A0A077ZK64_TRITR Loading...

Rrf2 domain containing protein

AlphaFold DB , UniProt , Accession A0A077ZK64, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 117 aa.

						>A0A077ZK64_TRITR|A0A077ZK64
MTSISEVTDVYGVSRNHMVKIINQLSRAGYVTAVRGKNGGIRLGKSASAIRIGDVVRELEPLSLVNCSSEFCHITPACRLKQALSKAVQSFLMELDNYTLADLVEENQPLYKLLLVE
					

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	81.3	Confident	88	Confident	142 Å²	142	77.3 Å²	77.3	70%	0.7	41%	0.409	S	S	*	.				0	140.9	0	-178.9	174.6	-89.4	0	0	106.3	V34 R42	M1-V34 HydrophobicContact CE-CB 4.47Å; M1-V34 HydrophobicContact CE-CG2 4.04Å; M1-R42 HydrophobicContact CE-CB 4.39Å; M1-R42 HydrophobicContact CE-CG 4.24Å
2	T	88.6	Confident	88.2	Confident	53 Å²	53	76.9 Å²	76.9	33%	0.325	44%	0.438	S	S	.	.	B	Isolated β-bridge	trans	-133.8	163.4	-177	-176.6	0	0	0	0	110.6	E6 V7 G40 I41	T2-E6 WeakPolarHBondContact CA-OE2 3.23Å; T2-E6 WeakPolarHBondContact CB-OE2 3.32Å; T2-E6 PolarHBondContact OG1-OE2 3.23Å; T2-V7 HydrophobicContact CG2-CG2 3.9Å; T2-G40 CarbonylContact O-C 3.4Å; T2-G40 WeakPolarHBondContact O-CA 3.42Å; T2-I41 HydrophobicContact CG2-CB 4.48Å; T2-I41 PolarHBondContact N-O 2.99Å; T2-I41 VanDerWaalsContact N-O 3.15Å; T2-I41 PolarHBondContact O-N 2.78Å
3	S	89.8	Confident	88.4	Confident	36 Å²	36	74.2 Å²	74.2	25%	0.252	42%	0.423	S	S	.	.			trans	-98.7	159.7	176	79	0	0	0	0	112.6	S5 E6 V7	S3-S5 PolarHBondContact O-N 3.15Å; S3-S5 PolarHBondContact OG-N 3.36Å; S3-E6 PolarHBondContact N-OE2 2.93Å; S3-E6 PolarHBondContact O-N 3.3Å; S3-E6 WeakPolarHBondContact OG-CG 3.4Å; S3-E6 PolarHBondContact OG-N 2.93Å; S3-E6 VanDerWaalsContact OG-N 3.09Å; S3-V7 WeakPolarHBondContact O-CG2 3.33Å; S3-V7 PolarHBondContact O-N 3.42Å
4	I	88.3	Confident	88.7	Confident	39 Å²	39	74.1 Å²	74.1	20%	0.2	43%	0.43	C	S	.	.	H	α-helix	trans	-57.4	-36.6	171.7	-69.2	171.6	0	0	0	110.6	V7 T8 R15 M18 V19 I41	I4-V7 PolarHBondContact O-N 3.31Å; I4-T8 HydrophobicContact CG2-CG2 4.13Å; I4-T8 WeakPolarHBondContact O-CG2 3.47Å; I4-T8 PolarHBondContact O-N 3.44Å; I4-T8 PolarHBondContact O-OG1 2.93Å; I4-R15 HydrophobicContact CG2-CG 4.21Å; I4-M18 HydrophobicContact CG2-CB 4.23Å; I4-M18 HydrophobicContact CG2-CG 3.95Å; I4-V19 HydrophobicContact CD1-CG2 4.01Å; I4-V19 HydrophobicContact CG2-CG2 4.15Å; I4-I41 HydrophobicContact CB-CD1 4.46Å; I4-I41 HydrophobicContact CG1-CD1 3.5Å; I4-I41 VanDerWaalsContact CG1-CD1 3.5Å; I4-I41 HydrophobicContact CG1-CG1 4.29Å
5	S	88.3	Confident	88.9	Confident	54 Å²	54	78.9 Å²	78.9	38%	0.378	44%	0.438	S	S	.	.	H	α-helix	trans	-65.7	-45.8	-179.1	-57.2	0	0	0	0	111.7	S3 V7 T8 D9	S3-S5 PolarHBondContact O-N 3.15Å; S3-S5 PolarHBondContact OG-N 3.36Å; S5-V7 VanDerWaalsContact C-N 3.31Å; S5-V7 PolarHBondContact O-N 3.23Å; S5-T8 VanDerWaalsContact CA-OG1 3.31Å; S5-T8 WeakPolarHBondContact CA-OG1 3.2Å; S5-T8 PolarHBondContact O-N 3.41Å; S5-T8 VanDerWaalsContact O-N 3.17Å; S5-T8 PolarHBondContact O-OG1 3.48Å; S5-D9 WeakPolarHBondContact O-CB 3.41Å; S5-D9 PolarHBondContact O-N 3.03Å
6	E	87.8	Confident	89.2	Confident	103 Å²	103	81.7 Å²	81.7	48%	0.481	45%	0.452	S	S	.	.	H	α-helix	trans	-57.8	-45.3	176.2	-73.3	164.8	179.9	0	0	111.1	T2 S3 D9 V10	T2-E6 WeakPolarHBondContact CA-OE2 3.23Å; T2-E6 WeakPolarHBondContact CB-OE2 3.32Å; T2-E6 PolarHBondContact OG1-OE2 3.23Å; S3-E6 PolarHBondContact N-OE2 2.93Å; S3-E6 PolarHBondContact O-N 3.3Å; S3-E6 WeakPolarHBondContact OG-CG 3.4Å; S3-E6 PolarHBondContact OG-N 2.93Å; S3-E6 VanDerWaalsContact OG-N 3.09Å; E6-D9 PolarHBondContact O-N 3.43Å; E6-V10 WeakPolarHBondContact O-CG2 3.47Å; E6-V10 PolarHBondContact O-N 3.32Å; E6-V10 VanDerWaalsContact O-N 3.15Å
7	V	89.5	Confident	89.5	Confident	28 Å²	28	82.6 Å²	82.6	17%	0.17	45%	0.451	C	S	.	.	H	α-helix	trans	-66.1	-40.6	178	-175.4	0	0	0	0	111.1	T2 S3 I4 S5 D9 Y11 M18	T2-V7 HydrophobicContact CG2-CG2 3.9Å; S3-V7 WeakPolarHBondContact O-CG2 3.33Å; S3-V7 PolarHBondContact O-N 3.42Å; I4-V7 PolarHBondContact O-N 3.31Å; S5-V7 VanDerWaalsContact C-N 3.31Å; S5-V7 PolarHBondContact O-N 3.23Å; V7-D9 VanDerWaalsContact C-N 3.33Å; V7-D9 PolarHBondContact O-N 3.36Å; V7-Y11 HydrophobicContact CG1-CD2 3.7Å; V7-Y11 HydrophobicContact CG1-CE2 3.97Å; V7-Y11 VanDerWaalsContact O-CD2 3.26Å; V7-Y11 WeakPolarHBondContact O-CD2 3.27Å; V7-Y11 PolarHBondContact O-N 3.06Å; V7-Y11 VanDerWaalsContact O-N 3.16Å; V7-M18 HydrophobicContact CB-SD 4.48Å; V7-M18 HydrophobicContact CG1-CE 3.61Å; V7-M18 HydrophobicContact CG1-CG 4.44Å; V7-M18 HydrophobicContact CG1-SD 3.71Å
8	T	90.4	Very high	89.7	Confident	13 Å²	13	78.7 Å²	78.7	8%	0.08	43%	0.43	C	S	.	.	H	α-helix	trans	-64.3	-39.3	178.3	51.8	0	0	0	0	112.5	I4 S5 G12 V13 R15 M18	I4-T8 HydrophobicContact CG2-CG2 4.13Å; I4-T8 WeakPolarHBondContact O-CG2 3.47Å; I4-T8 PolarHBondContact O-N 3.44Å; I4-T8 PolarHBondContact O-OG1 2.93Å; S5-T8 VanDerWaalsContact CA-OG1 3.31Å; S5-T8 WeakPolarHBondContact CA-OG1 3.2Å; S5-T8 PolarHBondContact O-N 3.41Å; S5-T8 VanDerWaalsContact O-N 3.17Å; S5-T8 PolarHBondContact O-OG1 3.48Å; T8-G12 PolarHBondContact O-N 3.24Å; T8-V13 WeakPolarHBondContact CB-O 3.33Å; T8-V13 WeakPolarHBondContact CG2-O 3.49Å; T8-V13 PolarHBondContact O-N 3.17Å; T8-R15 HydrophobicContact CG2-CB 4.27Å; T8-M18 HydrophobicContact CG2-CB 3.35Å; T8-M18 HydrophobicContact CG2-CG 3.72Å
9	D	88.3	Confident	89.9	Confident	132 Å²	132	76.7 Å²	76.7	71%	0.706	42%	0.42	S	S	*	.	H	α-helix	trans	-69.3	-39.9	-176.7	-65	-13.5	0	0	0	110.8	S5 E6 V7	S5-D9 WeakPolarHBondContact O-CB 3.41Å; S5-D9 PolarHBondContact O-N 3.03Å; E6-D9 PolarHBondContact O-N 3.43Å; V7-D9 VanDerWaalsContact C-N 3.33Å; V7-D9 PolarHBondContact O-N 3.36Å
10	V	87.5	Confident	90.1	Very high	106 Å²	106	79.8 Å²	79.8	64%	0.642	43%	0.429	S	S	*	.	H	α-helix	trans	-66.3	-44.3	176.3	171.7	0	0	0	0	112.2	E6	E6-V10 WeakPolarHBondContact O-CG2 3.47Å; E6-V10 PolarHBondContact O-N 3.32Å; E6-V10 VanDerWaalsContact O-N 3.15Å
11	Y	88.3	Confident	90.3	Very high	144 Å²	144	78.3 Å²	78.3	57%	0.565	42%	0.421	S	S	*	.	H	α-helix	trans	-95.3	-2.5	-171.9	-68.9	-75	0	0	0	114.7	V7 V13	V7-Y11 HydrophobicContact CG1-CD2 3.7Å; V7-Y11 HydrophobicContact CG1-CE2 3.97Å; V7-Y11 VanDerWaalsContact O-CD2 3.26Å; V7-Y11 WeakPolarHBondContact O-CD2 3.27Å; V7-Y11 PolarHBondContact O-N 3.06Å; V7-Y11 VanDerWaalsContact O-N 3.16Å; Y11-V13 PolarHBondContact O-N 3.09Å
12	G	90.5	Very high	90.8	Very high	73 Å²	73	72.1 Å²	72.1	75%	0.753	39%	0.39	S	S	*	.	T	Hydrogen-bonded Turn	trans	63.1	23.6	-179.4	0	0	0	0	0	114	T8	T8-G12 PolarHBondContact O-N 3.24Å
13	V	90.6	Very high	91.1	Very high	41 Å²	41	73.8 Å²	73.8	25%	0.248	40%	0.397	C	S	.	.			trans	-97.8	134.8	-178.4	175.9	0	0	0	0	109.5	T8 Y11 R15 H17 M18	T8-V13 WeakPolarHBondContact CB-O 3.33Å; T8-V13 WeakPolarHBondContact CG2-O 3.49Å; T8-V13 PolarHBondContact O-N 3.17Å; Y11-V13 PolarHBondContact O-N 3.09Å; V13-R15 PolarHBondContact O-N 3.48Å; V13-H17 HydrophobicContact CG1-CB 3.71Å; V13-M18 HydrophobicContact CB-CE 4.04Å; V13-M18 HydrophobicContact CG1-CE 4.24Å; V13-M18 HydrophobicContact CG2-CE 4.47Å
14	S	92.9	Very high	91.3	Very high	74 Å²	74	76.2 Å²	76.2	52%	0.517	40%	0.404	S	S	.	.			trans	-54.2	139.3	177.3	76.1	0	0	0	0	111.5	N16 H17 M18	S14-N16 PolarHBondContact O-N 3.42Å; S14-N16 VanDerWaalsContact O-N 3.12Å; S14-H17 WeakPolarHBondContact O-CB 3.3Å; S14-H17 PolarHBondContact O-N 2.73Å; S14-H17 WeakPolarHBondContact OG-CB 3.46Å; S14-H17 PolarHBondContact OG-N 3.19Å; S14-M18 PolarHBondContact O-N 3.34Å
15	R	92.1	Very high	91.7	Very high	146 Å²	146	75.7 Å²	75.7	55%	0.551	40%	0.402	S	S	*	.	H	α-helix	trans	-52.1	-38.7	178.5	-171.4	176.4	-173.5	-90	1.3	113	I4 T8 V13 H17 M18 V19	I4-R15 HydrophobicContact CG2-CG 4.21Å; T8-R15 HydrophobicContact CG2-CB 4.27Å; V13-R15 PolarHBondContact O-N 3.48Å; R15-H17 VanDerWaalsContact C-N 3.34Å; R15-H17 PolarHBondContact O-N 3.04Å; R15-M18 PolarHBondContact O-N 2.85Å; R15-V19 HydrophobicContact CG-CG2 4.45Å; R15-V19 WeakPolarHBondContact O-CB 3.5Å; R15-V19 WeakPolarHBondContact O-CG2 3.44Å; R15-V19 PolarHBondContact O-N 2.73Å
