A0A077ZLH0_TRITR Loading...

Sid transmembrane family member

AlphaFold DB , UniProt , Accession A0A077ZLH0, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 126 aa.

						>A0A077ZLH0_TRITR|A0A077ZLH0
MMKQPGDFPLFLVVIFISNLMLYLLFYVSMKLRHREHLNGRVLVIGTLSGLSWGFSLFFFLDKQLSWRVTAAQSRELNGACLIAKFYDAHDIWHFLSAISMFLSFLILLVIDDDLVNTAHDQIPVF
					

Structure Viewer

Loading PAE data...

(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	42.4	Very low	70.8	Confident	241 Å²	241	118.5 Å²	118.5	100%	1.187	61%	0.609	S	S	*	*				0	105.4	0	-168.6	175.5	177.6	0	0	107.3	K3	M1-K3 PolarHBondContact O-N 3.18Å; M1-K3 VanDerWaalsContact O-N 3.16Å
2	M	54.8	Low	72.6	Confident	185 Å²	185	113.5 Å²	113.5	91%	0.911	58%	0.584	S	S	*	*			trans	-64.8	115.6	172.8	-83.8	-177.3	-87.7	0	0	107	Q4	M2-Q4 PolarHBondContact O-N 3.22Å
3	K	57.5	Low	74.1	Confident	206 Å²	206	108.8 Å²	108.8	90%	0.896	56%	0.563	S	S	*	*			trans	-56.3	113.5	165.1	-102.9	-178.5	174.4	179.2	0	105.4	M1	M1-K3 PolarHBondContact O-N 3.18Å; M1-K3 VanDerWaalsContact O-N 3.16Å
4	Q	60.4	Low	75.5	Confident	123 Å²	123	106.6 Å²	106.6	58%	0.575	56%	0.557	S	S	*	*	P	Polyproline II helix	trans	-53.2	138.4	173.4	-75.7	177.5	-26.4	0	0	108.1	M2 R68	M2-Q4 PolarHBondContact O-N 3.22Å; Q4-R68 VanDerWaalsContact CD-O 3.25Å; Q4-R68 PolarHBondContact NE2-O 3.28Å; Q4-R68 PolarHBondContact OE1-O 2.83Å; Q4-R68 VanDerWaalsContact OE1-O 3.08Å
5	P	60.5	Low	77	Confident	101 Å²	101	104.9 Å²	104.9	66%	0.656	55%	0.547	S	S	*	.	P	Polyproline II helix	trans	-54.6	152.4	177.5	21.9	-30.2	0	0	0	109.4
6	G	67	Low	78.2	Confident	56 Å²	56	106.4 Å²	106.4	58%	0.577	55%	0.549	S	S	*	.	P	Polyproline II helix	trans	-52.5	171.8	165.1	0	0	0	0	0	110.6	F8	G6-F8 PolarHBondContact O-N 3.27Å
7	D	80.8	Confident	79.3	Confident	48 Å²	48	102.5 Å²	102.5	26%	0.257	53%	0.528	S	S	.	.			trans	-63	83.1	-179.9	-159.6	-21	0	0	0	110.2	L10 F11	D7-L10 HydrophobicContact CB-CB 3.83Å; D7-L10 HydrophobicContact CB-CD2 4.26Å; D7-L10 WeakPolarHBondContact O-CB 3.39Å; D7-L10 PolarHBondContact O-N 2.89Å; D7-F11 PolarHBondContact O-N 2.87Å
8	F	86.3	Confident	80.3	Confident	120 Å²	120	100.1 Å²	100.1	53%	0.526	52%	0.522	S	S	.	.	H	α-helix	trans	-63.9	-41	-169.5	171	-100.7	0	0	0	111.7	G6 L10 F11 L12	G6-F8 PolarHBondContact O-N 3.27Å; F8-L10 VanDerWaalsContact C-N 3.34Å; F8-L10 PolarHBondContact O-N 3.04Å; F8-F11 HydrophobicContact CD2-CD1 4.47Å; F8-F11 WeakPolarHBondContact O-CB 3.37Å; F8-F11 PolarHBondContact O-N 2.97Å; F8-L12 HydrophobicContact CD1-CD1 4.25Å; F8-L12 HydrophobicContact CE1-CD1 3.57Å; F8-L12 HydrophobicContact CE1-CG 4.19Å; F8-L12 HydrophobicContact CE2-CD2 4.41Å; F8-L12 HydrophobicContact CE2-CG 4.34Å; F8-L12 HydrophobicContact CZ-CD1 3.72Å; F8-L12 HydrophobicContact CZ-CD2 4.19Å; F8-L12 HydrophobicContact CZ-CG 4.02Å; F8-L12 PolarHBondContact O-N 3.28Å
9	P	88.6	Confident	81.2	Confident	34 Å²	34	99.2 Å²	99.2	22%	0.221	52%	0.518	C	S	.	.	H	α-helix	trans	-62.1	-40.6	172.7	-28.7	42	0	0	0	112.5	F11 L12 V13 W67	P9-F11 VanDerWaalsContact C-N 3.31Å; P9-F11 PolarHBondContact O-N 2.86Å; P9-L12 PolarHBondContact O-N 2.95Å; P9-V13 WeakPolarHBondContact O-CG2 3.12Å; P9-V13 PolarHBondContact O-N 3.05Å; P9-W67 HydrophobicContact CB-CZ2 4.17Å; P9-W67 HydrophobicContact CG-CD2 3.64Å; P9-W67 VanDerWaalsContact CG-CE2 3.5Å; P9-W67 HydrophobicContact CG-CE3 4.02Å; P9-W67 HydrophobicContact CG-CG 4.03Å; P9-W67 HydrophobicContact CG-CH2 4.16Å; P9-W67 HydrophobicContact CG-CZ2 3.79Å; P9-W67 HydrophobicContact CG-CZ3 4.26Å
10	L	89.1	Confident	82.1	Confident	70 Å²	70	94.7 Å²	94.7	37%	0.366	49%	0.494	S	S	.	.	H	α-helix	trans	-60.4	-42.5	173.4	178.5	64.1	0	0	0	111.6	D7 F8 L12 V13 V14 F60	D7-L10 HydrophobicContact CB-CB 3.83Å; D7-L10 HydrophobicContact CB-CD2 4.26Å; D7-L10 WeakPolarHBondContact O-CB 3.39Å; D7-L10 PolarHBondContact O-N 2.89Å; F8-L10 VanDerWaalsContact C-N 3.34Å; F8-L10 PolarHBondContact O-N 3.04Å; L10-L12 VanDerWaalsContact C-N 3.34Å; L10-L12 PolarHBondContact O-N 3.12Å; L10-V13 PolarHBondContact O-N 3.45Å; L10-V14 HydrophobicContact CD1-CG2 4.19Å; L10-V14 HydrophobicContact CG-CG2 4.4Å; L10-V14 VanDerWaalsContact O-CG2 3.3Å; L10-V14 WeakPolarHBondContact O-CG2 3.45Å; L10-V14 PolarHBondContact O-N 2.88Å; L10-F60 HydrophobicContact CD1-CZ 3.73Å
11	F	91.1	Very high	82.8	Confident	120 Å²	120	93.1 Å²	93.1	53%	0.526	49%	0.485	S	S	.	.	H	α-helix	trans	-57.3	-45.1	175.5	170	-98	0	0	0	112.2	D7 F8 P9 V14 I15	D7-F11 PolarHBondContact O-N 2.87Å; F8-F11 HydrophobicContact CD2-CD1 4.47Å; F8-F11 WeakPolarHBondContact O-CB 3.37Å; F8-F11 PolarHBondContact O-N 2.97Å; P9-F11 VanDerWaalsContact C-N 3.31Å; P9-F11 PolarHBondContact O-N 2.86Å; F11-V14 PolarHBondContact O-N 3.03Å; F11-I15 HydrophobicContact CD1-CD1 4.14Å; F11-I15 HydrophobicContact CD2-CD1 4.15Å; F11-I15 HydrophobicContact CE1-CD1 3.51Å; F11-I15 HydrophobicContact CE2-CD1 3.53Å; F11-I15 HydrophobicContact CE2-CG1 4.42Å; F11-I15 HydrophobicContact CG-CD1 4.44Å; F11-I15 HydrophobicContact CZ-CD1 3.19Å; F11-I15 HydrophobicContact CZ-CG1 4.44Å; F11-I15 PolarHBondContact O-N 3.5Å; F11-I15 VanDerWaalsContact O-N 3.1Å
12	L	92.3	Very high	85.4	Confident	58 Å²	58	87.1 Å²	87.1	30%	0.304	46%	0.457	S	S	.	.	H	α-helix	trans	-63.9	-46.4	175.9	-68.7	179.7	0	0	0	112.3	F8 P9 L10 V14 I15 F16	F8-L12 HydrophobicContact CD1-CD1 4.25Å; F8-L12 HydrophobicContact CE1-CD1 3.57Å; F8-L12 HydrophobicContact CE1-CG 4.19Å; F8-L12 HydrophobicContact CE2-CD2 4.41Å; F8-L12 HydrophobicContact CE2-CG 4.34Å; F8-L12 HydrophobicContact CZ-CD1 3.72Å; F8-L12 HydrophobicContact CZ-CD2 4.19Å; F8-L12 HydrophobicContact CZ-CG 4.02Å; F8-L12 PolarHBondContact O-N 3.28Å; P9-L12 PolarHBondContact O-N 2.95Å; L10-L12 VanDerWaalsContact C-N 3.34Å; L10-L12 PolarHBondContact O-N 3.12Å; L12-V14 VanDerWaalsContact C-N 3.31Å; L12-V14 PolarHBondContact O-N 3.38Å; L12-I15 PolarHBondContact O-N 2.73Å; L12-F16 HydrophobicContact CB-CD2 4.25Å; L12-F16 HydrophobicContact CB-CE2 4.04Å; L12-F16 HydrophobicContact CD2-CE2 4.15Å; L12-F16 HydrophobicContact CD2-CZ 4.29Å; L12-F16 WeakPolarHBondContact O-CB 3.47Å; L12-F16 VanDerWaalsContact O-CD2 3.23Å; L12-F16 WeakPolarHBondContact O-CD2 3.38Å; L12-F16 WeakPolarHBondContact O-CG 3.32Å; L12-F16 PolarHBondContact O-N 3.28Å
13	V	93	Very high	87.4	Confident	52 Å²	52	83.9 Å²	83.9	32%	0.315	44%	0.436	S	S	.	.	H	α-helix	trans	-57.2	-47	177.2	170.3	0	0	0	0	110.1	P9 L10 I15 F16 I17	P9-V13 WeakPolarHBondContact O-CG2 3.12Å; P9-V13 PolarHBondContact O-N 3.05Å; L10-V13 PolarHBondContact O-N 3.45Å; V13-I15 PolarHBondContact O-N 2.78Å; V13-F16 PolarHBondContact O-N 2.91Å; V13-I17 HydrophobicContact CG1-CG1 4.02Å; V13-I17 VanDerWaalsContact O-CB 3.27Å; V13-I17 WeakPolarHBondContact O-CB 3.43Å; V13-I17 VanDerWaalsContact O-CG1 3.23Å; V13-I17 WeakPolarHBondContact O-CG1 3.35Å; V13-I17 PolarHBondContact O-N 3.05Å
14	V	93.9	Very high	89.2	Confident	79 Å²	79	75.1 Å²	75.1	48%	0.479	40%	0.399	S	S	.	.	H	α-helix	trans	-59.5	-48.4	178.8	170.1	0	0	0	0	111.2	L10 F11 L12 S18	L10-V14 HydrophobicContact CD1-CG2 4.19Å; L10-V14 HydrophobicContact CG-CG2 4.4Å; L10-V14 VanDerWaalsContact O-CG2 3.3Å; L10-V14 WeakPolarHBondContact O-CG2 3.45Å; L10-V14 PolarHBondContact O-N 2.88Å; F11-V14 PolarHBondContact O-N 3.03Å; L12-V14 VanDerWaalsContact C-N 3.31Å; L12-V14 PolarHBondContact O-N 3.38Å; V14-S18 WeakPolarHBondContact O-CB 2.81Å; V14-S18 PolarHBondContact O-N 3.09Å; V14-S18 PolarHBondContact O-OG 3.43Å
15	I	96.7	Very high	90.9	Very high	80 Å²	80	74.5 Å²	74.5	41%	0.41	40%	0.399	S	S	.	.	H	α-helix	trans	-63.6	-49.5	-179.1	-71.5	176.3	0	0	0	111.4	F11 L12 V13 S18 N19	F11-I15 HydrophobicContact CD1-CD1 4.14Å; F11-I15 HydrophobicContact CD2-CD1 4.15Å; F11-I15 HydrophobicContact CE1-CD1 3.51Å; F11-I15 HydrophobicContact CE2-CD1 3.53Å; F11-I15 HydrophobicContact CE2-CG1 4.42Å; F11-I15 HydrophobicContact CG-CD1 4.44Å; F11-I15 HydrophobicContact CZ-CD1 3.19Å; F11-I15 HydrophobicContact CZ-CG1 4.44Å; F11-I15 PolarHBondContact O-N 3.5Å; F11-I15 VanDerWaalsContact O-N 3.1Å; L12-I15 PolarHBondContact O-N 2.73Å; V13-I15 PolarHBondContact O-N 2.78Å; I15-S18 PolarHBondContact O-N 3.5Å; I15-N19 WeakPolarHBondContact O-CB 3.47Å; I15-N19 PolarHBondContact O-N 2.8Å
16	F	97.1	Very high	92.6	Very high	130 Å²	130	74.5 Å²	74.5	57%	0.57	39%	0.388	S	S	*	.	H	α-helix	trans	-68.8	-43.6	-175.4	-65.5	-38.3	0	0	0	112.5	L12 V13 N19 L20	L12-F16 HydrophobicContact CB-CD2 4.25Å; L12-F16 HydrophobicContact CB-CE2 4.04Å; L12-F16 HydrophobicContact CD2-CE2 4.15Å; L12-F16 HydrophobicContact CD2-CZ 4.29Å; L12-F16 WeakPolarHBondContact O-CB 3.47Å; L12-F16 VanDerWaalsContact O-CD2 3.23Å; L12-F16 WeakPolarHBondContact O-CD2 3.38Å; L12-F16 WeakPolarHBondContact O-CG 3.32Å; L12-F16 PolarHBondContact O-N 3.28Å; V13-F16 PolarHBondContact O-N 2.91Å; F16-N19 PolarHBondContact O-N 3.4Å; F16-L20 PolarHBondContact O-N 3.43Å
