H2AX_HUMAN Loading...

Histone H2AX

Variant histone H2A which replaces conventional H2A in a subset of nucleosomes. Nucleosomes wrap and compact DNA into chromatin, limiting DNA accessibility to the cellular machineries which require DNA as a template. Histones thereby play a central role in transcription regulation, DNA repair, DNA replication and chromosomal stability. DNA accessibility is regulated via a complex set of post-translational modifications of histones, also called histone code, and nucleosome remodeling. Required for checkpoint-mediated arrest of cell cycle progression in response to low doses of ionizing radiation and for efficient repair of DNA double strand breaks (DSBs) specifically when modified by C-terminal phosphorylation.

AlphaFold DB , UniProt , Accession P16104, Species HUMAN (Homo sapiens, Human), Gene H2AX, Length 143 aa.

						>H2AX_HUMAN|P16104|H2AX
MSGRGKTGGKARAKAKSRSSRAGLQFPVGRVHRLLRKGHYAERVGAGAPVYLAAVLEYLTAEILELAGNAARDNKKTRIIPRHLQLAIRNDEELNKLLGGVTIAQGGVLPNIQAVLLPKKTSATVGPKAPSGGKKATQASQEY
					

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	50	Low	58.5	Low	250 Å²	250	134.2 Å²	134.2	100%	1.232	83%	0.83	S	S	*	*				0	101.4	0	-66.7	-159.9	-168.7	0	0	109.7
2	S	60.7	Low	59.1	Low	118 Å²	118	143.3 Å²	143.3	83%	0.825	84%	0.838	S	S	*	*			trans	-109.6	81.2	175.5	68.6	0	0	0	0	110.6	R4	S2-R4 VanDerWaalsContact C-N 3.31Å; S2-R4 PolarHBondContact O-N 3.47Å
3	G	59.9	Low	60	Low	80 Å²	80	139.2 Å²	139.2	83%	0.825	83%	0.83	S	S	*	*			trans	-72.7	88	165.3	0	0	0	0	0	108.9	G5	G3-G5 PolarHBondContact O-N 3.48Å
4	R	55.3	Low	61.2	Low	201 Å²	201	144.4 Å²	144.4	76%	0.758	84%	0.836	S	S	*	*			trans	-71.6	82.9	175.4	-165.4	161.2	-176.9	107.5	3.7	108.8	S2	S2-R4 VanDerWaalsContact C-N 3.31Å; S2-R4 PolarHBondContact O-N 3.47Å
5	G	59.2	Low	62.8	Low	61 Å²	61	140.4 Å²	140.4	63%	0.629	83%	0.827	S	S	*	*			trans	-57.1	134	179.5	0	0	0	0	0	112.5	G3 T7	G3-G5 PolarHBondContact O-N 3.48Å; G5-T7 PolarHBondContact O-N 2.89Å
6	K	63.9	Low	64.6	Low	200 Å²	200	141.3 Å²	141.3	87%	0.87	82%	0.818	S	S	*	*	T	Hydrogen-bonded Turn	trans	2.2	85.1	164.9	-92	175.2	169.9	172.5	0	114.7	G8	K6-G8 PolarHBondContact O-N 3.44Å
7	T	60.9	Low	66.4	Low	150 Å²	150	136.8 Å²	136.8	92%	0.92	80%	0.797	S	S	*	*	T	Hydrogen-bonded Turn	trans	46.5	29.6	146.6	46.7	0	0	0	0	118.4	G5	G5-T7 PolarHBondContact O-N 2.89Å
8	G	59.4	Low	68.1	Low	75 Å²	75	134.3 Å²	134.3	77%	0.773	77%	0.771	S	S	*	*			trans	-94.7	-8.6	-178.3	0	0	0	0	0	116.4	K6	K6-G8 PolarHBondContact O-N 3.44Å