16	N	93.7	Very high	92.1	Very high	123 Å²	123	75.2 Å²	75.2	66%	0.658	40%	0.399	S	S	*	.	H	α-helix	trans	-63.6	-39.6	177.9	-70.4	-16.3	0	0	0	112.3	S14 K20	S14-N16 PolarHBondContact O-N 3.42Å; S14-N16 VanDerWaalsContact O-N 3.12Å; N16-K20 WeakPolarHBondContact O-CG 3.38Å; N16-K20 PolarHBondContact O-N 2.83Å
17	H	93.3	Very high	92.4	Very high	97 Å²	97	80 Å²	80	45%	0.449	41%	0.413	S	S	.	.	H	α-helix	trans	-70.2	-45.9	176	-172.3	-177.4	0	0	0	110.7	V13 S14 R15 V19 K20 I21	V13-H17 HydrophobicContact CG1-CB 3.71Å; S14-H17 WeakPolarHBondContact O-CB 3.3Å; S14-H17 PolarHBondContact O-N 2.73Å; S14-H17 WeakPolarHBondContact OG-CB 3.46Å; S14-H17 PolarHBondContact OG-N 3.19Å; R15-H17 VanDerWaalsContact C-N 3.34Å; R15-H17 PolarHBondContact O-N 3.04Å; H17-V19 VanDerWaalsContact C-N 3.3Å; H17-V19 PolarHBondContact O-N 3.11Å; H17-K20 WeakPolarHBondContact O-CA 3.45Å; H17-K20 WeakPolarHBondContact O-CB 3.37Å; H17-K20 PolarHBondContact O-N 3.36Å; H17-I21 PolarHBondContact O-N 2.66Å
18	M	93.8	Very high	92.8	Very high	13 Å²	13	80.2 Å²	80.2	6%	0.064	42%	0.417	C	S	.	.	H	α-helix	trans	-58.9	-41.4	178	-171.6	60	62.2	0	0	112.3	I4 V7 T8 V13 S14 R15 K20 I21 I22	I4-M18 HydrophobicContact CG2-CB 4.23Å; I4-M18 HydrophobicContact CG2-CG 3.95Å; V7-M18 HydrophobicContact CB-SD 4.48Å; V7-M18 HydrophobicContact CG1-CE 3.61Å; V7-M18 HydrophobicContact CG1-CG 4.44Å; V7-M18 HydrophobicContact CG1-SD 3.71Å; T8-M18 HydrophobicContact CG2-CB 3.35Å; T8-M18 HydrophobicContact CG2-CG 3.72Å; V13-M18 HydrophobicContact CB-CE 4.04Å; V13-M18 HydrophobicContact CG1-CE 4.24Å; V13-M18 HydrophobicContact CG2-CE 4.47Å; S14-M18 PolarHBondContact O-N 3.34Å; R15-M18 PolarHBondContact O-N 2.85Å; M18-K20 VanDerWaalsContact C-N 3.27Å; M18-K20 PolarHBondContact O-N 3.15Å; M18-I21 PolarHBondContact O-N 3.05Å; M18-I22 HydrophobicContact CG-CG1 4.14Å; M18-I22 WeakPolarHBondContact O-CB 3.44Å; M18-I22 VanDerWaalsContact O-CG1 3.31Å; M18-I22 WeakPolarHBondContact O-CG1 3.31Å; M18-I22 PolarHBondContact O-N 3.2Å; M18-I22 HydrophobicContact SD-CD1 4.43Å; M18-I22 HydrophobicContact SD-CG1 4.14Å
19	V	93.1	Very high	93.1	Very high	40 Å²	40	81 Å²	81	24%	0.242	43%	0.428	C	S	.	.	H	α-helix	trans	-57.3	-40.4	174.2	168.7	0	0	0	0	111.5	I4 R15 H17 N23	I4-V19 HydrophobicContact CD1-CG2 4.01Å; I4-V19 HydrophobicContact CG2-CG2 4.15Å; R15-V19 HydrophobicContact CG-CG2 4.45Å; R15-V19 WeakPolarHBondContact O-CB 3.5Å; R15-V19 WeakPolarHBondContact O-CG2 3.44Å; R15-V19 PolarHBondContact O-N 2.73Å; H17-V19 VanDerWaalsContact C-N 3.3Å; H17-V19 PolarHBondContact O-N 3.11Å; V19-N23 VanDerWaalsContact O-CB 3.27Å; V19-N23 WeakPolarHBondContact O-CB 3.5Å; V19-N23 PolarHBondContact O-N 2.66Å; V19-N23 PolarHBondContact O-ND2 2.85Å; V19-N23 VanDerWaalsContact O-ND2 3.17Å
20	K	94	Very high	93.5	Very high	139 Å²	139	75.7 Å²	75.7	60%	0.604	40%	0.398	S	S	*	.	H	α-helix	trans	-64.4	-46.2	176.7	-68.7	175.8	-177.6	-177.9	0	111.6	N16 H17 M18 N23 Q24	N16-K20 WeakPolarHBondContact O-CG 3.38Å; N16-K20 PolarHBondContact O-N 2.83Å; H17-K20 WeakPolarHBondContact O-CA 3.45Å; H17-K20 WeakPolarHBondContact O-CB 3.37Å; H17-K20 PolarHBondContact O-N 3.36Å; M18-K20 VanDerWaalsContact C-N 3.27Å; M18-K20 PolarHBondContact O-N 3.15Å; K20-N23 PolarHBondContact O-N 3.24Å; K20-Q24 WeakPolarHBondContact O-CG 3.28Å; K20-Q24 PolarHBondContact O-N 3.47Å
21	I	93.9	Very high	93.9	Very high	48 Å²	48	71.4 Å²	71.4	25%	0.246	37%	0.372	C	S	.	.	H	α-helix	trans	-60.7	-50.3	178.4	-64.1	167.6	0	0	0	110.3	H17 M18 N23 Q24 L25	H17-I21 PolarHBondContact O-N 2.66Å; M18-I21 PolarHBondContact O-N 3.05Å; I21-N23 VanDerWaalsContact C-N 3.31Å; I21-N23 PolarHBondContact O-N 3.27Å; I21-Q24 WeakPolarHBondContact O-CB 3.39Å; I21-Q24 PolarHBondContact O-N 2.95Å; I21-Q24 VanDerWaalsContact O-N 3.13Å; I21-L25 HydrophobicContact CG2-CD1 3.93Å; I21-L25 HydrophobicContact CG2-CG 4.44Å; I21-L25 WeakPolarHBondContact O-CG 3.27Å; I21-L25 PolarHBondContact O-N 3.32Å
22	I	93.2	Very high	94.3	Very high	12 Å²	12	67 Å²	67	6%	0.062	36%	0.361	C	S	.	.	H	α-helix	trans	-62.1	-38.9	179.3	-66.1	-60.7	0	0	0	111.6	M18 L25 S26 V31 I41	M18-I22 HydrophobicContact CG-CG1 4.14Å; M18-I22 WeakPolarHBondContact O-CB 3.44Å; M18-I22 VanDerWaalsContact O-CG1 3.31Å; M18-I22 WeakPolarHBondContact O-CG1 3.31Å; M18-I22 PolarHBondContact O-N 3.2Å; M18-I22 HydrophobicContact SD-CD1 4.43Å; M18-I22 HydrophobicContact SD-CG1 4.14Å; I22-L25 HydrophobicContact CD1-CD1 4.31Å; I22-L25 PolarHBondContact O-N 3.49Å; I22-S26 WeakPolarHBondContact O-CB 3.45Å; I22-S26 PolarHBondContact O-N 3.42Å; I22-V31 HydrophobicContact CG2-CG2 4.4Å; I22-I41 HydrophobicContact CB-CD1 4.46Å; I22-I41 HydrophobicContact CD1-CD1 3.57Å; I22-I41 HydrophobicContact CD1-CG1 4.46Å; I22-I41 HydrophobicContact CD1-CG2 4.35Å; I22-I41 HydrophobicContact CG1-CD1 3.73Å; I22-I41 HydrophobicContact CG2-CD1 3.91Å; I22-I41 HydrophobicContact CG2-CG1 4.03Å
23	N	93.7	Very high	94.3	Very high	89 Å²	89	66 Å²	66	48%	0.476	35%	0.345	S	S	.	.	H	α-helix	trans	-63.5	-43.1	174.9	-75.4	-22.2	0	0	0	111.5	V19 K20 I21 S26 R27	V19-N23 VanDerWaalsContact O-CB 3.27Å; V19-N23 WeakPolarHBondContact O-CB 3.5Å; V19-N23 PolarHBondContact O-N 2.66Å; V19-N23 PolarHBondContact O-ND2 2.85Å; V19-N23 VanDerWaalsContact O-ND2 3.17Å; K20-N23 PolarHBondContact O-N 3.24Å; I21-N23 VanDerWaalsContact C-N 3.31Å; I21-N23 PolarHBondContact O-N 3.27Å; N23-S26 PolarHBondContact O-N 2.97Å; N23-R27 WeakPolarHBondContact O-CG 3.46Å; N23-R27 PolarHBondContact O-N 3.32Å
24	Q	95.1	Very high	94.2	Very high	86 Å²	86	66.9 Å²	66.9	40%	0.402	35%	0.35	S	S	.	.	H	α-helix	trans	-61.2	-50.4	175.8	-73.2	173.5	-17.6	0	0	111.2	K20 I21 S26 R27 A28 L59	K20-Q24 WeakPolarHBondContact O-CG 3.28Å; K20-Q24 PolarHBondContact O-N 3.47Å; I21-Q24 WeakPolarHBondContact O-CB 3.39Å; I21-Q24 PolarHBondContact O-N 2.95Å; I21-Q24 VanDerWaalsContact O-N 3.13Å; Q24-S26 VanDerWaalsContact C-N 3.27Å; Q24-S26 PolarHBondContact O-N 2.95Å; Q24-R27 PolarHBondContact O-N 3.22Å; Q24-A28 PolarHBondContact O-N 2.94Å; Q24-L59 HydrophobicContact CB-CD2 3.81Å
25	L	96.3	Very high	93.9	Very high	28 Å²	28	75 Å²	75	15%	0.147	37%	0.37	C	S	.	.	H	α-helix	trans	-58.1	-38	176.3	-72.6	171.3	0	0	0	112.6	I21 I22 A28 G29 Y30 V31 V55 L59	I21-L25 HydrophobicContact CG2-CD1 3.93Å; I21-L25 HydrophobicContact CG2-CG 4.44Å; I21-L25 WeakPolarHBondContact O-CG 3.27Å; I21-L25 PolarHBondContact O-N 3.32Å; I22-L25 HydrophobicContact CD1-CD1 4.31Å; I22-L25 PolarHBondContact O-N 3.49Å; L25-A28 PolarHBondContact O-N 3.22Å; L25-G29 PolarHBondContact O-N 3.49Å; L25-Y30 HydrophobicContact CD2-CD2 3.84Å; L25-Y30 HydrophobicContact CD2-CG 4.3Å; L25-Y30 PolarHBondContact O-N 3.31Å; L25-V31 HydrophobicContact CB-CG1 4.24Å; L25-V31 HydrophobicContact CB-CG2 3.63Å; L25-V31 HydrophobicContact CD1-CG1 4.42Å; L25-V31 PolarHBondContact O-N 3Å; L25-V55 HydrophobicContact CD2-CG1 4.39Å; L25-L59 HydrophobicContact CD2-CD1 3.76Å; L25-L59 HydrophobicContact CD2-CD2 4.46Å; L25-L59 HydrophobicContact CG-CD1 4.36Å
26	S	95.3	Very high	93.5	Very high	45 Å²	45	71.1 Å²	71.1	32%	0.315	38%	0.375	S	S	.	.	H	α-helix	trans	-68.7	-43.9	179	-174	0	0	0	0	111.6	I22 N23 Q24 A28 G29 V31	I22-S26 WeakPolarHBondContact O-CB 3.45Å; I22-S26 PolarHBondContact O-N 3.42Å; N23-S26 PolarHBondContact O-N 2.97Å; Q24-S26 VanDerWaalsContact C-N 3.27Å; Q24-S26 PolarHBondContact O-N 2.95Å; S26-A28 VanDerWaalsContact C-N 3.28Å; S26-A28 PolarHBondContact O-N 2.88Å; S26-G29 PolarHBondContact O-N 3.29Å; S26-V31 WeakPolarHBondContact CA-O 3.49Å
27	R	95.6	Very high	92.8	Very high	204 Å²	204	75.4 Å²	75.4	77%	0.77	39%	0.388	S	S	*	.	H	α-helix	trans	-62	-36.2	174.8	-69	-175.8	-31.1	163.8	14.7	112.4	N23 Q24 G29	N23-R27 WeakPolarHBondContact O-CG 3.46Å; N23-R27 PolarHBondContact O-N 3.32Å; Q24-R27 PolarHBondContact O-N 3.22Å; R27-G29 PolarHBondContact O-N 3.1Å