17	I	96.7	Very high	94	Very high	40 Å²	40	74.5 Å²	74.5	21%	0.205	37%	0.371	C	S	.	.	H	α-helix	trans	-69.1	-38.2	177.7	-59.6	-46.7	0	0	0	110.8	V13 N19 L20 M21 W53 M101	V13-I17 HydrophobicContact CG1-CG1 4.02Å; V13-I17 VanDerWaalsContact O-CB 3.27Å; V13-I17 WeakPolarHBondContact O-CB 3.43Å; V13-I17 VanDerWaalsContact O-CG1 3.23Å; V13-I17 WeakPolarHBondContact O-CG1 3.35Å; V13-I17 PolarHBondContact O-N 3.05Å; I17-N19 VanDerWaalsContact C-N 3.31Å; I17-N19 PolarHBondContact O-N 3.15Å; I17-L20 PolarHBondContact O-N 3.24Å; I17-M21 HydrophobicContact CG2-CG 4.23Å; I17-M21 WeakPolarHBondContact O-CB 3.48Å; I17-M21 VanDerWaalsContact O-CG 3.27Å; I17-M21 WeakPolarHBondContact O-CG 3.25Å; I17-M21 PolarHBondContact O-N 2.88Å; I17-W53 HydrophobicContact CD1-CH2 3.62Å; I17-W53 HydrophobicContact CD1-CZ2 4.4Å; I17-W53 HydrophobicContact CD1-CZ3 4.45Å; I17-W53 HydrophobicContact CG1-CH2 4.35Å; I17-W53 HydrophobicContact CG2-CH2 4.33Å; I17-M101 HydrophobicContact CD1-CG 4.37Å; I17-M101 HydrophobicContact CD1-SD 4.21Å
18	S	97.4	Very high	94.6	Very high	58 Å²	58	74.5 Å²	74.5	41%	0.406	37%	0.373	S	S	.	.	H	α-helix	trans	-61.1	-41.9	174.1	-61.1	0	0	0	0	111.6	V14 I15 M21 L22	V14-S18 WeakPolarHBondContact O-CB 2.81Å; V14-S18 PolarHBondContact O-N 3.09Å; V14-S18 PolarHBondContact O-OG 3.43Å; I15-S18 PolarHBondContact O-N 3.5Å; S18-M21 PolarHBondContact O-N 3.38Å; S18-L22 WeakPolarHBondContact O-CB 3.23Å; S18-L22 VanDerWaalsContact O-CG 3.27Å; S18-L22 WeakPolarHBondContact O-CG 3.15Å; S18-L22 PolarHBondContact O-N 3.21Å
19	N	98	Very high	95	Very high	84 Å²	84	71.2 Å²	71.2	45%	0.449	37%	0.365	S	S	.	.	H	α-helix	trans	-62.5	-46.6	176.6	-177	-103.1	0	0	0	112	I15 F16 I17 M21 L22 Y23	I15-N19 WeakPolarHBondContact O-CB 3.47Å; I15-N19 PolarHBondContact O-N 2.8Å; F16-N19 PolarHBondContact O-N 3.4Å; I17-N19 VanDerWaalsContact C-N 3.31Å; I17-N19 PolarHBondContact O-N 3.15Å; N19-M21 VanDerWaalsContact C-N 3.35Å; N19-M21 PolarHBondContact O-N 3.32Å; N19-L22 PolarHBondContact O-N 2.89Å; N19-Y23 VanDerWaalsContact O-CD2 3.29Å; N19-Y23 WeakPolarHBondContact O-CD2 3.47Å; N19-Y23 PolarHBondContact O-N 2.86Å; N19-Y23 VanDerWaalsContact OD1-CE2 3.31Å; N19-Y23 WeakPolarHBondContact OD1-CE2 3.09Å
20	L	97.8	Very high	95.3	Very high	8 Å²	8	70.9 Å²	70.9	4%	0.042	36%	0.361	C	S	.	.	H	α-helix	trans	-58.1	-46	175.3	177	62.4	0	0	0	111.9	F16 I17 Y23 L24 W53 M101 F105 L108	F16-L20 PolarHBondContact O-N 3.43Å; I17-L20 PolarHBondContact O-N 3.24Å; L20-Y23 PolarHBondContact O-N 3.47Å; L20-L24 HydrophobicContact CD1-CD1 4.34Å; L20-L24 HydrophobicContact CD1-CG 4.45Å; L20-L24 HydrophobicContact CG-CD1 4.17Å; L20-L24 WeakPolarHBondContact O-CG 3.19Å; L20-L24 PolarHBondContact O-N 3.41Å; L20-W53 HydrophobicContact CD2-CZ2 3.94Å; L20-M101 HydrophobicContact CD2-CG 4.49Å; L20-F105 HydrophobicContact CD1-CD1 4.11Å; L20-F105 HydrophobicContact CD1-CE1 3.79Å; L20-F105 HydrophobicContact CD1-CZ 4.32Å; L20-L108 HydrophobicContact CD1-CD1 4.05Å
21	M	96.6	Very high	95.5	Very high	62 Å²	62	67.7 Å²	67.7	31%	0.305	34%	0.344	S	S	.	.	H	α-helix	trans	-63.6	-41.2	178.5	-70.2	-58	110.4	0	0	111.8	I17 S18 N19 Y23 L24 L25 W53	I17-M21 HydrophobicContact CG2-CG 4.23Å; I17-M21 WeakPolarHBondContact O-CB 3.48Å; I17-M21 VanDerWaalsContact O-CG 3.27Å; I17-M21 WeakPolarHBondContact O-CG 3.25Å; I17-M21 PolarHBondContact O-N 2.88Å; S18-M21 PolarHBondContact O-N 3.38Å; N19-M21 VanDerWaalsContact C-N 3.35Å; N19-M21 PolarHBondContact O-N 3.32Å; M21-Y23 VanDerWaalsContact C-N 3.35Å; M21-Y23 PolarHBondContact O-N 3.2Å; M21-L24 HydrophobicContact CE-CD1 3.64Å; M21-L24 PolarHBondContact O-N 3.47Å; M21-L24 HydrophobicContact SD-CD1 4.4Å; M21-L25 VanDerWaalsContact O-CB 3.28Å; M21-L25 WeakPolarHBondContact O-CB 3.5Å; M21-L25 WeakPolarHBondContact O-CG 3.32Å; M21-L25 PolarHBondContact O-N 2.95Å; M21-W53 HydrophobicContact CE-CZ2 4.24Å
22	L	97.7	Very high	95.5	Very high	115 Å²	115	67.2 Å²	67.2	60%	0.602	35%	0.346	S	S	*	.	H	α-helix	trans	-60.4	-43.6	176	-75.3	170.4	0	0	0	111.7	S18 N19 F26	S18-L22 WeakPolarHBondContact O-CB 3.23Å; S18-L22 VanDerWaalsContact O-CG 3.27Å; S18-L22 WeakPolarHBondContact O-CG 3.15Å; S18-L22 PolarHBondContact O-N 3.21Å; N19-L22 PolarHBondContact O-N 2.89Å; L22-F26 WeakPolarHBondContact O-CB 3.2Å; L22-F26 PolarHBondContact O-N 3.48Å
23	Y	96.5	Very high	95.6	Very high	118 Å²	118	74 Å²	74	46%	0.463	37%	0.368	S	S	.	.	H	α-helix	trans	-63.1	-49.6	175.5	-83.2	-67.3	0	0	0	112.2	N19 L20 M21 L25 F26 Y27	N19-Y23 VanDerWaalsContact O-CD2 3.29Å; N19-Y23 WeakPolarHBondContact O-CD2 3.47Å; N19-Y23 PolarHBondContact O-N 2.86Å; N19-Y23 VanDerWaalsContact OD1-CE2 3.31Å; N19-Y23 WeakPolarHBondContact OD1-CE2 3.09Å; L20-Y23 PolarHBondContact O-N 3.47Å; M21-Y23 VanDerWaalsContact C-N 3.35Å; M21-Y23 PolarHBondContact O-N 3.2Å; Y23-L25 VanDerWaalsContact C-N 3.34Å; Y23-L25 PolarHBondContact O-N 2.99Å; Y23-F26 PolarHBondContact O-N 2.65Å; Y23-Y27 HydrophobicContact CD1-CD2 4.5Å; Y23-Y27 AromaticContact CD1-CE2 3.96Å; Y23-Y27 HydrophobicContact CD1-CE2 3.96Å; Y23-Y27 VanDerWaalsContact O-CD2 3.29Å; Y23-Y27 WeakPolarHBondContact O-CD2 3.24Å; Y23-Y27 PolarHBondContact O-N 2.94Å
24	L	96.4	Very high	95.6	Very high	22 Å²	22	75.7 Å²	75.7	12%	0.115	37%	0.372	C	S	.	.	H	α-helix	trans	-57.8	-47.2	177.9	-73.5	169.3	0	0	0	111.7	L20 M21 F26 V28 I107 L108	L20-L24 HydrophobicContact CD1-CD1 4.34Å; L20-L24 HydrophobicContact CD1-CG 4.45Å; L20-L24 HydrophobicContact CG-CD1 4.17Å; L20-L24 WeakPolarHBondContact O-CG 3.19Å; L20-L24 PolarHBondContact O-N 3.41Å; M21-L24 HydrophobicContact CE-CD1 3.64Å; M21-L24 PolarHBondContact O-N 3.47Å; M21-L24 HydrophobicContact SD-CD1 4.4Å; L24-F26 VanDerWaalsContact C-N 3.33Å; L24-F26 PolarHBondContact O-N 2.88Å; L24-V28 WeakPolarHBondContact O-CB 3.29Å; L24-V28 VanDerWaalsContact O-CG2 3.24Å; L24-V28 WeakPolarHBondContact O-CG2 3.4Å; L24-V28 PolarHBondContact O-N 3Å; L24-I107 HydrophobicContact CD2-CB 4.26Å; L24-I107 HydrophobicContact CD2-CG2 3.97Å; L24-L108 HydrophobicContact CD2-CD1 4.45Å; L24-L108 HydrophobicContact CD2-CD2 3.83Å; L24-L108 HydrophobicContact CD2-CG 3.79Å; L24-L108 HydrophobicContact CG-CD2 4.37Å; L24-L108 HydrophobicContact CG-CG 4.44Å
25	L	96.3	Very high	95.4	Very high	110 Å²	110	83.2 Å²	83.2	58%	0.576	39%	0.392	S	S	*	.	H	α-helix	trans	-62.2	-42	177.8	-72.3	172.3	0	0	0	111.3	M21 Y23 S29	M21-L25 VanDerWaalsContact O-CB 3.28Å; M21-L25 WeakPolarHBondContact O-CB 3.5Å; M21-L25 WeakPolarHBondContact O-CG 3.32Å; M21-L25 PolarHBondContact O-N 2.95Å; Y23-L25 VanDerWaalsContact C-N 3.34Å; Y23-L25 PolarHBondContact O-N 2.99Å; L25-S29 WeakPolarHBondContact O-CB 3.29Å; L25-S29 PolarHBondContact O-N 3.26Å; L25-S29 PolarHBondContact O-OG 3.29Å
26	F	96	Very high	95.1	Very high	101 Å²	101	81 Å²	81	44%	0.443	38%	0.38	S	S	.	.	H	α-helix	trans	-61.1	-55.9	178.3	174.5	-101.3	0	0	0	111.3	L22 Y23 L24 V28 S29 M30 V125	L22-F26 WeakPolarHBondContact O-CB 3.2Å; L22-F26 PolarHBondContact O-N 3.48Å; Y23-F26 PolarHBondContact O-N 2.65Å; L24-F26 VanDerWaalsContact C-N 3.33Å; L24-F26 PolarHBondContact O-N 2.88Å; F26-V28 PolarHBondContact O-N 3.24Å; F26-S29 PolarHBondContact O-N 3.14Å; F26-M30 HydrophobicContact CD2-CG 4.39Å; F26-M30 HydrophobicContact CE1-CG 4.25Å; F26-M30 HydrophobicContact CE2-CG 4.05Å; F26-M30 HydrophobicContact CE2-SD 4.39Å; F26-M30 HydrophobicContact CZ-CG 3.97Å; F26-M30 VanDerWaalsContact O-CG 3.32Å; F26-M30 WeakPolarHBondContact O-CG 3.31Å; F26-M30 PolarHBondContact O-N 3.45Å; F26-V125 HydrophobicContact CE1-CG1 3.83Å; F26-V125 HydrophobicContact CZ-CG1 4.34Å
27	Y	95.6	Very high	94.7	Very high	56 Å²	56	81.1 Å²	81.1	22%	0.22	38%	0.382	C	S	.	.	H	α-helix	trans	-64.5	-42.8	-177.4	-79.9	-78.1	0	0	0	112.5	Y23 S29 M30 K31 L108 V125	Y23-Y27 HydrophobicContact CD1-CD2 4.5Å; Y23-Y27 AromaticContact CD1-CE2 3.96Å; Y23-Y27 HydrophobicContact CD1-CE2 3.96Å; Y23-Y27 VanDerWaalsContact O-CD2 3.29Å; Y23-Y27 WeakPolarHBondContact O-CD2 3.24Å; Y23-Y27 PolarHBondContact O-N 2.94Å; Y27-S29 VanDerWaalsContact C-N 3.34Å; Y27-S29 PolarHBondContact O-N 3.14Å; Y27-M30 PolarHBondContact O-N 3.06Å; Y27-K31 WeakPolarHBondContact O-CG 3.43Å; Y27-K31 PolarHBondContact O-N 3.21Å; Y27-L108 HydrophobicContact CD2-CD2 3.71Å; Y27-L108 HydrophobicContact CE2-CD2 4.36Å; Y27-L108 HydrophobicContact CG-CD2 4.35Å; Y27-V125 HydrophobicContact CD1-CG1 4.03Å; Y27-V125 HydrophobicContact CE1-CG1 3.59Å
28	V	94	Very high	94.3	Very high	48 Å²	48	81 Å²	81	29%	0.291	38%	0.382	S	S	.	.	H	α-helix	trans	-63.7	-41.5	175.1	173.4	0	0	0	0	110.9	L24 F26 M30 K31 L32 I111	L24-V28 WeakPolarHBondContact O-CB 3.29Å; L24-V28 VanDerWaalsContact O-CG2 3.24Å; L24-V28 WeakPolarHBondContact O-CG2 3.4Å; L24-V28 PolarHBondContact O-N 3Å; F26-V28 PolarHBondContact O-N 3.24Å; V28-M30 VanDerWaalsContact C-N 3.3Å; V28-M30 PolarHBondContact O-N 3.27Å; V28-K31 PolarHBondContact O-N 2.91Å; V28-L32 HydrophobicContact CG1-CD1 4.02Å; V28-L32 HydrophobicContact CG1-CG 4.43Å; V28-L32 VanDerWaalsContact O-CG 3.29Å; V28-L32 WeakPolarHBondContact O-CG 3.32Å; V28-L32 PolarHBondContact O-N 3.38Å; V28-I111 HydrophobicContact CG2-CD1 3.84Å
29	S	94	Very high	94	Very high	50 Å²	50	80.7 Å²	80.7	35%	0.35	38%	0.375	S	S	.	.	H	α-helix	trans	-63.5	-38.3	176.8	-64.2	0	0	0	0	111.9	L25 F26 Y27 L32 R33	L25-S29 WeakPolarHBondContact O-CB 3.29Å; L25-S29 PolarHBondContact O-N 3.26Å; L25-S29 PolarHBondContact O-OG 3.29Å; F26-S29 PolarHBondContact O-N 3.14Å; Y27-S29 VanDerWaalsContact C-N 3.34Å; Y27-S29 PolarHBondContact O-N 3.14Å; S29-L32 PolarHBondContact O-N 3.38Å; S29-R33 WeakPolarHBondContact O-CB 3.24Å; S29-R33 VanDerWaalsContact O-CG 3.25Å; S29-R33 WeakPolarHBondContact O-CG 3.24Å; S29-R33 PolarHBondContact O-N 3.47Å