9	G	56.8	Low	69.7	Low	68 Å²	68	128.1 Å²	128.1	70%	0.701	74%	0.737	S	S	*	*	S	Bend	trans	-129.1	22.8	-158.9	0	0	0	0	0	118.1
10	K	56.8	Low	71.1	Confident	168 Å²	168	125.1 Å²	125.1	73%	0.73	72%	0.724	S	S	*	*	S	Bend	trans	-113.2	136.3	164	-75.6	-174.2	176.4	-176.5	0	107.4	R12	K10-R12 PolarHBondContact O-N 2.97Å
11	A	60.1	Low	72.3	Confident	105 Å²	105	127.3 Å²	127.3	87%	0.868	72%	0.72	S	S	*	*			trans	-36.4	112	175.1	0	0	0	0	0	108.9	A13	A11-A13 PolarHBondContact O-N 3.44Å
12	R	66.1	Low	74.6	Confident	244 Å²	244	117.4 Å²	117.4	92%	0.921	68%	0.678	S	S	*	*			trans	-58.9	104.3	-168.8	-106	-179.7	172.8	176.3	-0.3	107.5	K10 K14	K10-R12 PolarHBondContact O-N 2.97Å; R12-K14 PolarHBondContact O-N 3.16Å
13	A	71.4	Confident	76.4	Confident	89 Å²	89	114.9 Å²	114.9	74%	0.736	67%	0.671	S	S	*	*			trans	-48.8	137.7	165.1	0	0	0	0	0	107.7	A11 A15	A11-A13 PolarHBondContact O-N 3.44Å; A13-A15 PolarHBondContact O-N 2.76Å
14	K	76.8	Confident	78.2	Confident	212 Å²	212	112.3 Å²	112.3	92%	0.922	64%	0.638	S	S	*	*			trans	-48.5	113.9	-175.3	-167.4	174.2	-175.4	176.1	0	108.7	R12 K16	R12-K14 PolarHBondContact O-N 3.16Å; K14-K16 PolarHBondContact O-N 3.37Å; K14-K16 VanDerWaalsContact O-N 3.14Å
15	A	84.9	Confident	80.3	Confident	85 Å²	85	110.9 Å²	110.9	70%	0.702	64%	0.64	S	S	*	*	P	Polyproline II helix	trans	-59.9	122.7	-171.9	0	0	0	0	0	109.5	A13 S17	A13-A15 PolarHBondContact O-N 2.76Å; A15-S17 PolarHBondContact O-N 3.31Å
16	K	91.5	Very high	82.2	Confident	154 Å²	154	110.7 Å²	110.7	67%	0.67	62%	0.622	S	S	*	*	P	Polyproline II helix	trans	-59	131.1	173.8	-70.4	-171.9	178.6	-174.5	0	109.7	K14 R21	K14-K16 PolarHBondContact O-N 3.37Å; K14-K16 VanDerWaalsContact O-N 3.14Å; K16-R21 HydrophobicContact CB-CG 3.97Å; K16-R21 PolarHBondContact O-NE 3.34Å; K16-R21 VanDerWaalsContact O-NE 3.17Å; K16-R21 PolarHBondContact O-NH2 2.9Å
17	S	95.7	Very high	83.8	Confident	66 Å²	66	103.6 Å²	103.6	46%	0.462	60%	0.596	S	S	.	*	P	Polyproline II helix	trans	-64.7	153.4	176.9	75	0	0	0	0	110.6	A15 S19 S20 R21	A15-S17 PolarHBondContact O-N 3.31Å; S17-S19 PolarHBondContact O-N 2.89Å; S17-S20 PolarHBondContact N-OG 3.44Å; S17-S20 PolarHBondContact O-N 3.5Å; S17-S20 VanDerWaalsContact O-N 3.16Å; S17-S20 PolarHBondContact O-OG 2.73Å; S17-S20 WeakPolarHBondContact OG-CB 3.49Å; S17-S20 PolarHBondContact OG-N 2.81Å; S17-S20 PolarHBondContact OG-OG 3.2Å; S17-R21 WeakPolarHBondContact O-CG 3.49Å; S17-R21 PolarHBondContact O-N 2.95Å
