A0A077ZEF8_TRITR Loading...

DNA-directed RNA polymerase III subunit RPC9

Accessory protein for the calcitonin gene-related peptide (CGRP) receptor. It modulates CGRP responsiveness in a variety of tissues. DNA-dependent RNA polymerase catalyzes the transcription of DNA into RNA using the four ribonucleoside triphosphates as substrates. Specific peripheric component of RNA polymerase III (Pol III) which synthesizes small non-coding RNAs including 5S rRNA, snRNAs, tRNAs and miRNAs from at least 500 distinct genomic loci. With POLR3H/RPC8 forms a mobile stalk that protrudes from Pol III core and functions primarily in transcription initiation. Pol III plays a key role in sensing and limiting infection by intracellular bacteria and DNA viruses. Acts as nuclear and cytosolic DNA sensor involved in innate immune response. Can sense non-self dsDNA that serves as template for transcription into dsRNA. The non-self RNA polymerase III transcripts, such as Epstein-Barr virus-encoded RNAs (EBERs) induce type I interferon and NF-kappa-B through the RIG-I pathway.

AlphaFold DB , UniProt , Accession A0A077ZEF8, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 123 aa.

						>A0A077ZEF8_TRITR|A0A077ZEF8
MSKFRIWHEPVASVSNMEVFRFVKEELDSFKKKDVSSDGSFTAFFEELVEYFKMTDVTKQTEEGLSKVIEESEKLGLSKNEAIQIINLKPKSHLDLQLIVEDCESRLTELQIENFLALCGTSL
					

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	52.6	Low	76.8	Confident	238 Å²	238	167.5 Å²	167.5	100%	1.172	82%	0.82	S	S	*	*				0	112.2	0	-64	-178.6	-161.7	0	0	107.9	K3	M1-K3 PolarHBondContact O-N 2.9Å
2	S	69.3	Low	77.9	Confident	128 Å²	128	159.1 Å²	159.1	90%	0.895	80%	0.797	S	S	*	*	P	Polyproline II helix	trans	-66.6	121.5	173.7	-170	0	0	0	0	108.3	F4	S2-F4 PolarHBondContact O-N 2.76Å
3	K	78.9	Confident	78.9	Confident	182 Å²	182	151.2 Å²	151.2	79%	0.791	77%	0.766	S	S	*	*	P	Polyproline II helix	trans	-71.3	124.8	174.9	-72.5	-176.5	176.9	-177.4	0	108.1	M1 R5	M1-K3 PolarHBondContact O-N 2.9Å; K3-R5 PolarHBondContact O-N 3.23Å
4	F	83.7	Confident	79.9	Confident	182 Å²	182	146.4 Å²	146.4	80%	0.798	75%	0.748	S	S	*	*	P	Polyproline II helix	trans	-51.7	128	167.6	178.1	-99	0	0	0	109.2	S2 I6	S2-F4 PolarHBondContact O-N 2.76Å; F4-I6 HydrophobicContact CD1-CG1 4.4Å; F4-I6 HydrophobicContact CE1-CD1 4.33Å; F4-I6 HydrophobicContact CE1-CG1 3.63Å; F4-I6 HydrophobicContact CZ-CG1 4.29Å
5	R	83.4	Confident	80.9	Confident	173 Å²	173	137.1 Å²	137.1	65%	0.653	70%	0.701	S	S	*	*			trans	-120.5	132.9	174.9	-67.1	-172.2	-171	-138.8	3.9	108.2	K3 W7	K3-R5 PolarHBondContact O-N 3.23Å; R5-W7 HydrophobicContact CB-CZ2 4.3Å; R5-W7 PolarHBondContact O-NE1 3.21Å; R5-W7 VanDerWaalsContact O-NE1 3.15Å
6	I	82.2	Confident	81.8	Confident	142 Å²	142	130.9 Å²	130.9	73%	0.728	67%	0.67	S	S	*	*			trans	-82.9	118.7	166.7	-60.8	173.4	0	0	0	105.6	F4	F4-I6 HydrophobicContact CD1-CG1 4.4Å; F4-I6 HydrophobicContact CE1-CD1 4.33Å; F4-I6 HydrophobicContact CE1-CG1 3.63Å; F4-I6 HydrophobicContact CZ-CG1 4.29Å
7	W	73.6	Confident	82.6	Confident	200 Å²	200	124.1 Å²	124.1	76%	0.758	64%	0.635	S	S	*	*			trans	-83.5	-25.7	-167	-64.6	89.6	0	0	0	113.1	R5	R5-W7 HydrophobicContact CB-CZ2 4.3Å; R5-W7 PolarHBondContact O-NE1 3.21Å; R5-W7 VanDerWaalsContact O-NE1 3.15Å
8	H	72.9	Confident	83.2	Confident	153 Å²	153	123.1 Å²	123.1	71%	0.708	63%	0.627	S	S	*	*	S	Bend	trans	-153.3	164.7	-173.8	-66.9	-68.3	0	0	0	113.3
9	E	79.2	Confident	83.9	Confident	174 Å²	174	118.7 Å²	118.7	81%	0.813	61%	0.607	S	S	*	*	S	Bend	trans	-56.9	166.9	163.3	-73.7	176.8	-176.6	0	0	111.8	V11	E9-V11 PolarHBondContact O-N 3.15Å; E9-V11 VanDerWaalsContact O-N 3.12Å
10	P	81.5	Confident	84.5	Confident	129 Å²	129	113.8 Å²	113.8	84%	0.838	58%	0.581	S	S	*	*			trans	-49.2	119.9	-176.2	-27.8	35.4	0	0	0	112.8
11	V	87.4	Confident	85	Confident	142 Å²	142	112.4 Å²	112.4	86%	0.861	57%	0.569	S	S	*	*			trans	-77.7	-25.5	-174.9	-64.7	0	0	0	0	113.3	E9	E9-V11 PolarHBondContact O-N 3.15Å; E9-V11 VanDerWaalsContact O-N 3.12Å
12	A	89.8	Confident	87	Confident	66 Å²	66	106.4 Å²	106.4	55%	0.545	54%	0.536	S	S	.	.			trans	-159.7	153.2	-178.7	0	0	0	0	0	110.7
13	S	91.3	Very high	88.2	Confident	57 Å²	57	100.5 Å²	100.5	40%	0.399	50%	0.495	S	S	.	.			trans	-98.5	131.7	163.2	-53	0	0	0	0	107.8
14	V	93.3	Very high	88.9	Confident	84 Å²	84	96.8 Å²	96.8	51%	0.509	48%	0.479	S	S	.	.			trans	-117.9	142.3	179.1	-67.8	0	0	0	0	109.5	V19	V14-V19 HydrophobicContact CB-CG2 4.34Å; V14-V19 HydrophobicContact CG2-CG2 3.68Å
15	S	94.2	Very high	89.4	Confident	7 Å²	7	94 Å²	94	5%	0.049	47%	0.468	C	S	.	.			trans	-75	156.1	174.7	65.9	0	0	0	0	111.2	M17 E18 V19	S15-M17 PolarHBondContact O-N 2.95Å; S15-E18 WeakPolarHBondContact CB-OE2 3.5Å; S15-E18 PolarHBondContact N-OE2 3.35Å; S15-E18 PolarHBondContact O-N 3.35Å; S15-E18 VanDerWaalsContact OG-CG 3.29Å; S15-E18 WeakPolarHBondContact OG-CG 3.46Å; S15-E18 PolarHBondContact OG-N 2.72Å; S15-E18 PolarHBondContact OG-OE2 3.14Å; S15-V19 WeakPolarHBondContact O-CG2 3.19Å; S15-V19 PolarHBondContact O-N 2.71Å; S15-V19 VanDerWaalsContact O-N 3.1Å
16	N	95.9	Very high	89.8	Confident	38 Å²	38	89.1 Å²	89.1	20%	0.203	45%	0.453	C	S	.	.	H	α-helix	trans	-58.6	-31.2	173.1	-73.9	-12.2	0	0	0	111.6	F20 F52 V57 N87	N16-F20 VanDerWaalsContact O-CB 3.25Å; N16-F20 WeakPolarHBondContact O-CB 3.32Å; N16-F20 PolarHBondContact O-N 3.01Å; N16-F52 HydrophobicContact CB-CD1 4.37Å; N16-F52 HydrophobicContact CB-CE1 3.7Å; N16-V57 HydrophobicContact CB-CB 4.47Å; N16-V57 HydrophobicContact CB-CG1 4.07Å; N16-V57 HydrophobicContact CB-CG2 3.57Å; N16-N87 WeakPolarHBondContact CB-OD1 3.48Å; N16-N87 PolarHBondContact N-OD1 3.18Å
17	M	94.8	Very high	90.2	Very high	14 Å²	14	83 Å²	83	7%	0.069	42%	0.421	C	S	.	.	H	α-helix	trans	-68.3	-44.2	177.6	-174	53.7	-178.1	0	0	112.4	S15 V19 F20 R21 V57 L65	S15-M17 PolarHBondContact O-N 2.95Å; M17-V19 VanDerWaalsContact C-N 3.32Å; M17-V19 PolarHBondContact O-N 2.92Å; M17-F20 HydrophobicContact CE-CD1 4.43Å; M17-F20 PolarHBondContact O-N 3.39Å; M17-F20 HydrophobicContact SD-CD1 3.99Å; M17-R21 HydrophobicContact CE-CG 3.84Å; M17-R21 WeakPolarHBondContact O-CG 3.38Å; M17-R21 PolarHBondContact O-N 3.34Å; M17-R21 HydrophobicContact SD-CG 4.39Å; M17-V57 VanDerWaalsContact CA-CG1 3.47Å; M17-V57 HydrophobicContact CB-CG1 3.96Å; M17-V57 HydrophobicContact SD-CG1 3.88Å; M17-V57 VanDerWaalsContact SD-O 3.34Å; M17-L65 HydrophobicContact CB-CD1 4.14Å; M17-L65 HydrophobicContact CG-CD1 4.13Å
18	E	94.5	Very high	91	Very high	106 Å²	106	76.7 Å²	76.7	50%	0.495	40%	0.402	S	S	.	.	H	α-helix	trans	-60.8	-44.5	175.2	-72.2	163.6	128	0	0	110.9	S15 R21 F22	S15-E18 WeakPolarHBondContact CB-OE2 3.5Å; S15-E18 PolarHBondContact N-OE2 3.35Å; S15-E18 PolarHBondContact O-N 3.35Å; S15-E18 VanDerWaalsContact OG-CG 3.29Å; S15-E18 WeakPolarHBondContact OG-CG 3.46Å; S15-E18 PolarHBondContact OG-N 2.72Å; S15-E18 PolarHBondContact OG-OE2 3.14Å; E18-R21 PolarHBondContact O-N 3.49Å; E18-F22 WeakPolarHBondContact O-CB 3.47Å; E18-F22 PolarHBondContact O-N 3.16Å
19	V	95.9	Very high	91.7	Very high	41 Å²	41	71.4 Å²	71.4	25%	0.248	38%	0.383	C	S	.	.	H	α-helix	trans	-62.6	-46.4	176.5	179.5	0	0	0	0	110.6	V14 S15 M17 R21 F22 V23 L48 F52	V14-V19 HydrophobicContact CB-CG2 4.34Å; V14-V19 HydrophobicContact CG2-CG2 3.68Å; S15-V19 WeakPolarHBondContact O-CG2 3.19Å; S15-V19 PolarHBondContact O-N 2.71Å; S15-V19 VanDerWaalsContact O-N 3.1Å; M17-V19 VanDerWaalsContact C-N 3.32Å; M17-V19 PolarHBondContact O-N 2.92Å; V19-R21 PolarHBondContact O-N 2.99Å; V19-F22 PolarHBondContact O-N 2.87Å; V19-V23 HydrophobicContact CG1-CG2 4.06Å; V19-V23 WeakPolarHBondContact O-CB 3.44Å; V19-V23 WeakPolarHBondContact O-CG2 3.43Å; V19-V23 PolarHBondContact O-N 3.03Å; V19-L48 HydrophobicContact CG1-CD2 4.38Å; V19-F52 HydrophobicContact CB-CE2 4.37Å; V19-F52 HydrophobicContact CB-CZ 4.03Å; V19-F52 HydrophobicContact CG1-CE2 3.86Å; V19-F52 HydrophobicContact CG1-CZ 3.79Å
20	F	96.1	Very high	92	Very high	19 Å²	19	65.7 Å²	65.7	8%	0.083	36%	0.355	C	S	.	.	H	α-helix	trans	-59.2	-45	178.8	173.6	-113.1	0	0	0	112.3	N16 M17 K24 V49 F52 V57 T58	N16-F20 VanDerWaalsContact O-CB 3.25Å; N16-F20 WeakPolarHBondContact O-CB 3.32Å; N16-F20 PolarHBondContact O-N 3.01Å; M17-F20 HydrophobicContact CE-CD1 4.43Å; M17-F20 PolarHBondContact O-N 3.39Å; M17-F20 HydrophobicContact SD-CD1 3.99Å; F20-K24 HydrophobicContact CE1-CD 4.41Å; F20-K24 HydrophobicContact CZ-CD 4.12Å; F20-K24 VanDerWaalsContact O-CB 3.27Å; F20-K24 WeakPolarHBondContact O-CB 3.38Å; F20-K24 PolarHBondContact O-N 3.16Å; F20-V49 HydrophobicContact CE2-CG1 4.29Å; F20-F52 HydrophobicContact CB-CB 4.36Å; F20-F52 HydrophobicContact CB-CD1 4.45Å; F20-F52 HydrophobicContact CB-CD2 3.8Å; F20-F52 HydrophobicContact CB-CE2 4.12Å; F20-F52 HydrophobicContact CB-CG 3.96Å; F20-F52 HydrophobicContact CD2-CB 3.45Å; F20-F52 VanDerWaalsContact CD2-CB 3.45Å; F20-F52 AromaticContact CD2-CD2 3.71Å; F20-F52 HydrophobicContact CD2-CD2 3.71Å; F20-F52 AromaticContact CD2-CG 3.84Å; F20-F52 HydrophobicContact CD2-CG 3.84Å; F20-F52 HydrophobicContact CE2-CB 4.01Å; F20-F52 HydrophobicContact CG-CB 4.12Å; F20-F52 HydrophobicContact CG-CD2 4.22Å; F20-F52 HydrophobicContact CG-CG 4.25Å; F20-V57 HydrophobicContact CB-CG1 4.17Å; F20-T58 HydrophobicContact CD1-CG2 4.45Å; F20-T58 HydrophobicContact CE1-CG2 3.89Å; F20-T58 HydrophobicContact CE2-CG2 4Å; F20-T58 HydrophobicContact CZ-CG2 3.63Å