28	A	96.2	Very high	92.2	Very high	31 Å²	31	77.6 Å²	77.6	26%	0.256	40%	0.403	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.9	-2.2	176	0	0	0	0	0	113.4	Q24 L25 S26 Y30 E58	Q24-A28 PolarHBondContact O-N 2.94Å; L25-A28 PolarHBondContact O-N 3.22Å; S26-A28 VanDerWaalsContact C-N 3.28Å; S26-A28 PolarHBondContact O-N 2.88Å; A28-Y30 VanDerWaalsContact C-N 3.29Å; A28-Y30 HydrophobicContact CB-CD2 3.51Å; A28-Y30 HydrophobicContact CB-CE2 3.5Å; A28-Y30 VanDerWaalsContact CB-CE2 3.5Å; A28-Y30 HydrophobicContact CB-CG 4.49Å; A28-Y30 PolarHBondContact O-N 3.45Å; A28-E58 HydrophobicContact CB-CG 3.99Å
29	G	96.9	Very high	91.8	Very high	31 Å²	31	78 Å²	78	32%	0.32	41%	0.41	S	S	.	.	T	Hydrogen-bonded Turn	trans	74.4	12.3	177.8	0	0	0	0	0	114.9	L25 S26 R27	L25-G29 PolarHBondContact O-N 3.49Å; S26-G29 PolarHBondContact O-N 3.29Å; R27-G29 PolarHBondContact O-N 3.1Å
30	Y	97.6	Very high	91.7	Very high	20 Å²	20	76.6 Å²	76.6	8%	0.078	40%	0.404	C	S	.	.	S	Bend	trans	-75.9	-33	176.5	-63.4	-57.8	0	0	0	112.3	L25 A28 G44 K45 I50 D54 V55 E58	L25-Y30 HydrophobicContact CD2-CD2 3.84Å; L25-Y30 HydrophobicContact CD2-CG 4.3Å; L25-Y30 PolarHBondContact O-N 3.31Å; A28-Y30 VanDerWaalsContact C-N 3.29Å; A28-Y30 HydrophobicContact CB-CD2 3.51Å; A28-Y30 HydrophobicContact CB-CE2 3.5Å; A28-Y30 VanDerWaalsContact CB-CE2 3.5Å; A28-Y30 HydrophobicContact CB-CG 4.49Å; A28-Y30 PolarHBondContact O-N 3.45Å; Y30-G44 PolarHBondContact O-N 3.33Å; Y30-K45 VanDerWaalsContact CD1-CE 3.49Å; Y30-I50 HydrophobicContact CD1-CG1 4.27Å; Y30-I50 HydrophobicContact CD1-CG2 3.8Å; Y30-I50 HydrophobicContact CE1-CG2 4.11Å; Y30-D54 VanDerWaalsContact OH-C 3.32Å; Y30-D54 WeakPolarHBondContact OH-CB 3.47Å; Y30-D54 PolarHBondContact OH-O 3.35Å; Y30-V55 HydrophobicContact CD1-CG2 3.97Å; Y30-V55 HydrophobicContact CD2-CG2 4.3Å; Y30-V55 HydrophobicContact CE1-CG2 3.68Å; Y30-V55 HydrophobicContact CE2-CG2 4.02Å; Y30-V55 HydrophobicContact CG-CG2 4.29Å; Y30-V55 PolarHBondContact OH-N 3.36Å; Y30-E58 HydrophobicContact CE2-CB 4.45Å
31	V	96.7	Very high	91.7	Very high	16 Å²	16	70.6 Å²	70.6	10%	0.097	38%	0.378	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	161.8	175.6	-56	0	0	0	0	110.8	I22 L25 S26 I41 R42	I22-V31 HydrophobicContact CG2-CG2 4.4Å; L25-V31 HydrophobicContact CB-CG1 4.24Å; L25-V31 HydrophobicContact CB-CG2 3.63Å; L25-V31 HydrophobicContact CD1-CG1 4.42Å; L25-V31 PolarHBondContact O-N 3Å; S26-V31 WeakPolarHBondContact CA-O 3.49Å; V31-I41 HydrophobicContact CB-CG2 3.75Å; V31-I41 HydrophobicContact CG1-CG2 4.06Å; V31-I41 HydrophobicContact CG2-CG2 4.12Å; V31-R42 CarbonylContact C-O 3.57Å; V31-R42 WeakPolarHBondContact CA-O 3.27Å; V31-R42 WeakPolarHBondContact CB-O 3.48Å
32	T	94.9	Very high	91.7	Very high	52 Å²	52	75.1 Å²	75.1	32%	0.319	39%	0.392	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	126	168.1	-58.8	0	0	0	0	108.6	R42	T32-R42 PolarHBondContact N-O 2.99Å; T32-R42 PolarHBondContact O-N 3.4Å; T32-R42 VanDerWaalsContact O-N 3.12Å
33	A	91.3	Very high	91.9	Very high	51 Å²	51	78.4 Å²	78.4	42%	0.421	41%	0.41	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.7	123.9	172.8	0	0	0	0	0	110.3	G40	A33-G40 CarbonylContact C-O 3.48Å; A33-G40 WeakPolarHBondContact CA-O 3.33Å
34	V	89.5	Confident	92	Very high	60 Å²	60	75.9 Å²	75.9	36%	0.364	40%	0.404	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	129.8	174.5	-177.7	0	0	0	0	108.3	M1 G39 G40	M1-V34 HydrophobicContact CE-CB 4.47Å; M1-V34 HydrophobicContact CE-CG2 4.04Å; V34-G39 CarbonylContact O-C 3.38Å; V34-G39 WeakPolarHBondContact O-CA 3.37Å; V34-G40 PolarHBondContact N-O 3.46Å; V34-G40 PolarHBondContact O-N 2.99Å
35	R	85	Confident	92.1	Very high	245 Å²	245	75.6 Å²	75.6	93%	0.925	40%	0.402	S	S	*	.	P	Polyproline II helix	trans	-87.1	155.6	175.4	-66.5	-175.7	176.4	-174.6	-0.3	110.9
36	G	83.6	Confident	92.2	Very high	64 Å²	64	77.5 Å²	77.5	66%	0.66	42%	0.417	S	S	*	.	S	Bend	trans	115.5	178.6	174.4	0	0	0	0	0	113.4	N38 G39	G36-N38 PolarHBondContact O-N 3.25Å; G36-G39 WeakPolarHBondContact O-CA 3.33Å; G36-G39 PolarHBondContact O-N 3.44Å
37	K	79.8	Confident	92.3	Very high	213 Å²	213	76.3 Å²	76.3	93%	0.926	41%	0.41	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.9	-34.5	-176.9	-173.1	179.1	178.3	-177.5	0	113.2
38	N	79.9	Confident	92.4	Very high	143 Å²	143	70.2 Å²	70.2	77%	0.765	40%	0.399	S	S	*	.	T	Hydrogen-bonded Turn	trans	-106.3	22.5	175	-56.6	-22.1	0	0	0	111.3	G36	G36-N38 PolarHBondContact O-N 3.25Å
39	G	86.1	Confident	92.5	Very high	21 Å²	21	71.2 Å²	71.2	22%	0.216	41%	0.407	C	S	.	.			trans	-72.8	178.4	175.4	0	0	0	0	0	111.5	V34 G36	V34-G39 CarbonylContact O-C 3.38Å; V34-G39 WeakPolarHBondContact O-CA 3.37Å; G36-G39 WeakPolarHBondContact O-CA 3.33Å; G36-G39 PolarHBondContact O-N 3.44Å
40	G	91	Very high	92.6	Very high	11 Å²	11	70.1 Å²	70.1	11%	0.113	39%	0.394	C	S	.	.	E	Extended strand (participates in β ladder)	trans	158.8	-167	-177.6	0	0	0	0	0	111.4	T2 A33 V34	T2-G40 CarbonylContact O-C 3.4Å; T2-G40 WeakPolarHBondContact O-CA 3.42Å; A33-G40 CarbonylContact C-O 3.48Å; A33-G40 WeakPolarHBondContact CA-O 3.33Å; V34-G40 PolarHBondContact N-O 3.46Å; V34-G40 PolarHBondContact O-N 2.99Å
41	I	93.6	Very high	92.6	Very high	13 Å²	13	74 Å²	74	7%	0.067	41%	0.408	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	139.1	178	-56.2	154.9	0	0	0	107.6	T2 I4 I22 V31	T2-I41 HydrophobicContact CG2-CB 4.48Å; T2-I41 PolarHBondContact N-O 2.99Å; T2-I41 VanDerWaalsContact N-O 3.15Å; T2-I41 PolarHBondContact O-N 2.78Å; I4-I41 HydrophobicContact CB-CD1 4.46Å; I4-I41 HydrophobicContact CG1-CD1 3.5Å; I4-I41 VanDerWaalsContact CG1-CD1 3.5Å; I4-I41 HydrophobicContact CG1-CG1 4.29Å; I22-I41 HydrophobicContact CB-CD1 4.46Å; I22-I41 HydrophobicContact CD1-CD1 3.57Å; I22-I41 HydrophobicContact CD1-CG1 4.46Å; I22-I41 HydrophobicContact CD1-CG2 4.35Å; I22-I41 HydrophobicContact CG1-CD1 3.73Å; I22-I41 HydrophobicContact CG2-CD1 3.91Å; I22-I41 HydrophobicContact CG2-CG1 4.03Å; V31-I41 HydrophobicContact CB-CG2 3.75Å; V31-I41 HydrophobicContact CG1-CG2 4.06Å; V31-I41 HydrophobicContact CG2-CG2 4.12Å
42	R	94.4	Very high	92.7	Very high	143 Å²	143	74.7 Å²	74.7	54%	0.54	41%	0.411	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.7	165.6	169.8	60.7	175.4	-177.8	149.4	2.8	109.3	M1 V31 T32	M1-R42 HydrophobicContact CE-CB 4.39Å; M1-R42 HydrophobicContact CE-CG 4.24Å; V31-R42 CarbonylContact C-O 3.57Å; V31-R42 WeakPolarHBondContact CA-O 3.27Å; V31-R42 WeakPolarHBondContact CB-O 3.48Å; T32-R42 PolarHBondContact N-O 2.99Å; T32-R42 PolarHBondContact O-N 3.4Å; T32-R42 VanDerWaalsContact O-N 3.12Å
43	L	96.9	Very high	92.9	Very high	81 Å²	81	72.2 Å²	72.2	42%	0.424	40%	0.396	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.6	139.9	171.5	-60.9	178.9	0	0	0	110.5	K45 A47 I50 L100	L43-K45 VanDerWaalsContact CB-O 3.31Å; L43-K45 WeakPolarHBondContact CB-O 3.35Å; L43-A47 HydrophobicContact CD1-CB 4.21Å; L43-I50 HydrophobicContact CD2-CD1 4Å; L43-L100 HydrophobicContact CD1-CD2 4.06Å; L43-L100 HydrophobicContact CD2-CD2 3.79Å
44	G	96.6	Very high	93.2	Very high	35 Å²	35	72.2 Å²	72.2	36%	0.361	39%	0.389	S	S	.	.	S	Bend	trans	-84	-14	176.7	0	0	0	0	0	113.5	Y30	Y30-G44 PolarHBondContact O-N 3.33Å
45	K	97	Very high	93.6	Very high	81 Å²	81	70.7 Å²	70.7	35%	0.352	38%	0.38	S	S	.	.	S	Bend	trans	-152.4	171.2	176.7	50.8	-173.4	153.1	178.4	0	109.6	Y30 L43 A49 I50	Y30-K45 VanDerWaalsContact CD1-CE 3.49Å; L43-K45 VanDerWaalsContact CB-O 3.31Å; L43-K45 WeakPolarHBondContact CB-O 3.35Å; K45-A49 HydrophobicContact CB-CB 4.39Å; K45-A49 HydrophobicContact CD-CB 4.23Å; K45-A49 HydrophobicContact CG-CB 4.4Å; K45-I50 HydrophobicContact CD-CG1 4.12Å; K45-I50 HydrophobicContact CG-CD1 4.1Å; K45-I50 HydrophobicContact CG-CG1 3.66Å
46	S	97.7	Very high	94.2	Very high	67 Å²	67	60.6 Å²	60.6	47%	0.469	35%	0.345	S	S	.	.			trans	-59.9	148.8	177.6	61.9	0	0	0	0	111.1	S48 A49	S46-S48 PolarHBondContact O-N 3.09Å; S46-S48 PolarHBondContact OG-OG 3.34Å; S46-S48 VanDerWaalsContact OG-OG 3.07Å; S46-A49 WeakPolarHBondContact O-CB 3.15Å; S46-A49 PolarHBondContact O-N 3.5Å; S46-A49 WeakPolarHBondContact OG-CB 3.43Å; S46-A49 PolarHBondContact OG-N 3.35Å