30	M	94.5	Very high	93.7	Very high	28 Å²	28	78.4 Å²	78.4	14%	0.138	37%	0.372	C	S	.	.	H	α-helix	trans	-65.4	-45.6	177.2	-72.6	-64	-75.7	0	0	111.7	F26 Y27 V28 L32 R33 H34 V125	F26-M30 HydrophobicContact CD2-CG 4.39Å; F26-M30 HydrophobicContact CE1-CG 4.25Å; F26-M30 HydrophobicContact CE2-CG 4.05Å; F26-M30 HydrophobicContact CE2-SD 4.39Å; F26-M30 HydrophobicContact CZ-CG 3.97Å; F26-M30 VanDerWaalsContact O-CG 3.32Å; F26-M30 WeakPolarHBondContact O-CG 3.31Å; F26-M30 PolarHBondContact O-N 3.45Å; Y27-M30 PolarHBondContact O-N 3.06Å; V28-M30 VanDerWaalsContact C-N 3.3Å; V28-M30 PolarHBondContact O-N 3.27Å; M30-L32 VanDerWaalsContact C-N 3.32Å; M30-L32 PolarHBondContact O-N 3Å; M30-R33 PolarHBondContact O-N 3.32Å; M30-H34 WeakPolarHBondContact CE-CE1 3.29Å; M30-H34 PolarHBondContact O-N 2.87Å; M30-H34 PolarHBondContact O-ND1 2.95Å; M30-V125 HydrophobicContact CB-CG2 3.5Å; M30-V125 VanDerWaalsContact CB-CG2 3.5Å; M30-V125 HydrophobicContact CE-CB 4.31Å; M30-V125 HydrophobicContact CE-CG2 3.67Å; M30-V125 HydrophobicContact CG-CG2 3.87Å
31	K	93.4	Very high	93.6	Very high	2 Å²	2	85.7 Å²	85.7	1%	0.009	40%	0.398	C	S	.	.	H	α-helix	trans	-52.7	-50.5	172.6	-75.6	-85	168.7	-154.5	0	111.4	Y27 V28 H34 R35 E36 L38 I111 D112 D114	Y27-K31 WeakPolarHBondContact O-CG 3.43Å; Y27-K31 PolarHBondContact O-N 3.21Å; V28-K31 PolarHBondContact O-N 2.91Å; K31-H34 PolarHBondContact O-N 2.89Å; K31-R35 PolarHBondContact O-N 3.32Å; K31-R35 VanDerWaalsContact O-N 3.12Å; K31-E36 HydrophobicContact CB-CB 4.48Å; K31-E36 HydrophobicContact CD-CB 3.67Å; K31-E36 WeakPolarHBondContact CD-OE2 3.27Å; K31-E36 VanDerWaalsContact CE-OE2 3.23Å; K31-E36 WeakPolarHBondContact CE-OE2 3.46Å; K31-E36 IonicContact NZ-OE2 2.8Å; K31-E36 PolarHBondContact NZ-OE2 3.28Å; K31-E36 PolarHBondContact O-N 3.07Å; K31-L38 HydrophobicContact CB-CD2 4.07Å; K31-L38 HydrophobicContact CD-CD2 4.21Å; K31-L38 HydrophobicContact CG-CD2 4.05Å; K31-I111 HydrophobicContact CD-CG1 4.44Å; K31-I111 WeakPolarHBondContact CE-O 3.49Å; K31-I111 HydrophobicContact CG-CD1 4.27Å; K31-I111 HydrophobicContact CG-CG1 4.11Å; K31-I111 PolarHBondContact NZ-O 3.44Å; K31-D112 WeakPolarHBondContact CE-OD1 3.28Å; K31-D112 IonicContact NZ-OD1 3.57Å; K31-D112 PolarHBondContact NZ-OD1 3.03Å; K31-D114 IonicContact NZ-OD1 2.78Å; K31-D114 PolarHBondContact NZ-OD1 3.06Å; K31-D114 IonicContact NZ-OD2 2.73Å
32	L	92.4	Very high	93.6	Very high	111 Å²	111	83.1 Å²	83.1	58%	0.581	39%	0.386	S	S	*	.	H	α-helix	trans	-66.1	-40.5	-178.3	-66.9	174.5	0	0	0	112.7	V28 S29 M30 R35	V28-L32 HydrophobicContact CG1-CD1 4.02Å; V28-L32 HydrophobicContact CG1-CG 4.43Å; V28-L32 VanDerWaalsContact O-CG 3.29Å; V28-L32 WeakPolarHBondContact O-CG 3.32Å; V28-L32 PolarHBondContact O-N 3.38Å; S29-L32 PolarHBondContact O-N 3.38Å; M30-L32 VanDerWaalsContact C-N 3.32Å; M30-L32 PolarHBondContact O-N 3Å; L32-R35 PolarHBondContact O-N 3.43Å
33	R	94.6	Very high	93.5	Very high	201 Å²	201	82 Å²	82	76%	0.758	38%	0.381	S	S	*	.	H	α-helix	trans	-66.4	-39.1	179.6	-78.5	178.5	-179.7	-156.1	1.4	112.6	S29 M30 R35	S29-R33 WeakPolarHBondContact O-CB 3.24Å; S29-R33 VanDerWaalsContact O-CG 3.25Å; S29-R33 WeakPolarHBondContact O-CG 3.24Å; S29-R33 PolarHBondContact O-N 3.47Å; M30-R33 PolarHBondContact O-N 3.32Å; R33-R35 VanDerWaalsContact C-N 3.29Å
34	H	91.7	Very high	93.6	Very high	86 Å²	86	81.4 Å²	81.4	40%	0.398	39%	0.389	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90	4.9	-179.6	-60.2	90.5	0	0	0	113.1	M30 K31 E36 P124	M30-H34 WeakPolarHBondContact CE-CE1 3.29Å; M30-H34 PolarHBondContact O-N 2.87Å; M30-H34 PolarHBondContact O-ND1 2.95Å; K31-H34 PolarHBondContact O-N 2.89Å; H34-E36 HydrophobicContact CB-CG 4.16Å; H34-E36 PolarHBondContact O-N 2.75Å; H34-P124 HydrophobicContact CB-CG 4.25Å; H34-P124 VanDerWaalsContact CD2-CB 3.48Å; H34-P124 WeakPolarHBondContact CD2-CB 3.38Å; H34-P124 WeakPolarHBondContact NE2-CB 3.33Å
35	R	89.1	Confident	93.7	Very high	238 Å²	238	81.8 Å²	81.8	90%	0.898	39%	0.39	S	S	*	.	T	Hydrogen-bonded Turn	trans	56.3	33.1	-179.1	-56.2	-175.1	175.1	127.5	-1.9	113	K31 L32 R33	K31-R35 PolarHBondContact O-N 3.32Å; K31-R35 VanDerWaalsContact O-N 3.12Å; L32-R35 PolarHBondContact O-N 3.43Å; R33-R35 VanDerWaalsContact C-N 3.29Å
36	E	91	Very high	93.7	Very high	34 Å²	34	77.9 Å²	77.9	16%	0.159	38%	0.377	C	S	.	.			trans	-75.3	155	172.1	-68.4	175.3	-166.2	0	0	110.4	K31 H34 P124	K31-E36 HydrophobicContact CB-CB 4.48Å; K31-E36 HydrophobicContact CD-CB 3.67Å; K31-E36 WeakPolarHBondContact CD-OE2 3.27Å; K31-E36 VanDerWaalsContact CE-OE2 3.23Å; K31-E36 WeakPolarHBondContact CE-OE2 3.46Å; K31-E36 IonicContact NZ-OE2 2.8Å; K31-E36 PolarHBondContact NZ-OE2 3.28Å; K31-E36 PolarHBondContact O-N 3.07Å; H34-E36 HydrophobicContact CB-CG 4.16Å; H34-E36 PolarHBondContact O-N 2.75Å; E36-P124 WeakPolarHBondContact OE1-CD 3.45Å
37	H	88.2	Confident	93.8	Very high	131 Å²	131	77.3 Å²	77.3	61%	0.606	38%	0.382	S	S	*	.			trans	-92.5	125.8	-171.1	179.7	-87.2	0	0	0	111.4	N39	H37-N39 PolarHBondContact O-N 3.15Å; H37-N39 VanDerWaalsContact O-N 3.15Å
38	L	89.1	Confident	93.9	Very high	39 Å²	39	79.2 Å²	79.2	20%	0.204	40%	0.395	C	S	.	.			trans	-75.9	105.8	170	-64.1	178.2	0	0	0	109.8	K31 V42 L43 I111	K31-L38 HydrophobicContact CB-CD2 4.07Å; K31-L38 HydrophobicContact CD-CD2 4.21Å; K31-L38 HydrophobicContact CG-CD2 4.05Å; L38-V42 HydrophobicContact CD2-CG1 4.36Å; L38-L43 HydrophobicContact CB-CD2 4.09Å; L38-L43 HydrophobicContact CB-CG 4.37Å; L38-L43 HydrophobicContact CD1-CD2 4.22Å; L38-I111 HydrophobicContact CD2-CG1 4.45Å
39	N	90.2	Very high	94.1	Very high	51 Å²	51	77.1 Å²	77.1	27%	0.273	38%	0.383	S	S	.	.			trans	-52.4	143.9	175.6	-173	-4.2	0	0	0	111.1	H37 R41 V42 L43	H37-N39 PolarHBondContact O-N 3.15Å; H37-N39 VanDerWaalsContact O-N 3.15Å; N39-R41 PolarHBondContact O-N 2.93Å; N39-R41 VanDerWaalsContact O-N 3.07Å; N39-V42 HydrophobicContact CB-CG2 4.31Å; N39-V42 WeakPolarHBondContact O-CA 3.33Å; N39-V42 WeakPolarHBondContact O-CB 3.47Å; N39-V42 PolarHBondContact O-N 3.02Å; N39-L43 PolarHBondContact O-N 2.95Å; N39-L43 VanDerWaalsContact O-N 3.15Å
40	G	93.1	Very high	94.3	Very high	36 Å²	36	76.9 Å²	76.9	37%	0.371	39%	0.389	S	S	.	.	H	α-helix	trans	-54.1	-30.8	178.1	0	0	0	0	0	113.4	L43 V44	G40-L43 PolarHBondContact O-N 3.32Å; G40-V44 WeakPolarHBondContact O-CG2 3.46Å; G40-V44 PolarHBondContact O-N 2.95Å
41	R	95	Very high	94.4	Very high	160 Å²	160	80.2 Å²	80.2	60%	0.604	41%	0.407	S	S	*	.	H	α-helix	trans	-59	-47.8	171.9	-66.4	-177.2	-177	176.4	0.3	112.1	N39 L43 V44 I45	N39-R41 PolarHBondContact O-N 2.93Å; N39-R41 VanDerWaalsContact O-N 3.07Å; R41-L43 VanDerWaalsContact C-N 3.29Å; R41-L43 PolarHBondContact O-N 3.47Å; R41-V44 PolarHBondContact O-N 2.98Å; R41-I45 WeakPolarHBondContact O-CB 3.18Å; R41-I45 WeakPolarHBondContact O-CD1 3.49Å; R41-I45 VanDerWaalsContact O-CG1 3.24Å; R41-I45 WeakPolarHBondContact O-CG1 3.28Å; R41-I45 PolarHBondContact O-N 3.48Å
42	V	96.4	Very high	94.7	Very high	9 Å²	9	80.6 Å²	80.6	6%	0.055	41%	0.409	C	S	.	.	H	α-helix	trans	-61.2	-40.8	177.3	179.5	0	0	0	0	110.2	L38 N39 G46 I107 V110 I111	L38-V42 HydrophobicContact CD2-CG1 4.36Å; N39-V42 HydrophobicContact CB-CG2 4.31Å; N39-V42 WeakPolarHBondContact O-CA 3.33Å; N39-V42 WeakPolarHBondContact O-CB 3.47Å; N39-V42 PolarHBondContact O-N 3.02Å; V42-G46 WeakPolarHBondContact O-CA 3.43Å; V42-G46 PolarHBondContact O-N 3.34Å; V42-I107 HydrophobicContact CG1-CG2 4.3Å; V42-V110 HydrophobicContact CG2-CG2 4.05Å; V42-I111 HydrophobicContact CG1-CG1 4.43Å
43	L	96	Very high	94.9	Very high	92 Å²	92	77.7 Å²	77.7	48%	0.482	39%	0.391	S	S	.	.	H	α-helix	trans	-65.2	-43.4	178.1	-63.9	176.5	0	0	0	112.5	L38 N39 G40 R41 T47	L38-L43 HydrophobicContact CB-CD2 4.09Å; L38-L43 HydrophobicContact CB-CG 4.37Å; L38-L43 HydrophobicContact CD1-CD2 4.22Å; N39-L43 PolarHBondContact O-N 2.95Å; N39-L43 VanDerWaalsContact O-N 3.15Å; G40-L43 PolarHBondContact O-N 3.32Å; R41-L43 VanDerWaalsContact C-N 3.29Å; R41-L43 PolarHBondContact O-N 3.47Å; L43-T47 WeakPolarHBondContact O-CB 3.24Å; L43-T47 PolarHBondContact O-N 3.45Å; L43-T47 PolarHBondContact O-OG1 2.89Å
44	V	98	Very high	95.1	Very high	105 Å²	105	70.3 Å²	70.3	64%	0.636	38%	0.377	S	S	*	.	H	α-helix	trans	-65.6	-50.2	178	171.2	0	0	0	0	110.9	G40 R41 G46 T47 L48	G40-V44 WeakPolarHBondContact O-CG2 3.46Å; G40-V44 PolarHBondContact O-N 2.95Å; R41-V44 PolarHBondContact O-N 2.98Å; V44-G46 VanDerWaalsContact C-N 3.32Å; V44-G46 PolarHBondContact O-N 2.89Å; V44-T47 PolarHBondContact O-N 2.64Å; V44-L48 PolarHBondContact O-N 2.93Å