21	R	94.6	Very high	92.1	Very high	86 Å²	86	65.9 Å²	65.9	33%	0.325	34%	0.343	S	S	.	.	H	α-helix	trans	-60.9	-50.5	176.7	-74.7	-176.4	179.3	177.7	8.3	111.6	M17 E18 V19 V23 K24 E25 E62	M17-R21 HydrophobicContact CE-CG 3.84Å; M17-R21 WeakPolarHBondContact O-CG 3.38Å; M17-R21 PolarHBondContact O-N 3.34Å; M17-R21 HydrophobicContact SD-CG 4.39Å; E18-R21 PolarHBondContact O-N 3.49Å; V19-R21 PolarHBondContact O-N 2.99Å; R21-V23 PolarHBondContact O-N 3.2Å; R21-K24 PolarHBondContact O-N 3.28Å; R21-E25 WeakPolarHBondContact O-CB 3.48Å; R21-E25 WeakPolarHBondContact O-CG 3.41Å; R21-E25 PolarHBondContact O-N 3.44Å; R21-E62 IonicContact CZ-OE1 2.66Å; R21-E62 IonicContact NE-OE1 3.52Å; R21-E62 VanDerWaalsContact NH1-CD 3.26Å; R21-E62 IonicContact NH1-OE1 2.75Å; R21-E62 PolarHBondContact NH1-OE1 3.2Å; R21-E62 IonicContact NH2-OE1 2.67Å; R21-E62 PolarHBondContact NH2-OE1 2.95Å
22	F	95.6	Very high	91.9	Very high	111 Å²	111	67.5 Å²	67.5	49%	0.487	34%	0.338	S	S	.	.	H	α-helix	trans	-57	-50.4	179.3	173.5	-100.5	0	0	0	111.7	E18 V19 K24 E25 E26	E18-F22 WeakPolarHBondContact O-CB 3.47Å; E18-F22 PolarHBondContact O-N 3.16Å; V19-F22 PolarHBondContact O-N 2.87Å; F22-K24 VanDerWaalsContact C-N 3.31Å; F22-K24 PolarHBondContact O-N 3.03Å; F22-E25 PolarHBondContact O-N 3.25Å; F22-E26 HydrophobicContact CD2-CG 4.38Å; F22-E26 HydrophobicContact CE1-CG 4.08Å; F22-E26 HydrophobicContact CE2-CG 3.87Å; F22-E26 HydrophobicContact CZ-CG 3.7Å; F22-E26 WeakPolarHBondContact O-CG 3.34Å; F22-E26 PolarHBondContact O-N 3.35Å
23	V	94.6	Very high	91.3	Very high	4 Å²	4	71.6 Å²	71.6	2%	0.024	34%	0.344	C	S	.	.	H	α-helix	trans	-62.1	-40.7	-178.9	175.9	0	0	0	0	111	V19 R21 L27 F45 L48 V49	V19-V23 HydrophobicContact CG1-CG2 4.06Å; V19-V23 WeakPolarHBondContact O-CB 3.44Å; V19-V23 WeakPolarHBondContact O-CG2 3.43Å; V19-V23 PolarHBondContact O-N 3.03Å; R21-V23 PolarHBondContact O-N 3.2Å; V23-L27 WeakPolarHBondContact O-CB 3.44Å; V23-L27 PolarHBondContact O-N 3.24Å; V23-F45 HydrophobicContact CG1-CB 3.75Å; V23-F45 HydrophobicContact CG1-CD1 4.36Å; V23-F45 HydrophobicContact CG1-CD2 3.92Å; V23-F45 HydrophobicContact CG1-CG 3.77Å; V23-L48 HydrophobicContact CG1-CD2 4.31Å; V23-L48 HydrophobicContact CG2-CD2 3.63Å; V23-L48 HydrophobicContact CG2-CG 4.46Å; V23-V49 HydrophobicContact CG1-CG2 3.74Å
24	K	93.1	Very high	90.1	Very high	105 Å²	105	76.4 Å²	76.4	46%	0.457	37%	0.365	S	S	.	.	H	α-helix	trans	-66.2	-42.9	178.2	-173.7	176.9	178.5	-176.2	0	112.2	F20 R21 F22 L27 D28	F20-K24 HydrophobicContact CE1-CD 4.41Å; F20-K24 HydrophobicContact CZ-CD 4.12Å; F20-K24 VanDerWaalsContact O-CB 3.27Å; F20-K24 WeakPolarHBondContact O-CB 3.38Å; F20-K24 PolarHBondContact O-N 3.16Å; R21-K24 PolarHBondContact O-N 3.28Å; F22-K24 VanDerWaalsContact C-N 3.31Å; F22-K24 PolarHBondContact O-N 3.03Å; K24-L27 PolarHBondContact O-N 3.39Å; K24-D28 WeakPolarHBondContact O-CB 3.26Å; K24-D28 PolarHBondContact O-N 2.99Å
25	E	93.4	Very high	88.6	Confident	123 Å²	123	76.6 Å²	76.6	58%	0.575	37%	0.366	S	S	*	.	H	α-helix	trans	-63.8	-40.5	177.3	-74.3	174.8	-172.8	0	0	112.5	R21 F22 S29	R21-E25 WeakPolarHBondContact O-CB 3.48Å; R21-E25 WeakPolarHBondContact O-CG 3.41Å; R21-E25 PolarHBondContact O-N 3.44Å; F22-E25 PolarHBondContact O-N 3.25Å; E25-S29 WeakPolarHBondContact O-CB 3.2Å; E25-S29 PolarHBondContact O-N 3.23Å; E25-S29 PolarHBondContact O-OG 2.99Å
26	E	91.8	Very high	86.8	Confident	71 Å²	71	81.9 Å²	81.9	33%	0.332	40%	0.403	S	S	.	.	H	α-helix	trans	-66.7	-43.7	175.1	-73.7	-62.3	136.6	0	0	111.5	F22 D28 S29 F30 F45	F22-E26 HydrophobicContact CD2-CG 4.38Å; F22-E26 HydrophobicContact CE1-CG 4.08Å; F22-E26 HydrophobicContact CE2-CG 3.87Å; F22-E26 HydrophobicContact CZ-CG 3.7Å; F22-E26 WeakPolarHBondContact O-CG 3.34Å; F22-E26 PolarHBondContact O-N 3.35Å; E26-D28 VanDerWaalsContact C-N 3.35Å; E26-D28 PolarHBondContact O-N 3.36Å; E26-S29 WeakPolarHBondContact O-CA 3.49Å; E26-S29 WeakPolarHBondContact O-CB 3.32Å; E26-S29 PolarHBondContact O-N 3.2Å; E26-S29 VanDerWaalsContact O-N 3.1Å; E26-F30 HydrophobicContact CB-CE2 4.28Å; E26-F30 WeakPolarHBondContact O-CD2 3.37Å; E26-F30 WeakPolarHBondContact O-CG 3.46Å; E26-F30 PolarHBondContact O-N 3.1Å; E26-F45 HydrophobicContact CB-CD2 4.03Å; E26-F45 HydrophobicContact CB-CE2 3.62Å; E26-F45 HydrophobicContact CG-CE2 4.21Å
27	L	90.7	Very high	85	Confident	12 Å²	12	81.2 Å²	81.2	6%	0.063	40%	0.401	C	S	.	.	H	α-helix	trans	-59.7	-44.6	175.9	-168.1	81.4	0	0	0	111.8	V23 K24 S29 F30 K31 T42 F45 E46	V23-L27 WeakPolarHBondContact O-CB 3.44Å; V23-L27 PolarHBondContact O-N 3.24Å; K24-L27 PolarHBondContact O-N 3.39Å; L27-S29 VanDerWaalsContact C-N 3.26Å; L27-S29 PolarHBondContact O-N 2.91Å; L27-F30 PolarHBondContact O-N 2.93Å; L27-K31 WeakPolarHBondContact O-CG 3.46Å; L27-K31 PolarHBondContact O-N 3.43Å; L27-K31 VanDerWaalsContact O-N 3.12Å; L27-T42 HydrophobicContact CD1-CG2 4.04Å; L27-F45 HydrophobicContact CD1-CB 4.13Å; L27-E46 HydrophobicContact CD1-CG 3.61Å; L27-E46 HydrophobicContact CD2-CG 4.24Å
28	D	90.1	Very high	83.5	Confident	69 Å²	69	86.8 Å²	86.8	37%	0.369	43%	0.432	S	S	.	.	H	α-helix	trans	-65.7	-31.6	176.6	-73.5	-16.7	0	0	0	111.7	K24 E26 K32	K24-D28 WeakPolarHBondContact O-CB 3.26Å; K24-D28 PolarHBondContact O-N 2.99Å; E26-D28 VanDerWaalsContact C-N 3.35Å; E26-D28 PolarHBondContact O-N 3.36Å; D28-K32 WeakPolarHBondContact O-CG 3.35Å; D28-K32 PolarHBondContact O-N 3.08Å
29	S	89.1	Confident	82.4	Confident	42 Å²	42	84.5 Å²	84.5	29%	0.294	44%	0.436	S	S	.	.	H	α-helix	trans	-71.2	-39.1	175	-64.6	0	0	0	0	112.7	E25 E26 L27 K32 K33	E25-S29 WeakPolarHBondContact O-CB 3.2Å; E25-S29 PolarHBondContact O-N 3.23Å; E25-S29 PolarHBondContact O-OG 2.99Å; E26-S29 WeakPolarHBondContact O-CA 3.49Å; E26-S29 WeakPolarHBondContact O-CB 3.32Å; E26-S29 PolarHBondContact O-N 3.2Å; E26-S29 VanDerWaalsContact O-N 3.1Å; L27-S29 VanDerWaalsContact C-N 3.26Å; L27-S29 PolarHBondContact O-N 2.91Å; S29-K32 PolarHBondContact O-N 3.29Å; S29-K33 WeakPolarHBondContact O-CG 3.47Å; S29-K33 PolarHBondContact O-N 2.74Å
30	F	85.3	Confident	81.7	Confident	53 Å²	53	87 Å²	87	23%	0.232	46%	0.456	C	S	.	.	H	α-helix	trans	-62.8	-43.6	174	-68.7	-48.9	0	0	0	111.6	E26 L27 K32 K33 F45	E26-F30 HydrophobicContact CB-CE2 4.28Å; E26-F30 WeakPolarHBondContact O-CD2 3.37Å; E26-F30 WeakPolarHBondContact O-CG 3.46Å; E26-F30 PolarHBondContact O-N 3.1Å; L27-F30 PolarHBondContact O-N 2.93Å; F30-K32 VanDerWaalsContact C-N 3.29Å; F30-K32 PolarHBondContact O-N 2.99Å; F30-K33 PolarHBondContact O-N 3.29Å; F30-F45 HydrophobicContact CE2-CD2 4.24Å; F30-F45 HydrophobicContact CE2-CE2 4.22Å
31	K	83	Confident	81.1	Confident	134 Å²	134	92 Å²	92	58%	0.583	48%	0.477	S	S	*	.	H	α-helix	trans	-61	-34.7	177.1	-71.3	173.2	-177.5	172.7	0	113.2	L27	L27-K31 WeakPolarHBondContact O-CG 3.46Å; L27-K31 PolarHBondContact O-N 3.43Å; L27-K31 VanDerWaalsContact O-N 3.12Å
32	K	82.7	Confident	80.7	Confident	176 Å²	176	89.4 Å²	89.4	77%	0.765	47%	0.472	S	S	*	.	H	α-helix	trans	-75.4	-30	179.5	-74.6	172.5	-174.2	171.9	0	113.9	D28 S29 F30	D28-K32 WeakPolarHBondContact O-CG 3.35Å; D28-K32 PolarHBondContact O-N 3.08Å; S29-K32 PolarHBondContact O-N 3.29Å; F30-K32 VanDerWaalsContact C-N 3.29Å; F30-K32 PolarHBondContact O-N 2.99Å
33	K	78	Confident	80.5	Confident	151 Å²	151	86 Å²	86	66%	0.657	46%	0.463	S	S	*	.	H	α-helix	trans	-87.3	-8.8	-171.7	-72.9	178.6	179.6	170.1	0	113.8	S29 F30 V35	S29-K33 WeakPolarHBondContact O-CG 3.47Å; S29-K33 PolarHBondContact O-N 2.74Å; F30-K33 PolarHBondContact O-N 3.29Å; K33-V35 HydrophobicContact CB-CB 4.19Å; K33-V35 HydrophobicContact CB-CG2 3.77Å; K33-V35 PolarHBondContact O-N 2.85Å
34	D	66.7	Low	80.3	Confident	158 Å²	158	91 Å²	91	85%	0.845	49%	0.485	S	S	*	.	T	Hydrogen-bonded Turn	trans	47	23.5	-169.9	-157.5	24.9	0	0	0	112.7	S36	D34-S36 PolarHBondContact O-N 2.94Å
35	V	60.2	Low	80.4	Confident	88 Å²	88	87 Å²	87	53%	0.533	47%	0.468	S	S	.	.			trans	-83.6	119.2	177	172.6	0	0	0	0	104.6	K33 S37	K33-V35 HydrophobicContact CB-CB 4.19Å; K33-V35 HydrophobicContact CB-CG2 3.77Å; K33-V35 PolarHBondContact O-N 2.85Å; V35-S37 PolarHBondContact O-N 2.83Å