18	R	97	Very high	85.6	Confident	91 Å²	91	96.5 Å²	96.5	34%	0.343	55%	0.552	S	S	.	*	H	α-helix	trans	-58.4	-35.5	175.6	-73.4	-169.1	-77.8	156.6	-2.3	112.4	R21 A22 V28 H32	R18-R21 PolarHBondContact O-N 3.13Å; R18-A22 WeakPolarHBondContact O-CB 3.43Å; R18-A22 PolarHBondContact O-N 3.22Å; R18-V28 HydrophobicContact CB-CB 3.97Å; R18-V28 HydrophobicContact CB-CG1 3.71Å; R18-H32 PolarHBondContact NH1-ND1 3.29Å; R18-H32 VanDerWaalsContact NH2-CB 3.3Å; R18-H32 PolarHBondContact NH2-ND1 3.39Å
19	S	98.2	Very high	87.4	Confident	17 Å²	17	94.7 Å²	94.7	12%	0.119	53%	0.534	C	S	.	.	H	α-helix	trans	-60.1	-51.5	172.6	-59.3	0	0	0	0	111.8	S17 R21 A22 G23 L24 F26 P27 V28	S17-S19 PolarHBondContact O-N 2.89Å; S19-R21 VanDerWaalsContact C-N 3.26Å; S19-R21 PolarHBondContact O-N 2.91Å; S19-A22 CarbonylContact O-C 3.49Å; S19-A22 PolarHBondContact O-N 3.3Å; S19-G23 PolarHBondContact O-N 2.91Å; S19-L24 WeakPolarHBondContact CB-O 3.45Å; S19-L24 PolarHBondContact O-N 2.91Å; S19-L24 VanDerWaalsContact O-N 3.09Å; S19-F26 WeakPolarHBondContact CB-O 3.34Å; S19-F26 PolarHBondContact OG-O 3.18Å; S19-P27 WeakPolarHBondContact OG-CA 3.42Å; S19-V28 PolarHBondContact OG-N 3.16Å
20	S	97.3	Very high	89.4	Confident	68 Å²	68	98.7 Å²	98.7	48%	0.476	53%	0.528	S	S	.	.	H	α-helix	trans	-62.9	-29.8	179	67	0	0	0	0	113.6	S17	S17-S20 PolarHBondContact N-OG 3.44Å; S17-S20 PolarHBondContact O-N 3.5Å; S17-S20 VanDerWaalsContact O-N 3.16Å; S17-S20 PolarHBondContact O-OG 2.73Å; S17-S20 WeakPolarHBondContact OG-CB 3.49Å; S17-S20 PolarHBondContact OG-N 2.81Å; S17-S20 PolarHBondContact OG-OG 3.2Å
21	R	97.2	Very high	91.4	Very high	172 Å²	172	91.3 Å²	91.3	65%	0.649	50%	0.497	S	S	*	.	H	α-helix	trans	-74.8	-29.4	174.3	-67.4	-178.9	-163.4	-179.8	1.3	112.6	K16 S17 R18 S19	K16-R21 HydrophobicContact CB-CG 3.97Å; K16-R21 PolarHBondContact O-NE 3.34Å; K16-R21 VanDerWaalsContact O-NE 3.17Å; K16-R21 PolarHBondContact O-NH2 2.9Å; S17-R21 WeakPolarHBondContact O-CG 3.49Å; S17-R21 PolarHBondContact O-N 2.95Å; R18-R21 PolarHBondContact O-N 3.13Å; S19-R21 VanDerWaalsContact C-N 3.26Å; S19-R21 PolarHBondContact O-N 2.91Å
22	A	97.8	Very high	93.2	Very high	41 Å²	41	88 Å²	88	34%	0.339	46%	0.463	S	S	.	.	H	α-helix	trans	-89.1	-6.1	179.3	0	0	0	0	0	113.4	R18 S19 L24 V50	R18-A22 WeakPolarHBondContact O-CB 3.43Å; R18-A22 PolarHBondContact O-N 3.22Å; S19-A22 CarbonylContact O-C 3.49Å; S19-A22 PolarHBondContact O-N 3.3Å; A22-L24 VanDerWaalsContact C-N 3.31Å; A22-L24 HydrophobicContact CB-CD1 3.91Å; A22-L24 HydrophobicContact CB-CG 3.96Å; A22-V50 HydrophobicContact CB-CG1 3.73Å