45	I	98.3	Very high	95.4	Very high	29 Å²	29	71.7 Å²	71.7	15%	0.149	38%	0.382	C	S	.	.	H	α-helix	trans	-65.2	-40.2	179.4	-60.9	162.4	0	0	0	110	R41 L48 S49 L103 L106 I107 V110	R41-I45 WeakPolarHBondContact O-CB 3.18Å; R41-I45 WeakPolarHBondContact O-CD1 3.49Å; R41-I45 VanDerWaalsContact O-CG1 3.24Å; R41-I45 WeakPolarHBondContact O-CG1 3.28Å; R41-I45 PolarHBondContact O-N 3.48Å; I45-L48 PolarHBondContact O-N 2.89Å; I45-S49 VanDerWaalsContact O-CB 3.28Å; I45-S49 WeakPolarHBondContact O-CB 3.47Å; I45-S49 PolarHBondContact O-N 3.33Å; I45-L103 HydrophobicContact CG2-CB 4.22Å; I45-L103 HydrophobicContact CG2-CD2 4.05Å; I45-L106 HydrophobicContact CD1-CD2 3.75Å; I45-L106 HydrophobicContact CD1-CG 3.99Å; I45-L106 HydrophobicContact CG1-CD2 4.23Å; I45-L106 HydrophobicContact CG2-CB 4.36Å; I45-L106 HydrophobicContact CG2-CD2 4.04Å; I45-L106 HydrophobicContact CG2-CG 4.3Å; I45-I107 HydrophobicContact CB-CG1 4.19Å; I45-I107 HydrophobicContact CG2-CD1 4.23Å; I45-I107 HydrophobicContact CG2-CG1 3.61Å; I45-V110 HydrophobicContact CD1-CG2 4.08Å
46	G	97	Very high	95.8	Very high	28 Å²	28	60.5 Å²	60.5	29%	0.289	34%	0.34	S	S	.	.	H	α-helix	trans	-59.2	-46.2	174.9	0	0	0	0	0	112.9	V42 V44 S49 G50	V42-G46 WeakPolarHBondContact O-CA 3.43Å; V42-G46 PolarHBondContact O-N 3.34Å; V44-G46 VanDerWaalsContact C-N 3.32Å; V44-G46 PolarHBondContact O-N 2.89Å; G46-S49 PolarHBondContact O-N 3.3Å; G46-G50 PolarHBondContact O-N 3.16Å
47	T	97.8	Very high	96	Very high	90 Å²	90	63.5 Å²	63.5	55%	0.552	36%	0.357	S	S	*	.	H	α-helix	trans	-62.7	-46.4	176.4	-56.3	0	0	0	0	110.8	L43 V44 S49 G50 L51	L43-T47 WeakPolarHBondContact O-CB 3.24Å; L43-T47 PolarHBondContact O-N 3.45Å; L43-T47 PolarHBondContact O-OG1 2.89Å; V44-T47 PolarHBondContact O-N 2.64Å; T47-S49 PolarHBondContact O-N 3.42Å; T47-G50 PolarHBondContact O-N 3Å; T47-L51 HydrophobicContact CG2-CD1 4.36Å; T47-L51 WeakPolarHBondContact O-CG 3.33Å; T47-L51 PolarHBondContact O-N 2.93Å
48	L	98.3	Very high	96.4	Very high	95 Å²	95	63.9 Å²	63.9	50%	0.497	36%	0.357	S	S	.	.	H	α-helix	trans	-64.3	-41.4	177.9	-174.6	63.1	0	0	0	112	V44 I45 L51 S52 L103	V44-L48 PolarHBondContact O-N 2.93Å; I45-L48 PolarHBondContact O-N 2.89Å; L48-L51 PolarHBondContact O-N 3.31Å; L48-S52 WeakPolarHBondContact O-CB 3.37Å; L48-S52 PolarHBondContact O-N 2.93Å; L48-S52 PolarHBondContact O-OG 3.34Å; L48-L103 HydrophobicContact CB-CD1 4.15Å; L48-L103 HydrophobicContact CD2-CD1 3.74Å; L48-L103 HydrophobicContact CD2-CD2 4.1Å; L48-L103 HydrophobicContact CG-CD1 3.58Å
49	S	98.1	Very high	96.6	Very high	4 Å²	4	64 Å²	64	3%	0.028	36%	0.356	C	S	.	.	H	α-helix	trans	-61	-48.6	175.8	-171.2	0	0	0	0	110.4	I45 G46 T47 L51 S52 W53 S104	I45-S49 VanDerWaalsContact O-CB 3.28Å; I45-S49 WeakPolarHBondContact O-CB 3.47Å; I45-S49 PolarHBondContact O-N 3.33Å; G46-S49 PolarHBondContact O-N 3.3Å; T47-S49 PolarHBondContact O-N 3.42Å; S49-L51 PolarHBondContact O-N 2.9Å; S49-S52 WeakPolarHBondContact CA-OG 3.16Å; S49-S52 PolarHBondContact O-N 3.37Å; S49-S52 PolarHBondContact O-OG 3.03Å; S49-W53 WeakPolarHBondContact O-CB 3.42Å; S49-W53 PolarHBondContact O-N 3.35Å; S49-S104 PolarHBondContact OG-OG 3.17Å
50	G	97.4	Very high	96.8	Very high	46 Å²	46	65 Å²	65	47%	0.474	36%	0.358	S	S	.	.	H	α-helix	trans	-59.2	-44.6	177.7	0	0	0	0	0	113.2	G46 T47 W53 G54	G46-G50 PolarHBondContact O-N 3.16Å; T47-G50 PolarHBondContact O-N 3Å; G50-W53 PolarHBondContact O-N 2.89Å; G50-G54 PolarHBondContact O-N 2.74Å
51	L	98.4	Very high	96.7	Very high	98 Å²	98	69.5 Å²	69.5	51%	0.513	37%	0.373	S	S	.	.	H	α-helix	trans	-62.1	-48.2	174.8	-70.4	174.1	0	0	0	111.5	T47 L48 S49 W53 G54 F55	T47-L51 HydrophobicContact CG2-CD1 4.36Å; T47-L51 WeakPolarHBondContact O-CG 3.33Å; T47-L51 PolarHBondContact O-N 2.93Å; L48-L51 PolarHBondContact O-N 3.31Å; S49-L51 PolarHBondContact O-N 2.9Å; L51-W53 VanDerWaalsContact C-N 3.33Å; L51-W53 PolarHBondContact O-N 3.38Å; L51-G54 PolarHBondContact O-N 2.92Å; L51-F55 WeakPolarHBondContact O-CD2 3.46Å; L51-F55 PolarHBondContact O-N 3.3Å
52	S	98	Very high	96.4	Very high	10 Å²	10	65.6 Å²	65.6	7%	0.07	36%	0.364	C	S	.	.	H	α-helix	trans	-62	-40.2	179.6	71.2	0	0	0	0	112.2	L48 S49 F55 S56 S100	L48-S52 WeakPolarHBondContact O-CB 3.37Å; L48-S52 PolarHBondContact O-N 2.93Å; L48-S52 PolarHBondContact O-OG 3.34Å; S49-S52 WeakPolarHBondContact CA-OG 3.16Å; S49-S52 PolarHBondContact O-N 3.37Å; S49-S52 PolarHBondContact O-OG 3.03Å; S52-F55 PolarHBondContact O-N 2.86Å; S52-S56 VanDerWaalsContact O-CB 3.29Å; S52-S56 WeakPolarHBondContact O-CB 3.36Å; S52-S56 PolarHBondContact O-N 3.24Å; S52-S100 VanDerWaalsContact CB-OG 3.28Å; S52-S100 WeakPolarHBondContact CB-OG 3.24Å; S52-S100 PolarHBondContact O-OG 3.35Å; S52-S100 WeakPolarHBondContact OG-CA 3.33Å; S52-S100 WeakPolarHBondContact OG-CB 3.29Å; S52-S100 PolarHBondContact OG-OG 3.35Å
53	W	98.2	Very high	95.4	Very high	50 Å²	50	72.7 Å²	72.7	19%	0.189	39%	0.394	C	S	.	.	H	α-helix	trans	-64.1	-42	174.8	-88.3	119.8	0	0	0	111.3	I17 L20 M21 S49 G50 L51 S56 L57 S100 M101 S104	I17-W53 HydrophobicContact CD1-CH2 3.62Å; I17-W53 HydrophobicContact CD1-CZ2 4.4Å; I17-W53 HydrophobicContact CD1-CZ3 4.45Å; I17-W53 HydrophobicContact CG1-CH2 4.35Å; I17-W53 HydrophobicContact CG2-CH2 4.33Å; L20-W53 HydrophobicContact CD2-CZ2 3.94Å; M21-W53 HydrophobicContact CE-CZ2 4.24Å; S49-W53 WeakPolarHBondContact O-CB 3.42Å; S49-W53 PolarHBondContact O-N 3.35Å; G50-W53 PolarHBondContact O-N 2.89Å; L51-W53 VanDerWaalsContact C-N 3.33Å; L51-W53 PolarHBondContact O-N 3.38Å; W53-S56 PolarHBondContact O-N 3.48Å; W53-L57 WeakPolarHBondContact O-CB 3.5Å; W53-L57 PolarHBondContact O-N 2.78Å; W53-S100 VanDerWaalsContact CD2-CB 3.43Å; W53-S100 PolarHBondContact N-OG 3.31Å; W53-S100 VanDerWaalsContact N-OG 3.17Å; W53-M101 HydrophobicContact CH2-CG 3.93Å; W53-M101 HydrophobicContact CZ2-CG 3.97Å; W53-S104 PolarHBondContact NE1-OG 2.83Å
54	G	97.7	Very high	94.7	Very high	45 Å²	45	69.4 Å²	69.4	46%	0.464	38%	0.376	S	S	.	.	H	α-helix	trans	-58.9	-46.8	175.8	0	0	0	0	0	112.3	G50 L51 L57 F58	G50-G54 PolarHBondContact O-N 2.74Å; L51-G54 PolarHBondContact O-N 2.92Å; G54-L57 PolarHBondContact O-N 3.45Å; G54-F58 PolarHBondContact O-N 3.44Å
55	F	97.5	Very high	94	Very high	116 Å²	116	66.3 Å²	66.3	51%	0.509	36%	0.356	S	S	.	.	H	α-helix	trans	-69.5	-40.4	175.8	-70.2	-65.4	0	0	0	112.7	L51 S52 L57 F58 F59 L96	L51-F55 WeakPolarHBondContact O-CD2 3.46Å; L51-F55 PolarHBondContact O-N 3.3Å; S52-F55 PolarHBondContact O-N 2.86Å; F55-L57 VanDerWaalsContact C-N 3.32Å; F55-L57 PolarHBondContact O-N 3Å; F55-F58 WeakPolarHBondContact O-CB 3.11Å; F55-F58 PolarHBondContact O-N 3.27Å; F55-F59 VanDerWaalsContact O-CD2 3.24Å; F55-F59 WeakPolarHBondContact O-CD2 3.27Å; F55-F59 PolarHBondContact O-N 3.41Å; F55-F59 VanDerWaalsContact O-N 3.1Å; F55-L96 HydrophobicContact CB-CD1 3.76Å
56	S	97.4	Very high	93.3	Very high	3 Å²	3	66.3 Å²	66.3	2%	0.021	36%	0.358	C	S	.	.	H	α-helix	trans	-56.3	-47.9	173.2	161.4	0	0	0	0	110.6	S52 W53 F58 F59 F60 W93 S97	S52-S56 VanDerWaalsContact O-CB 3.29Å; S52-S56 WeakPolarHBondContact O-CB 3.36Å; S52-S56 PolarHBondContact O-N 3.24Å; W53-S56 PolarHBondContact O-N 3.48Å; S56-F58 VanDerWaalsContact C-N 3.31Å; S56-F58 PolarHBondContact O-N 3.43Å; S56-F59 PolarHBondContact O-N 3.04Å; S56-F60 WeakPolarHBondContact O-CB 3.28Å; S56-F60 PolarHBondContact O-N 3.1Å; S56-W93 VanDerWaalsContact O-CD1 3.26Å; S56-S97 PolarHBondContact OG-OG 3.34Å
57	L	95.8	Very high	92.5	Very high	96 Å²	96	72.9 Å²	72.9	50%	0.503	38%	0.375	S	S	.	.	H	α-helix	trans	-62	-39.7	177.9	-177.9	61.1	0	0	0	111.8	W53 G54 F55 F59 F60 L61	W53-L57 WeakPolarHBondContact O-CB 3.5Å; W53-L57 PolarHBondContact O-N 2.78Å; G54-L57 PolarHBondContact O-N 3.45Å; F55-L57 VanDerWaalsContact C-N 3.32Å; F55-L57 PolarHBondContact O-N 3Å; L57-F59 PolarHBondContact O-N 3.26Å; L57-F60 HydrophobicContact CD1-CD1 4.27Å; L57-F60 PolarHBondContact O-N 3.45Å; L57-L61 HydrophobicContact CD1-CG 4.32Å; L57-L61 HydrophobicContact CG-CD1 4.39Å; L57-L61 VanDerWaalsContact O-CG 3.31Å; L57-L61 WeakPolarHBondContact O-CG 3.37Å; L57-L61 PolarHBondContact O-N 3.23Å; L57-L61 VanDerWaalsContact O-N 3.12Å
58	F	96	Very high	91.8	Very high	139 Å²	139	75.6 Å²	75.6	61%	0.61	38%	0.375	S	S	*	.	H	α-helix	trans	-57.1	-49.4	175.5	174	-96	0	0	0	112	G54 F55 S56	G54-F58 PolarHBondContact O-N 3.44Å; F55-F58 WeakPolarHBondContact O-CB 3.11Å; F55-F58 PolarHBondContact O-N 3.27Å; S56-F58 VanDerWaalsContact C-N 3.31Å; S56-F58 PolarHBondContact O-N 3.43Å
59	F	94.4	Very high	91.2	Very high	41 Å²	41	73.9 Å²	73.9	18%	0.18	37%	0.368	C	S	.	.	H	α-helix	trans	-75	-26.8	178.2	-71	-73.3	0	0	0	113.3	F55 S56 L57 L61 D62 L82 A89 I92 W93 L96	F55-F59 VanDerWaalsContact O-CD2 3.24Å; F55-F59 WeakPolarHBondContact O-CD2 3.27Å; F55-F59 PolarHBondContact O-N 3.41Å; F55-F59 VanDerWaalsContact O-N 3.1Å; S56-F59 PolarHBondContact O-N 3.04Å; L57-F59 PolarHBondContact O-N 3.26Å; F59-L61 VanDerWaalsContact C-N 3.32Å; F59-L61 PolarHBondContact O-N 3.46Å; F59-D62 WeakPolarHBondContact O-CB 3.29Å; F59-D62 PolarHBondContact O-N 2.93Å; F59-L82 HydrophobicContact CE1-CD1 4.37Å; F59-A89 HydrophobicContact CD1-CB 3.99Å; F59-I92 HydrophobicContact CD1-CG2 4.29Å; F59-I92 HydrophobicContact CD2-CG2 3.63Å; F59-I92 HydrophobicContact CE1-CD1 4.36Å; F59-I92 HydrophobicContact CE1-CG2 4.19Å; F59-I92 HydrophobicContact CE2-CG2 3.53Å; F59-I92 HydrophobicContact CG-CB 4.49Å; F59-I92 HydrophobicContact CG-CG2 4.02Å; F59-I92 HydrophobicContact CZ-CG2 3.82Å; F59-W93 HydrophobicContact CB-CB 3.73Å; F59-L96 HydrophobicContact CD2-CD1 3.68Å; F59-L96 HydrophobicContact CE2-CD1 3.91Å