36	S	56.6	Low	80.3	Confident	119 Å²	119	85.7 Å²	85.7	83%	0.832	46%	0.462	S	S	*	.			trans	-62.7	71.7	164.4	17.9	0	0	0	0	108.5	D34 D38	D34-S36 PolarHBondContact O-N 2.94Å; S36-D38 PolarHBondContact O-N 2.88Å
37	S	59.2	Low	80.5	Confident	23 Å²	23	88.9 Å²	88.9	16%	0.161	48%	0.477	C	S	.	.			trans	-48.4	133.7	161.2	160.9	0	0	0	0	106.9	V35 G39 T42	V35-S37 PolarHBondContact O-N 2.83Å; S37-G39 PolarHBondContact O-N 3.45Å; S37-T42 WeakPolarHBondContact CB-OG1 3.3Å; S37-T42 PolarHBondContact OG-OG1 2.94Å; S37-T42 VanDerWaalsContact OG-OG1 3.08Å
38	D	61.8	Low	80.7	Confident	132 Å²	132	90 Å²	90	71%	0.706	48%	0.483	S	S	*	.			trans	-40.6	111.7	176.8	-84.7	-30.6	0	0	0	108.4	S36 S40 F41	S36-D38 PolarHBondContact O-N 2.88Å; D38-S40 CarbonylContact O-C 3.59Å; D38-S40 PolarHBondContact O-N 3.26Å; D38-F41 PolarHBondContact O-N 2.91Å
39	G	71.4	Confident	80.9	Confident	57 Å²	57	87.4 Å²	87.4	59%	0.588	47%	0.469	S	S	*	.	H	α-helix	trans	-53.9	-21.2	-164.5	0	0	0	0	0	114.1	S37 A43	S37-G39 PolarHBondContact O-N 3.45Å; G39-A43 VanDerWaalsContact O-CB 3.26Å; G39-A43 WeakPolarHBondContact O-CB 3.22Å; G39-A43 PolarHBondContact O-N 3.43Å
40	S	81.3	Confident	81.2	Confident	95 Å²	95	89.6 Å²	89.6	66%	0.664	48%	0.475	S	S	*	.	H	α-helix	trans	-62.2	-41	171.6	-171.3	0	0	0	0	114.4	D38 F44	D38-S40 CarbonylContact O-C 3.59Å; D38-S40 PolarHBondContact O-N 3.26Å; S40-F44 WeakPolarHBondContact O-CB 3.43Å; S40-F44 PolarHBondContact O-N 3.45Å
41	F	84.8	Confident	81.7	Confident	122 Å²	122	93.2 Å²	93.2	54%	0.535	49%	0.488	S	S	.	.	H	α-helix	trans	-73.3	-42.8	-178.3	-105.6	-85.2	0	0	0	111.4	D38 F44 F45	D38-F41 PolarHBondContact O-N 2.91Å; F41-F44 PolarHBondContact O-N 3.41Å; F41-F45 AromaticContact CD1-CE1 3.92Å; F41-F45 HydrophobicContact CD1-CE1 3.92Å; F41-F45 HydrophobicContact CD1-CZ 4.28Å; F41-F45 HydrophobicContact CE1-CE1 4.32Å; F41-F45 WeakPolarHBondContact O-CD1 3.42Å; F41-F45 PolarHBondContact O-N 3.31Å
42	T	86.6	Confident	82.3	Confident	33 Å²	33	87.1 Å²	87.1	20%	0.202	46%	0.461	C	S	.	.	H	α-helix	trans	-61.9	-47.6	176	-52	0	0	0	0	110.6	L27 S37 F44 F45 E46	L27-T42 HydrophobicContact CD1-CG2 4.04Å; S37-T42 WeakPolarHBondContact CB-OG1 3.3Å; S37-T42 PolarHBondContact OG-OG1 2.94Å; S37-T42 VanDerWaalsContact OG-OG1 3.08Å; T42-F44 VanDerWaalsContact C-N 3.34Å; T42-F44 PolarHBondContact O-N 3.21Å; T42-F45 PolarHBondContact O-N 3.23Å; T42-F45 VanDerWaalsContact O-N 3.17Å; T42-E46 WeakPolarHBondContact O-CG 3.39Å; T42-E46 PolarHBondContact O-N 3.13Å
43	A	89.4	Confident	82.8	Confident	38 Å²	38	84.1 Å²	84.1	31%	0.314	45%	0.448	S	S	.	.	H	α-helix	trans	-59.1	-44.2	176.9	0	0	0	0	0	112	G39 F45 E46 E47	G39-A43 VanDerWaalsContact O-CB 3.26Å; G39-A43 WeakPolarHBondContact O-CB 3.22Å; G39-A43 PolarHBondContact O-N 3.43Å; A43-F45 VanDerWaalsContact C-N 3.35Å; A43-F45 PolarHBondContact O-N 3.07Å; A43-E46 PolarHBondContact O-N 2.99Å; A43-E47 WeakPolarHBondContact O-CG 3.31Å; A43-E47 PolarHBondContact O-N 3.06Å
44	F	91.7	Very high	83.5	Confident	109 Å²	109	84 Å²	84	48%	0.478	45%	0.452	S	S	.	.	H	α-helix	trans	-60.5	-42	175.6	174	-112.3	0	0	0	112.5	S40 F41 T42 E47 L48	S40-F44 WeakPolarHBondContact O-CB 3.43Å; S40-F44 PolarHBondContact O-N 3.45Å; F41-F44 PolarHBondContact O-N 3.41Å; T42-F44 VanDerWaalsContact C-N 3.34Å; T42-F44 PolarHBondContact O-N 3.21Å; F44-E47 PolarHBondContact O-N 3.36Å; F44-L48 HydrophobicContact CE1-CD2 4.39Å; F44-L48 HydrophobicContact CZ-CD2 4.33Å; F44-L48 VanDerWaalsContact O-CB 3.32Å; F44-L48 WeakPolarHBondContact O-CB 3.46Å; F44-L48 PolarHBondContact O-N 3.16Å
45	F	93.7	Very high	84.7	Confident	23 Å²	23	78 Å²	78	10%	0.101	42%	0.421	C	S	.	.	H	α-helix	trans	-68.3	-37	178.1	-80.1	22.8	0	0	0	111.7	V23 E26 L27 F30 F41 T42 A43 L48 V49	V23-F45 HydrophobicContact CG1-CB 3.75Å; V23-F45 HydrophobicContact CG1-CD1 4.36Å; V23-F45 HydrophobicContact CG1-CD2 3.92Å; V23-F45 HydrophobicContact CG1-CG 3.77Å; E26-F45 HydrophobicContact CB-CD2 4.03Å; E26-F45 HydrophobicContact CB-CE2 3.62Å; E26-F45 HydrophobicContact CG-CE2 4.21Å; L27-F45 HydrophobicContact CD1-CB 4.13Å; F30-F45 HydrophobicContact CE2-CD2 4.24Å; F30-F45 HydrophobicContact CE2-CE2 4.22Å; F41-F45 AromaticContact CD1-CE1 3.92Å; F41-F45 HydrophobicContact CD1-CE1 3.92Å; F41-F45 HydrophobicContact CD1-CZ 4.28Å; F41-F45 HydrophobicContact CE1-CE1 4.32Å; F41-F45 WeakPolarHBondContact O-CD1 3.42Å; F41-F45 PolarHBondContact O-N 3.31Å; T42-F45 PolarHBondContact O-N 3.23Å; T42-F45 VanDerWaalsContact O-N 3.17Å; A43-F45 VanDerWaalsContact C-N 3.35Å; A43-F45 PolarHBondContact O-N 3.07Å; F45-L48 PolarHBondContact O-N 3.39Å; F45-V49 WeakPolarHBondContact O-CB 3.32Å; F45-V49 VanDerWaalsContact O-CG2 3.3Å; F45-V49 WeakPolarHBondContact O-CG2 3.34Å; F45-V49 PolarHBondContact O-N 2.97Å
46	E	92.8	Very high	86.1	Confident	95 Å²	95	75.6 Å²	75.6	44%	0.444	41%	0.405	S	S	.	.	H	α-helix	trans	-63.7	-45.4	173.9	-71.2	179.8	160.9	0	0	111.8	L27 T42 A43 L48 V49 E50	L27-E46 HydrophobicContact CD1-CG 3.61Å; L27-E46 HydrophobicContact CD2-CG 4.24Å; T42-E46 WeakPolarHBondContact O-CG 3.39Å; T42-E46 PolarHBondContact O-N 3.13Å; A43-E46 PolarHBondContact O-N 2.99Å; E46-L48 VanDerWaalsContact C-N 3.35Å; E46-L48 PolarHBondContact O-N 3.41Å; E46-V49 PolarHBondContact O-N 3.37Å; E46-E50 WeakPolarHBondContact O-CB 3.43Å; E46-E50 PolarHBondContact O-N 2.67Å
47	E	95	Very high	87.8	Confident	138 Å²	138	70 Å²	70	65%	0.645	37%	0.366	S	S	*	.	H	α-helix	trans	-60.7	-42.8	174.3	-74.3	176.5	-167.8	0	0	111.9	A43 F44 E50 Y51	A43-E47 WeakPolarHBondContact O-CG 3.31Å; A43-E47 PolarHBondContact O-N 3.06Å; F44-E47 PolarHBondContact O-N 3.36Å; E47-E50 PolarHBondContact O-N 2.97Å; E47-Y51 PolarHBondContact O-N 3.46Å
48	L	95.5	Very high	89.2	Confident	36 Å²	36	71.4 Å²	71.4	19%	0.188	37%	0.373	C	S	.	.	H	α-helix	trans	-67.4	-39.8	179.7	-175.7	57.8	0	0	0	112	V19 V23 F44 F45 E46 E50 Y51 F52	V19-L48 HydrophobicContact CG1-CD2 4.38Å; V23-L48 HydrophobicContact CG1-CD2 4.31Å; V23-L48 HydrophobicContact CG2-CD2 3.63Å; V23-L48 HydrophobicContact CG2-CG 4.46Å; F44-L48 HydrophobicContact CE1-CD2 4.39Å; F44-L48 HydrophobicContact CZ-CD2 4.33Å; F44-L48 VanDerWaalsContact O-CB 3.32Å; F44-L48 WeakPolarHBondContact O-CB 3.46Å; F44-L48 PolarHBondContact O-N 3.16Å; F45-L48 PolarHBondContact O-N 3.39Å; E46-L48 VanDerWaalsContact C-N 3.35Å; E46-L48 PolarHBondContact O-N 3.41Å; L48-E50 VanDerWaalsContact C-N 3.3Å; L48-E50 PolarHBondContact O-N 2.88Å; L48-Y51 HydrophobicContact CD1-CD1 4.34Å; L48-Y51 WeakPolarHBondContact O-CB 3.35Å; L48-Y51 PolarHBondContact O-N 2.98Å; L48-F52 HydrophobicContact CD1-CD2 4.17Å; L48-F52 HydrophobicContact CD1-CE2 3.61Å; L48-F52 HydrophobicContact CD1-CZ 4.02Å; L48-F52 HydrophobicContact CD2-CE2 4.18Å; L48-F52 HydrophobicContact CG-CD2 4.02Å; L48-F52 HydrophobicContact CG-CE2 3.57Å; L48-F52 HydrophobicContact CG-CZ 4.42Å; L48-F52 WeakPolarHBondContact O-CD2 3.4Å; L48-F52 PolarHBondContact O-N 3.21Å
49	V	94.9	Very high	90.6	Very high	14 Å²	14	71.7 Å²	71.7	9%	0.085	37%	0.368	C	S	.	.	H	α-helix	trans	-61.5	-41.6	171.5	163.4	0	0	0	0	110.7	F20 V23 F45 E46 F52 K53	F20-V49 HydrophobicContact CE2-CG1 4.29Å; V23-V49 HydrophobicContact CG1-CG2 3.74Å; F45-V49 WeakPolarHBondContact O-CB 3.32Å; F45-V49 VanDerWaalsContact O-CG2 3.3Å; F45-V49 WeakPolarHBondContact O-CG2 3.34Å; F45-V49 PolarHBondContact O-N 2.97Å; E46-V49 PolarHBondContact O-N 3.37Å; V49-F52 PolarHBondContact O-N 3.12Å; V49-K53 WeakPolarHBondContact O-CG 3.43Å; V49-K53 PolarHBondContact O-N 3.4Å
50	E	95.1	Very high	91.7	Very high	88 Å²	88	69.4 Å²	69.4	41%	0.411	34%	0.342	S	S	.	.	H	α-helix	trans	-65.6	-41.4	178	-165.2	57.8	-151.9	0	0	111.9	E46 E47 L48 F52 K53 M54	E46-E50 WeakPolarHBondContact O-CB 3.43Å; E46-E50 PolarHBondContact O-N 2.67Å; E47-E50 PolarHBondContact O-N 2.97Å; L48-E50 VanDerWaalsContact C-N 3.3Å; L48-E50 PolarHBondContact O-N 2.88Å; E50-F52 PolarHBondContact O-N 2.91Å; E50-K53 WeakPolarHBondContact O-CB 3.32Å; E50-K53 PolarHBondContact O-N 3.34Å; E50-K53 WeakPolarHBondContact OE2-CD 3.46Å; E50-K53 IonicContact OE2-NZ 2.78Å; E50-K53 PolarHBondContact OE2-NZ 3.31Å; E50-M54 HydrophobicContact CG-CE 4.32Å; E50-M54 PolarHBondContact O-N 3.23Å
51	Y	95.6	Very high	92.3	Very high	128 Å²	128	68 Å²	68	50%	0.502	33%	0.33	S	S	.	.	H	α-helix	trans	-55.5	-49.9	170.6	169.4	-99.2	0	0	0	111.4	E47 L48 K53 M54 T55	E47-Y51 PolarHBondContact O-N 3.46Å; L48-Y51 HydrophobicContact CD1-CD1 4.34Å; L48-Y51 WeakPolarHBondContact O-CB 3.35Å; L48-Y51 PolarHBondContact O-N 2.98Å; Y51-K53 VanDerWaalsContact C-N 3.3Å; Y51-K53 PolarHBondContact O-N 2.86Å; Y51-M54 WeakPolarHBondContact O-CB 3.42Å; Y51-M54 PolarHBondContact O-N 3.01Å; Y51-T55 HydrophobicContact CE1-CG2 4.29Å