23	G	98.2	Very high	94.8	Very high	65 Å²	65	83.2 Å²	83.2	67%	0.67	45%	0.445	S	S	*	.	T	Hydrogen-bonded Turn	trans	72.3	22.8	-175.6	0	0	0	0	0	114	S19	S19-G23 PolarHBondContact O-N 2.91Å
24	L	98.5	Very high	96.1	Very high	27 Å²	27	83.2 Å²	83.2	14%	0.141	43%	0.433	C	S	.	.			trans	-105.9	140.9	-174.8	-62.2	176.1	0	0	0	111.6	S19 A22 V28 V50 A53 A54 E57	S19-L24 WeakPolarHBondContact CB-O 3.45Å; S19-L24 PolarHBondContact O-N 2.91Å; S19-L24 VanDerWaalsContact O-N 3.09Å; A22-L24 VanDerWaalsContact C-N 3.31Å; A22-L24 HydrophobicContact CB-CD1 3.91Å; A22-L24 HydrophobicContact CB-CG 3.96Å; L24-V28 HydrophobicContact CD1-CG2 3.82Å; L24-V50 HydrophobicContact CD1-CG1 4.31Å; L24-A53 HydrophobicContact CD1-CB 3.9Å; L24-A54 HydrophobicContact CD1-CB 4.05Å; L24-A54 HydrophobicContact CD2-CB 3.78Å; L24-E57 WeakPolarHBondContact CA-OE2 3.12Å; L24-E57 WeakPolarHBondContact CB-OE2 3.31Å
25	Q	98.5	Very high	97.1	Very high	171 Å²	171	74.5 Å²	74.5	80%	0.799	40%	0.396	S	S	*	.	S	Bend	trans	-75.4	-31.8	165.2	-59.9	-58.1	-33.5	0	0	111.2	E57	Q25-E57 PolarHBondContact N-OE1 2.92Å; Q25-E57 VanDerWaalsContact N-OE1 3.12Å; Q25-E57 PolarHBondContact N-OE2 2.96Å
26	F	98.4	Very high	97.7	Very high	57 Å²	57	76.4 Å²	76.4	25%	0.25	39%	0.385	C	S	.	.	S	Bend	trans	-69.3	146.8	-179	-92.8	-126.7	0	0	0	112.8	S19 V28 A53 L56 E57 T60	S19-F26 WeakPolarHBondContact CB-O 3.34Å; S19-F26 PolarHBondContact OG-O 3.18Å; F26-V28 PolarHBondContact O-N 3.31Å; F26-A53 HydrophobicContact CB-CB 4.19Å; F26-L56 HydrophobicContact CD1-CB 3.73Å; F26-L56 HydrophobicContact CE1-CB 3.69Å; F26-E57 HydrophobicContact CB-CB 4.12Å; F26-E57 HydrophobicContact CD1-CB 4.49Å; F26-E57 HydrophobicContact CD2-CB 3.57Å; F26-E57 HydrophobicContact CD2-CG 3.71Å; F26-E57 HydrophobicContact CE2-CB 4.11Å; F26-E57 HydrophobicContact CE2-CG 4.23Å; F26-E57 HydrophobicContact CG-CB 3.8Å; F26-E57 HydrophobicContact CG-CG 4.38Å; F26-E57 PolarHBondContact N-OE2 3.03Å; F26-T60 HydrophobicContact CE2-CG2 4.36Å; F26-T60 HydrophobicContact CZ-CG2 4.1Å; F26-T60 VanDerWaalsContact CZ-OG1 3.26Å; F26-T60 WeakPolarHBondContact CZ-OG1 3.4Å