60	F	93.4	Very high	90.7	Very high	74 Å²	74	77.6 Å²	77.6	33%	0.325	39%	0.391	S	S	.	.	H	α-helix	trans	-63.9	-38.1	174.7	178.4	-110.5	0	0	0	112.7	L10 S56 L57 D62 W93	L10-F60 HydrophobicContact CD1-CZ 3.73Å; S56-F60 WeakPolarHBondContact O-CB 3.28Å; S56-F60 PolarHBondContact O-N 3.1Å; L57-F60 HydrophobicContact CD1-CD1 4.27Å; L57-F60 PolarHBondContact O-N 3.45Å; F60-D62 PolarHBondContact O-N 2.88Å; F60-W93 HydrophobicContact CB-CG 4.22Å; F60-W93 HydrophobicContact CD2-CD2 4.07Å; F60-W93 AromaticContact CD2-CE2 3.37Å; F60-W93 HydrophobicContact CD2-CH2 4.12Å; F60-W93 AromaticContact CD2-CZ2 3.4Å; F60-W93 HydrophobicContact CD2-CZ2 3.4Å; F60-W93 VanDerWaalsContact CD2-CZ2 3.4Å; F60-W93 AromaticContact CD2-NE1 3.51Å; F60-W93 HydrophobicContact CE2-CH2 4.18Å; F60-W93 AromaticContact CE2-CZ2 3.69Å; F60-W93 HydrophobicContact CE2-CZ2 3.69Å; F60-W93 AromaticContact CG-NE1 3.88Å
61	L	91.9	Very high	90.3	Very high	129 Å²	129	79.2 Å²	79.2	68%	0.675	40%	0.399	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.9	-17.3	178.3	-67.5	173.8	0	0	0	112.2	L57 F59 K63	L57-L61 HydrophobicContact CD1-CG 4.32Å; L57-L61 HydrophobicContact CG-CD1 4.39Å; L57-L61 VanDerWaalsContact O-CG 3.31Å; L57-L61 WeakPolarHBondContact O-CG 3.37Å; L57-L61 PolarHBondContact O-N 3.23Å; L57-L61 VanDerWaalsContact O-N 3.12Å; F59-L61 VanDerWaalsContact C-N 3.32Å; F59-L61 PolarHBondContact O-N 3.46Å; L61-K63 PolarHBondContact O-N 3.45Å
62	D	87.7	Confident	89.9	Confident	78 Å²	78	77.8 Å²	77.8	42%	0.417	40%	0.402	S	S	.	.	S	Bend	trans	-81.8	95.1	171.4	-171.9	36.5	0	0	0	110.8	F59 F60 Q64 A89	F59-D62 WeakPolarHBondContact O-CB 3.29Å; F59-D62 PolarHBondContact O-N 2.93Å; F60-D62 PolarHBondContact O-N 2.88Å; D62-Q64 PolarHBondContact O-N 2.91Å; D62-Q64 PolarHBondContact OD2-NE2 2.94Å; D62-A89 VanDerWaalsContact OD2-CB 3.27Å; D62-A89 WeakPolarHBondContact OD2-CB 3.28Å
63	K	76	Confident	89.6	Confident	159 Å²	159	81.9 Å²	81.9	69%	0.691	42%	0.42	S	S	*	.			trans	-81.1	104.9	-172.2	-172.3	176.9	-175.8	172.5	0	111.9	L61 L65	L61-K63 PolarHBondContact O-N 3.45Å; K63-L65 WeakPolarHBondContact CE-O 3.36Å
64	Q	81.3	Confident	89.2	Confident	23 Å²	23	80.4 Å²	80.4	11%	0.107	42%	0.417	C	S	.	.			trans	-115.1	19.2	179.2	-56.1	-166.2	-0.8	0	0	114.7	D62 L77 G79 A89	D62-Q64 PolarHBondContact O-N 2.91Å; D62-Q64 PolarHBondContact OD2-NE2 2.94Å; Q64-L77 CarbonylContact O-C 3.58Å; Q64-G79 VanDerWaalsContact OE1-CA 3.3Å; Q64-A89 VanDerWaalsContact NE2-CB 3.34Å
65	L	83.7	Confident	88.7	Confident	39 Å²	39	87.1 Å²	87.1	20%	0.204	43%	0.429	C	S	.	.			trans	-146.8	162.3	-178.7	72.9	92.2	0	0	0	113.6	K63 W67 H90	K63-L65 WeakPolarHBondContact CE-O 3.36Å; L65-W67 HydrophobicContact CD1-CG 4.2Å; L65-H90 WeakPolarHBondContact CD2-CE1 3.34Å; L65-H90 VanDerWaalsContact CD2-ND1 3.31Å; L65-H90 WeakPolarHBondContact CD2-ND1 3.23Å
66	S	82.5	Confident	88.4	Confident	30 Å²	30	89.4 Å²	89.4	21%	0.21	44%	0.441	C	S	.	.			trans	-143.5	120.7	170	178.2	0	0	0	0	112.7	R68 S74 L77	S66-R68 PolarHBondContact O-N 2.8Å; S66-R68 PolarHBondContact OG-N 2.85Å; S66-S74 PolarHBondContact N-OG 3.26Å; S66-S74 PolarHBondContact O-OG 3.17Å; S66-L77 VanDerWaalsContact CB-CD1 3.46Å
67	W	80.5	Confident	87.9	Confident	166 Å²	166	93.5 Å²	93.5	63%	0.629	46%	0.462	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.8	-4.6	173.2	-68.5	98.9	0	0	0	114.2	P9 L65	P9-W67 HydrophobicContact CB-CZ2 4.17Å; P9-W67 HydrophobicContact CG-CD2 3.64Å; P9-W67 VanDerWaalsContact CG-CE2 3.5Å; P9-W67 HydrophobicContact CG-CE3 4.02Å; P9-W67 HydrophobicContact CG-CG 4.03Å; P9-W67 HydrophobicContact CG-CH2 4.16Å; P9-W67 HydrophobicContact CG-CZ2 3.79Å; P9-W67 HydrophobicContact CG-CZ3 4.26Å; L65-W67 HydrophobicContact CD1-CG 4.2Å
68	R	82.7	Confident	87.5	Confident	146 Å²	146	93 Å²	93	55%	0.551	46%	0.46	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.8	-10.8	-177.1	-65.8	-174.3	-172	170.6	3.7	113.3	Q4 S66	Q4-R68 VanDerWaalsContact CD-O 3.25Å; Q4-R68 PolarHBondContact NE2-O 3.28Å; Q4-R68 PolarHBondContact OE1-O 2.83Å; Q4-R68 VanDerWaalsContact OE1-O 3.08Å; S66-R68 PolarHBondContact O-N 2.8Å; S66-R68 PolarHBondContact OG-N 2.85Å
69	V	86	Confident	87.1	Confident	60 Å²	60	87.8 Å²	87.8	36%	0.364	45%	0.445	S	S	.	.	S	Bend	trans	-116.9	168.3	-175.9	-61.1	0	0	0	0	110.1	Q73	V69-Q73 HydrophobicContact CB-CB 3.74Å; V69-Q73 HydrophobicContact CG2-CB 3.79Å
70	T	88.9	Confident	86.8	Confident	82 Å²	82	89.8 Å²	89.8	50%	0.503	47%	0.469	S	S	.	.			trans	-62.3	155.8	173.2	62.7	0	0	0	0	110.4	A72 Q73 S74	T70-A72 PolarHBondContact O-N 3.36Å; T70-A72 VanDerWaalsContact O-N 3.16Å; T70-Q73 VanDerWaalsContact N-OE1 3.12Å; T70-Q73 PolarHBondContact O-N 2.84Å; T70-Q73 WeakPolarHBondContact OG1-CG 3.39Å; T70-Q73 PolarHBondContact OG1-N 3.25Å; T70-Q73 PolarHBondContact OG1-OE1 3.44Å; T70-S74 PolarHBondContact O-N 3.43Å
71	A	88.3	Confident	86.8	Confident	79 Å²	79	89.2 Å²	89.2	65%	0.653	47%	0.474	S	S	*	.	H	α-helix	trans	-56.5	-34.3	178.5	0	0	0	0	0	112.7	S74 R75	A71-S74 PolarHBondContact O-N 3.46Å; A71-R75 VanDerWaalsContact O-CG 3.3Å; A71-R75 WeakPolarHBondContact O-CG 3.48Å; A71-R75 PolarHBondContact O-N 2.76Å; A71-R75 VanDerWaalsContact O-N 3.1Å
72	A	91	Very high	86.7	Confident	68 Å²	68	88.1 Å²	88.1	56%	0.562	47%	0.468	S	S	*	.	H	α-helix	trans	-64.3	-45.7	175.2	0	0	0	0	0	112.1	T70 R75	T70-A72 PolarHBondContact O-N 3.36Å; T70-A72 VanDerWaalsContact O-N 3.16Å; A72-R75 WeakPolarHBondContact O-CB 3.41Å; A72-R75 PolarHBondContact O-N 3.19Å
73	Q	90.6	Very high	86.8	Confident	96 Å²	96	88.8 Å²	88.8	45%	0.449	47%	0.47	S	S	.	.	H	α-helix	trans	-68.4	-35.5	176.3	-71	168.8	-48.8	0	0	112.2	V69 T70 R75 E76	V69-Q73 HydrophobicContact CB-CB 3.74Å; V69-Q73 HydrophobicContact CG2-CB 3.79Å; T70-Q73 VanDerWaalsContact N-OE1 3.12Å; T70-Q73 PolarHBondContact O-N 2.84Å; T70-Q73 WeakPolarHBondContact OG1-CG 3.39Å; T70-Q73 PolarHBondContact OG1-N 3.25Å; T70-Q73 PolarHBondContact OG1-OE1 3.44Å; Q73-R75 VanDerWaalsContact C-N 3.26Å; Q73-R75 PolarHBondContact O-N 3.23Å; Q73-E76 WeakPolarHBondContact O-CB 3.43Å; Q73-E76 PolarHBondContact O-N 2.91Å
74	S	89.2	Confident	87.5	Confident	19 Å²	19	85.5 Å²	85.5	13%	0.133	47%	0.473	C	S	.	.	H	α-helix	trans	-66.6	-31.4	176.6	-171.3	0	0	0	0	111.6	S66 T70 A71 E76 L77 N78	S66-S74 PolarHBondContact N-OG 3.26Å; S66-S74 PolarHBondContact O-OG 3.17Å; T70-S74 PolarHBondContact O-N 3.43Å; A71-S74 PolarHBondContact O-N 3.46Å; S74-E76 PolarHBondContact O-N 3.5Å; S74-L77 VanDerWaalsContact O-CB 3.31Å; S74-L77 WeakPolarHBondContact O-CB 3.5Å; S74-L77 PolarHBondContact O-N 3.45Å; S74-N78 PolarHBondContact O-OD1 2.95Å
75	R	89	Confident	87.9	Confident	187 Å²	187	93.5 Å²	93.5	71%	0.706	51%	0.507	S	S	*	.	H	α-helix	trans	-62.8	-25.2	176.5	-77.6	169	174.9	-105.1	-1.1	113.1	A71 A72 Q73 L77 N78	A71-R75 VanDerWaalsContact O-CG 3.3Å; A71-R75 WeakPolarHBondContact O-CG 3.48Å; A71-R75 PolarHBondContact O-N 2.76Å; A71-R75 VanDerWaalsContact O-N 3.1Å; A72-R75 WeakPolarHBondContact O-CB 3.41Å; A72-R75 PolarHBondContact O-N 3.19Å; Q73-R75 VanDerWaalsContact C-N 3.26Å; Q73-R75 PolarHBondContact O-N 3.23Å; R75-L77 PolarHBondContact O-N 2.99Å; R75-N78 WeakPolarHBondContact O-CB 3.3Å; R75-N78 PolarHBondContact O-N 2.65Å
76	E	90.2	Very high	88.3	Confident	164 Å²	164	98.3 Å²	98.3	77%	0.766	53%	0.527	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.2	-16.2	174.4	-60.3	176.8	176.8	0	0	112.3	Q73 S74	Q73-E76 WeakPolarHBondContact O-CB 3.43Å; Q73-E76 PolarHBondContact O-N 2.91Å; S74-E76 PolarHBondContact O-N 3.5Å
77	L	86.9	Confident	88.7	Confident	89 Å²	89	102.4 Å²	102.4	47%	0.466	54%	0.538	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.8	-7.9	176.7	-55.7	174.1	0	0	0	113.2	Q64 S66 S74 R75 G79	Q64-L77 CarbonylContact O-C 3.58Å; S66-L77 VanDerWaalsContact CB-CD1 3.46Å; S74-L77 VanDerWaalsContact O-CB 3.31Å; S74-L77 WeakPolarHBondContact O-CB 3.5Å; S74-L77 PolarHBondContact O-N 3.45Å; R75-L77 PolarHBondContact O-N 2.99Å; L77-G79 PolarHBondContact O-N 3.19Å
78	N	88.1	Confident	89.3	Confident	86 Å²	86	95.1 Å²	95.1	46%	0.46	51%	0.512	S	S	.	.			trans	-63	131.7	-179.2	-72.7	24.7	0	0	0	109.9	S74 R75	S74-N78 PolarHBondContact O-OD1 2.95Å; R75-N78 WeakPolarHBondContact O-CB 3.3Å; R75-N78 PolarHBondContact O-N 2.65Å
79	G	86.5	Confident	89.8	Confident	28 Å²	28	88.2 Å²	88.2	29%	0.289	49%	0.486	S	S	.	.			trans	-72.6	175.2	173.7	0	0	0	0	0	112.5	Q64 L77	Q64-G79 VanDerWaalsContact OE1-CA 3.3Å; L77-G79 PolarHBondContact O-N 3.19Å
80	A	89.6	Confident	90.1	Very high	83 Å²	83	87.4 Å²	87.4	69%	0.686	48%	0.478	S	S	*	.			trans	-66.8	137.6	170.6	0	0	0	0	0	110.5	L82	A80-L82 PolarHBondContact O-N 3.47Å
81	C	92	Very high	90.4	Very high	63 Å²	63	86.3 Å²	86.3	43%	0.426	47%	0.469	S	S	.	.			trans	-64.3	128.4	175.5	-55.3	0	0	0	0	110.7	F86 Y87	C81-F86 PolarHBondContact SG-O 2.99Å; C81-F86 VanDerWaalsContact SG-O 3.39Å; C81-Y87 CarbonylContact C-O 3.52Å
82	L	89.6	Confident	90.7	Very high	106 Å²	106	83.6 Å²	83.6	56%	0.555	44%	0.443	S	S	*	.			trans	-93.3	-46.5	-174.1	-61.7	174.5	0	0	0	112.4	F59 A80 Y87 A89 I92	F59-L82 HydrophobicContact CE1-CD1 4.37Å; A80-L82 PolarHBondContact O-N 3.47Å; L82-Y87 PolarHBondContact N-O 2.66Å; L82-A89 HydrophobicContact CD1-CB 4.05Å; L82-I92 HydrophobicContact CB-CD1 4.12Å; L82-I92 HydrophobicContact CD1-CD1 3.96Å