52	F	95.1	Very high	92.7	Very high	6 Å²	6	66.3 Å²	66.3	3%	0.026	32%	0.323	C	S	.	.	H	α-helix	trans	-63.5	-33.7	-179.5	-74.3	-54.4	0	0	0	113	N16 V19 F20 L48 V49 E50 M54 T55 V57 T58	N16-F52 HydrophobicContact CB-CD1 4.37Å; N16-F52 HydrophobicContact CB-CE1 3.7Å; V19-F52 HydrophobicContact CB-CE2 4.37Å; V19-F52 HydrophobicContact CB-CZ 4.03Å; V19-F52 HydrophobicContact CG1-CE2 3.86Å; V19-F52 HydrophobicContact CG1-CZ 3.79Å; F20-F52 HydrophobicContact CB-CB 4.36Å; F20-F52 HydrophobicContact CB-CD1 4.45Å; F20-F52 HydrophobicContact CB-CD2 3.8Å; F20-F52 HydrophobicContact CB-CE2 4.12Å; F20-F52 HydrophobicContact CB-CG 3.96Å; F20-F52 HydrophobicContact CD2-CB 3.45Å; F20-F52 VanDerWaalsContact CD2-CB 3.45Å; F20-F52 AromaticContact CD2-CD2 3.71Å; F20-F52 HydrophobicContact CD2-CD2 3.71Å; F20-F52 AromaticContact CD2-CG 3.84Å; F20-F52 HydrophobicContact CD2-CG 3.84Å; F20-F52 HydrophobicContact CE2-CB 4.01Å; F20-F52 HydrophobicContact CG-CB 4.12Å; F20-F52 HydrophobicContact CG-CD2 4.22Å; F20-F52 HydrophobicContact CG-CG 4.25Å; L48-F52 HydrophobicContact CD1-CD2 4.17Å; L48-F52 HydrophobicContact CD1-CE2 3.61Å; L48-F52 HydrophobicContact CD1-CZ 4.02Å; L48-F52 HydrophobicContact CD2-CE2 4.18Å; L48-F52 HydrophobicContact CG-CD2 4.02Å; L48-F52 HydrophobicContact CG-CE2 3.57Å; L48-F52 HydrophobicContact CG-CZ 4.42Å; L48-F52 WeakPolarHBondContact O-CD2 3.4Å; L48-F52 PolarHBondContact O-N 3.21Å; V49-F52 PolarHBondContact O-N 3.12Å; E50-F52 PolarHBondContact O-N 2.91Å; F52-M54 PolarHBondContact O-N 3.44Å; F52-T55 WeakPolarHBondContact O-CA 3.26Å; F52-T55 PolarHBondContact O-N 2.85Å; F52-T55 PolarHBondContact O-OG1 3.24Å; F52-V57 HydrophobicContact CD1-CG1 4.47Å; F52-T58 WeakPolarHBondContact O-CG2 3.42Å
53	K	93.1	Very high	93.2	Very high	114 Å²	114	70.8 Å²	70.8	50%	0.496	34%	0.342	S	S	.	.	H	α-helix	trans	-62.3	-26.1	173.5	-71	177.9	-159.3	155.2	0	113.5	V49 E50 Y51 T55 T58	V49-K53 WeakPolarHBondContact O-CG 3.43Å; V49-K53 PolarHBondContact O-N 3.4Å; E50-K53 WeakPolarHBondContact O-CB 3.32Å; E50-K53 PolarHBondContact O-N 3.34Å; E50-K53 WeakPolarHBondContact OE2-CD 3.46Å; E50-K53 IonicContact OE2-NZ 2.78Å; E50-K53 PolarHBondContact OE2-NZ 3.31Å; Y51-K53 VanDerWaalsContact C-N 3.3Å; Y51-K53 PolarHBondContact O-N 2.86Å; K53-T55 PolarHBondContact O-N 2.78Å; K53-T58 HydrophobicContact CG-CG2 4.45Å
54	M	93.2	Very high	93.5	Very high	149 Å²	149	69.2 Å²	69.2	73%	0.734	33%	0.33	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.5	-12	173.8	-59.1	-176.8	-176	0	0	112.7	E50 Y51 F52	E50-M54 HydrophobicContact CG-CE 4.32Å; E50-M54 PolarHBondContact O-N 3.23Å; Y51-M54 WeakPolarHBondContact O-CB 3.42Å; Y51-M54 PolarHBondContact O-N 3.01Å; F52-M54 PolarHBondContact O-N 3.44Å
55	T	90.8	Very high	93.7	Very high	32 Å²	32	64.5 Å²	64.5	20%	0.196	31%	0.31	C	S	.	.	S	Bend	trans	-103.3	164.6	178.4	74.7	0	0	0	0	111.7	Y51 F52 K53 V57	Y51-T55 HydrophobicContact CE1-CG2 4.29Å; F52-T55 WeakPolarHBondContact O-CA 3.26Å; F52-T55 PolarHBondContact O-N 2.85Å; F52-T55 PolarHBondContact O-OG1 3.24Å; K53-T55 PolarHBondContact O-N 2.78Å; T55-V57 PolarHBondContact O-N 3.4Å; T55-V57 WeakPolarHBondContact OG1-CB 3.49Å; T55-V57 WeakPolarHBondContact OG1-CG2 3.24Å; T55-V57 PolarHBondContact OG1-N 2.91Å
56	D	90.3	Very high	93.8	Very high	37 Å²	37	66 Å²	66	20%	0.198	32%	0.323	C	S	.	.	G	3₁₀ helix	trans	-75.6	-5.4	176.5	-77	-45.8	0	0	0	113.3	T58 K59 K89 K91	D56-T58 PolarHBondContact O-N 3.33Å; D56-T58 VanDerWaalsContact O-N 3.15Å; D56-K59 PolarHBondContact O-N 3.44Å; D56-K59 IonicContact OD1-NZ 2.89Å; D56-K59 PolarHBondContact OD1-NZ 3.33Å; D56-K89 HydrophobicContact CB-CD 3.85Å; D56-K91 IonicContact OD2-NZ 3.58Å; D56-K91 PolarHBondContact OD2-NZ 3.12Å
57	V	92.1	Very high	94	Very high	1 Å²	1	67 Å²	67	1%	0.006	33%	0.325	C	S	.	.	G	3₁₀ helix	trans	-54	-37.6	-180	173.9	0	0	0	0	112.2	N16 M17 F20 F52 T55 K59 Q60	N16-V57 HydrophobicContact CB-CB 4.47Å; N16-V57 HydrophobicContact CB-CG1 4.07Å; N16-V57 HydrophobicContact CB-CG2 3.57Å; M17-V57 VanDerWaalsContact CA-CG1 3.47Å; M17-V57 HydrophobicContact CB-CG1 3.96Å; M17-V57 HydrophobicContact SD-CG1 3.88Å; M17-V57 VanDerWaalsContact SD-O 3.34Å; F20-V57 HydrophobicContact CB-CG1 4.17Å; F52-V57 HydrophobicContact CD1-CG1 4.47Å; T55-V57 PolarHBondContact O-N 3.4Å; T55-V57 WeakPolarHBondContact OG1-CB 3.49Å; T55-V57 WeakPolarHBondContact OG1-CG2 3.24Å; T55-V57 PolarHBondContact OG1-N 2.91Å; V57-K59 PolarHBondContact O-N 3.27Å; V57-K59 VanDerWaalsContact O-N 3.11Å; V57-Q60 WeakPolarHBondContact O-CB 3.47Å; V57-Q60 PolarHBondContact O-N 2.97Å
58	T	89.6	Confident	94.1	Very high	52 Å²	52	60.4 Å²	60.4	32%	0.319	30%	0.295	S	S	.	.	G	3₁₀ helix	trans	-65.5	-14.8	-178.6	59.4	0	0	0	0	114.7	F20 F52 K53 D56	F20-T58 HydrophobicContact CD1-CG2 4.45Å; F20-T58 HydrophobicContact CE1-CG2 3.89Å; F20-T58 HydrophobicContact CE2-CG2 4Å; F20-T58 HydrophobicContact CZ-CG2 3.63Å; F52-T58 WeakPolarHBondContact O-CG2 3.42Å; K53-T58 HydrophobicContact CG-CG2 4.45Å; D56-T58 PolarHBondContact O-N 3.33Å; D56-T58 VanDerWaalsContact O-N 3.15Å
59	K	90.9	Very high	94.2	Very high	139 Å²	139	62.4 Å²	62.4	60%	0.604	31%	0.305	S	S	*	.	G	3₁₀ helix	trans	-100.1	-8.7	-179.3	-58.1	172	-167.6	155.5	0	112.8	D56 V57	D56-K59 PolarHBondContact O-N 3.44Å; D56-K59 IonicContact OD1-NZ 2.89Å; D56-K59 PolarHBondContact OD1-NZ 3.33Å; V57-K59 PolarHBondContact O-N 3.27Å; V57-K59 VanDerWaalsContact O-N 3.11Å
60	Q	93	Very high	94.3	Very high	9 Å²	9	66.9 Å²	66.9	4%	0.042	33%	0.325	C	S	.	.			trans	-72.5	146.8	-176.8	-65.4	178.2	-18	0	0	111.4	V57 L65 I86 L123	V57-Q60 WeakPolarHBondContact O-CB 3.47Å; V57-Q60 PolarHBondContact O-N 2.97Å; Q60-L65 HydrophobicContact CB-CD2 4.47Å; Q60-L65 HydrophobicContact CB-CG 4.4Å; Q60-I86 PolarHBondContact NE2-O 3.39Å; Q60-L123 HydrophobicContact CG-CB 4.4Å; Q60-L123 HydrophobicContact CG-CD2 4.29Å
61	T	94.4	Very high	94.5	Very high	64 Å²	64	65.5 Å²	65.5	39%	0.393	32%	0.318	S	S	.	.			trans	-118.9	159.5	173.3	82.8	0	0	0	0	110.5	E63 G64 L65	T61-E63 VanDerWaalsContact CB-OE2 3.23Å; T61-E63 WeakPolarHBondContact CB-OE2 3.28Å; T61-E63 PolarHBondContact O-N 2.99Å; T61-E63 PolarHBondContact OG1-N 3.5Å; T61-E63 PolarHBondContact OG1-OE2 3.04Å; T61-G64 PolarHBondContact O-N 2.9Å; T61-G64 PolarHBondContact OG1-N 3.3Å; T61-G64 VanDerWaalsContact OG1-N 3.12Å; T61-L65 WeakPolarHBondContact O-CG 3.13Å; T61-L65 PolarHBondContact O-N 2.89Å
62	E	94.2	Very high	94.6	Very high	87 Å²	87	59.4 Å²	59.4	41%	0.407	30%	0.295	S	S	.	.	H	α-helix	trans	-59.5	-38.9	176.5	-68	-57.4	119.2	0	0	111.7	R21 S66	R21-E62 IonicContact CZ-OE1 2.66Å; R21-E62 IonicContact NE-OE1 3.52Å; R21-E62 VanDerWaalsContact NH1-CD 3.26Å; R21-E62 IonicContact NH1-OE1 2.75Å; R21-E62 PolarHBondContact NH1-OE1 3.2Å; R21-E62 IonicContact NH2-OE1 2.67Å; R21-E62 PolarHBondContact NH2-OE1 2.95Å; E62-S66 WeakPolarHBondContact O-CB 3.37Å; E62-S66 PolarHBondContact O-N 3.43Å; E62-S66 PolarHBondContact O-OG 3Å
63	E	95.9	Very high	94.7	Very high	127 Å²	127	66.4 Å²	66.4	59%	0.593	33%	0.327	S	S	*	.	H	α-helix	trans	-66.8	-40.1	178.4	-54.8	81.3	-175.5	0	0	111.3	T61 K67	T61-E63 VanDerWaalsContact CB-OE2 3.23Å; T61-E63 WeakPolarHBondContact CB-OE2 3.28Å; T61-E63 PolarHBondContact O-N 2.99Å; T61-E63 PolarHBondContact OG1-N 3.5Å; T61-E63 PolarHBondContact OG1-OE2 3.04Å; E63-K67 WeakPolarHBondContact O-CG 3.39Å; E63-K67 PolarHBondContact O-N 3.47Å; E63-K67 VanDerWaalsContact O-N 3.15Å
64	G	96.1	Very high	94.9	Very high	5 Å²	5	67.8 Å²	67.8	5%	0.052	33%	0.333	C	S	.	.	H	α-helix	trans	-65.3	-46.4	176.9	0	0	0	0	0	112.2	T61 K67 V68 S122	T61-G64 PolarHBondContact O-N 2.9Å; T61-G64 PolarHBondContact OG1-N 3.3Å; T61-G64 VanDerWaalsContact OG1-N 3.12Å; G64-K67 PolarHBondContact O-N 2.82Å; G64-V68 PolarHBondContact O-N 3.01Å; G64-S122 VanDerWaalsContact CA-O 3.29Å; G64-S122 WeakPolarHBondContact CA-O 3.49Å
65	L	96	Very high	95	Very high	11 Å²	11	61.7 Å²	61.7	6%	0.058	30%	0.304	C	S	.	.	H	α-helix	trans	-60	-47.1	175.2	-70.4	173.9	0	0	0	111.6	M17 Q60 T61 K67 V68 I69 I86 L123	M17-L65 HydrophobicContact CB-CD1 4.14Å; M17-L65 HydrophobicContact CG-CD1 4.13Å; Q60-L65 HydrophobicContact CB-CD2 4.47Å; Q60-L65 HydrophobicContact CB-CG 4.4Å; T61-L65 WeakPolarHBondContact O-CG 3.13Å; T61-L65 PolarHBondContact O-N 2.89Å; L65-K67 VanDerWaalsContact C-N 3.32Å; L65-K67 PolarHBondContact O-N 3.34Å; L65-V68 PolarHBondContact O-N 2.74Å; L65-I69 WeakPolarHBondContact O-CB 3.32Å; L65-I69 VanDerWaalsContact O-CG1 3.24Å; L65-I69 WeakPolarHBondContact O-CG1 3.31Å; L65-I69 PolarHBondContact O-N 2.9Å; L65-I86 HydrophobicContact CD2-CB 3.71Å; L65-I86 HydrophobicContact CD2-CD1 4.27Å; L65-I86 HydrophobicContact CD2-CG2 3.79Å; L65-L123 HydrophobicContact CD2-CD2 3.75Å
66	S	96.1	Very high	95.3	Very high	54 Å²	54	62.6 Å²	62.6	38%	0.378	32%	0.32	S	S	.	.	H	α-helix	trans	-58	-44.5	179.8	-59.5	0	0	0	0	111.6	E62 V68 I69 E70	E62-S66 WeakPolarHBondContact O-CB 3.37Å; E62-S66 PolarHBondContact O-N 3.43Å; E62-S66 PolarHBondContact O-OG 3Å; S66-V68 PolarHBondContact O-N 3.33Å; S66-I69 PolarHBondContact O-N 3.45Å; S66-E70 WeakPolarHBondContact O-CB 3.46Å; S66-E70 VanDerWaalsContact O-CG 3.3Å; S66-E70 WeakPolarHBondContact O-CG 3.26Å; S66-E70 PolarHBondContact O-N 3.19Å