47	A	98	Very high	94.8	Very high	21 Å²	21	61.7 Å²	61.7	17%	0.174	33%	0.33	C	S	.	.	G	3₁₀ helix	trans	-57.5	-35.3	178.3	0	0	0	0	0	112.1	L43 A49 I50 L100 A101	L43-A47 HydrophobicContact CD1-CB 4.21Å; A47-A49 PolarHBondContact O-N 2.99Å; A47-I50 PolarHBondContact O-N 3.11Å; A47-L100 HydrophobicContact CB-CB 4.13Å; A47-L100 HydrophobicContact CB-CD2 4.17Å; A47-L100 HydrophobicContact CB-CG 4.1Å; A47-L100 WeakPolarHBondContact O-CB 3.36Å; A47-L100 PolarHBondContact O-N 3.31Å; A47-A101 HydrophobicContact CB-CB 4.05Å; A47-A101 PolarHBondContact O-N 3.32Å
48	S	98.3	Very high	95.5	Very high	76 Å²	76	57.1 Å²	57.1	53%	0.531	31%	0.311	S	S	.	.	G	3₁₀ helix	trans	-66.1	-16.5	174.3	55.7	0	0	0	0	114.7	S46 T99	S46-S48 PolarHBondContact O-N 3.09Å; S46-S48 PolarHBondContact OG-OG 3.34Å; S46-S48 VanDerWaalsContact OG-OG 3.07Å; S48-T99 WeakPolarHBondContact O-CG2 3.32Å
49	A	98.3	Very high	96.2	Very high	52 Å²	52	52.6 Å²	52.6	43%	0.43	29%	0.287	S	S	.	.	G	3₁₀ helix	trans	-98.6	6.1	177.1	0	0	0	0	0	113	K45 S46 A47	K45-A49 HydrophobicContact CB-CB 4.39Å; K45-A49 HydrophobicContact CD-CB 4.23Å; K45-A49 HydrophobicContact CG-CB 4.4Å; S46-A49 WeakPolarHBondContact O-CB 3.15Å; S46-A49 PolarHBondContact O-N 3.5Å; S46-A49 WeakPolarHBondContact OG-CB 3.43Å; S46-A49 PolarHBondContact OG-N 3.35Å; A47-A49 PolarHBondContact O-N 2.99Å
50	I	98.6	Very high	96.5	Very high	8 Å²	8	57 Å²	57	4%	0.041	30%	0.302	C	S	.	.			trans	-110.3	92.2	179.6	-57.9	175.3	0	0	0	108	Y30 L43 K45 A47 V55 T99 L100	Y30-I50 HydrophobicContact CD1-CG1 4.27Å; Y30-I50 HydrophobicContact CD1-CG2 3.8Å; Y30-I50 HydrophobicContact CE1-CG2 4.11Å; L43-I50 HydrophobicContact CD2-CD1 4Å; K45-I50 HydrophobicContact CD-CG1 4.12Å; K45-I50 HydrophobicContact CG-CD1 4.1Å; K45-I50 HydrophobicContact CG-CG1 3.66Å; A47-I50 PolarHBondContact O-N 3.11Å; I50-V55 HydrophobicContact CG2-CG2 3.57Å; I50-T99 CarbonylContact O-C 3.52Å; I50-T99 WeakPolarHBondContact O-CA 3.36Å; I50-L100 HydrophobicContact CB-CB 4.02Å; I50-L100 HydrophobicContact CD1-CD2 4.04Å; I50-L100 HydrophobicContact CG2-CB 4.26Å; I50-L100 PolarHBondContact O-N 3.04Å
51	R	98.4	Very high	96.4	Very high	100 Å²	100	61.5 Å²	61.5	38%	0.377	33%	0.329	S	S	.	.	B	Isolated β-bridge	trans	-73.8	131.8	174	-176.1	170.8	61.5	175.2	6.9	110.5	G53 D54 V55 D96 Y98	R51-G53 PolarHBondContact O-N 3.48Å; R51-D54 IonicContact CZ-OD1 3.45Å; R51-D54 IonicContact CZ-OD2 3.31Å; R51-D54 VanDerWaalsContact CZ-OD2 3.31Å; R51-D54 VanDerWaalsContact NE-CG 3.32Å; R51-D54 IonicContact NE-OD1 3.36Å; R51-D54 PolarHBondContact NE-OD1 3.23Å; R51-D54 IonicContact NE-OD2 2.83Å; R51-D54 PolarHBondContact NE-OD2 3.3Å; R51-D54 VanDerWaalsContact NH2-CG 3.28Å; R51-D54 IonicContact NH2-OD1 2.73Å; R51-D54 PolarHBondContact NH2-OD1 3.47Å; R51-D54 IonicContact NH2-OD2 3.05Å; R51-D54 PolarHBondContact NH2-OD2 3.09Å; R51-D54 PolarHBondContact O-N 2.86Å; R51-V55 PolarHBondContact O-N 3.18Å; R51-D96 VanDerWaalsContact CD-O 3.28Å; R51-D96 WeakPolarHBondContact CD-O 3.47Å; R51-D96 IonicContact CZ-OD1 3.85Å; R51-D96 IonicContact NE-OD1 3.64Å; R51-Y98 WeakPolarHBondContact CA-O 3.48Å
52	I	98.4	Very high	96.3	Very high	31 Å²	31	63.5 Å²	63.5	16%	0.159	34%	0.339	C	S	.	.	H	α-helix	trans	-65.2	-42.1	-174.1	-59.1	-57.6	0	0	0	111.2	D54 V55 V56 L95 Y98 L100 L103	I52-D54 PolarHBondContact O-N 3.43Å; I52-V55 PolarHBondContact O-N 3.14Å; I52-V55 VanDerWaalsContact O-N 3.13Å; I52-V56 HydrophobicContact CG2-CG2 4.4Å; I52-V56 PolarHBondContact O-N 3.34Å; I52-L95 HydrophobicContact CG2-CB 4.45Å; I52-L95 HydrophobicContact CG2-CD2 4.3Å; I52-Y98 WeakPolarHBondContact CG1-O 3.39Å; I52-Y98 PolarHBondContact N-O 2.71Å; I52-L100 HydrophobicContact CD1-CB 4.5Å; I52-L103 HydrophobicContact CD1-CD1 3.61Å; I52-L103 HydrophobicContact CD1-CG 4.41Å; I52-L103 HydrophobicContact CG1-CD1 3.82Å; I52-L103 HydrophobicContact CG1-CG 4.37Å
53	G	98.3	Very high	96	Very high	0 Å²	0	61.2 Å²	61.2	0%	0	35%	0.345	C	S	.	.	H	α-helix	trans	-55.3	-36.1	174.8	0	0	0	0	0	113.7	R51 R57 L95	R51-G53 PolarHBondContact O-N 3.48Å; G53-R57 VanDerWaalsContact C-NH1 3.26Å; G53-R57 WeakPolarHBondContact O-CB 3.18Å; G53-R57 VanDerWaalsContact O-CG 3.27Å; G53-R57 WeakPolarHBondContact O-CG 3.43Å; G53-R57 PolarHBondContact O-N 3.43Å; G53-R57 PolarHBondContact O-NH1 3.03Å; G53-L95 PolarHBondContact N-O 2.71Å; G53-L95 VanDerWaalsContact N-O 3.09Å
54	D	97.8	Very high	95.7	Very high	52 Å²	52	62.7 Å²	62.7	28%	0.278	35%	0.353	S	S	.	.	H	α-helix	trans	-73.1	-37.7	177.9	-64.8	-30.2	0	0	0	112.4	Y30 R51 I52 V56 R57 E58	Y30-D54 VanDerWaalsContact OH-C 3.32Å; Y30-D54 WeakPolarHBondContact OH-CB 3.47Å; Y30-D54 PolarHBondContact OH-O 3.35Å; R51-D54 IonicContact CZ-OD1 3.45Å; R51-D54 IonicContact CZ-OD2 3.31Å; R51-D54 VanDerWaalsContact CZ-OD2 3.31Å; R51-D54 VanDerWaalsContact NE-CG 3.32Å; R51-D54 IonicContact NE-OD1 3.36Å; R51-D54 PolarHBondContact NE-OD1 3.23Å; R51-D54 IonicContact NE-OD2 2.83Å; R51-D54 PolarHBondContact NE-OD2 3.3Å; R51-D54 VanDerWaalsContact NH2-CG 3.28Å; R51-D54 IonicContact NH2-OD1 2.73Å; R51-D54 PolarHBondContact NH2-OD1 3.47Å; R51-D54 IonicContact NH2-OD2 3.05Å; R51-D54 PolarHBondContact NH2-OD2 3.09Å; R51-D54 PolarHBondContact O-N 2.86Å; I52-D54 PolarHBondContact O-N 3.43Å; D54-V56 VanDerWaalsContact C-N 3.35Å; D54-R57 PolarHBondContact O-N 3.13Å; D54-R57 IonicContact OD1-NH1 3.56Å; D54-E58 WeakPolarHBondContact O-CB 3.33Å; D54-E58 PolarHBondContact O-N 3.23Å; D54-E58 VanDerWaalsContact O-N 3.09Å
55	V	97.9	Very high	95.4	Very high	28 Å²	28	65 Å²	65	17%	0.17	36%	0.36	C	S	.	.	H	α-helix	trans	-62.5	-45.9	175.3	178.2	0	0	0	0	110	L25 Y30 I50 R51 I52 E58 L59	L25-V55 HydrophobicContact CD2-CG1 4.39Å; Y30-V55 HydrophobicContact CD1-CG2 3.97Å; Y30-V55 HydrophobicContact CD2-CG2 4.3Å; Y30-V55 HydrophobicContact CE1-CG2 3.68Å; Y30-V55 HydrophobicContact CE2-CG2 4.02Å; Y30-V55 HydrophobicContact CG-CG2 4.29Å; Y30-V55 PolarHBondContact OH-N 3.36Å; I50-V55 HydrophobicContact CG2-CG2 3.57Å; R51-V55 PolarHBondContact O-N 3.18Å; I52-V55 PolarHBondContact O-N 3.14Å; I52-V55 VanDerWaalsContact O-N 3.13Å; V55-E58 PolarHBondContact O-N 3.18Å; V55-L59 HydrophobicContact CG1-CD1 3.76Å; V55-L59 HydrophobicContact CG1-CG 4.45Å; V55-L59 WeakPolarHBondContact O-CB 3.48Å; V55-L59 WeakPolarHBondContact O-CG 3.38Å; V55-L59 PolarHBondContact O-N 3.39Å; V55-L59 VanDerWaalsContact O-N 3.1Å
56	V	97.3	Very high	95	Very high	33 Å²	33	66 Å²	66	20%	0.2	37%	0.37	C	S	.	.	H	α-helix	trans	-66.4	-42.9	179.7	175.8	0	0	0	0	111.5	I52 D54 E58 L59 E60 L62 F91 L92 L95	I52-V56 HydrophobicContact CG2-CG2 4.4Å; I52-V56 PolarHBondContact O-N 3.34Å; D54-V56 VanDerWaalsContact C-N 3.35Å; V56-E58 VanDerWaalsContact C-N 3.27Å; V56-E58 PolarHBondContact O-N 3.38Å; V56-L59 PolarHBondContact O-N 3.47Å; V56-E60 HydrophobicContact CG1-CB 4.36Å; V56-E60 HydrophobicContact CG1-CG 4.15Å; V56-E60 WeakPolarHBondContact O-CB 3.34Å; V56-E60 PolarHBondContact O-N 2.87Å; V56-L62 HydrophobicContact CG1-CD2 4.19Å; V56-F91 HydrophobicContact CG1-CE1 4.3Å; V56-L92 HydrophobicContact CG1-CD2 4.09Å; V56-L95 HydrophobicContact CB-CD1 4.11Å; V56-L95 HydrophobicContact CG1-CD1 4.2Å; V56-L95 HydrophobicContact CG2-CD1 3.78Å
57	R	96.3	Very high	94.6	Very high	87 Å²	87	64.6 Å²	64.6	33%	0.328	36%	0.359	S	S	.	.	H	α-helix	trans	-60.5	-34.3	175.9	-76.3	-177.9	-166.2	95.3	-0.7	113.7	G53 D54 L62 L92 D96	G53-R57 VanDerWaalsContact C-NH1 3.26Å; G53-R57 WeakPolarHBondContact O-CB 3.18Å; G53-R57 VanDerWaalsContact O-CG 3.27Å; G53-R57 WeakPolarHBondContact O-CG 3.43Å; G53-R57 PolarHBondContact O-N 3.43Å; G53-R57 PolarHBondContact O-NH1 3.03Å; D54-R57 PolarHBondContact O-N 3.13Å; D54-R57 IonicContact OD1-NH1 3.56Å; R57-L62 HydrophobicContact CB-CD1 4.3Å; R57-L62 HydrophobicContact CG-CD1 3.92Å; R57-L92 HydrophobicContact CG-CD1 4.04Å; R57-L92 HydrophobicContact CG-CD2 3.92Å; R57-D96 IonicContact CZ-OD1 3.2Å; R57-D96 IonicContact CZ-OD2 2.66Å; R57-D96 IonicContact NH1-OD1 3.54Å; R57-D96 PolarHBondContact NH1-OD1 3.38Å; R57-D96 IonicContact NH1-OD2 3.38Å; R57-D96 VanDerWaalsContact NH2-CG 3.27Å; R57-D96 IonicContact NH2-OD1 2.66Å; R57-D96 PolarHBondContact NH2-OD1 2.98Å; R57-D96 IonicContact NH2-OD2 3.59Å; R57-D96 PolarHBondContact NH2-OD2 3.47Å