83	I	91	Very high	90.9	Very high	91 Å²	91	82 Å²	82	47%	0.467	42%	0.423	S	S	.	.	B	Isolated β-bridge	trans	-101.6	125	-175.6	-59.5	173.4	0	0	0	109.8	K85 F86 Y87 I92	I83-K85 PolarHBondContact O-N 3.44Å; I83-F86 PolarHBondContact O-N 2.95Å; I83-Y87 HydrophobicContact CB-CD2 4.22Å; I83-Y87 HydrophobicContact CG2-CD2 4.19Å; I83-Y87 PolarHBondContact N-O 3.16Å; I83-Y87 VanDerWaalsContact N-O 3.15Å; I83-Y87 PolarHBondContact O-N 2.67Å; I83-Y87 VanDerWaalsContact O-N 3.1Å; I83-I92 HydrophobicContact CD1-CD1 3.6Å; I83-I92 HydrophobicContact CD1-CG1 3.69Å; I83-I92 HydrophobicContact CG1-CD1 3.9Å; I83-I92 HydrophobicContact CG1-CG1 4.42Å
84	A	89.3	Confident	91.1	Very high	90 Å²	90	81.9 Å²	81.9	74%	0.744	42%	0.422	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.9	20.5	178.8	0	0	0	0	0	114.4	F86	A84-F86 PolarHBondContact O-N 3.18Å
85	K	90.3	Very high	91.5	Very high	191 Å²	191	87.6 Å²	87.6	83%	0.83	45%	0.445	S	S	*	.	T	Hydrogen-bonded Turn	trans	54.2	26.6	-169.6	-54.8	-179.5	178.4	-179.8	0	113.4	I83	I83-K85 PolarHBondContact O-N 3.44Å
86	F	91.5	Very high	91.9	Very high	141 Å²	141	80.2 Å²	80.2	62%	0.618	42%	0.419	S	S	*	.	T	Hydrogen-bonded Turn	trans	-120.3	-53	-178.9	-170.9	-93.1	0	0	0	111.7	C81 I83 A84	C81-F86 PolarHBondContact SG-O 2.99Å; C81-F86 VanDerWaalsContact SG-O 3.39Å; I83-F86 PolarHBondContact O-N 2.95Å; A84-F86 PolarHBondContact O-N 3.18Å
87	Y	92.8	Very high	92.3	Very high	115 Å²	115	73.1 Å²	73.1	45%	0.451	39%	0.388	S	S	.	.	B	Isolated β-bridge	trans	-91.7	128.9	-177	-57.3	-75.4	0	0	0	111.9	C81 L82 I83 D91	C81-Y87 CarbonylContact C-O 3.52Å; L82-Y87 PolarHBondContact N-O 2.66Å; I83-Y87 HydrophobicContact CB-CD2 4.22Å; I83-Y87 HydrophobicContact CG2-CD2 4.19Å; I83-Y87 PolarHBondContact N-O 3.16Å; I83-Y87 VanDerWaalsContact N-O 3.15Å; I83-Y87 PolarHBondContact O-N 2.67Å; I83-Y87 VanDerWaalsContact O-N 3.1Å; Y87-D91 WeakPolarHBondContact CA-OD2 3.48Å; Y87-D91 HydrophobicContact CD1-CB 3.88Å; Y87-D91 HydrophobicContact CG-CB 4.41Å
88	D	92.3	Very high	92.8	Very high	13 Å²	13	71.8 Å²	71.8	7%	0.07	39%	0.39	C	S	.	.			trans	-87.5	-175.4	172.4	69.8	22.2	0	0	0	112.1	H90 D91 I92	D88-H90 VanDerWaalsContact C-N 3.27Å; D88-H90 PolarHBondContact O-N 3.38Å; D88-H90 WeakPolarHBondContact OD1-CA 3.43Å; D88-H90 VanDerWaalsContact OD1-CB 3.28Å; D88-H90 WeakPolarHBondContact OD1-CB 3.33Å; D88-H90 PolarHBondContact OD1-N 3.28Å; D88-D91 PolarHBondContact N-OD2 3.44Å; D88-D91 PolarHBondContact O-N 3.07Å; D88-D91 PolarHBondContact OD1-N 3.49Å; D88-I92 WeakPolarHBondContact O-CD1 3.27Å; D88-I92 VanDerWaalsContact O-CG1 3.24Å; D88-I92 WeakPolarHBondContact O-CG1 3.23Å; D88-I92 PolarHBondContact O-N 3.48Å; D88-I92 VanDerWaalsContact O-N 3.17Å
89	A	92.5	Very high	93.3	Very high	1 Å²	1	70.6 Å²	70.6	1%	0.008	38%	0.383	C	S	.	.	H	α-helix	trans	-65.1	-33.5	179.4	0	0	0	0	0	112.5	F59 D62 Q64 L82 I92 W93	F59-A89 HydrophobicContact CD1-CB 3.99Å; D62-A89 VanDerWaalsContact OD2-CB 3.27Å; D62-A89 WeakPolarHBondContact OD2-CB 3.28Å; Q64-A89 VanDerWaalsContact NE2-CB 3.34Å; L82-A89 HydrophobicContact CD1-CB 4.05Å; A89-I92 PolarHBondContact O-N 3.27Å; A89-W93 PolarHBondContact O-N 3.39Å
90	H	92.5	Very high	93.9	Very high	44 Å²	44	69.2 Å²	69.2	20%	0.204	37%	0.369	C	S	.	.	H	α-helix	trans	-70.2	-39.8	179.7	173.8	72.3	0	0	0	111.5	L65 D88 I92 W93 H94	L65-H90 WeakPolarHBondContact CD2-CE1 3.34Å; L65-H90 VanDerWaalsContact CD2-ND1 3.31Å; L65-H90 WeakPolarHBondContact CD2-ND1 3.23Å; D88-H90 VanDerWaalsContact C-N 3.27Å; D88-H90 PolarHBondContact O-N 3.38Å; D88-H90 WeakPolarHBondContact OD1-CA 3.43Å; D88-H90 VanDerWaalsContact OD1-CB 3.28Å; D88-H90 WeakPolarHBondContact OD1-CB 3.33Å; D88-H90 PolarHBondContact OD1-N 3.28Å; H90-I92 VanDerWaalsContact C-N 3.34Å; H90-W93 AromaticContact CE1-CE3 3.6Å; H90-W93 AromaticContact CE1-CZ3 3.39Å; H90-W93 WeakPolarHBondContact CE1-CZ3 3.33Å; H90-W93 AromaticContact ND1-CE3 3.37Å; H90-W93 AromaticContact ND1-CZ3 3.62Å; H90-W93 WeakPolarHBondContact O-CB 3.3Å; H90-W93 PolarHBondContact O-N 3.39Å; H90-H94 AromaticContact CD2-CD2 3.81Å; H90-H94 AromaticContact CE1-CD2 3.51Å; H90-H94 AromaticContact CE1-NE2 3.14Å; H90-H94 PolarHBondContact CE1-NE2 3.04Å; H90-H94 AromaticContact NE2-CD2 3.34Å; H90-H94 PolarHBondContact NE2-CD2 3.49Å; H90-H94 VanDerWaalsContact NE2-CD2 3.34Å; H90-H94 AromaticContact NE2-NE2 3.16Å; H90-H94 PolarHBondContact NE2-NE2 3.01Å; H90-H94 VanDerWaalsContact NE2-NE2 3.16Å; H90-H94 PolarHBondContact O-N 3.2Å
91	D	94.5	Very high	94.3	Very high	59 Å²	59	68.6 Å²	68.6	32%	0.316	35%	0.353	S	S	.	.	H	α-helix	trans	-61.5	-43.2	172.2	-65.7	-42	0	0	0	111.6	Y87 D88 W93 H94 F95	Y87-D91 WeakPolarHBondContact CA-OD2 3.48Å; Y87-D91 HydrophobicContact CD1-CB 3.88Å; Y87-D91 HydrophobicContact CG-CB 4.41Å; D88-D91 PolarHBondContact N-OD2 3.44Å; D88-D91 PolarHBondContact O-N 3.07Å; D88-D91 PolarHBondContact OD1-N 3.49Å; D91-W93 VanDerWaalsContact C-N 3.34Å; D91-H94 PolarHBondContact O-N 3.41Å; D91-F95 WeakPolarHBondContact O-CB 3.45Å; D91-F95 PolarHBondContact O-N 2.88Å
92	I	95.1	Very high	94.6	Very high	21 Å²	21	72 Å²	72	11%	0.108	36%	0.36	C	S	.	.	H	α-helix	trans	-63.6	-42.3	177	-65.6	164.9	0	0	0	110.4	F59 L82 I83 D88 A89 H90 H94 F95 L96	F59-I92 HydrophobicContact CD1-CG2 4.29Å; F59-I92 HydrophobicContact CD2-CG2 3.63Å; F59-I92 HydrophobicContact CE1-CD1 4.36Å; F59-I92 HydrophobicContact CE1-CG2 4.19Å; F59-I92 HydrophobicContact CE2-CG2 3.53Å; F59-I92 HydrophobicContact CG-CB 4.49Å; F59-I92 HydrophobicContact CG-CG2 4.02Å; F59-I92 HydrophobicContact CZ-CG2 3.82Å; L82-I92 HydrophobicContact CB-CD1 4.12Å; L82-I92 HydrophobicContact CD1-CD1 3.96Å; I83-I92 HydrophobicContact CD1-CD1 3.6Å; I83-I92 HydrophobicContact CD1-CG1 3.69Å; I83-I92 HydrophobicContact CG1-CD1 3.9Å; I83-I92 HydrophobicContact CG1-CG1 4.42Å; D88-I92 WeakPolarHBondContact O-CD1 3.27Å; D88-I92 VanDerWaalsContact O-CG1 3.24Å; D88-I92 WeakPolarHBondContact O-CG1 3.23Å; D88-I92 PolarHBondContact O-N 3.48Å; D88-I92 VanDerWaalsContact O-N 3.17Å; A89-I92 PolarHBondContact O-N 3.27Å; H90-I92 VanDerWaalsContact C-N 3.34Å; I92-H94 PolarHBondContact O-N 3.12Å; I92-F95 PolarHBondContact O-N 3.16Å; I92-L96 HydrophobicContact CG2-CD1 3.7Å; I92-L96 HydrophobicContact CG2-CG 4.21Å; I92-L96 WeakPolarHBondContact O-CB 3.38Å; I92-L96 WeakPolarHBondContact O-CG 3.37Å; I92-L96 PolarHBondContact O-N 3Å
93	W	95.7	Very high	95	Very high	35 Å²	35	67.6 Å²	67.6	13%	0.133	34%	0.337	C	S	.	.	H	α-helix	trans	-55.8	-50.4	172.5	163.6	59.4	0	0	0	111.4	S56 F59 F60 A89 H90 D91 F95 L96 S97	S56-W93 VanDerWaalsContact O-CD1 3.26Å; F59-W93 HydrophobicContact CB-CB 3.73Å; F60-W93 HydrophobicContact CB-CG 4.22Å; F60-W93 HydrophobicContact CD2-CD2 4.07Å; F60-W93 AromaticContact CD2-CE2 3.37Å; F60-W93 HydrophobicContact CD2-CH2 4.12Å; F60-W93 AromaticContact CD2-CZ2 3.4Å; F60-W93 HydrophobicContact CD2-CZ2 3.4Å; F60-W93 VanDerWaalsContact CD2-CZ2 3.4Å; F60-W93 AromaticContact CD2-NE1 3.51Å; F60-W93 HydrophobicContact CE2-CH2 4.18Å; F60-W93 AromaticContact CE2-CZ2 3.69Å; F60-W93 HydrophobicContact CE2-CZ2 3.69Å; F60-W93 AromaticContact CG-NE1 3.88Å; A89-W93 PolarHBondContact O-N 3.39Å; H90-W93 AromaticContact CE1-CE3 3.6Å; H90-W93 AromaticContact CE1-CZ3 3.39Å; H90-W93 WeakPolarHBondContact CE1-CZ3 3.33Å; H90-W93 AromaticContact ND1-CE3 3.37Å; H90-W93 AromaticContact ND1-CZ3 3.62Å; H90-W93 WeakPolarHBondContact O-CB 3.3Å; H90-W93 PolarHBondContact O-N 3.39Å; D91-W93 VanDerWaalsContact C-N 3.34Å; W93-F95 VanDerWaalsContact C-N 3.34Å; W93-F95 PolarHBondContact O-N 2.82Å; W93-L96 PolarHBondContact O-N 2.82Å; W93-S97 PolarHBondContact NE1-OG 3.1Å; W93-S97 VanDerWaalsContact O-CB 3.27Å; W93-S97 WeakPolarHBondContact O-CB 3.27Å; W93-S97 PolarHBondContact O-N 3.16Å; W93-S97 PolarHBondContact O-OG 3.25Å
94	H	95.3	Very high	95.4	Very high	94 Å²	94	63.2 Å²	63.2	44%	0.435	32%	0.315	S	S	.	.	H	α-helix	trans	-59.7	-44.6	179.1	-86.6	-51.5	0	0	0	112.2	H90 D91 I92 S97 A98	H90-H94 AromaticContact CD2-CD2 3.81Å; H90-H94 AromaticContact CE1-CD2 3.51Å; H90-H94 AromaticContact CE1-NE2 3.14Å; H90-H94 PolarHBondContact CE1-NE2 3.04Å; H90-H94 AromaticContact NE2-CD2 3.34Å; H90-H94 PolarHBondContact NE2-CD2 3.49Å; H90-H94 VanDerWaalsContact NE2-CD2 3.34Å; H90-H94 AromaticContact NE2-NE2 3.16Å; H90-H94 PolarHBondContact NE2-NE2 3.01Å; H90-H94 VanDerWaalsContact NE2-NE2 3.16Å; H90-H94 PolarHBondContact O-N 3.2Å; D91-H94 PolarHBondContact O-N 3.41Å; I92-H94 PolarHBondContact O-N 3.12Å; H94-S97 PolarHBondContact O-N 3.14Å; H94-A98 PolarHBondContact O-N 2.98Å
95	F	96.9	Very high	95.8	Very high	138 Å²	138	64.4 Å²	64.4	61%	0.605	30%	0.303	S	S	*	.	H	α-helix	trans	-62	-49.7	178.6	-178.6	-105.5	0	0	0	112.3	D91 I92 W93 A98 I99	D91-F95 WeakPolarHBondContact O-CB 3.45Å; D91-F95 PolarHBondContact O-N 2.88Å; I92-F95 PolarHBondContact O-N 3.16Å; W93-F95 VanDerWaalsContact C-N 3.34Å; W93-F95 PolarHBondContact O-N 2.82Å; F95-A98 PolarHBondContact O-N 3.49Å; F95-I99 HydrophobicContact CD1-CD1 4.03Å; F95-I99 HydrophobicContact CE1-CD1 3.55Å; F95-I99 HydrophobicContact CE2-CD1 4.47Å; F95-I99 HydrophobicContact CZ-CD1 3.81Å; F95-I99 PolarHBondContact O-N 3.44Å