67	K	97.5	Very high	95.6	Very high	115 Å²	115	61.7 Å²	61.7	50%	0.5	32%	0.315	S	S	.	.	H	α-helix	trans	-60.4	-44.7	176.8	-73.4	173.1	-177.6	177.9	0	112.8	E63 G64 L65 E71 L118	E63-K67 WeakPolarHBondContact O-CG 3.39Å; E63-K67 PolarHBondContact O-N 3.47Å; E63-K67 VanDerWaalsContact O-N 3.15Å; G64-K67 PolarHBondContact O-N 2.82Å; L65-K67 VanDerWaalsContact C-N 3.32Å; L65-K67 PolarHBondContact O-N 3.34Å; K67-E71 WeakPolarHBondContact O-CB 3.37Å; K67-E71 PolarHBondContact O-N 2.7Å; K67-L118 HydrophobicContact CB-CD1 4.47Å
68	V	97.6	Very high	95.8	Very high	0 Å²	0	64.3 Å²	64.3	0%	0	33%	0.333	C	S	.	.	H	α-helix	trans	-68.7	-38.4	180	175.6	0	0	0	0	111	G64 L65 S66 E71 S72 I85 I86 F115 L118 L123	G64-V68 PolarHBondContact O-N 3.01Å; L65-V68 PolarHBondContact O-N 2.74Å; S66-V68 PolarHBondContact O-N 3.33Å; V68-E71 PolarHBondContact O-N 3.43Å; V68-S72 VanDerWaalsContact O-CB 3.31Å; V68-S72 WeakPolarHBondContact O-CB 3.49Å; V68-S72 PolarHBondContact O-N 3.23Å; V68-S72 PolarHBondContact O-OG 3.23Å; V68-I85 HydrophobicContact CG1-CG2 3.83Å; V68-I86 HydrophobicContact CB-CG2 4.43Å; V68-I86 HydrophobicContact CG1-CG2 4.03Å; V68-F115 HydrophobicContact CG1-CE2 4.23Å; V68-F115 HydrophobicContact CG1-CZ 4.02Å; V68-L118 HydrophobicContact CG2-CD2 4.44Å; V68-L118 HydrophobicContact CG2-CG 4.3Å; V68-L123 HydrophobicContact CG1-CD1 4.41Å; V68-L123 HydrophobicContact CG2-CD1 4.24Å; V68-L123 HydrophobicContact CG2-CD2 4Å; V68-L123 HydrophobicContact CG2-CG 3.92Å
69	I	97	Very high	96	Very high	78 Å²	78	68.7 Å²	68.7	40%	0.4	35%	0.348	S	S	.	.	H	α-helix	trans	-65.2	-47.6	177	-68.3	165.6	0	0	0	110.6	L65 S66 E71 S72 E73 I86	L65-I69 WeakPolarHBondContact O-CB 3.32Å; L65-I69 VanDerWaalsContact O-CG1 3.24Å; L65-I69 WeakPolarHBondContact O-CG1 3.31Å; L65-I69 PolarHBondContact O-N 2.9Å; S66-I69 PolarHBondContact O-N 3.45Å; I69-E71 VanDerWaalsContact C-N 3.33Å; I69-E71 PolarHBondContact O-N 3.19Å; I69-S72 WeakPolarHBondContact O-CB 3.23Å; I69-S72 PolarHBondContact O-N 3.38Å; I69-E73 PolarHBondContact O-N 3.41Å; I69-I86 HydrophobicContact CG1-CG2 4.48Å
70	E	97.7	Very high	96.2	Very high	108 Å²	108	67 Å²	67	51%	0.505	35%	0.345	S	S	.	.	H	α-helix	trans	-60.1	-42.3	176.5	-75.1	175.7	-168.7	0	0	111.9	S66 E73 K74	S66-E70 WeakPolarHBondContact O-CB 3.46Å; S66-E70 VanDerWaalsContact O-CG 3.3Å; S66-E70 WeakPolarHBondContact O-CG 3.26Å; S66-E70 PolarHBondContact O-N 3.19Å; E70-E73 PolarHBondContact O-N 3.07Å; E70-K74 WeakPolarHBondContact O-CG 3.46Å; E70-K74 PolarHBondContact O-N 3.49Å; E70-K74 VanDerWaalsContact O-N 3.12Å
71	E	97.9	Very high	96.4	Very high	59 Å²	59	67.5 Å²	67.5	28%	0.276	35%	0.348	S	S	.	.	H	α-helix	trans	-70	-36.2	177.9	-162.6	63.5	-160	0	0	111.8	K67 V68 I69 E73 K74 L75 F115 L118	K67-E71 WeakPolarHBondContact O-CB 3.37Å; K67-E71 PolarHBondContact O-N 2.7Å; V68-E71 PolarHBondContact O-N 3.43Å; I69-E71 VanDerWaalsContact C-N 3.33Å; I69-E71 PolarHBondContact O-N 3.19Å; E71-E73 VanDerWaalsContact C-N 3.29Å; E71-E73 PolarHBondContact O-N 3.02Å; E71-K74 PolarHBondContact O-N 2.95Å; E71-K74 WeakPolarHBondContact OE2-CD 3.3Å; E71-K74 IonicContact OE2-NZ 3.93Å; E71-K74 PolarHBondContact OE2-NZ 3.07Å; E71-L75 WeakPolarHBondContact O-CG 3.25Å; E71-L75 PolarHBondContact O-N 2.81Å; E71-F115 HydrophobicContact CB-CD2 4.19Å; E71-F115 HydrophobicContact CB-CE2 4.04Å; E71-F115 HydrophobicContact CG-CD2 3.79Å; E71-F115 HydrophobicContact CG-CE2 4.15Å; E71-L118 HydrophobicContact CB-CD2 3.52Å; E71-L118 HydrophobicContact CG-CD2 3.74Å
72	S	97.6	Very high	96.5	Very high	1 Å²	1	65 Å²	65	1%	0.007	33%	0.334	C	S	.	.	H	α-helix	trans	-59.3	-41.5	172.9	-60.1	0	0	0	0	111.3	V68 I69 L75 G76 L77 F115	V68-S72 VanDerWaalsContact O-CB 3.31Å; V68-S72 WeakPolarHBondContact O-CB 3.49Å; V68-S72 PolarHBondContact O-N 3.23Å; V68-S72 PolarHBondContact O-OG 3.23Å; I69-S72 WeakPolarHBondContact O-CB 3.23Å; I69-S72 PolarHBondContact O-N 3.38Å; S72-L75 PolarHBondContact O-N 2.89Å; S72-G76 PolarHBondContact O-N 2.61Å; S72-L77 WeakPolarHBondContact O-CB 3.33Å; S72-L77 PolarHBondContact O-N 2.74Å; S72-F115 WeakPolarHBondContact OG-CZ 3.43Å
73	E	97.1	Very high	96.6	Very high	153 Å²	153	62.2 Å²	62.2	72%	0.715	32%	0.321	S	S	*	.	H	α-helix	trans	-63.4	-43.7	175.8	-173.8	176.8	-167.3	0	0	111.7	I69 E70 E71 L75 G76	I69-E73 PolarHBondContact O-N 3.41Å; E70-E73 PolarHBondContact O-N 3.07Å; E71-E73 VanDerWaalsContact C-N 3.29Å; E71-E73 PolarHBondContact O-N 3.02Å; E73-L75 VanDerWaalsContact C-N 3.28Å; E73-L75 PolarHBondContact O-N 3.32Å; E73-G76 PolarHBondContact O-N 2.85Å
74	K	97.4	Very high	96.6	Very high	142 Å²	142	60.6 Å²	60.6	62%	0.617	31%	0.313	S	S	*	.	H	α-helix	trans	-62.8	-33.4	176.6	-68.3	177.1	-149	153.5	0	113.2	E70 E71 G76	E70-K74 WeakPolarHBondContact O-CG 3.46Å; E70-K74 PolarHBondContact O-N 3.49Å; E70-K74 VanDerWaalsContact O-N 3.12Å; E71-K74 PolarHBondContact O-N 2.95Å; E71-K74 WeakPolarHBondContact OE2-CD 3.3Å; E71-K74 IonicContact OE2-NZ 3.93Å; E71-K74 PolarHBondContact OE2-NZ 3.07Å; K74-G76 PolarHBondContact O-N 3.12Å
75	L	97.1	Very high	96.7	Very high	21 Å²	21	60.3 Å²	60.3	11%	0.11	31%	0.311	C	S	.	.	T	Hydrogen-bonded Turn	trans	-78.7	-2.1	175.4	-65.4	177.2	0	0	0	112.9	E71 S72 E73 L77 L107 Q111 F115	E71-L75 WeakPolarHBondContact O-CG 3.25Å; E71-L75 PolarHBondContact O-N 2.81Å; S72-L75 PolarHBondContact O-N 2.89Å; E73-L75 VanDerWaalsContact C-N 3.28Å; E73-L75 PolarHBondContact O-N 3.32Å; L75-L77 VanDerWaalsContact C-N 3.32Å; L75-L77 HydrophobicContact CB-CG 4.06Å; L75-L107 HydrophobicContact CB-CD2 4.04Å; L75-L107 HydrophobicContact CD2-CD2 4.17Å; L75-Q111 HydrophobicContact CD2-CB 4.01Å; L75-Q111 HydrophobicContact CD2-CG 3.99Å; L75-F115 HydrophobicContact CD1-CB 3.96Å; L75-F115 HydrophobicContact CD1-CD1 4.29Å; L75-F115 HydrophobicContact CD1-CD2 3.62Å; L75-F115 HydrophobicContact CD1-CE2 4.16Å; L75-F115 HydrophobicContact CD1-CG 3.69Å
76	G	96.4	Very high	96.7	Very high	52 Å²	52	60.1 Å²	60.1	54%	0.536	31%	0.31	S	S	.	.	T	Hydrogen-bonded Turn	trans	69.2	31.4	-178.6	0	0	0	0	0	112.9	S72 E73 K74 R106	S72-G76 PolarHBondContact O-N 2.61Å; E73-G76 PolarHBondContact O-N 2.85Å; K74-G76 PolarHBondContact O-N 3.12Å; G76-R106 PolarHBondContact O-NH2 2.92Å; G76-R106 VanDerWaalsContact O-NH2 3.1Å
77	L	97.1	Very high	96.6	Very high	18 Å²	18	58.6 Å²	58.6	9%	0.094	30%	0.298	C	S	.	.			trans	-79.1	143.3	173.7	-55.3	-173.6	0	0	0	110.2	S72 L75 E81 I85 V100 L107 F115	S72-L77 WeakPolarHBondContact O-CB 3.33Å; S72-L77 PolarHBondContact O-N 2.74Å; L75-L77 VanDerWaalsContact C-N 3.32Å; L75-L77 HydrophobicContact CB-CG 4.06Å; L77-E81 WeakPolarHBondContact CA-OE2 3.32Å; L77-E81 HydrophobicContact CB-CB 4.17Å; L77-I85 HydrophobicContact CD1-CD1 3.45Å; L77-I85 VanDerWaalsContact CD1-CD1 3.45Å; L77-V100 HydrophobicContact CD1-CG2 4.36Å; L77-V100 HydrophobicContact CD2-CG1 3.86Å; L77-V100 HydrophobicContact CD2-CG2 3.97Å; L77-L107 HydrophobicContact CD2-CD1 4.43Å; L77-F115 HydrophobicContact CD1-CE1 4.32Å; L77-F115 HydrophobicContact CD1-CZ 4.29Å
78	S	95.6	Very high	96.5	Very high	56 Å²	56	58.4 Å²	58.4	39%	0.392	30%	0.301	S	S	.	.			trans	-69.3	159.4	174.4	74.9	0	0	0	0	111.1	N80 E81 A82	S78-N80 PolarHBondContact O-N 3.18Å; S78-E81 PolarHBondContact N-OE2 2.73Å; S78-E81 PolarHBondContact O-N 2.82Å; S78-E81 VanDerWaalsContact O-N 3.13Å; S78-E81 VanDerWaalsContact OG-CG 3.3Å; S78-E81 WeakPolarHBondContact OG-CG 3.33Å; S78-E81 PolarHBondContact OG-N 3.1Å; S78-E81 PolarHBondContact OG-OE2 2.9Å; S78-A82 PolarHBondContact O-N 2.84Å
79	K	94.7	Very high	96.4	Very high	144 Å²	144	59.8 Å²	59.8	63%	0.626	31%	0.307	S	S	*	.	H	α-helix	trans	-54.5	-38.8	175.1	-175.7	179.8	178.4	-178.9	0	112.5	A82 I83	K79-A82 PolarHBondContact O-N 3.22Å; K79-I83 HydrophobicContact CG-CD1 4Å; K79-I83 WeakPolarHBondContact O-CB 3.33Å; K79-I83 VanDerWaalsContact O-CG1 3.26Å; K79-I83 WeakPolarHBondContact O-CG1 3.41Å; K79-I83 PolarHBondContact O-N 3.22Å
80	N	94.8	Very high	96.3	Very high	104 Å²	104	56.3 Å²	56.3	56%	0.556	29%	0.29	S	S	*	.	H	α-helix	trans	-70.5	-39.9	-179.7	-71.8	-15.9	0	0	0	111.6	S78 I83 Q84	S78-N80 PolarHBondContact O-N 3.18Å; N80-I83 PolarHBondContact O-N 3.36Å; N80-Q84 VanDerWaalsContact O-CG 3.22Å; N80-Q84 WeakPolarHBondContact O-CG 3.5Å; N80-Q84 PolarHBondContact O-N 3.49Å
