 3.44Å; P130-F132 VanDerWaalsContact CG-CE2 3.44Å; P130-F132 HydrophobicContact CG-CZ 3.56Å
133	A	34.4	Very low	39.1	Very low	76 Å²	76	107.4 Å²	107.4	63%	0.628	58%	0.584	S	S	*	*	P	Polyproline II helix	trans	-84.9	121.6	-176.9	0	0	0	0	0	110
134	V	30.2	Very low	38.4	Very low	62 Å²	62	109.3 Å²	109.3	38%	0.376	59%	0.591	S	S	.	*	P	Polyproline II helix	trans	-83	127.9	162	178.3	0	0	0	0	108.2	D89 E90	D89-V134 WeakPolarHBondContact OD1-CG2 3.44Å; E90-V134 HydrophobicContact CG-CG1 3.63Å; E90-V134 HydrophobicContact CG-CG2 4.34Å; E90-V134 WeakPolarHBondContact OE1-CG1 3.38Å
135	R	26.9	Very low	37.7	Very low	233 Å²	233	110.4 Å²	110.4	88%	0.879	59%	0.594	S	S	*	*	P	Polyproline II helix	trans	-93.7	122.1	-175.9	-150.6	179.9	-172.6	-173.3	0.9	107.6	A137	R135-A137 PolarHBondContact O-N 2.89Å
136	N	30.4	Very low	36.9	Very low	132 Å²	132	111.2 Å²	111.2	71%	0.706	60%	0.602	S	S	*	*			trans	-26.9	115.5	175.5	-86.3	-7.1	0	0	0	113.3	S138	N136-S138 PolarHBondContact O-N 2.9Å
137	A	30.1	Very low	36.2	Very low	85 Å²	85	112.5 Å²	112.5	70%	0.702	61%	0.614	S	S	*	*			trans	-62.5	112.8	145	0	0	0	0	0	105.4	R135 I139	R135-A137 PolarHBondContact O-N 2.89Å; A137-I139 PolarHBondContact O-N 2.85Å
138	S	29.1	Very low	35.7	Very low	99 Å²	99	117.7 Å²	117.7	69%	0.692	63%	0.634	S	S	*	*			trans	-50.8	110.1	171.7	48.5	0	0	0	0	108.2	N136 D140	N136-S138 PolarHBondContact O-N 2.9Å; S138-D140 PolarHBondContact O-N 2.88Å
139	I	31.4	Very low	34.8	Very low	125 Å²	125	114.6 Å²	114.6	64%	0.641	64%	0.635	S	S	*	*			trans	-66.2	97	158.8	-60.4	172.4	0	0	0	103.7	A137 D141	A137-I139 PolarHBondContact O-N 2.85Å; I139-D141 VanDerWaalsContact C-N 3.35Å; I139-D141 PolarHBondContact O-N 2.8Å
140	D	31.4	Very low	33.8	Very low	127 Å²	127	121.6 Å²	121.6	68%	0.679	67%	0.674	S	S	*	*			trans	-66.1	100.3	169.9	-144.1	-42.6	0	0	0	105.4	S138 S142	S138-D140 PolarHBondContact O-N 2.88Å; D140-S142 PolarHBondContact O-N 3.23Å; D140-S142 PolarHBondContact OD1-OG 3.18Å
141	D	35.9	Very low	33.1	Very low	152 Å²	152	125.8 Å²	125.8	81%	0.813	69%	0.692	S	S	*	*			trans	-69.4	53	175	-90.9	-37	0	0	0	110.5	I139	I139-D141 VanDerWaalsContact C-N 3.35Å; I139-D141 PolarHBondContact O-N 2.8Å
142	S	35.3	Very low	32.2	Very low	97 Å²	97	133.2 Å²	133.2	68%	0.678	73%	0.733	S	S	*	*			trans	-102.7	69.4	172.9	-64.2	0	0	0	0	109.2	D140	D140-S142 PolarHBondContact O-N 3.23Å; D140-S142 PolarHBondContact OD1-OG 3.18Å
143	L	34.8	Very low	31.8	Very low	245 Å²	245	130.3 Å²	130.3	100%	1.283	73%	0.734	S	S	*	*			trans	-124.4	0	161	-88.5	168	0	0	0	108.6

Retrieved 143 of 143 residues in 951.9 ms (Link to these results)

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