96	L	97.7	Very high	96.2	Very high	32 Å²	32	57.6 Å²	57.6	17%	0.168	28%	0.276	C	S	.	.	H	α-helix	trans	-65.1	-42	179.1	-70.5	172.7	0	0	0	111.7	F55 F59 I92 W93 A98 I99 S100	F55-L96 HydrophobicContact CB-CD1 3.76Å; F59-L96 HydrophobicContact CD2-CD1 3.68Å; F59-L96 HydrophobicContact CE2-CD1 3.91Å; I92-L96 HydrophobicContact CG2-CD1 3.7Å; I92-L96 HydrophobicContact CG2-CG 4.21Å; I92-L96 WeakPolarHBondContact O-CB 3.38Å; I92-L96 WeakPolarHBondContact O-CG 3.37Å; I92-L96 PolarHBondContact O-N 3Å; W93-L96 PolarHBondContact O-N 2.82Å; L96-A98 VanDerWaalsContact C-N 3.3Å; L96-A98 PolarHBondContact O-N 3.43Å; L96-I99 WeakPolarHBondContact O-CB 3.39Å; L96-I99 PolarHBondContact O-N 2.92Å; L96-I99 VanDerWaalsContact O-N 3.16Å; L96-S100 PolarHBondContact O-N 3.31Å; L96-S100 PolarHBondContact O-OG 3.21Å
97	S	97.6	Very high	96.5	Very high	15 Å²	15	51.5 Å²	51.5	11%	0.105	25%	0.25	C	C	.	.	H	α-helix	trans	-62.3	-37.7	178.9	-56.2	0	0	0	0	112.4	S56 W93 H94 S100 M101	S56-S97 PolarHBondContact OG-OG 3.34Å; W93-S97 PolarHBondContact NE1-OG 3.1Å; W93-S97 VanDerWaalsContact O-CB 3.27Å; W93-S97 WeakPolarHBondContact O-CB 3.27Å; W93-S97 PolarHBondContact O-N 3.16Å; W93-S97 PolarHBondContact O-OG 3.25Å; H94-S97 PolarHBondContact O-N 3.14Å; S97-S100 PolarHBondContact O-N 2.91Å; S97-M101 WeakPolarHBondContact O-CG 3.31Å; S97-M101 PolarHBondContact O-N 3.48Å
98	A	98.4	Very high	96.6	Very high	62 Å²	62	48.1 Å²	48.1	51%	0.512	24%	0.239	S	C	.	.	H	α-helix	trans	-62.3	-43.7	175.1	0	0	0	0	0	111.4	H94 F95 L96 F102	H94-A98 PolarHBondContact O-N 2.98Å; F95-A98 PolarHBondContact O-N 3.49Å; L96-A98 VanDerWaalsContact C-N 3.3Å; L96-A98 PolarHBondContact O-N 3.43Å; A98-F102 WeakPolarHBondContact O-CB 3.14Å; A98-F102 PolarHBondContact O-N 2.72Å
99	I	98.6	Very high	96.8	Very high	60 Å²	60	53.8 Å²	53.8	31%	0.308	27%	0.269	S	S	.	.	H	α-helix	trans	-61.8	-46.1	173.6	-67.1	166.4	0	0	0	110.4	F95 L96 M101 F102 L103	F95-I99 HydrophobicContact CD1-CD1 4.03Å; F95-I99 HydrophobicContact CE1-CD1 3.55Å; F95-I99 HydrophobicContact CE2-CD1 4.47Å; F95-I99 HydrophobicContact CZ-CD1 3.81Å; F95-I99 PolarHBondContact O-N 3.44Å; L96-I99 WeakPolarHBondContact O-CB 3.39Å; L96-I99 PolarHBondContact O-N 2.92Å; L96-I99 VanDerWaalsContact O-N 3.16Å; I99-M101 PolarHBondContact O-N 2.9Å; I99-F102 PolarHBondContact O-N 3.37Å; I99-L103 HydrophobicContact CG2-CD1 3.69Å; I99-L103 HydrophobicContact CG2-CG 4.23Å; I99-L103 VanDerWaalsContact O-CG 3.3Å; I99-L103 WeakPolarHBondContact O-CG 3.44Å; I99-L103 PolarHBondContact O-N 3.48Å
100	S	98.6	Very high	96.9	Very high	0 Å²	0	54.6 Å²	54.6	0%	0	27%	0.273	C	S	.	.	H	α-helix	trans	-59.6	-46.1	-179.5	-56	0	0	0	0	112.4	S52 W53 L96 S97 L103 S104	S52-S100 VanDerWaalsContact CB-OG 3.28Å; S52-S100 WeakPolarHBondContact CB-OG 3.24Å; S52-S100 PolarHBondContact O-OG 3.35Å; S52-S100 WeakPolarHBondContact OG-CA 3.33Å; S52-S100 WeakPolarHBondContact OG-CB 3.29Å; S52-S100 PolarHBondContact OG-OG 3.35Å; W53-S100 VanDerWaalsContact CD2-CB 3.43Å; W53-S100 PolarHBondContact N-OG 3.31Å; W53-S100 VanDerWaalsContact N-OG 3.17Å; L96-S100 PolarHBondContact O-N 3.31Å; L96-S100 PolarHBondContact O-OG 3.21Å; S97-S100 PolarHBondContact O-N 2.91Å; S100-L103 PolarHBondContact O-N 3.19Å; S100-S104 WeakPolarHBondContact O-CB 3.39Å; S100-S104 PolarHBondContact O-N 3.39Å; S100-S104 PolarHBondContact O-OG 3.48Å
101	M	98	Very high	97	Very high	70 Å²	70	52.5 Å²	52.5	35%	0.345	26%	0.264	S	S	.	.	H	α-helix	trans	-62.5	-46.1	175.2	-73.8	-176.1	63.1	0	0	112	I17 L20 W53 S97 I99 L103 S104 F105	I17-M101 HydrophobicContact CD1-CG 4.37Å; I17-M101 HydrophobicContact CD1-SD 4.21Å; L20-M101 HydrophobicContact CD2-CG 4.49Å; W53-M101 HydrophobicContact CH2-CG 3.93Å; W53-M101 HydrophobicContact CZ2-CG 3.97Å; S97-M101 WeakPolarHBondContact O-CG 3.31Å; S97-M101 PolarHBondContact O-N 3.48Å; I99-M101 PolarHBondContact O-N 2.9Å; M101-L103 PolarHBondContact O-N 3.26Å; M101-S104 WeakPolarHBondContact O-CB 3.4Å; M101-S104 PolarHBondContact O-N 3.08Å; M101-F105 HydrophobicContact CB-CE2 4.43Å; M101-F105 HydrophobicContact CE-CE2 4Å; M101-F105 HydrophobicContact CE-CZ 4.41Å; M101-F105 WeakPolarHBondContact O-CD2 2.99Å; M101-F105 PolarHBondContact O-N 2.88Å
102	F	98.5	Very high	97	Very high	133 Å²	133	51.2 Å²	51.2	58%	0.583	26%	0.257	S	S	*	.	H	α-helix	trans	-57	-49.1	177.3	172.3	-98.5	0	0	0	111.6	A98 I99 S104 F105 L106	A98-F102 WeakPolarHBondContact O-CB 3.14Å; A98-F102 PolarHBondContact O-N 2.72Å; I99-F102 PolarHBondContact O-N 3.37Å; F102-S104 VanDerWaalsContact C-N 3.33Å; F102-S104 PolarHBondContact O-N 3.36Å; F102-F105 PolarHBondContact O-N 3.23Å; F102-L106 HydrophobicContact CE1-CD2 4.33Å; F102-L106 WeakPolarHBondContact O-CB 3.45Å; F102-L106 PolarHBondContact O-N 2.87Å
103	L	98.6	Very high	96.9	Very high	14 Å²	14	53.2 Å²	53.2	7%	0.073	27%	0.268	C	S	.	.	H	α-helix	trans	-66.2	-35.8	179.4	-64.9	171.3	0	0	0	112	I45 L48 I99 S100 M101 L106 I107	I45-L103 HydrophobicContact CG2-CB 4.22Å; I45-L103 HydrophobicContact CG2-CD2 4.05Å; L48-L103 HydrophobicContact CB-CD1 4.15Å; L48-L103 HydrophobicContact CD2-CD1 3.74Å; L48-L103 HydrophobicContact CD2-CD2 4.1Å; L48-L103 HydrophobicContact CG-CD1 3.58Å; I99-L103 HydrophobicContact CG2-CD1 3.69Å; I99-L103 HydrophobicContact CG2-CG 4.23Å; I99-L103 VanDerWaalsContact O-CG 3.3Å; I99-L103 WeakPolarHBondContact O-CG 3.44Å; I99-L103 PolarHBondContact O-N 3.48Å; S100-L103 PolarHBondContact O-N 3.19Å; M101-L103 PolarHBondContact O-N 3.26Å; L103-L106 WeakPolarHBondContact O-CB 3.39Å; L103-L106 PolarHBondContact O-N 3.04Å; L103-I107 VanDerWaalsContact O-CG1 3.29Å; L103-I107 WeakPolarHBondContact O-CG1 3.31Å; L103-I107 PolarHBondContact O-N 3.16Å
104	S	98.5	Very high	96.7	Very high	0 Å²	0	54 Å²	54	0%	0	28%	0.275	C	S	.	.	H	α-helix	trans	-63.4	-43.6	174.3	-71	0	0	0	0	112.7	S49 W53 S100 M101 F102 L106 I107 L108	S49-S104 PolarHBondContact OG-OG 3.17Å; W53-S104 PolarHBondContact NE1-OG 2.83Å; S100-S104 WeakPolarHBondContact O-CB 3.39Å; S100-S104 PolarHBondContact O-N 3.39Å; S100-S104 PolarHBondContact O-OG 3.48Å; M101-S104 WeakPolarHBondContact O-CB 3.4Å; M101-S104 PolarHBondContact O-N 3.08Å; F102-S104 VanDerWaalsContact C-N 3.33Å; F102-S104 PolarHBondContact O-N 3.36Å; S104-L106 VanDerWaalsContact C-N 3.33Å; S104-I107 WeakPolarHBondContact O-CB 3.41Å; S104-I107 PolarHBondContact O-N 2.86Å; S104-L108 PolarHBondContact O-N 3.1Å; S104-L108 VanDerWaalsContact O-N 3.14Å
105	F	98.3	Very high	96.5	Very high	114 Å²	114	50.6 Å²	50.6	50%	0.5	26%	0.259	S	S	.	.	H	α-helix	trans	-67	-36.3	173.1	-68.8	-53.6	0	0	0	112.2	L20 M101 F102 I107 L108 L109	L20-F105 HydrophobicContact CD1-CD1 4.11Å; L20-F105 HydrophobicContact CD1-CE1 3.79Å; L20-F105 HydrophobicContact CD1-CZ 4.32Å; M101-F105 HydrophobicContact CB-CE2 4.43Å; M101-F105 HydrophobicContact CE-CE2 4Å; M101-F105 HydrophobicContact CE-CZ 4.41Å; M101-F105 WeakPolarHBondContact O-CD2 2.99Å; M101-F105 PolarHBondContact O-N 2.88Å; F102-F105 PolarHBondContact O-N 3.23Å; F105-I107 VanDerWaalsContact C-N 3.3Å; F105-I107 PolarHBondContact O-N 2.71Å; F105-L108 HydrophobicContact CD1-CD1 4.32Å; F105-L108 PolarHBondContact O-N 3.46Å; F105-L109 PolarHBondContact O-N 3.44Å
106	L	98.2	Very high	96.3	Very high	48 Å²	48	49.4 Å²	49.4	25%	0.251	26%	0.263	S	S	.	.	H	α-helix	trans	-62.6	-38.6	174.7	-175	62.5	0	0	0	111.5	I45 F102 L103 S104 L109 V110	I45-L106 HydrophobicContact CD1-CD2 3.75Å; I45-L106 HydrophobicContact CD1-CG 3.99Å; I45-L106 HydrophobicContact CG1-CD2 4.23Å; I45-L106 HydrophobicContact CG2-CB 4.36Å; I45-L106 HydrophobicContact CG2-CD2 4.04Å; I45-L106 HydrophobicContact CG2-CG 4.3Å; F102-L106 HydrophobicContact CE1-CD2 4.33Å; F102-L106 WeakPolarHBondContact O-CB 3.45Å; F102-L106 PolarHBondContact O-N 2.87Å; L103-L106 WeakPolarHBondContact O-CB 3.39Å; L103-L106 PolarHBondContact O-N 3.04Å; S104-L106 VanDerWaalsContact C-N 3.33Å; L106-L109 HydrophobicContact CD1-CD2 4.35Å; L106-L109 WeakPolarHBondContact O-CB 3.49Å; L106-L109 PolarHBondContact O-N 3.26Å; L106-V110 HydrophobicContact CD1-CG1 4.11Å; L106-V110 VanDerWaalsContact O-CG2 3.24Å; L106-V110 WeakPolarHBondContact O-CG2 3.33Å; L106-V110 PolarHBondContact O-N 3.33Å
107	I	97.9	Very high	96	Very high	13 Å²	13	55.4 Å²	55.4	7%	0.067	30%	0.296	C	S	.	.	H	α-helix	trans	-59.6	-51.7	172.3	-69.2	159.9	0	0	0	110.1	L24 V42 I45 L103 S104 F105 L109 V110 I111	L24-I107 HydrophobicContact CD2-CB 4.26Å; L24-I107 HydrophobicContact CD2-CG2 3.97Å; V42-I107 HydrophobicContact CG1-CG2 4.3Å; I45-I107 HydrophobicContact CB-CG1 4.19Å; I45-I107 HydrophobicContact CG2-CD1 4.23Å; I45-I107 HydrophobicContact CG2-CG1 3.61Å; L103-I107 VanDerWaalsContact O-CG1 3.29Å; L103-I107 WeakPolarHBondContact O-CG1 3.31Å; L103-I107 PolarHBondContact O-N 3.16Å; S104-I107 WeakPolarHBondContact O-CB 3.41Å; S104-I107 PolarHBondContact O-N 2.86Å; F105-I107 VanDerWaalsContact C-N 3.3Å; F105-I107 PolarHBondContact O-N 2.71Å; I107-L109 PolarHBondContact O-N 3.42Å; I107-V110 PolarHBondContact O-N 3.28Å; I107-V110 VanDerWaalsContact O-N 3.14Å; I107-I111 HydrophobicContact CG2-CD1 4.45Å; I107-I111 VanDerWaalsContact O-CB 3.24Å; I107-I111 WeakPolarHBondContact O-CB 3.48Å; I107-I111 PolarHBondContact O-N 2.99Å