81	E	97.1	Very high	96.1	Very high	19 Å²	19	58.4 Å²	58.4	9%	0.089	30%	0.297	C	S	.	.	H	α-helix	trans	-60.6	-47.8	173.6	-71.1	168.9	149	0	0	110.5	L77 S78 I83 Q84 I85 I99 V100 R106	L77-E81 WeakPolarHBondContact CA-OE2 3.32Å; L77-E81 HydrophobicContact CB-CB 4.17Å; S78-E81 PolarHBondContact N-OE2 2.73Å; S78-E81 PolarHBondContact O-N 2.82Å; S78-E81 VanDerWaalsContact O-N 3.13Å; S78-E81 VanDerWaalsContact OG-CG 3.3Å; S78-E81 WeakPolarHBondContact OG-CG 3.33Å; S78-E81 PolarHBondContact OG-N 3.1Å; S78-E81 PolarHBondContact OG-OE2 2.9Å; E81-I83 PolarHBondContact O-N 3.39Å; E81-Q84 PolarHBondContact O-N 2.86Å; E81-Q84 VanDerWaalsContact O-N 3.16Å; E81-I85 WeakPolarHBondContact O-CD1 3.48Å; E81-I85 VanDerWaalsContact O-CG1 3.32Å; E81-I85 WeakPolarHBondContact O-CG1 3.1Å; E81-I85 PolarHBondContact O-N 3.15Å; E81-I99 HydrophobicContact CB-CG2 4.43Å; E81-V100 HydrophobicContact CG-CG2 4.46Å; E81-V100 WeakPolarHBondContact OE1-CA 3.44Å; E81-R106 IonicContact OE1-CZ 3.81Å; E81-R106 IonicContact OE1-NH1 2.72Å; E81-R106 PolarHBondContact OE1-NH1 3.43Å; E81-R106 IonicContact OE1-NH2 2.99Å; E81-R106 IonicContact OE2-CZ 3.33Å; E81-R106 IonicContact OE2-NH1 3.67Å; E81-R106 IonicContact OE2-NH2 2.81Å; E81-R106 PolarHBondContact OE2-NH2 2.93Å
82	A	96.8	Very high	96	Very high	12 Å²	12	57.7 Å²	57.7	10%	0.099	30%	0.299	C	S	.	.	H	α-helix	trans	-59.1	-44.3	177.6	0	0	0	0	0	112.2	S78 K79 Q84 I85 I86	S78-A82 PolarHBondContact O-N 2.84Å; K79-A82 PolarHBondContact O-N 3.22Å; A82-Q84 VanDerWaalsContact C-N 3.34Å; A82-Q84 PolarHBondContact O-N 3.21Å; A82-I85 PolarHBondContact O-N 3.42Å; A82-I86 PolarHBondContact O-N 2.93Å
83	I	95.9	Very high	95.9	Very high	27 Å²	27	60.5 Å²	60.5	14%	0.138	31%	0.312	C	S	.	.	H	α-helix	trans	-62.1	-41	176.3	-72	172.3	0	0	0	111.4	K79 N80 E81 I86 N87	K79-I83 HydrophobicContact CG-CD1 4Å; K79-I83 WeakPolarHBondContact O-CB 3.33Å; K79-I83 VanDerWaalsContact O-CG1 3.26Å; K79-I83 WeakPolarHBondContact O-CG1 3.41Å; K79-I83 PolarHBondContact O-N 3.22Å; N80-I83 PolarHBondContact O-N 3.36Å; E81-I83 PolarHBondContact O-N 3.39Å; I83-I86 WeakPolarHBondContact O-CG1 3.48Å; I83-N87 VanDerWaalsContact O-CB 3.28Å; I83-N87 WeakPolarHBondContact O-CB 3.4Å; I83-N87 PolarHBondContact O-N 3.5Å; I83-N87 PolarHBondContact O-ND2 3.11Å
84	Q	96.2	Very high	95.8	Very high	93 Å²	93	58.3 Å²	58.3	44%	0.435	31%	0.305	S	S	.	.	H	α-helix	trans	-68.3	-38.2	177.6	-68.8	-73	73.4	0	0	111.8	N80 E81 A82 N87 L88 I99	N80-Q84 VanDerWaalsContact O-CG 3.22Å; N80-Q84 WeakPolarHBondContact O-CG 3.5Å; N80-Q84 PolarHBondContact O-N 3.49Å; E81-Q84 PolarHBondContact O-N 2.86Å; E81-Q84 VanDerWaalsContact O-N 3.16Å; A82-Q84 VanDerWaalsContact C-N 3.34Å; A82-Q84 PolarHBondContact O-N 3.21Å; Q84-N87 PolarHBondContact O-N 2.99Å; Q84-L88 VanDerWaalsContact O-CB 3.32Å; Q84-L88 WeakPolarHBondContact O-CB 3.29Å; Q84-L88 WeakPolarHBondContact O-CG 3.29Å; Q84-L88 PolarHBondContact O-N 3.32Å; Q84-I99 HydrophobicContact CB-CG1 4.49Å; Q84-I99 HydrophobicContact CB-CG2 3.61Å
85	I	96.6	Very high	95.7	Very high	0 Å²	0	54.3 Å²	54.3	0%	0	29%	0.29	C	S	.	.	H	α-helix	trans	-60.2	-49.3	175.2	-72.8	156.5	0	0	0	110.9	V68 L77 E81 A82 N87 K89 P90 L96 I99 F115	V68-I85 HydrophobicContact CG1-CG2 3.83Å; L77-I85 HydrophobicContact CD1-CD1 3.45Å; L77-I85 VanDerWaalsContact CD1-CD1 3.45Å; E81-I85 WeakPolarHBondContact O-CD1 3.48Å; E81-I85 VanDerWaalsContact O-CG1 3.32Å; E81-I85 WeakPolarHBondContact O-CG1 3.1Å; E81-I85 PolarHBondContact O-N 3.15Å; A82-I85 PolarHBondContact O-N 3.42Å; I85-N87 VanDerWaalsContact C-N 3.31Å; I85-N87 PolarHBondContact O-N 3.45Å; I85-K89 WeakPolarHBondContact O-CA 3.5Å; I85-K89 PolarHBondContact O-N 3.29Å; I85-P90 HydrophobicContact CG2-CG 4.21Å; I85-L96 HydrophobicContact CD1-CD1 4.15Å; I85-L96 HydrophobicContact CG1-CD1 4.17Å; I85-I99 HydrophobicContact CG1-CD1 4.17Å; I85-I99 HydrophobicContact CG1-CG2 4.03Å; I85-F115 HydrophobicContact CD1-CE1 3.69Å; I85-F115 HydrophobicContact CD1-CZ 3.93Å; I85-F115 HydrophobicContact CG1-CE1 4.31Å; I85-F115 HydrophobicContact CG2-CE1 3.96Å; I85-F115 HydrophobicContact CG2-CZ 3.94Å
86	I	95.8	Very high	95.7	Very high	7 Å²	7	53.3 Å²	53.3	4%	0.036	29%	0.285	C	S	.	.	H	α-helix	trans	-68	-31.9	179.1	64.5	177.5	0	0	0	112	Q60 L65 V68 I69 A82 I83 L123	Q60-I86 PolarHBondContact NE2-O 3.39Å; L65-I86 HydrophobicContact CD2-CB 3.71Å; L65-I86 HydrophobicContact CD2-CD1 4.27Å; L65-I86 HydrophobicContact CD2-CG2 3.79Å; V68-I86 HydrophobicContact CB-CG2 4.43Å; V68-I86 HydrophobicContact CG1-CG2 4.03Å; I69-I86 HydrophobicContact CG1-CG2 4.48Å; A82-I86 PolarHBondContact O-N 2.93Å; I83-I86 WeakPolarHBondContact O-CG1 3.48Å; I86-L123 HydrophobicContact CG2-CD2 4.42Å
87	N	95.3	Very high	95.6	Very high	22 Å²	22	54 Å²	54	12%	0.118	27%	0.274	C	S	.	.	H	α-helix	trans	-75.1	-37.8	180	-76.9	-13.6	0	0	0	113.2	N16 I83 Q84 I85	N16-N87 WeakPolarHBondContact CB-OD1 3.48Å; N16-N87 PolarHBondContact N-OD1 3.18Å; I83-N87 VanDerWaalsContact O-CB 3.28Å; I83-N87 WeakPolarHBondContact O-CB 3.4Å; I83-N87 PolarHBondContact O-N 3.5Å; I83-N87 PolarHBondContact O-ND2 3.11Å; Q84-N87 PolarHBondContact O-N 2.99Å; I85-N87 VanDerWaalsContact C-N 3.31Å; I85-N87 PolarHBondContact O-N 3.45Å
88	L	94.6	Very high	95.6	Very high	111 Å²	111	59.8 Å²	59.8	58%	0.581	30%	0.304	S	S	*	.	H	α-helix	trans	-101.5	-23.6	-171.7	-63	175.9	0	0	0	113.7	Q84 I99	Q84-L88 VanDerWaalsContact O-CB 3.32Å; Q84-L88 WeakPolarHBondContact O-CB 3.29Å; Q84-L88 WeakPolarHBondContact O-CG 3.29Å; Q84-L88 PolarHBondContact O-N 3.32Å; L88-I99 HydrophobicContact CB-CD1 4.47Å; L88-I99 HydrophobicContact CD1-CD1 4.23Å; L88-I99 HydrophobicContact CD1-CG1 4.31Å
89	K	95.2	Very high	95.6	Very high	29 Å²	29	58.6 Å²	58.6	13%	0.126	29%	0.293	C	S	.	.			trans	51.1	81.3	-176.1	-174.6	-178.2	-178.8	169.2	0	111.9	D56 I85 K91 L123	D56-K89 HydrophobicContact CB-CD 3.85Å; I85-K89 WeakPolarHBondContact O-CA 3.5Å; I85-K89 PolarHBondContact O-N 3.29Å; K89-K91 PolarHBondContact O-N 3.21Å; K89-L123 HydrophobicContact CB-CD1 4.38Å; K89-L123 HydrophobicContact CD-CB 3.92Å; K89-L123 VanDerWaalsContact CE-OXT 3.23Å; K89-L123 WeakPolarHBondContact CE-OXT 3.48Å; K89-L123 HydrophobicContact CG-CB 3.99Å; K89-L123 HydrophobicContact CG-CD1 4.29Å; K89-L123 PolarHBondContact NZ-O 3.33Å; K89-L123 PolarHBondContact NZ-OXT 2.91Å
90	P	95.5	Very high	95.7	Very high	5 Å²	5	51.9 Å²	51.9	3%	0.032	26%	0.264	C	S	.	.			trans	-60.9	136.4	-179.5	26.8	-34.3	0	0	0	111	I85 D95 L96 I99 L116	I85-P90 HydrophobicContact CG2-CG 4.21Å; P90-D95 HydrophobicContact CB-CB 3.68Å; P90-L96 HydrophobicContact CG-CD1 4.15Å; P90-I99 HydrophobicContact CB-CD1 4.39Å; P90-I99 HydrophobicContact CG-CD1 4.46Å; P90-L116 HydrophobicContact CB-CD2 3.93Å; P90-L116 HydrophobicContact CG-CD2 4.14Å
91	K	94.1	Very high	95.7	Very high	151 Å²	151	54 Å²	54	66%	0.657	27%	0.271	S	S	*	.			trans	-111.3	-14.5	-177.4	-63.8	179	-177.6	174.2	0	112.3	D56 K89 D95	D56-K91 IonicContact OD2-NZ 3.58Å; D56-K91 PolarHBondContact OD2-NZ 3.12Å; K89-K91 PolarHBondContact O-N 3.21Å; K91-D95 PolarHBondContact N-OD2 3.35Å
92	S	96.1	Very high	95.5	Very high	45 Å²	45	58.6 Å²	58.6	32%	0.315	30%	0.296	S	S	.	.	S	Bend	trans	-139.4	164.2	-178.2	68.9	0	0	0	0	111.4	L94 D95 L96	S92-L94 PolarHBondContact O-N 3.25Å; S92-D95 PolarHBondContact N-OD2 3.45Å; S92-D95 PolarHBondContact O-N 3.03Å; S92-D95 PolarHBondContact OG-N 3.28Å; S92-D95 PolarHBondContact OG-OD1 3.15Å; S92-D95 PolarHBondContact OG-OD2 3.32Å; S92-L96 PolarHBondContact O-N 3.15Å
93	H	95.3	Very high	95.4	Very high	60 Å²	60	58.2 Å²	58.2	28%	0.278	29%	0.292	S	S	.	.	H	α-helix	trans	-57.2	-41.6	172.8	-171.9	171.7	0	0	0	110.9	D95 L96 Q97 I112	H93-D95 VanDerWaalsContact C-N 3.32Å; H93-D95 PolarHBondContact O-N 3.02Å; H93-L96 PolarHBondContact O-N 3.36Å; H93-L96 VanDerWaalsContact O-N 3.08Å; H93-Q97 PolarHBondContact CD2-NE2 3.44Å; H93-Q97 PolarHBondContact NE2-NE2 3.43Å; H93-Q97 WeakPolarHBondContact O-CG 3.34Å; H93-Q97 PolarHBondContact O-N 2.95Å; H93-I112 HydrophobicContact CB-CG2 4.34Å; H93-I112 WeakPolarHBondContact NE2-CD1 3.38Å
94	L	95.1	Very high	95.2	Very high	107 Å²	107	63.6 Å²	63.6	56%	0.56	32%	0.317	S	S	*	.	H	α-helix	trans	-59.6	-42	177.5	-178.8	62.1	0	0	0	112	S92 L96 Q97 L98	S92-L94 PolarHBondContact O-N 3.25Å; L94-L96 VanDerWaalsContact C-N 3.26Å; L94-L96 PolarHBondContact O-N 2.96Å; L94-Q97 PolarHBondContact O-N 3.36Å; L94-L98 WeakPolarHBondContact O-CG 3.43Å; L94-L98 PolarHBondContact O-N 2.93Å; L94-L98 VanDerWaalsContact O-N 3.16Å
95	D	95.5	Very high	95.1	Very high	58 Å²	58	63.7 Å²	63.7	31%	0.31	33%	0.328	S	S	.	.	H	α-helix	trans	-60.8	-38.8	176.9	-56.5	-38.9	0	0	0	111.5	P90 K91 S92 H93 L98 I99	P90-D95 HydrophobicContact CB-CB 3.68Å; K91-D95 PolarHBondContact N-OD2 3.35Å; S92-D95 PolarHBondContact N-OD2 3.45Å; S92-D95 PolarHBondContact O-N 3.03Å; S92-D95 PolarHBondContact OG-N 3.28Å; S92-D95 PolarHBondContact OG-OD1 3.15Å; S92-D95 PolarHBondContact OG-OD2 3.32Å; H93-D95 VanDerWaalsContact C-N 3.32Å; H93-D95 PolarHBondContact O-N 3.02Å; D95-L98 PolarHBondContact O-N 3.31Å; D95-I99 WeakPolarHBondContact O-CG1 3.14Å