58	E	95.1	Very high	94.1	Very high	117 Å²	117	65.3 Å²	65.3	55%	0.547	36%	0.363	S	S	.	.	H	α-helix	trans	-79.5	-34.5	-177.9	-172.1	65.6	-156.6	0	0	112.4	A28 Y30 D54 V55 V56	A28-E58 HydrophobicContact CB-CG 3.99Å; Y30-E58 HydrophobicContact CE2-CB 4.45Å; D54-E58 WeakPolarHBondContact O-CB 3.33Å; D54-E58 PolarHBondContact O-N 3.23Å; D54-E58 VanDerWaalsContact O-N 3.09Å; V55-E58 PolarHBondContact O-N 3.18Å; V56-E58 VanDerWaalsContact C-N 3.27Å; V56-E58 PolarHBondContact O-N 3.38Å
59	L	93.6	Very high	93.7	Very high	48 Å²	48	66.2 Å²	66.2	25%	0.251	37%	0.369	S	S	.	.	H	α-helix	trans	-95.6	-31.7	-172.7	-63.8	-178.9	0	0	0	113.8	Q24 L25 V55 V56	Q24-L59 HydrophobicContact CB-CD2 3.81Å; L25-L59 HydrophobicContact CD2-CD1 3.76Å; L25-L59 HydrophobicContact CD2-CD2 4.46Å; L25-L59 HydrophobicContact CG-CD1 4.36Å; V55-L59 HydrophobicContact CG1-CD1 3.76Å; V55-L59 HydrophobicContact CG1-CG 4.45Å; V55-L59 WeakPolarHBondContact O-CB 3.48Å; V55-L59 WeakPolarHBondContact O-CG 3.38Å; V55-L59 PolarHBondContact O-N 3.39Å; V55-L59 VanDerWaalsContact O-N 3.1Å; V56-L59 PolarHBondContact O-N 3.47Å
60	E	92.2	Very high	93.3	Very high	114 Å²	114	71.4 Å²	71.4	53%	0.533	38%	0.384	S	S	.	.	S	Bend	trans	-100.3	138.8	-174.3	-64	-62.2	157.9	0	0	111.5	V56 L62	V56-E60 HydrophobicContact CG1-CB 4.36Å; V56-E60 HydrophobicContact CG1-CG 4.15Å; V56-E60 WeakPolarHBondContact O-CB 3.34Å; V56-E60 PolarHBondContact O-N 2.87Å; E60-L62 HydrophobicContact CB-CD2 4.31Å; E60-L62 HydrophobicContact CB-CG 4.31Å; E60-L62 PolarHBondContact O-N 3.41Å; E60-L62 VanDerWaalsContact O-N 3.11Å
61	P	89.2	Confident	92.9	Very high	105 Å²	105	78.2 Å²	78.2	68%	0.682	41%	0.414	S	S	*	.			trans	-66.9	-12.4	178.3	27.3	-34.5	0	0	0	113.7	S63	P61-S63 PolarHBondContact O-N 3.06Å; P61-S63 PolarHBondContact O-OG 3.5Å
62	L	91	Very high	92.6	Very high	54 Å²	54	75.2 Å²	75.2	28%	0.283	41%	0.408	S	S	.	.			trans	50.7	11.5	177.9	-66.2	170.6	0	0	0	116.2	V56 R57 E60 L64 V88 L92	V56-L62 HydrophobicContact CG1-CD2 4.19Å; R57-L62 HydrophobicContact CB-CD1 4.3Å; R57-L62 HydrophobicContact CG-CD1 3.92Å; E60-L62 HydrophobicContact CB-CD2 4.31Å; E60-L62 HydrophobicContact CB-CG 4.31Å; E60-L62 PolarHBondContact O-N 3.41Å; E60-L62 VanDerWaalsContact O-N 3.11Å; L62-L64 PolarHBondContact O-N 2.95Å; L62-V88 HydrophobicContact CB-CG1 4.26Å; L62-V88 HydrophobicContact CD2-CG1 4.27Å; L62-L92 HydrophobicContact CD1-CD1 3.66Å; L62-L92 HydrophobicContact CD1-CD2 4.14Å; L62-L92 HydrophobicContact CD1-CG 4.48Å; L62-L92 HydrophobicContact CD2-CD1 4.3Å; L62-L92 HydrophobicContact CD2-CD2 3.94Å; L62-L92 HydrophobicContact CD2-CG 4.42Å
63	S	88.6	Confident	92.3	Very high	95 Å²	95	82.6 Å²	82.6	66%	0.664	44%	0.441	S	S	*	.			trans	-97.5	93.5	-177.4	-62.6	0	0	0	0	108.9	P61 V65	P61-S63 PolarHBondContact O-N 3.06Å; P61-S63 PolarHBondContact O-OG 3.5Å; S63-V65 VanDerWaalsContact C-N 3.3Å; S63-V65 PolarHBondContact O-N 3.1Å
64	L	90.5	Very high	92.1	Very high	113 Å²	113	87.6 Å²	87.6	59%	0.592	47%	0.467	S	S	*	.	S	Bend	trans	-62.8	-36.4	-177.6	-64.1	-180	0	0	0	113.1	L62 L84 V88	L62-L64 PolarHBondContact O-N 2.95Å; L64-L84 HydrophobicContact CD1-CD2 4.06Å; L64-V88 HydrophobicContact CD1-CG2 3.46Å; L64-V88 VanDerWaalsContact CD1-CG2 3.46Å; L64-V88 HydrophobicContact CD2-CG2 4.39Å; L64-V88 HydrophobicContact CG-CG2 3.64Å
65	V	90.1	Very high	91.9	Very high	84 Å²	84	86 Å²	86	51%	0.509	46%	0.459	S	S	.	.	S	Bend	trans	-140.7	139.3	-178	-178.6	0	0	0	0	108.6	S63 C67 L84	S63-V65 VanDerWaalsContact C-N 3.3Å; S63-V65 PolarHBondContact O-N 3.1Å; V65-C67 PolarHBondContact O-N 2.91Å; V65-L84 HydrophobicContact CB-CD1 4.19Å; V65-L84 HydrophobicContact CG2-CD1 3.73Å
66	N	89.1	Confident	91.6	Very high	102 Å²	102	90.5 Å²	90.5	55%	0.545	49%	0.489	S	S	.	.			trans	-72	93.4	170.5	-175.6	-8.9	0	0	0	110	S68 F71	N66-S68 VanDerWaalsContact C-N 3.28Å; N66-S68 PolarHBondContact O-N 3.19Å; N66-S68 WeakPolarHBondContact OD1-CB 3.2Å; N66-S68 PolarHBondContact OD1-N 3.13Å; N66-S68 VanDerWaalsContact OD1-N 3.09Å; N66-F71 WeakPolarHBondContact ND2-CD2 3.43Å
67	C	89.1	Confident	91.5	Very high	36 Å²	36	93 Å²	93	24%	0.243	51%	0.514	C	S	.	.			trans	-90.8	31.6	176.6	-61	0	0	0	0	113.1	V65 T75 K81	V65-C67 PolarHBondContact O-N 2.91Å; C67-T75 VanDerWaalsContact O-CG2 3.23Å; C67-T75 WeakPolarHBondContact O-CG2 3.32Å; C67-T75 PolarHBondContact O-OG1 3.24Å; C67-K81 HydrophobicContact CB-CD 4.15Å; C67-K81 HydrophobicContact CB-CG 4.29Å
68	S	88	Confident	91.4	Very high	36 Å²	36	90 Å²	90	25%	0.252	51%	0.505	S	S	.	.			trans	-66.4	141.5	173	175.8	0	0	0	0	110.8	N66 E70 F71 C72	N66-S68 VanDerWaalsContact C-N 3.28Å; N66-S68 PolarHBondContact O-N 3.19Å; N66-S68 WeakPolarHBondContact OD1-CB 3.2Å; N66-S68 PolarHBondContact OD1-N 3.13Å; N66-S68 VanDerWaalsContact OD1-N 3.09Å; S68-E70 PolarHBondContact O-N 3.26Å; S68-E70 PolarHBondContact OG-N 3.48Å; S68-F71 PolarHBondContact O-N 3.01Å; S68-F71 VanDerWaalsContact O-N 3.11Å; S68-C72 PolarHBondContact O-N 3.07Å
69	S	88.9	Confident	91.4	Very high	95 Å²	95	94.6 Å²	94.6	66%	0.664	52%	0.518	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.3	-20.1	174	48	0	0	0	0	113	F71	S69-F71 VanDerWaalsContact C-N 3.32Å
70	E	91.1	Very high	91.5	Very high	161 Å²	161	97.4 Å²	97.4	75%	0.752	53%	0.533	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.8	-29.3	175.5	-63.3	177.8	167.6	0	0	112.8	S68	S68-E70 PolarHBondContact O-N 3.26Å; S68-E70 PolarHBondContact OG-N 3.48Å
71	F	89.7	Confident	91.5	Very high	151 Å²	151	96.6 Å²	96.6	66%	0.662	53%	0.527	S	S	*	.	T	Hydrogen-bonded Turn	trans	-113	-13.6	-176.1	-58	-67.9	0	0	0	113.6	N66 S68 S69	N66-F71 WeakPolarHBondContact ND2-CD2 3.43Å; S68-F71 PolarHBondContact O-N 3.01Å; S68-F71 VanDerWaalsContact O-N 3.11Å; S69-F71 VanDerWaalsContact C-N 3.32Å
72	C	92.6	Very high	91.6	Very high	38 Å²	38	98.5 Å²	98.5	26%	0.257	53%	0.527	S	S	.	.			trans	-138	102.7	-175	-176.4	0	0	0	0	112.1	S68 I74 T75	S68-C72 PolarHBondContact O-N 3.07Å; C72-I74 VanDerWaalsContact C-N 3.29Å; C72-I74 PolarHBondContact O-N 3.33Å; C72-I74 VanDerWaalsContact SG-CG1 3.56Å; C72-T75 VanDerWaalsContact CB-OG1 3.27Å; C72-T75 WeakPolarHBondContact CB-OG1 3.48Å; C72-T75 WeakPolarHBondContact O-CB 3.31Å; C72-T75 PolarHBondContact O-N 3.37Å; C72-T75 PolarHBondContact O-OG1 2.81Å
73	H	92.4	Very high	91.9	Very high	185 Å²	185	98.6 Å²	98.6	86%	0.856	54%	0.536	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.2	-33.9	-178.3	-174.2	71.1	0	0	0	113.7	T75	H73-T75 VanDerWaalsContact C-N 3.29Å; H73-T75 PolarHBondContact O-N 3.3Å
74	I	94.1	Very high	92.2	Very high	106 Å²	106	96.1 Å²	96.1	54%	0.544	52%	0.515	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.9	-2.6	-177.5	64.8	165.2	0	0	0	113.6	C72 P76 A77 C78	C72-I74 VanDerWaalsContact C-N 3.29Å; C72-I74 PolarHBondContact O-N 3.33Å; C72-I74 VanDerWaalsContact SG-CG1 3.56Å; I74-P76 VanDerWaalsContact C-N 3.3Å; I74-P76 VanDerWaalsContact O-N 3.12Å; I74-A77 CarbonylContact O-C 3.46Å; I74-A77 PolarHBondContact O-N 3.34Å; I74-C78 HydrophobicContact CD1-CB 4.39Å; I74-C78 HydrophobicContact CG1-CB 4.28Å; I74-C78 WeakPolarHBondContact O-CB 3.1Å; I74-C78 PolarHBondContact O-N 3.48Å
75	T	92.8	Very high	92.3	Very high	18 Å²	18	93.8 Å²	93.8	11%	0.11	51%	0.508	C	S	.	.	G	3₁₀ helix	trans	-45.5	-44.4	-175.1	-64.2	0	0	0	0	114.1	C67 C72 H73 A77 C78 K81	C67-T75 VanDerWaalsContact O-CG2 3.23Å; C67-T75 WeakPolarHBondContact O-CG2 3.32Å; C67-T75 PolarHBondContact O-OG1 3.24Å; C72-T75 VanDerWaalsContact CB-OG1 3.27Å; C72-T75 WeakPolarHBondContact CB-OG1 3.48Å; C72-T75 WeakPolarHBondContact O-CB 3.31Å; C72-T75 PolarHBondContact O-N 3.37Å; C72-T75 PolarHBondContact O-OG1 2.81Å; H73-T75 VanDerWaalsContact C-N 3.29Å; H73-T75 PolarHBondContact O-N 3.3Å; T75-A77 PolarHBondContact O-N 3.39Å; T75-C78 PolarHBondContact O-N 3.25Å; T75-K81 HydrophobicContact CG2-CD 4.23Å