108	L	95.6	Very high	95.7	Very high	44 Å²	44	57.1 Å²	57.1	23%	0.23	31%	0.306	C	S	.	.	H	α-helix	trans	-58.8	-31.5	178.9	-69.3	174.4	0	0	0	112.7	L20 L24 Y27 S104 F105	L20-L108 HydrophobicContact CD1-CD1 4.05Å; L24-L108 HydrophobicContact CD2-CD1 4.45Å; L24-L108 HydrophobicContact CD2-CD2 3.83Å; L24-L108 HydrophobicContact CD2-CG 3.79Å; L24-L108 HydrophobicContact CG-CD2 4.37Å; L24-L108 HydrophobicContact CG-CG 4.44Å; Y27-L108 HydrophobicContact CD2-CD2 3.71Å; Y27-L108 HydrophobicContact CE2-CD2 4.36Å; Y27-L108 HydrophobicContact CG-CD2 4.35Å; S104-L108 PolarHBondContact O-N 3.1Å; S104-L108 VanDerWaalsContact O-N 3.14Å; F105-L108 HydrophobicContact CD1-CD1 4.32Å; F105-L108 PolarHBondContact O-N 3.46Å
109	L	95.5	Very high	95.3	Very high	132 Å²	132	56.7 Å²	56.7	69%	0.691	30%	0.302	S	S	*	.	H	α-helix	trans	-71.2	-41.6	176.6	-179.9	63.9	0	0	0	112.7	F105 L106 I107	F105-L109 PolarHBondContact O-N 3.44Å; L106-L109 HydrophobicContact CD1-CD2 4.35Å; L106-L109 WeakPolarHBondContact O-CB 3.49Å; L106-L109 PolarHBondContact O-N 3.26Å; I107-L109 PolarHBondContact O-N 3.42Å
110	V	95.7	Very high	94.9	Very high	18 Å²	18	60.8 Å²	60.8	11%	0.109	32%	0.32	C	S	.	.	H	α-helix	trans	-105.2	0.3	-169.7	-52.2	0	0	0	0	113.8	V42 I45 L106 I107 D112 D113	V42-V110 HydrophobicContact CG2-CG2 4.05Å; I45-V110 HydrophobicContact CD1-CG2 4.08Å; L106-V110 HydrophobicContact CD1-CG1 4.11Å; L106-V110 VanDerWaalsContact O-CG2 3.24Å; L106-V110 WeakPolarHBondContact O-CG2 3.33Å; L106-V110 PolarHBondContact O-N 3.33Å; I107-V110 PolarHBondContact O-N 3.28Å; I107-V110 VanDerWaalsContact O-N 3.14Å; V110-D112 PolarHBondContact O-N 3.36Å; V110-D113 WeakPolarHBondContact O-CB 3.37Å; V110-D113 PolarHBondContact O-N 3.1Å
111	I	94.8	Very high	94.5	Very high	1 Å²	1	66.7 Å²	66.7	1%	0.005	35%	0.351	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62.3	-34	-175.1	-167.4	159.1	0	0	0	112.3	V28 K31 L38 V42 I107	V28-I111 HydrophobicContact CG2-CD1 3.84Å; K31-I111 HydrophobicContact CD-CG1 4.44Å; K31-I111 WeakPolarHBondContact CE-O 3.49Å; K31-I111 HydrophobicContact CG-CD1 4.27Å; K31-I111 HydrophobicContact CG-CG1 4.11Å; K31-I111 PolarHBondContact NZ-O 3.44Å; L38-I111 HydrophobicContact CD2-CG1 4.45Å; V42-I111 HydrophobicContact CG1-CG1 4.43Å; I107-I111 HydrophobicContact CG2-CD1 4.45Å; I107-I111 VanDerWaalsContact O-CB 3.24Å; I107-I111 WeakPolarHBondContact O-CB 3.48Å; I107-I111 PolarHBondContact O-N 2.99Å
112	D	93.6	Very high	94.1	Very high	32 Å²	32	69.4 Å²	69.4	17%	0.171	36%	0.363	C	S	.	.	T	Hydrogen-bonded Turn	trans	-99.2	11.9	-179	-70.3	-42.9	0	0	0	113.7	K31 V110 D114 L115	K31-D112 WeakPolarHBondContact CE-OD1 3.28Å; K31-D112 IonicContact NZ-OD1 3.57Å; K31-D112 PolarHBondContact NZ-OD1 3.03Å; V110-D112 PolarHBondContact O-N 3.36Å; D112-D114 PolarHBondContact O-N 3.39Å; D112-D114 VanDerWaalsContact O-N 3.09Å; D112-L115 WeakPolarHBondContact O-CA 3.27Å; D112-L115 WeakPolarHBondContact O-CB 3.43Å; D112-L115 PolarHBondContact O-N 2.87Å
113	D	93.6	Very high	93.7	Very high	63 Å²	63	63.5 Å²	63.5	34%	0.337	34%	0.338	S	S	.	.	G	3₁₀ helix	trans	-58.6	-24.4	177.6	-84.6	4.9	0	0	0	112.5	V110 L115	V110-D113 WeakPolarHBondContact O-CB 3.37Å; V110-D113 PolarHBondContact O-N 3.1Å; D113-L115 PolarHBondContact O-N 2.96Å
114	D	91.3	Very high	93	Very high	52 Å²	52	65.7 Å²	65.7	28%	0.278	35%	0.353	S	S	.	.	G	3₁₀ helix	trans	-69.4	-21.8	174.7	67.8	-53.7	0	0	0	113	K31 D112	K31-D114 IonicContact NZ-OD1 2.78Å; K31-D114 PolarHBondContact NZ-OD1 3.06Å; K31-D114 IonicContact NZ-OD2 2.73Å; D112-D114 PolarHBondContact O-N 3.39Å; D112-D114 VanDerWaalsContact O-N 3.09Å
115	L	91.4	Very high	92.2	Very high	21 Å²	21	67 Å²	67	11%	0.11	36%	0.36	C	S	.	.	G	3₁₀ helix	trans	-97.2	12.7	-179	-58.2	-179.6	0	0	0	113.3	D112 D113 N117 T118 I123	D112-L115 WeakPolarHBondContact O-CA 3.27Å; D112-L115 WeakPolarHBondContact O-CB 3.43Å; D112-L115 PolarHBondContact O-N 2.87Å; D113-L115 PolarHBondContact O-N 2.96Å; L115-N117 PolarHBondContact O-N 3.39Å; L115-T118 VanDerWaalsContact O-CB 3.32Å; L115-T118 WeakPolarHBondContact O-CB 3.24Å; L115-T118 PolarHBondContact O-N 3.37Å; L115-I123 HydrophobicContact CB-CD1 4.26Å; L115-I123 HydrophobicContact CD1-CD1 4.33Å; L115-I123 HydrophobicContact CD1-CG1 4.15Å; L115-I123 HydrophobicContact CD1-CG2 3.86Å
116	V	91	Very high	91	Very high	113 Å²	113	69.6 Å²	69.6	69%	0.685	37%	0.372	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.6	-27.6	-177.2	70.5	0	0	0	0	114
117	N	92.2	Very high	90.7	Very high	158 Å²	158	70.7 Å²	70.7	85%	0.845	38%	0.378	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99.9	2.4	177.8	-61.3	-51	0	0	0	113.3	L115	L115-N117 PolarHBondContact O-N 3.39Å
118	T	90.8	Very high	90.3	Very high	52 Å²	52	73.7 Å²	73.7	32%	0.319	39%	0.394	S	S	.	.	S	Bend	trans	-88	130.9	177.8	-56.3	0	0	0	0	108.6	L115 Q122 I123	L115-T118 VanDerWaalsContact O-CB 3.32Å; L115-T118 WeakPolarHBondContact O-CB 3.24Å; L115-T118 PolarHBondContact O-N 3.37Å; T118-Q122 HydrophobicContact CG2-CB 3.92Å; T118-I123 HydrophobicContact CG2-CG1 3.94Å
119	A	91.4	Very high	90	Very high	53 Å²	53	75.3 Å²	75.3	44%	0.438	40%	0.403	S	S	.	.			trans	-62.7	139.9	175.3	0	0	0	0	0	109.9	D121 Q122	A119-D121 WeakPolarHBondContact CB-OD1 3.31Å; A119-D121 PolarHBondContact O-N 3.27Å; A119-Q122 HydrophobicContact CB-CG 4.19Å; A119-Q122 WeakPolarHBondContact O-CA 3.3Å; A119-Q122 WeakPolarHBondContact O-CB 3.43Å; A119-Q122 PolarHBondContact O-N 3.15Å
120	H	88.5	Confident	89.7	Confident	146 Å²	146	72 Å²	72	68%	0.676	39%	0.386	S	S	*	.	G	3₁₀ helix	trans	-59	-33.2	-171.6	-76	80.2	0	0	0	113.1	Q122 I123	H120-Q122 PolarHBondContact O-N 2.75Å; H120-I123 PolarHBondContact O-N 3.39Å
121	D	91.8	Very high	89.3	Confident	124 Å²	124	75.4 Å²	75.4	66%	0.663	40%	0.404	S	S	*	.	G	3₁₀ helix	trans	-69.9	-10.8	176.6	65.5	-48.5	0	0	0	113.7	A119	A119-D121 WeakPolarHBondContact CB-OD1 3.31Å; A119-D121 PolarHBondContact O-N 3.27Å
122	Q	88.7	Confident	88.9	Confident	126 Å²	126	80.3 Å²	80.3	59%	0.589	43%	0.43	S	S	*	.	G	3₁₀ helix	trans	-102.1	-1.1	177.1	-54.2	-59.6	-50.1	0	0	112.4	T118 A119 H120 P124	T118-Q122 HydrophobicContact CG2-CB 3.92Å; A119-Q122 HydrophobicContact CB-CG 4.19Å; A119-Q122 WeakPolarHBondContact O-CA 3.3Å; A119-Q122 WeakPolarHBondContact O-CB 3.43Å; A119-Q122 PolarHBondContact O-N 3.15Å; H120-Q122 PolarHBondContact O-N 2.75Å; Q122-P124 WeakPolarHBondContact O-CD 3.42Å
123	I	89.5	Confident	88.6	Confident	10 Å²	10	83.8 Å²	83.8	5%	0.051	45%	0.449	C	S	.	.			trans	-90.9	111.2	177.6	-57.2	177.5	0	0	0	108.5	L115 T118 H120 V125 F126	L115-I123 HydrophobicContact CB-CD1 4.26Å; L115-I123 HydrophobicContact CD1-CD1 4.33Å; L115-I123 HydrophobicContact CD1-CG1 4.15Å; L115-I123 HydrophobicContact CD1-CG2 3.86Å; T118-I123 HydrophobicContact CG2-CG1 3.94Å; H120-I123 PolarHBondContact O-N 3.39Å; I123-V125 HydrophobicContact CG2-CB 4.45Å; I123-V125 PolarHBondContact O-N 3.33Å; I123-F126 HydrophobicContact CB-CD2 3.77Å; I123-F126 HydrophobicContact CB-CE2 4.46Å; I123-F126 HydrophobicContact CD1-CD2 4.09Å; I123-F126 HydrophobicContact CD1-CE2 4.23Å; I123-F126 HydrophobicContact CG2-CD2 3.46Å; I123-F126 VanDerWaalsContact CG2-CD2 3.46Å; I123-F126 HydrophobicContact CG2-CE2 3.8Å; I123-F126 HydrophobicContact CG2-CG 4.47Å; I123-F126 PolarHBondContact O-N 3.21Å
124	P	84.8	Confident	88.2	Confident	60 Å²	60	85.4 Å²	85.4	39%	0.39	46%	0.457	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.7	-13.8	-169.9	-24.4	35.2	0	0	0	116.2	H34 E36 Q122	H34-P124 HydrophobicContact CB-CG 4.25Å; H34-P124 VanDerWaalsContact CD2-CB 3.48Å; H34-P124 WeakPolarHBondContact CD2-CB 3.38Å; H34-P124 WeakPolarHBondContact NE2-CB 3.33Å; E36-P124 WeakPolarHBondContact OE1-CD 3.45Å; Q122-P124 WeakPolarHBondContact O-CD 3.42Å
125	V	82.3	Confident	87.9	Confident	27 Å²	27	88.2 Å²	88.2	16%	0.164	47%	0.472	C	S	.	.	T	Hydrogen-bonded Turn	trans	-81.1	-22.1	178.8	-177.3	0	0	0	0	112.1	F26 Y27 M30 I123	F26-V125 HydrophobicContact CE1-CG1 3.83Å; F26-V125 HydrophobicContact CZ-CG1 4.34Å; Y27-V125 HydrophobicContact CD1-CG1 4.03Å; Y27-V125 HydrophobicContact CE1-CG1 3.59Å; M30-V125 HydrophobicContact CB-CG2 3.5Å; M30-V125 VanDerWaalsContact CB-CG2 3.5Å; M30-V125 HydrophobicContact CE-CB 4.31Å; M30-V125 HydrophobicContact CE-CG2 3.67Å; M30-V125 HydrophobicContact CG-CG2 3.87Å; I123-V125 HydrophobicContact CG2-CB 4.45Å; I123-V125 PolarHBondContact O-N 3.33Å
126	F	73	Confident	87.6	Confident	168 Å²	168	94.3 Å²	94.3	74%	0.737	51%	0.505	S	S	*	.			trans	-105.9	0	-174.5	-60.9	-56.2	0	0	0	113	I123	I123-F126 HydrophobicContact CB-CD2 3.77Å; I123-F126 HydrophobicContact CB-CE2 4.46Å; I123-F126 HydrophobicContact CD1-CD2 4.09Å; I123-F126 HydrophobicContact CD1-CE2 4.23Å; I123-F126 HydrophobicContact CG2-CD2 3.46Å; I123-F126 VanDerWaalsContact CG2-CD2 3.46Å; I123-F126 HydrophobicContact CG2-CE2 3.8Å; I123-F126 HydrophobicContact CG2-CG 4.47Å; I123-F126 PolarHBondContact O-N 3.21Å

Retrieved 126 of 126 residues in 865.5 ms (Link to these results)

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