96	L	95.9	Very high	95.1	Very high	0 Å²	0	68.3 Å²	68.3	0%	0	35%	0.345	C	S	.	.	H	α-helix	trans	-70.2	-38.7	179.4	-167	67.1	0	0	0	111.8	I85 P90 S92 H93 L94 L98 I99 V100 I112 F115	I85-L96 HydrophobicContact CD1-CD1 4.15Å; I85-L96 HydrophobicContact CG1-CD1 4.17Å; P90-L96 HydrophobicContact CG-CD1 4.15Å; S92-L96 PolarHBondContact O-N 3.15Å; H93-L96 PolarHBondContact O-N 3.36Å; H93-L96 VanDerWaalsContact O-N 3.08Å; L94-L96 VanDerWaalsContact C-N 3.26Å; L94-L96 PolarHBondContact O-N 2.96Å; L96-L98 PolarHBondContact O-N 3.34Å; L96-I99 PolarHBondContact O-N 3.06Å; L96-V100 HydrophobicContact CD1-CG2 4.05Å; L96-V100 HydrophobicContact CG-CG2 4.25Å; L96-V100 PolarHBondContact O-N 3.48Å; L96-I112 HydrophobicContact CD2-CB 4.45Å; L96-I112 HydrophobicContact CD2-CG1 4.21Å; L96-I112 HydrophobicContact CD2-CG2 3.94Å; L96-F115 HydrophobicContact CD1-CD1 4.18Å; L96-F115 HydrophobicContact CD1-CE1 4.07Å; L96-F115 HydrophobicContact CD2-CD1 4.28Å
97	Q	95.2	Very high	95.1	Very high	65 Å²	65	68.4 Å²	68.4	30%	0.304	35%	0.346	S	S	.	.	H	α-helix	trans	-63	-28.6	174.8	-70.1	178.8	-7.6	0	0	113.1	H93 L94 I99 C103 E104	H93-Q97 PolarHBondContact CD2-NE2 3.44Å; H93-Q97 PolarHBondContact NE2-NE2 3.43Å; H93-Q97 WeakPolarHBondContact O-CG 3.34Å; H93-Q97 PolarHBondContact O-N 2.95Å; L94-Q97 PolarHBondContact O-N 3.36Å; Q97-I99 VanDerWaalsContact C-N 3.25Å; Q97-I99 PolarHBondContact O-N 2.92Å; Q97-C103 HydrophobicContact CG-CB 4.05Å; Q97-E104 VanDerWaalsContact NE2-CD 3.3Å; Q97-E104 PolarHBondContact NE2-OE1 3.43Å
98	L	96.2	Very high	95.2	Very high	141 Å²	141	71.1 Å²	71.1	74%	0.738	36%	0.363	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.6	-18.7	174.5	-67.4	172	0	0	0	112.8	L94 D95 L96	L94-L98 WeakPolarHBondContact O-CG 3.43Å; L94-L98 PolarHBondContact O-N 2.93Å; L94-L98 VanDerWaalsContact O-N 3.16Å; D95-L98 PolarHBondContact O-N 3.31Å; L96-L98 PolarHBondContact O-N 3.34Å
99	I	96.6	Very high	95.2	Very high	31 Å²	31	72.4 Å²	72.4	16%	0.159	37%	0.366	C	S	.	.	T	Hydrogen-bonded Turn	trans	-99.6	-44.2	179.9	-60.7	167.2	0	0	0	111.4	E81 Q84 I85 L88 P90 D95 L96 Q97	E81-I99 HydrophobicContact CB-CG2 4.43Å; Q84-I99 HydrophobicContact CB-CG1 4.49Å; Q84-I99 HydrophobicContact CB-CG2 3.61Å; I85-I99 HydrophobicContact CG1-CD1 4.17Å; I85-I99 HydrophobicContact CG1-CG2 4.03Å; L88-I99 HydrophobicContact CB-CD1 4.47Å; L88-I99 HydrophobicContact CD1-CD1 4.23Å; L88-I99 HydrophobicContact CD1-CG1 4.31Å; P90-I99 HydrophobicContact CB-CD1 4.39Å; P90-I99 HydrophobicContact CG-CD1 4.46Å; D95-I99 WeakPolarHBondContact O-CG1 3.14Å; L96-I99 PolarHBondContact O-N 3.06Å; Q97-I99 VanDerWaalsContact C-N 3.25Å; Q97-I99 PolarHBondContact O-N 2.92Å
100	V	96.2	Very high	95.3	Very high	2 Å²	2	76.2 Å²	76.2	1%	0.012	39%	0.387	C	S	.	.	S	Bend	trans	-101	114.1	-173	-179.4	0	0	0	0	109.4	L77 E81 L96 C103 R106	L77-V100 HydrophobicContact CD1-CG2 4.36Å; L77-V100 HydrophobicContact CD2-CG1 3.86Å; L77-V100 HydrophobicContact CD2-CG2 3.97Å; E81-V100 HydrophobicContact CG-CG2 4.46Å; E81-V100 WeakPolarHBondContact OE1-CA 3.44Å; L96-V100 HydrophobicContact CD1-CG2 4.05Å; L96-V100 HydrophobicContact CG-CG2 4.25Å; L96-V100 PolarHBondContact O-N 3.48Å; V100-C103 HydrophobicContact CB-CB 4.01Å; V100-C103 HydrophobicContact CG1-CB 4.03Å; V100-C103 WeakPolarHBondContact O-CB 3.41Å; V100-C103 PolarHBondContact O-N 2.66Å; V100-R106 VanDerWaalsContact CG1-NH1 3.29Å
101	E	94.1	Very high	95.3	Very high	149 Å²	149	79.4 Å²	79.4	70%	0.696	40%	0.402	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.6	137	177.4	-171.6	171.8	-163.4	0	0	110.6	C103 R106	E101-C103 PolarHBondContact O-N 2.67Å; E101-C103 VanDerWaalsContact O-N 3.16Å; E101-R106 WeakPolarHBondContact O-CD 3.42Å; E101-R106 PolarHBondContact O-NH1 2.91Å
102	D	93.4	Very high	95.5	Very high	115 Å²	115	72.4 Å²	72.4	62%	0.615	37%	0.372	S	S	*	.	T	Hydrogen-bonded Turn	trans	48.4	38	-176.1	-61.2	-38.2	0	0	0	113.6	E104 S105 R106	D102-E104 VanDerWaalsContact C-N 3.31Å; D102-E104 PolarHBondContact O-N 3.36Å; D102-S105 WeakPolarHBondContact CB-OG 3.39Å; D102-S105 WeakPolarHBondContact O-CA 3.26Å; D102-S105 WeakPolarHBondContact O-CB 3.3Å; D102-S105 PolarHBondContact O-N 3.41Å; D102-S105 PolarHBondContact O-OG 3.27Å; D102-R106 PolarHBondContact O-N 3.01Å; D102-R106 VanDerWaalsContact O-N 3.15Å
103	C	94.1	Very high	95.5	Very high	4 Å²	4	75.5 Å²	75.5	3%	0.027	38%	0.381	C	S	.	.	H	α-helix	trans	-47.9	-48.4	-174.7	-173.5	0	0	0	0	113.1	Q97 V100 E101 S105 R106 L107	Q97-C103 HydrophobicContact CG-CB 4.05Å; V100-C103 HydrophobicContact CB-CB 4.01Å; V100-C103 HydrophobicContact CG1-CB 4.03Å; V100-C103 WeakPolarHBondContact O-CB 3.41Å; V100-C103 PolarHBondContact O-N 2.66Å; E101-C103 PolarHBondContact O-N 2.67Å; E101-C103 VanDerWaalsContact O-N 3.16Å; C103-S105 PolarHBondContact O-N 2.93Å; C103-R106 PolarHBondContact O-N 3.43Å; C103-R106 VanDerWaalsContact O-N 3.14Å; C103-L107 PolarHBondContact O-N 3.48Å
104	E	92	Very high	95.6	Very high	140 Å²	140	77.3 Å²	77.3	65%	0.654	39%	0.393	S	S	*	.	H	α-helix	trans	-64.8	-23.1	-179.4	-63.2	-174.4	164.1	0	0	113.6	Q97 D102	Q97-E104 VanDerWaalsContact NE2-CD 3.3Å; Q97-E104 PolarHBondContact NE2-OE1 3.43Å; D102-E104 VanDerWaalsContact C-N 3.31Å; D102-E104 PolarHBondContact O-N 3.36Å
105	S	94.5	Very high	95.7	Very high	95 Å²	95	72.4 Å²	72.4	66%	0.664	37%	0.367	S	S	*	.	H	α-helix	trans	-86.8	-27.4	176.3	81	0	0	0	0	112.8	D102 C103	D102-S105 WeakPolarHBondContact CB-OG 3.39Å; D102-S105 WeakPolarHBondContact O-CA 3.26Å; D102-S105 WeakPolarHBondContact O-CB 3.3Å; D102-S105 PolarHBondContact O-N 3.41Å; D102-S105 PolarHBondContact O-OG 3.27Å; C103-S105 PolarHBondContact O-N 2.93Å
106	R	95.8	Very high	95.8	Very high	97 Å²	97	71 Å²	71	37%	0.366	36%	0.359	S	S	.	.	H	α-helix	trans	-90.8	-33.7	-175.4	-72.8	168.2	64.2	-167.7	-0.8	112.4	G76 E81 V100 E101 D102 C103	G76-R106 PolarHBondContact O-NH2 2.92Å; G76-R106 VanDerWaalsContact O-NH2 3.1Å; E81-R106 IonicContact OE1-CZ 3.81Å; E81-R106 IonicContact OE1-NH1 2.72Å; E81-R106 PolarHBondContact OE1-NH1 3.43Å; E81-R106 IonicContact OE1-NH2 2.99Å; E81-R106 IonicContact OE2-CZ 3.33Å; E81-R106 IonicContact OE2-NH1 3.67Å; E81-R106 IonicContact OE2-NH2 2.81Å; E81-R106 PolarHBondContact OE2-NH2 2.93Å; V100-R106 VanDerWaalsContact CG1-NH1 3.29Å; E101-R106 WeakPolarHBondContact O-CD 3.42Å; E101-R106 PolarHBondContact O-NH1 2.91Å; D102-R106 PolarHBondContact O-N 3.01Å; D102-R106 VanDerWaalsContact O-N 3.15Å; C103-R106 PolarHBondContact O-N 3.43Å; C103-R106 VanDerWaalsContact O-N 3.14Å
107	L	96.4	Very high	95.9	Very high	9 Å²	9	73.9 Å²	73.9	5%	0.047	38%	0.383	C	S	.	.	S	Bend	trans	-124.8	140.1	-171.5	-54.1	-179	0	0	0	110.9	L75 L77 C103 Q111 I112	L75-L107 HydrophobicContact CB-CD2 4.04Å; L75-L107 HydrophobicContact CD2-CD2 4.17Å; L77-L107 HydrophobicContact CD2-CD1 4.43Å; C103-L107 PolarHBondContact O-N 3.48Å; L107-Q111 HydrophobicContact CB-CB 4.5Å; L107-I112 HydrophobicContact CB-CD1 4.1Å; L107-I112 HydrophobicContact CB-CG1 3.84Å; L107-I112 HydrophobicContact CD1-CG1 4.24Å
108	T	96.4	Very high	96	Very high	79 Å²	79	72.7 Å²	72.7	49%	0.485	38%	0.379	S	S	.	.			trans	-72.6	153.8	170.4	62.2	0	0	0	0	111	L110 Q111 I112	T108-L110 PolarHBondContact O-N 3.17Å; T108-Q111 WeakPolarHBondContact O-CB 3.27Å; T108-Q111 PolarHBondContact O-N 2.84Å; T108-Q111 VanDerWaalsContact OG1-CG 3.26Å; T108-Q111 WeakPolarHBondContact OG1-CG 3.23Å; T108-Q111 PolarHBondContact OG1-N 2.75Å; T108-Q111 PolarHBondContact OG1-OE1 2.79Å; T108-I112 WeakPolarHBondContact O-CG1 3.47Å; T108-I112 PolarHBondContact O-N 2.97Å
109	E	95.3	Very high	96	Very high	138 Å²	138	66 Å²	66	65%	0.645	34%	0.344	S	S	*	.	H	α-helix	trans	-53.4	-41.2	175.1	-171.2	170.7	-158.6	0	0	111.8	Q111 I112 E113	E109-Q111 PolarHBondContact O-N 2.78Å; E109-I112 WeakPolarHBondContact O-CB 3.47Å; E109-I112 PolarHBondContact O-N 3.38Å; E109-E113 WeakPolarHBondContact O-CG 3.5Å; E109-E113 PolarHBondContact O-N 3.4Å
110	L	96.8	Very high	96	Very high	109 Å²	109	66.8 Å²	66.8	57%	0.571	36%	0.36	S	S	*	.	H	α-helix	trans	-63	-39.4	176.1	-177.3	63.9	0	0	0	113	T108 I112 N114	T108-L110 PolarHBondContact O-N 3.17Å; L110-I112 VanDerWaalsContact C-N 3.34Å; L110-N114 WeakPolarHBondContact O-CB 3.35Å; L110-N114 VanDerWaalsContact O-CG 3.23Å; L110-N114 PolarHBondContact O-N 2.93Å; L110-N114 PolarHBondContact O-ND2 3Å
111	Q	97.3	Very high	95.9	Very high	72 Å²	72	72.3 Å²	72.3	34%	0.336	39%	0.393	S	S	.	.	H	α-helix	trans	-64.9	-41.4	175.2	-77.3	167	-54.9	0	0	111	L75 L107 T108 E109 F115	L75-Q111 HydrophobicContact CD2-CB 4.01Å; L75-Q111 HydrophobicContact CD2-CG 3.99Å; L107-Q111 HydrophobicContact CB-CB 4.5Å; T108-Q111 WeakPolarHBondContact O-CB 3.27Å; T108-Q111 PolarHBondContact O-N 2.84Å; T108-Q111 VanDerWaalsContact OG1-CG 3.26Å; T108-Q111 WeakPolarHBondContact OG1-CG 3.23Å; T108-Q111 PolarHBondContact OG1-N 2.75Å; T108-Q111 PolarHBondContact OG1-OE1 2.79Å; E109-Q111 PolarHBondContact O-N 2.78Å; Q111-F115 WeakPolarHBondContact O-CB 3.49Å; Q111-F115 PolarHBondContact O-N 2.9Å