76	P	91.8	Very high	92.6	Very high	123 Å²	123	96.9 Å²	96.9	80%	0.799	51%	0.514	S	S	*	.	G	3₁₀ helix	trans	-61.9	-27.3	-179.6	-24.6	36.1	0	0	0	114.6	I74	I74-P76 VanDerWaalsContact C-N 3.3Å; I74-P76 VanDerWaalsContact O-N 3.12Å
77	A	94.4	Very high	92.9	Very high	86 Å²	86	94.6 Å²	94.6	71%	0.711	51%	0.51	S	S	*	.	G	3₁₀ helix	trans	-113.8	4.3	-178.2	0	0	0	0	0	113.4	I74 T75 R79	I74-A77 CarbonylContact O-C 3.46Å; I74-A77 PolarHBondContact O-N 3.34Å; T75-A77 PolarHBondContact O-N 3.39Å; A77-R79 PolarHBondContact O-N 2.63Å; A77-R79 VanDerWaalsContact O-N 3.15Å
78	C	95	Very high	93.3	Very high	23 Å²	23	94.1 Å²	94.1	16%	0.155	51%	0.506	C	S	.	.			trans	-76	104.3	-171.4	-176.5	0	0	0	0	111.9	I74 T75 L80 K81	I74-C78 HydrophobicContact CD1-CB 4.39Å; I74-C78 HydrophobicContact CG1-CB 4.28Å; I74-C78 WeakPolarHBondContact O-CB 3.1Å; I74-C78 PolarHBondContact O-N 3.48Å; T75-C78 PolarHBondContact O-N 3.25Å; C78-L80 PolarHBondContact O-N 3.03Å; C78-K81 HydrophobicContact CB-CB 4.38Å; C78-K81 WeakPolarHBondContact O-CB 3.27Å; C78-K81 PolarHBondContact O-N 2.98Å
79	R	95.5	Very high	93.7	Very high	213 Å²	213	97.9 Å²	97.9	80%	0.804	52%	0.519	S	S	*	.	H	α-helix	trans	-64.7	-26.9	173.5	-66	-178.1	179.4	179.4	-0.7	113.1	A77 K81 Q82 A83	A77-R79 PolarHBondContact O-N 2.63Å; A77-R79 VanDerWaalsContact O-N 3.15Å; R79-K81 VanDerWaalsContact C-N 3.32Å; R79-K81 PolarHBondContact O-N 2.84Å; R79-Q82 PolarHBondContact O-N 3.34Å; R79-A83 PolarHBondContact O-N 2.82Å
80	L	94.7	Very high	94.1	Very high	108 Å²	108	96.1 Å²	96.1	57%	0.565	51%	0.507	S	S	*	.	H	α-helix	trans	-62.5	-38.3	176.9	177.7	63.5	0	0	0	111.6	C78 Q82 A83 L84	C78-L80 PolarHBondContact O-N 3.03Å; L80-Q82 VanDerWaalsContact C-N 3.27Å; L80-Q82 PolarHBondContact O-N 3.43Å; L80-A83 PolarHBondContact O-N 3.06Å; L80-A83 VanDerWaalsContact O-N 3.15Å; L80-L84 HydrophobicContact CD1-CD1 4.23Å; L80-L84 HydrophobicContact CD1-CD2 4.31Å; L80-L84 HydrophobicContact CD1-CG 3.93Å; L80-L84 HydrophobicContact CD2-CD1 4.49Å; L80-L84 HydrophobicContact CG-CD1 3.93Å; L80-L84 HydrophobicContact CG-CG 4.12Å; L80-L84 WeakPolarHBondContact O-CB 3.45Å; L80-L84 WeakPolarHBondContact O-CG 3.47Å; L80-L84 PolarHBondContact O-N 3.25Å
81	K	92.9	Very high	94.4	Very high	96 Å²	96	93.9 Å²	93.9	42%	0.417	50%	0.495	S	S	.	.	H	α-helix	trans	-55.1	-43.9	175.3	179	-179.7	176.4	177	0	111.7	C67 T75 C78 R79 S85	C67-K81 HydrophobicContact CB-CD 4.15Å; C67-K81 HydrophobicContact CB-CG 4.29Å; T75-K81 HydrophobicContact CG2-CD 4.23Å; C78-K81 HydrophobicContact CB-CB 4.38Å; C78-K81 WeakPolarHBondContact O-CB 3.27Å; C78-K81 PolarHBondContact O-N 2.98Å; R79-K81 VanDerWaalsContact C-N 3.32Å; R79-K81 PolarHBondContact O-N 2.84Å; K81-S85 WeakPolarHBondContact O-CB 3.46Å; K81-S85 PolarHBondContact O-N 3.31Å
82	Q	92.2	Very high	94.8	Very high	145 Å²	145	87.3 Å²	87.3	68%	0.678	47%	0.467	S	S	*	.	H	α-helix	trans	-68.8	-43.2	177.7	-62.9	179.5	11	0	0	111.6	R79 L80 L84 S85 K86	R79-Q82 PolarHBondContact O-N 3.34Å; L80-Q82 VanDerWaalsContact C-N 3.27Å; L80-Q82 PolarHBondContact O-N 3.43Å; Q82-L84 PolarHBondContact O-N 2.93Å; Q82-S85 PolarHBondContact O-N 3.47Å; Q82-K86 WeakPolarHBondContact O-CB 3.31Å; Q82-K86 PolarHBondContact O-N 2.91Å
83	A	95.5	Very high	95.1	Very high	57 Å²	57	90.7 Å²	90.7	47%	0.471	48%	0.48	S	S	.	.	H	α-helix	trans	-60.1	-44.7	177.1	0	0	0	0	0	112.1	R79 L80 K86 A87	R79-A83 PolarHBondContact O-N 2.82Å; L80-A83 PolarHBondContact O-N 3.06Å; L80-A83 VanDerWaalsContact O-N 3.15Å; A83-K86 PolarHBondContact O-N 3.13Å; A83-A87 WeakPolarHBondContact O-CB 3.37Å; A83-A87 PolarHBondContact O-N 3.28Å
84	L	95.2	Very high	95.4	Very high	43 Å²	43	86.4 Å²	86.4	23%	0.225	46%	0.46	C	S	.	.	H	α-helix	trans	-64.2	-44.7	176.2	-68.6	174.4	0	0	0	111.8	L64 V65 L80 Q82 K86 A87 V88	L64-L84 HydrophobicContact CD1-CD2 4.06Å; V65-L84 HydrophobicContact CB-CD1 4.19Å; V65-L84 HydrophobicContact CG2-CD1 3.73Å; L80-L84 HydrophobicContact CD1-CD1 4.23Å; L80-L84 HydrophobicContact CD1-CD2 4.31Å; L80-L84 HydrophobicContact CD1-CG 3.93Å; L80-L84 HydrophobicContact CD2-CD1 4.49Å; L80-L84 HydrophobicContact CG-CD1 3.93Å; L80-L84 HydrophobicContact CG-CG 4.12Å; L80-L84 WeakPolarHBondContact O-CB 3.45Å; L80-L84 WeakPolarHBondContact O-CG 3.47Å; L80-L84 PolarHBondContact O-N 3.25Å; Q82-L84 PolarHBondContact O-N 2.93Å; L84-K86 VanDerWaalsContact C-N 3.34Å; L84-K86 PolarHBondContact O-N 2.98Å; L84-A87 PolarHBondContact O-N 2.97Å; L84-V88 WeakPolarHBondContact O-CG2 3.41Å; L84-V88 PolarHBondContact O-N 2.88Å
85	S	93	Very high	95.6	Very high	64 Å²	64	82.9 Å²	82.9	45%	0.448	44%	0.443	S	S	.	.	H	α-helix	trans	-60.3	-43.6	176.8	178.3	0	0	0	0	111.8	K81 Q82 V88 Q89	K81-S85 WeakPolarHBondContact O-CB 3.46Å; K81-S85 PolarHBondContact O-N 3.31Å; Q82-S85 PolarHBondContact O-N 3.47Å; S85-V88 PolarHBondContact O-N 3.17Å; S85-Q89 WeakPolarHBondContact O-CG 3.2Å; S85-Q89 PolarHBondContact O-N 2.94Å
86	K	95.7	Very high	95.8	Very high	148 Å²	148	83.9 Å²	83.9	64%	0.643	45%	0.448	S	S	*	.	H	α-helix	trans	-64.1	-40.7	175.6	-171.8	175.1	-178.7	178.9	0	111.9	Q82 A83 L84 Q89 S90	Q82-K86 WeakPolarHBondContact O-CB 3.31Å; Q82-K86 PolarHBondContact O-N 2.91Å; A83-K86 PolarHBondContact O-N 3.13Å; L84-K86 VanDerWaalsContact C-N 3.34Å; L84-K86 PolarHBondContact O-N 2.98Å; K86-Q89 PolarHBondContact O-N 2.87Å; K86-S90 PolarHBondContact O-N 2.84Å; K86-S90 PolarHBondContact O-OG 3.3Å
87	A	97.1	Very high	96.2	Very high	55 Å²	55	83.2 Å²	83.2	46%	0.455	44%	0.437	S	S	.	.	H	α-helix	trans	-62	-45.2	177.1	0	0	0	0	0	112.1	A83 L84 Q89 S90 F91	A83-A87 WeakPolarHBondContact O-CB 3.37Å; A83-A87 PolarHBondContact O-N 3.28Å; L84-A87 PolarHBondContact O-N 2.97Å; A87-Q89 VanDerWaalsContact C-N 3.35Å; A87-Q89 PolarHBondContact O-N 3.2Å; A87-S90 PolarHBondContact O-N 3.46Å; A87-F91 PolarHBondContact O-N 2.97Å
88	V	96.5	Very high	96.4	Very high	25 Å²	25	83.5 Å²	83.5	15%	0.152	42%	0.421	C	S	.	.	H	α-helix	trans	-61.5	-43.4	174.8	173.8	0	0	0	0	111	L62 L64 L84 S85 F91 L92	L62-V88 HydrophobicContact CB-CG1 4.26Å; L62-V88 HydrophobicContact CD2-CG1 4.27Å; L64-V88 HydrophobicContact CD1-CG2 3.46Å; L64-V88 VanDerWaalsContact CD1-CG2 3.46Å; L64-V88 HydrophobicContact CD2-CG2 4.39Å; L64-V88 HydrophobicContact CG-CG2 3.64Å; L84-V88 WeakPolarHBondContact O-CG2 3.41Å; L84-V88 PolarHBondContact O-N 2.88Å; S85-V88 PolarHBondContact O-N 3.17Å; V88-F91 WeakPolarHBondContact O-CB 3.49Å; V88-F91 PolarHBondContact O-N 3.36Å; V88-L92 HydrophobicContact CG1-CD1 3.9Å; V88-L92 HydrophobicContact CG1-CG 4.37Å; V88-L92 VanDerWaalsContact O-CG 3.31Å; V88-L92 WeakPolarHBondContact O-CG 3.38Å; V88-L92 PolarHBondContact O-N 3.34Å
89	Q	96.2	Very high	96.5	Very high	115 Å²	115	83.9 Å²	83.9	54%	0.537	42%	0.422	S	S	.	.	H	α-helix	trans	-61.9	-44.6	176.3	-75	-176.7	-10.2	0	0	112.1	S85 K86 A87 F91 L92 M93	S85-Q89 WeakPolarHBondContact O-CG 3.2Å; S85-Q89 PolarHBondContact O-N 2.94Å; K86-Q89 PolarHBondContact O-N 2.87Å; A87-Q89 VanDerWaalsContact C-N 3.35Å; A87-Q89 PolarHBondContact O-N 3.2Å; Q89-F91 VanDerWaalsContact C-N 3.34Å; Q89-F91 PolarHBondContact O-N 3.32Å; Q89-L92 PolarHBondContact O-N 3.07Å; Q89-M93 WeakPolarHBondContact O-CB 3.33Å; Q89-M93 VanDerWaalsContact O-CG 3.3Å; Q89-M93 WeakPolarHBondContact O-CG 3.35Å; Q89-M93 PolarHBondContact O-N 2.97Å
90	S	98	Very high	96.7	Very high	59 Å²	59	75.9 Å²	75.9	41%	0.413	40%	0.395	S	S	.	.	H	α-helix	trans	-60.3	-42.7	175.5	-67.1	0	0	0	0	112.5	K86 A87 M93 E94	K86-S90 PolarHBondContact O-N 2.84Å; K86-S90 PolarHBondContact O-OG 3.3Å; A87-S90 PolarHBondContact O-N 3.46Å; S90-M93 PolarHBondContact O-N 2.8Å; S90-E94 PolarHBondContact O-N 3.2Å; S90-E94 VanDerWaalsContact O-N 3.1Å
91	F	97.7	Very high	96.8	Very high	114 Å²	114	70.9 Å²	70.9	50%	0.5	37%	0.369	S	S	.	.	H	α-helix	trans	-59.4	-47.5	174.5	170.8	-103.7	0	0	0	111.8	V56 A87 V88 Q89 E94 L95	V56-F91 HydrophobicContact CG1-CE1 4.3Å; A87-F91 PolarHBondContact O-N 2.97Å; V88-F91 WeakPolarHBondContact O-CB 3.49Å; V88-F91 PolarHBondContact O-N 3.36Å; Q89-F91 VanDerWaalsContact C-N 3.34Å; Q89-F91 PolarHBondContact O-N 3.32Å; F91-E94 PolarHBondContact O-N 3Å; F91-L95 HydrophobicContact CD1-CD1 4.21Å; F91-L95 HydrophobicContact CE1-CD1 3.54Å; F91-L95 HydrophobicContact CE1-CG 4.41Å; F91-L95 HydrophobicContact CE2-CD1 4.19Å; F91-L95 HydrophobicContact CE2-CG 4.42Å; F91-L95 HydrophobicContact CZ-CD1 3.54Å; F91-L95 HydrophobicContact CZ-CG 4.25Å; F91-L95 WeakPolarHBondContact O-CG 3.5Å; F91-L95 PolarHBondContact O-N 2.93Å; F91-L95 VanDerWaalsContact O-N 3.14Å