112	I	96.9	Very high	95.9	Very high	4 Å²	4	66.1 Å²	66.1	2%	0.021	37%	0.367	C	S	.	.	H	α-helix	trans	-63.3	-48.4	178.8	-66.8	166.5	0	0	0	110.5	H93 L96 L107 T108 E109 L110 F115 L116	H93-I112 HydrophobicContact CB-CG2 4.34Å; H93-I112 WeakPolarHBondContact NE2-CD1 3.38Å; L96-I112 HydrophobicContact CD2-CB 4.45Å; L96-I112 HydrophobicContact CD2-CG1 4.21Å; L96-I112 HydrophobicContact CD2-CG2 3.94Å; L107-I112 HydrophobicContact CB-CD1 4.1Å; L107-I112 HydrophobicContact CB-CG1 3.84Å; L107-I112 HydrophobicContact CD1-CG1 4.24Å; T108-I112 WeakPolarHBondContact O-CG1 3.47Å; T108-I112 PolarHBondContact O-N 2.97Å; E109-I112 WeakPolarHBondContact O-CB 3.47Å; E109-I112 PolarHBondContact O-N 3.38Å; L110-I112 VanDerWaalsContact C-N 3.34Å; I112-F115 PolarHBondContact O-N 3Å; I112-L116 HydrophobicContact CG2-CD1 3.92Å; I112-L116 HydrophobicContact CG2-CG 4.46Å; I112-L116 WeakPolarHBondContact O-CB 3.17Å; I112-L116 WeakPolarHBondContact O-CG 3.47Å; I112-L116 PolarHBondContact O-N 3.06Å
113	E	97	Very high	95.9	Very high	111 Å²	111	61.4 Å²	61.4	52%	0.519	34%	0.341	S	S	.	.	H	α-helix	trans	-60.3	-47.8	178.3	-72.8	-178.3	165.2	0	0	112.2	E109 F115 L116 A117	E109-E113 WeakPolarHBondContact O-CG 3.5Å; E109-E113 PolarHBondContact O-N 3.4Å; E113-F115 VanDerWaalsContact C-N 3.32Å; E113-F115 PolarHBondContact O-N 3.37Å; E113-L116 PolarHBondContact O-N 2.97Å; E113-A117 WeakPolarHBondContact O-CB 3.35Å; E113-A117 PolarHBondContact O-N 3.28Å
114	N	97.4	Very high	96	Very high	98 Å²	98	64.3 Å²	64.3	52%	0.524	36%	0.357	S	S	.	.	H	α-helix	trans	-62	-41	178.2	-74.1	-31.4	0	0	0	111.7	L110 A117 L118	L110-N114 WeakPolarHBondContact O-CB 3.35Å; L110-N114 VanDerWaalsContact O-CG 3.23Å; L110-N114 PolarHBondContact O-N 2.93Å; L110-N114 PolarHBondContact O-ND2 3Å; N114-A117 PolarHBondContact O-N 3.43Å; N114-L118 PolarHBondContact O-N 3.33Å
115	F	97.4	Very high	96.2	Very high	3 Å²	3	60.3 Å²	60.3	1%	0.013	34%	0.342	C	S	.	.	H	α-helix	trans	-69.9	-39.8	-179.7	-171.8	-113.3	0	0	0	112.5	V68 E71 S72 L75 L77 I85 L96 Q111 I112 E113 A117 L118 C119	V68-F115 HydrophobicContact CG1-CE2 4.23Å; V68-F115 HydrophobicContact CG1-CZ 4.02Å; E71-F115 HydrophobicContact CB-CD2 4.19Å; E71-F115 HydrophobicContact CB-CE2 4.04Å; E71-F115 HydrophobicContact CG-CD2 3.79Å; E71-F115 HydrophobicContact CG-CE2 4.15Å; S72-F115 WeakPolarHBondContact OG-CZ 3.43Å; L75-F115 HydrophobicContact CD1-CB 3.96Å; L75-F115 HydrophobicContact CD1-CD1 4.29Å; L75-F115 HydrophobicContact CD1-CD2 3.62Å; L75-F115 HydrophobicContact CD1-CE2 4.16Å; L75-F115 HydrophobicContact CD1-CG 3.69Å; L77-F115 HydrophobicContact CD1-CE1 4.32Å; L77-F115 HydrophobicContact CD1-CZ 4.29Å; I85-F115 HydrophobicContact CD1-CE1 3.69Å; I85-F115 HydrophobicContact CD1-CZ 3.93Å; I85-F115 HydrophobicContact CG1-CE1 4.31Å; I85-F115 HydrophobicContact CG2-CE1 3.96Å; I85-F115 HydrophobicContact CG2-CZ 3.94Å; L96-F115 HydrophobicContact CD1-CD1 4.18Å; L96-F115 HydrophobicContact CD1-CE1 4.07Å; L96-F115 HydrophobicContact CD2-CD1 4.28Å; Q111-F115 WeakPolarHBondContact O-CB 3.49Å; Q111-F115 PolarHBondContact O-N 2.9Å; I112-F115 PolarHBondContact O-N 3Å; E113-F115 VanDerWaalsContact C-N 3.32Å; E113-F115 PolarHBondContact O-N 3.37Å; F115-A117 VanDerWaalsContact C-N 3.34Å; F115-L118 HydrophobicContact CD2-CD2 4.41Å; F115-L118 WeakPolarHBondContact O-CB 3.47Å; F115-L118 PolarHBondContact O-N 3.26Å; F115-C119 PolarHBondContact O-N 2.99Å; F115-C119 PolarHBondContact O-SG 3.25Å
116	L	97.4	Very high	96.3	Very high	29 Å²	29	58.4 Å²	58.4	15%	0.152	32%	0.324	C	S	.	.	H	α-helix	trans	-63.5	-39.8	173	-72.4	171.8	0	0	0	111.6	P90 I112 E113 L118 C119 G120	P90-L116 HydrophobicContact CB-CD2 3.93Å; P90-L116 HydrophobicContact CG-CD2 4.14Å; I112-L116 HydrophobicContact CG2-CD1 3.92Å; I112-L116 HydrophobicContact CG2-CG 4.46Å; I112-L116 WeakPolarHBondContact O-CB 3.17Å; I112-L116 WeakPolarHBondContact O-CG 3.47Å; I112-L116 PolarHBondContact O-N 3.06Å; E113-L116 PolarHBondContact O-N 2.97Å; L116-L118 VanDerWaalsContact C-N 3.35Å; L116-C119 PolarHBondContact O-N 3.12Å; L116-G120 PolarHBondContact O-N 3.44Å
117	A	97.5	Very high	96.3	Very high	60 Å²	60	56.1 Å²	56.1	50%	0.496	32%	0.321	S	S	.	.	H	α-helix	trans	-63.6	-40	174.4	0	0	0	0	0	112.2	E113 N114 F115 G120 T121	E113-A117 WeakPolarHBondContact O-CB 3.35Å; E113-A117 PolarHBondContact O-N 3.28Å; N114-A117 PolarHBondContact O-N 3.43Å; F115-A117 VanDerWaalsContact C-N 3.34Å; A117-G120 PolarHBondContact O-N 3.35Å; A117-T121 WeakPolarHBondContact O-CG2 3.38Å; A117-T121 PolarHBondContact O-N 3.08Å; A117-T121 PolarHBondContact O-OG1 2.7Å
118	L	97.4	Very high	96.3	Very high	41 Å²	41	59.1 Å²	59.1	22%	0.215	34%	0.338	C	S	.	.	H	α-helix	trans	-61.8	-48.2	173.3	179.4	67.9	0	0	0	111.2	K67 V68 E71 N114 F115 L116 G120 T121 S122	K67-L118 HydrophobicContact CB-CD1 4.47Å; V68-L118 HydrophobicContact CG2-CD2 4.44Å; V68-L118 HydrophobicContact CG2-CG 4.3Å; E71-L118 HydrophobicContact CB-CD2 3.52Å; E71-L118 HydrophobicContact CG-CD2 3.74Å; N114-L118 PolarHBondContact O-N 3.33Å; F115-L118 HydrophobicContact CD2-CD2 4.41Å; F115-L118 WeakPolarHBondContact O-CB 3.47Å; F115-L118 PolarHBondContact O-N 3.26Å; L116-L118 VanDerWaalsContact C-N 3.35Å; L118-G120 VanDerWaalsContact C-N 3.32Å; L118-G120 PolarHBondContact O-N 2.89Å; L118-T121 PolarHBondContact O-N 2.83Å; L118-T121 PolarHBondContact O-OG1 3.1Å; L118-T121 VanDerWaalsContact O-OG1 3.07Å; L118-S122 WeakPolarHBondContact CD1-OG 3.34Å; L118-S122 VanDerWaalsContact O-CB 3.26Å; L118-S122 WeakPolarHBondContact O-CB 3.37Å; L118-S122 PolarHBondContact O-N 3.43Å; L118-S122 PolarHBondContact O-OG 3.26Å
119	C	96.4	Very high	96.3	Very high	0 Å²	0	57.7 Å²	57.7	0%	0	33%	0.328	C	S	.	.	H	α-helix	trans	-60.8	-40.6	178.1	-67.8	0	0	0	0	111.9	F115 L116 T121 L123	F115-C119 PolarHBondContact O-N 2.99Å; F115-C119 PolarHBondContact O-SG 3.25Å; L116-C119 PolarHBondContact O-N 3.12Å; C119-T121 VanDerWaalsContact C-N 3.29Å; C119-T121 PolarHBondContact O-N 3.42Å; C119-L123 HydrophobicContact CB-CD1 4.27Å; C119-L123 VanDerWaalsContact O-CB 3.31Å; C119-L123 WeakPolarHBondContact O-CB 3.4Å; C119-L123 PolarHBondContact O-N 3.28Å
120	G	95.4	Very high	96.4	Very high	48 Å²	48	52 Å²	52	50%	0.495	31%	0.306	S	S	.	.	H	α-helix	trans	-67.6	-25.4	178.9	0	0	0	0	0	114.6	L116 A117 L118	L116-G120 PolarHBondContact O-N 3.44Å; A117-G120 PolarHBondContact O-N 3.35Å; L118-G120 VanDerWaalsContact C-N 3.32Å; L118-G120 PolarHBondContact O-N 2.89Å
121	T	95.2	Very high	96.4	Very high	117 Å²	117	47.6 Å²	47.6	72%	0.718	29%	0.286	S	S	*	.	H	α-helix	trans	-99.1	-27.5	-178.6	53.7	0	0	0	0	113.8	A117 L118 C119	A117-T121 WeakPolarHBondContact O-CG2 3.38Å; A117-T121 PolarHBondContact O-N 3.08Å; A117-T121 PolarHBondContact O-OG1 2.7Å; L118-T121 PolarHBondContact O-N 2.83Å; L118-T121 PolarHBondContact O-OG1 3.1Å; L118-T121 VanDerWaalsContact O-OG1 3.07Å; C119-T121 VanDerWaalsContact C-N 3.29Å; C119-T121 PolarHBondContact O-N 3.42Å
122	S	94.4	Very high	96.3	Very high	20 Å²	20	45.6 Å²	45.6	14%	0.14	28%	0.281	C	S	.	.	H	α-helix	trans	-104.8	-22.5	-173.4	-58.1	0	0	0	0	114	G64 L118	G64-S122 VanDerWaalsContact CA-O 3.29Å; G64-S122 WeakPolarHBondContact CA-O 3.49Å; L118-S122 WeakPolarHBondContact CD1-OG 3.34Å; L118-S122 VanDerWaalsContact O-CB 3.26Å; L118-S122 WeakPolarHBondContact O-CB 3.37Å; L118-S122 PolarHBondContact O-N 3.43Å; L118-S122 PolarHBondContact O-OG 3.26Å
123	L	93.2	Very high	96.2	Very high	16 Å²	16	49.4 Å²	49.4	8%	0.084	31%	0.305	C	S	.	.			trans	-106.2	0	170.4	-51.1	176.6	0	0	0	109.6	Q60 L65 V68 I86 K89 C119	Q60-L123 HydrophobicContact CG-CB 4.4Å; Q60-L123 HydrophobicContact CG-CD2 4.29Å; L65-L123 HydrophobicContact CD2-CD2 3.75Å; V68-L123 HydrophobicContact CG1-CD1 4.41Å; V68-L123 HydrophobicContact CG2-CD1 4.24Å; V68-L123 HydrophobicContact CG2-CD2 4Å; V68-L123 HydrophobicContact CG2-CG 3.92Å; I86-L123 HydrophobicContact CG2-CD2 4.42Å; K89-L123 HydrophobicContact CB-CD1 4.38Å; K89-L123 HydrophobicContact CD-CB 3.92Å; K89-L123 VanDerWaalsContact CE-OXT 3.23Å; K89-L123 WeakPolarHBondContact CE-OXT 3.48Å; K89-L123 HydrophobicContact CG-CB 3.99Å; K89-L123 HydrophobicContact CG-CD1 4.29Å; K89-L123 PolarHBondContact NZ-O 3.33Å; K89-L123 PolarHBondContact NZ-OXT 2.91Å; C119-L123 HydrophobicContact CB-CD1 4.27Å; C119-L123 VanDerWaalsContact O-CB 3.31Å; C119-L123 WeakPolarHBondContact O-CB 3.4Å; C119-L123 PolarHBondContact O-N 3.28Å

Retrieved 123 of 123 residues in 34.9 ms (Link to these results)

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