92	L	97.7	Very high	97.1	Very high	12 Å²	12	70.8 Å²	70.8	6%	0.063	37%	0.373	C	S	.	.	H	α-helix	trans	-68.3	-36	179.9	-68.1	171.9	0	0	0	113.1	V56 R57 L62 V88 Q89 E94 L95 D96	V56-L92 HydrophobicContact CG1-CD2 4.09Å; R57-L92 HydrophobicContact CG-CD1 4.04Å; R57-L92 HydrophobicContact CG-CD2 3.92Å; L62-L92 HydrophobicContact CD1-CD1 3.66Å; L62-L92 HydrophobicContact CD1-CD2 4.14Å; L62-L92 HydrophobicContact CD1-CG 4.48Å; L62-L92 HydrophobicContact CD2-CD1 4.3Å; L62-L92 HydrophobicContact CD2-CD2 3.94Å; L62-L92 HydrophobicContact CD2-CG 4.42Å; V88-L92 HydrophobicContact CG1-CD1 3.9Å; V88-L92 HydrophobicContact CG1-CG 4.37Å; V88-L92 VanDerWaalsContact O-CG 3.31Å; V88-L92 WeakPolarHBondContact O-CG 3.38Å; V88-L92 PolarHBondContact O-N 3.34Å; Q89-L92 PolarHBondContact O-N 3.07Å; L92-E94 VanDerWaalsContact C-N 3.29Å; L92-E94 PolarHBondContact O-N 3.43Å; L92-L95 PolarHBondContact O-N 3.36Å; L92-D96 VanDerWaalsContact O-CG 3.26Å; L92-D96 PolarHBondContact O-N 3.3Å
93	M	98.2	Very high	97.3	Very high	110 Å²	110	67.5 Å²	67.5	54%	0.542	36%	0.36	S	S	.	.	H	α-helix	trans	-63.2	-36.9	174.1	-75.7	-173.2	-59.1	0	0	111.6	Q89 S90 D96 N97	Q89-M93 WeakPolarHBondContact O-CB 3.33Å; Q89-M93 VanDerWaalsContact O-CG 3.3Å; Q89-M93 WeakPolarHBondContact O-CG 3.35Å; Q89-M93 PolarHBondContact O-N 2.97Å; S90-M93 PolarHBondContact O-N 2.8Å; M93-D96 PolarHBondContact O-N 3.12Å; M93-N97 PolarHBondContact O-ND2 3.08Å
94	E	98.6	Very high	97.3	Very high	94 Å²	94	66.4 Å²	66.4	44%	0.439	35%	0.347	S	S	.	.	H	α-helix	trans	-64.4	-45.5	173.4	-178.5	57.4	-152.4	0	0	110.8	S90 F91 L92 D96 N97 Y98	S90-E94 PolarHBondContact O-N 3.2Å; S90-E94 VanDerWaalsContact O-N 3.1Å; F91-E94 PolarHBondContact O-N 3Å; L92-E94 VanDerWaalsContact C-N 3.29Å; L92-E94 PolarHBondContact O-N 3.43Å; E94-D96 PolarHBondContact O-N 2.8Å; E94-N97 WeakPolarHBondContact O-CB 3.11Å; E94-N97 PolarHBondContact O-N 2.92Å; E94-N97 VanDerWaalsContact O-N 3.13Å; E94-N97 PolarHBondContact O-ND2 3.17Å; E94-Y98 HydrophobicContact CG-CE2 4.37Å; E94-Y98 WeakPolarHBondContact O-CD2 3.2Å; E94-Y98 VanDerWaalsContact O-CE2 3.27Å; E94-Y98 WeakPolarHBondContact O-CE2 3.47Å; E94-Y98 WeakPolarHBondContact OE1-CE2 3.13Å; E94-Y98 PolarHBondContact OE1-OH 3.15Å
95	L	98.4	Very high	97.3	Very high	32 Å²	32	70.3 Å²	70.3	17%	0.168	37%	0.365	C	S	.	.	H	α-helix	trans	-65.8	-20.7	178	-63.9	-173.6	0	0	0	114	I52 G53 V56 F91 L92 N97 Y98	I52-L95 HydrophobicContact CG2-CB 4.45Å; I52-L95 HydrophobicContact CG2-CD2 4.3Å; G53-L95 PolarHBondContact N-O 2.71Å; G53-L95 VanDerWaalsContact N-O 3.09Å; V56-L95 HydrophobicContact CB-CD1 4.11Å; V56-L95 HydrophobicContact CG1-CD1 4.2Å; V56-L95 HydrophobicContact CG2-CD1 3.78Å; F91-L95 HydrophobicContact CD1-CD1 4.21Å; F91-L95 HydrophobicContact CE1-CD1 3.54Å; F91-L95 HydrophobicContact CE1-CG 4.41Å; F91-L95 HydrophobicContact CE2-CD1 4.19Å; F91-L95 HydrophobicContact CE2-CG 4.42Å; F91-L95 HydrophobicContact CZ-CD1 3.54Å; F91-L95 HydrophobicContact CZ-CG 4.25Å; F91-L95 WeakPolarHBondContact O-CG 3.5Å; F91-L95 PolarHBondContact O-N 2.93Å; F91-L95 VanDerWaalsContact O-N 3.14Å; L92-L95 PolarHBondContact O-N 3.36Å; L95-N97 PolarHBondContact O-N 3.3Å; L95-Y98 PolarHBondContact O-N 3.12Å
96	D	98.5	Very high	97.3	Very high	40 Å²	40	76.3 Å²	76.3	21%	0.214	39%	0.385	C	S	.	.	T	Hydrogen-bonded Turn	trans	-69.5	-16.6	175.3	-74.3	-26.5	0	0	0	113.4	R51 R57 L92 M93 E94 Y98	R51-D96 VanDerWaalsContact CD-O 3.28Å; R51-D96 WeakPolarHBondContact CD-O 3.47Å; R51-D96 IonicContact CZ-OD1 3.85Å; R51-D96 IonicContact NE-OD1 3.64Å; R57-D96 IonicContact CZ-OD1 3.2Å; R57-D96 IonicContact CZ-OD2 2.66Å; R57-D96 IonicContact NH1-OD1 3.54Å; R57-D96 PolarHBondContact NH1-OD1 3.38Å; R57-D96 IonicContact NH1-OD2 3.38Å; R57-D96 VanDerWaalsContact NH2-CG 3.27Å; R57-D96 IonicContact NH2-OD1 2.66Å; R57-D96 PolarHBondContact NH2-OD1 2.98Å; R57-D96 IonicContact NH2-OD2 3.59Å; R57-D96 PolarHBondContact NH2-OD2 3.47Å; L92-D96 VanDerWaalsContact O-CG 3.26Å; L92-D96 PolarHBondContact O-N 3.3Å; M93-D96 PolarHBondContact O-N 3.12Å; E94-D96 PolarHBondContact O-N 2.8Å; D96-Y98 VanDerWaalsContact C-N 3.25Å; D96-Y98 PolarHBondContact O-N 2.92Å
97	N	98.4	Very high	97.3	Very high	108 Å²	108	72 Å²	72	58%	0.578	37%	0.369	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.3	-7.2	179.1	-61.4	-41.7	0	0	0	113.4	M93 E94 L95	M93-N97 PolarHBondContact O-ND2 3.08Å; E94-N97 WeakPolarHBondContact O-CB 3.11Å; E94-N97 PolarHBondContact O-N 2.92Å; E94-N97 VanDerWaalsContact O-N 3.13Å; E94-N97 PolarHBondContact O-ND2 3.17Å; L95-N97 PolarHBondContact O-N 3.3Å
98	Y	98.6	Very high	97.1	Very high	93 Å²	93	75 Å²	75	37%	0.365	37%	0.374	S	S	.	.			trans	-122.8	141.1	-175	-52.3	-89.5	0	0	0	111.6	R51 I52 E94 L95 D96 L103	R51-Y98 WeakPolarHBondContact CA-O 3.48Å; I52-Y98 WeakPolarHBondContact CG1-O 3.39Å; I52-Y98 PolarHBondContact N-O 2.71Å; E94-Y98 HydrophobicContact CG-CE2 4.37Å; E94-Y98 WeakPolarHBondContact O-CD2 3.2Å; E94-Y98 VanDerWaalsContact O-CE2 3.27Å; E94-Y98 WeakPolarHBondContact O-CE2 3.47Å; E94-Y98 WeakPolarHBondContact OE1-CE2 3.13Å; E94-Y98 PolarHBondContact OE1-OH 3.15Å; L95-Y98 PolarHBondContact O-N 3.12Å; D96-Y98 VanDerWaalsContact C-N 3.25Å; D96-Y98 PolarHBondContact O-N 2.92Å; Y98-L103 HydrophobicContact CD1-CD2 4.43Å
99	T	98.7	Very high	97	Very high	30 Å²	30	78 Å²	78	18%	0.184	39%	0.394	C	S	.	.	B	Isolated β-bridge	trans	-105.1	168.8	165.3	70.5	0	0	0	0	110.4	S48 I50 A101 D102 L103	S48-T99 WeakPolarHBondContact O-CG2 3.32Å; I50-T99 CarbonylContact O-C 3.52Å; I50-T99 WeakPolarHBondContact O-CA 3.36Å; T99-A101 PolarHBondContact O-N 3.38Å; T99-A101 PolarHBondContact OG1-N 3.18Å; T99-D102 WeakPolarHBondContact CA-OD2 3.19Å; T99-D102 VanDerWaalsContact CB-OD2 3.32Å; T99-D102 WeakPolarHBondContact CB-OD2 3.26Å; T99-D102 PolarHBondContact N-OD2 2.61Å; T99-D102 PolarHBondContact O-N 3.16Å; T99-D102 PolarHBondContact OG1-N 3.36Å; T99-D102 PolarHBondContact OG1-OD2 2.88Å; T99-L103 PolarHBondContact O-N 3.45Å
100	L	98.3	Very high	96.9	Very high	45 Å²	45	74.8 Å²	74.8	24%	0.236	38%	0.38	C	S	.	.	H	α-helix	trans	-60.3	-33.7	172.8	-179.5	62.9	0	0	0	111.3	L43 A47 I50 I52 L103 V104	L43-L100 HydrophobicContact CD1-CD2 4.06Å; L43-L100 HydrophobicContact CD2-CD2 3.79Å; A47-L100 HydrophobicContact CB-CB 4.13Å; A47-L100 HydrophobicContact CB-CD2 4.17Å; A47-L100 HydrophobicContact CB-CG 4.1Å; A47-L100 WeakPolarHBondContact O-CB 3.36Å; A47-L100 PolarHBondContact O-N 3.31Å; I50-L100 HydrophobicContact CB-CB 4.02Å; I50-L100 HydrophobicContact CD1-CD2 4.04Å; I50-L100 HydrophobicContact CG2-CB 4.26Å; I50-L100 PolarHBondContact O-N 3.04Å; I52-L100 HydrophobicContact CD1-CB 4.5Å; L100-L103 PolarHBondContact O-N 3.07Å; L100-V104 HydrophobicContact CD1-CG1 4.02Å; L100-V104 HydrophobicContact CG-CG1 4.46Å; L100-V104 WeakPolarHBondContact O-CG1 3.39Å; L100-V104 WeakPolarHBondContact O-CG2 3.27Å; L100-V104 PolarHBondContact O-N 3.33Å
101	A	98.4	Very high	96.5	Very high	3 Å²	3	76 Å²	76	3%	0.025	38%	0.376	C	S	.	.	H	α-helix	trans	-59.3	-48.2	175.7	0	0	0	0	0	111.2	A47 T99 L103 V104 E105	A47-A101 HydrophobicContact CB-CB 4.05Å; A47-A101 PolarHBondContact O-N 3.32Å; T99-A101 PolarHBondContact O-N 3.38Å; T99-A101 PolarHBondContact OG1-N 3.18Å; A101-L103 PolarHBondContact O-N 3.35Å; A101-V104 PolarHBondContact O-N 2.91Å; A101-E105 HydrophobicContact CB-CG 4.28Å; A101-E105 WeakPolarHBondContact CB-OE1 3.49Å; A101-E105 WeakPolarHBondContact O-CB 3.47Å; A101-E105 WeakPolarHBondContact O-CG 3.29Å; A101-E105 PolarHBondContact O-N 3.29Å
102	D	97.9	Very high	96.2	Very high	95 Å²	95	78.6 Å²	78.6	51%	0.508	39%	0.387	S	S	.	.	H	α-helix	trans	-59	-26.2	-179.7	-55.7	-57.9	0	0	0	113	T99	T99-D102 WeakPolarHBondContact CA-OD2 3.19Å; T99-D102 VanDerWaalsContact CB-OD2 3.32Å; T99-D102 WeakPolarHBondContact CB-OD2 3.26Å; T99-D102 PolarHBondContact N-OD2 2.61Å; T99-D102 PolarHBondContact O-N 3.16Å; T99-D102 PolarHBondContact OG1-N 3.36Å; T99-D102 PolarHBondContact OG1-OD2 2.88Å
103	L	96.9	Very high	95.7	Very high	75 Å²	75	84.2 Å²	84.2	39%	0.393	42%	0.417	S	S	.	.	H	α-helix	trans	-85.1	-25.2	179.2	-59.5	-171	0	0	0	113.9	I52 Y98 T99 L100 A101 N107	I52-L103 HydrophobicContact CD1-CD1 3.61Å; I52-L103 HydrophobicContact CD1-CG 4.41Å; I52-L103 HydrophobicContact CG1-CD1 3.82Å; I52-L103 HydrophobicContact CG1-CG 4.37Å; Y98-L103 HydrophobicContact CD1-CD2 4.43Å; T99-L103 PolarHBondContact O-N 3.45Å; L100-L103 PolarHBondContact O-N 3.07Å; A101-L103 PolarHBondContact O-N 3.35Å; L103-N107 PolarHBondContact O-ND2 3.4Å
104	V	96.1	Very high	95.1	Very high	35 Å²	35	83.3 Å²	83.3	21%	0.212	41%	0.414	C	S	.	.	H	α-helix	trans	-114.2	-27.3	-170.5	-54	0	0	0	0	113.7	L100 A101 N107 L110 Y111	L100-V104 HydrophobicContact CD1-CG1 4.02Å; L100-V104 HydrophobicContact CG-CG1 4.46Å; L100-V104 WeakPolarHBondContact O-CG1 3.39Å; L100-V104 WeakPolarHBondContact O-CG2 3.27Å; L100-V104 PolarHBondContact O-N 3.33Å; A101-V104 PolarHBondContact O-N 2.91Å; V104-N107 PolarHBondContact O-N 3.09Å; V104-L110 HydrophobicContact CB-CD2 4.3Å; V104-L110 HydrophobicContact CG1-CD2 3.95Å; V104-Y111 WeakPolarHBondContact O-CE2 3.48Å; V104-Y111 PolarHBondContact O-OH 3.38Å
105	E	95.2	Very high	94	Very high	125 Å²	125	84.9 Å²	84.9	58%	0.584	42%	0.424	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.3	137.6	178.6	-70.8	-179	-178.3	0	0	109.9	A101 N107	A101-E105 HydrophobicContact CB-CG 4.28Å; A101-E105 WeakPolarHBondContact CB-OE1 3.49Å; A101-E105 WeakPolarHBondContact O-CB 3.47Å; A101-E105 WeakPolarHBondContact O-CG 3.29Å; A101-E105 PolarHBondContact O-N 3.29Å; E105-N107 PolarHBondContact O-N 3.22Å
106	E	93.1	Very high	92	Very high	189 Å²	189	89 Å²	89	88%	0.883	45%	0.451	S	S	*	.	T	Hydrogen-bonded Turn	trans	56.5	10.4	-178	-55.2	-173.5	176	0	0	115.8	Q108	E106-Q108 PolarHBondContact O-N 3.28Å; E106-Q108 VanDerWaalsContact O-N 3.08Å
107	N	94.9	Very high	89.5	Confident	57 Å²	57	99.3 Å²	99.3	31%	0.305	50%	0.497	S	S	.	.			trans	-89.9	66.8	-177.8	-163.7	-16.4	0	0	0	112.2	L103 V104 E105 P109 L110 Y111	L103-N107 PolarHBondContact O-ND2 3.4Å; V104-N107 PolarHBondContact O-N 3.09Å; E105-N107 PolarHBondContact O-N 3.22Å; N107-P109 VanDerWaalsContact C-CD 3.42Å; N107-P109 VanDerWaalsContact C-N 3.32Å; N107-L110 HydrophobicContact CB-CB 3.94Å; N107-L110 HydrophobicContact CB-CD2 4.41Å; N107-L110 WeakPolarHBondContact O-CB 3.39Å; N107-L110 PolarHBondContact O-N 2.82Å; N107-L110 WeakPolarHBondContact OD1-CB 3.41Å; N107-L110 PolarHBondContact OD1-N 2.77Å; N107-Y111 WeakPolarHBondContact O-CD2 3.45Å; N107-Y111 PolarHBondContact O-N 3.33Å; N107-Y111 VanDerWaalsContact O-N 3.17Å
108	Q	93.1	Very high	89	Confident	120 Å²	120	98.9 Å²	98.9	56%	0.561	49%	0.493	S	S	*	.	H	α-helix	trans	-53	-40.1	179.7	-64.9	-59.7	-42	0	0	114.2	E106 L110 Y111 K112	E106-Q108 PolarHBondContact O-N 3.28Å; E106-Q108 VanDerWaalsContact O-N 3.08Å; Q108-L110 VanDerWaalsContact C-N 3.32Å; Q108-L110 PolarHBondContact O-N 3.24Å; Q108-Y111 PolarHBondContact O-N 3.36Å; Q108-K112 WeakPolarHBondContact O-CG 3.22Å; Q108-K112 PolarHBondContact O-N 3.42Å
109	P	94.6	Very high	88.5	Confident	86 Å²	86	99.2 Å²	99.2	56%	0.558	50%	0.5	S	S	*	.	H	α-helix	trans	-58.7	-40.7	173.5	-25.1	36	0	0	0	113.2	N107 K112 L113	N107-P109 VanDerWaalsContact C-CD 3.42Å; N107-P109 VanDerWaalsContact C-N 3.32Å; P109-K112 PolarHBondContact O-N 3.15Å; P109-L113 WeakPolarHBondContact O-CG 3.45Å; P109-L113 PolarHBondContact O-N 3.41Å
110	L	93.1	Very high	87.9	Confident	48 Å²	48	103 Å²	103	25%	0.251	52%	0.518	S	S	.	.	H	α-helix	trans	-63.5	-45.3	177.2	179.3	67.8	0	0	0	111.8	V104 N107 Q108 K112 L113 L114	V104-L110 HydrophobicContact CB-CD2 4.3Å; V104-L110 HydrophobicContact CG1-CD2 3.95Å; N107-L110 HydrophobicContact CB-CB 3.94Å; N107-L110 HydrophobicContact CB-CD2 4.41Å; N107-L110 WeakPolarHBondContact O-CB 3.39Å; N107-L110 PolarHBondContact O-N 2.82Å; N107-L110 WeakPolarHBondContact OD1-CB 3.41Å; N107-L110 PolarHBondContact OD1-N 2.77Å; Q108-L110 VanDerWaalsContact C-N 3.32Å; Q108-L110 PolarHBondContact O-N 3.24Å; L110-K112 VanDerWaalsContact C-N 3.28Å; L110-K112 PolarHBondContact O-N 3.17Å; L110-L113 PolarHBondContact O-N 2.91Å; L110-L113 VanDerWaalsContact O-N 3.07Å; L110-L114 HydrophobicContact CD1-CD1 3.89Å; L110-L114 HydrophobicContact CD1-CG 4.1Å; L110-L114 HydrophobicContact CD2-CD1 4.35Å; L110-L114 HydrophobicContact CG-CD1 3.82Å; L110-L114 HydrophobicContact CG-CG 4.33Å; L110-L114 WeakPolarHBondContact O-CG 3.36Å; L110-L114 PolarHBondContact O-N 2.97Å
111	Y	90.5	Very high	87.3	Confident	85 Å²	85	106.4 Å²	106.4	33%	0.333	53%	0.534	S	S	.	.	H	α-helix	trans	-60.4	-38.1	178.6	-72.6	-70.6	0	0	0	112.3	V104 N107 Q108 L113 L114 L115	V104-Y111 WeakPolarHBondContact O-CE2 3.48Å; V104-Y111 PolarHBondContact O-OH 3.38Å; N107-Y111 WeakPolarHBondContact O-CD2 3.45Å; N107-Y111 PolarHBondContact O-N 3.33Å; N107-Y111 VanDerWaalsContact O-N 3.17Å; Q108-Y111 PolarHBondContact O-N 3.36Å; Y111-L113 VanDerWaalsContact C-N 3.27Å; Y111-L113 PolarHBondContact O-N 2.94Å; Y111-L114 PolarHBondContact O-N 3.44Å; Y111-L115 HydrophobicContact CD1-CD1 4.38Å; Y111-L115 VanDerWaalsContact O-CB 3.27Å; Y111-L115 WeakPolarHBondContact O-CB 3.31Å; Y111-L115 WeakPolarHBondContact O-CG 3.33Å; Y111-L115 PolarHBondContact O-N 3.22Å
112	K	90.4	Very high	86.6	Confident	168 Å²	168	112.9 Å²	112.9	73%	0.73	57%	0.566	S	S	*	*	H	α-helix	trans	-62.9	-32.3	175.6	-71	177.8	-179.8	-178.6	0	113.3	Q108 P109 L110	Q108-K112 WeakPolarHBondContact O-CG 3.22Å; Q108-K112 PolarHBondContact O-N 3.42Å; P109-K112 PolarHBondContact O-N 3.15Å; L110-K112 VanDerWaalsContact C-N 3.28Å; L110-K112 PolarHBondContact O-N 3.17Å
113	L	88.6	Confident	85.9	Confident	131 Å²	131	114.1 Å²	114.1	69%	0.686	57%	0.57	S	S	*	*	H	α-helix	trans	-80.8	-29.3	178.6	-66.6	172.5	0	0	0	112.7	P109 L110 Y111 V116	P109-L113 WeakPolarHBondContact O-CG 3.45Å; P109-L113 PolarHBondContact O-N 3.41Å; L110-L113 PolarHBondContact O-N 2.91Å; L110-L113 VanDerWaalsContact O-N 3.07Å; Y111-L113 VanDerWaalsContact C-N 3.27Å; Y111-L113 PolarHBondContact O-N 2.94Å; L113-V116 VanDerWaalsContact O-CG2 3.29Å; L113-V116 WeakPolarHBondContact O-CG2 3.47Å
114	L	84.7	Confident	85.1	Confident	90 Å²	90	116.9 Å²	116.9	47%	0.471	58%	0.583	S	S	.	*	H	α-helix	trans	-91.4	-32.4	-177.6	-65.7	179.8	0	0	0	113.5	L110 Y111 V116	L110-L114 HydrophobicContact CD1-CD1 3.89Å; L110-L114 HydrophobicContact CD1-CG 4.1Å; L110-L114 HydrophobicContact CD2-CD1 4.35Å; L110-L114 HydrophobicContact CG-CD1 3.82Å; L110-L114 HydrophobicContact CG-CG 4.33Å; L110-L114 WeakPolarHBondContact O-CG 3.36Å; L110-L114 PolarHBondContact O-N 2.97Å; Y111-L114 PolarHBondContact O-N 3.44Å; L114-V116 PolarHBondContact O-N 3.19Å
115	L	74.9	Confident	84.2	Confident	127 Å²	127	123.2 Å²	123.2	67%	0.665	61%	0.611	S	S	*	*	S	Bend	trans	-89.9	48.8	179.4	-61.4	175.4	0	0	0	110.9	Y111 E117	Y111-L115 HydrophobicContact CD1-CD1 4.38Å; Y111-L115 VanDerWaalsContact O-CB 3.27Å; Y111-L115 WeakPolarHBondContact O-CB 3.31Å; Y111-L115 WeakPolarHBondContact O-CG 3.33Å; Y111-L115 PolarHBondContact O-N 3.22Å; L115-E117 PolarHBondContact O-N 2.97Å
116	V	57.1	Low	83.3	Confident	119 Å²	119	123 Å²	123	72%	0.721	61%	0.613	S	S	*	*			trans	-61.8	107.4	174.4	-173.3	0	0	0	0	108.2	L113 L114	L113-V116 VanDerWaalsContact O-CG2 3.29Å; L113-V116 WeakPolarHBondContact O-CG2 3.47Å; L114-V116 PolarHBondContact O-N 3.19Å
117	E	45	Very low	82.4	Confident	256 Å²	256	117 Å²	117	100%	1.196	59%	0.589	S	S	*	*			trans	-73.6	0	152.7	-68.2	-176.3	165.1	0	0	109.8	L115	L115-E117 PolarHBondContact O-N 2.97Å

Retrieved 117 of 117 residues in 925.3 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).