27	P	98.5	Very high	98	Very high	51 Å²	51	76.4 Å²	76.4	33%	0.331	39%	0.385	S	S	.	.			trans	-83	83.1	-169.8	33.7	-37.4	0	0	0	112.9	S19 G29 R30 V31	S19-P27 WeakPolarHBondContact OG-CA 3.42Å; P27-G29 PolarHBondContact O-N 2.89Å; P27-R30 HydrophobicContact CB-CB 3.84Å; P27-R30 HydrophobicContact CG-CB 3.95Å; P27-R30 WeakPolarHBondContact O-CA 3.27Å; P27-R30 WeakPolarHBondContact O-CB 3.49Å; P27-R30 PolarHBondContact O-N 3.27Å; P27-V31 PolarHBondContact O-N 3.22Å
28	V	98.7	Very high	98.1	Very high	0 Å²	0	74.9 Å²	74.9	0%	0	38%	0.38	C	S	.	.	H	α-helix	trans	-48	-39.1	176.6	177.6	0	0	0	0	112.5	R18 S19 L24 F26 R30 H32 P49 V50 A53	R18-V28 HydrophobicContact CB-CB 3.97Å; R18-V28 HydrophobicContact CB-CG1 3.71Å; S19-V28 PolarHBondContact OG-N 3.16Å; L24-V28 HydrophobicContact CD1-CG2 3.82Å; F26-V28 PolarHBondContact O-N 3.31Å; V28-R30 PolarHBondContact O-N 3.2Å; V28-H32 PolarHBondContact O-N 2.79Å; V28-P49 HydrophobicContact CG1-CB 4.3Å; V28-P49 HydrophobicContact CG1-CG 4.5Å; V28-V50 HydrophobicContact CG1-CG2 3.77Å; V28-A53 HydrophobicContact CG2-CB 3.87Å
29	G	98.1	Very high	98.1	Very high	38 Å²	38	78.2 Å²	78.2	39%	0.392	40%	0.399	S	S	.	.	H	α-helix	trans	-59.1	-45.3	176.5	0	0	0	0	0	113.3	P27 R33	P27-G29 PolarHBondContact O-N 2.89Å; G29-R33 PolarHBondContact O-N 3.29Å
30	R	98.5	Very high	98.1	Very high	152 Å²	152	85.9 Å²	85.9	57%	0.574	43%	0.427	S	S	*	.	H	α-helix	trans	-71.5	-43.7	179.6	-175.5	-179.7	-66.7	173.7	-1.5	111	P27 V28 H32 R33 L34	P27-R30 HydrophobicContact CB-CB 3.84Å; P27-R30 HydrophobicContact CG-CB 3.95Å; P27-R30 WeakPolarHBondContact O-CA 3.27Å; P27-R30 WeakPolarHBondContact O-CB 3.49Å; P27-R30 PolarHBondContact O-N 3.27Å; V28-R30 PolarHBondContact O-N 3.2Å; R30-H32 VanDerWaalsContact C-N 3.3Å; R30-H32 PolarHBondContact O-N 2.81Å; R30-R33 PolarHBondContact O-N 3.24Å; R30-R33 VanDerWaalsContact O-N 3.1Å; R30-L34 HydrophobicContact CG-CD1 4.09Å; R30-L34 HydrophobicContact CG-CG 4.39Å; R30-L34 WeakPolarHBondContact O-CG 3.38Å; R30-L34 PolarHBondContact O-N 2.99Å
31	V	98.6	Very high	98.1	Very high	13 Å²	13	85.5 Å²	85.5	8%	0.079	43%	0.428	C	S	.	.	H	α-helix	trans	-56.7	-45.5	176.2	177.4	0	0	0	0	110.5	P27 R33 L34 L35 P49 L52 A53	P27-V31 PolarHBondContact O-N 3.22Å; V31-R33 VanDerWaalsContact C-N 3.34Å; V31-R33 PolarHBondContact O-N 2.84Å; V31-L34 PolarHBondContact O-N 3.33Å; V31-L35 HydrophobicContact CG1-CD1 4.13Å; V31-L35 HydrophobicContact CG1-CG 4.43Å; V31-L35 WeakPolarHBondContact O-CG 3.29Å; V31-L35 PolarHBondContact O-N 3.17Å; V31-P49 HydrophobicContact CB-CB 4.3Å; V31-P49 HydrophobicContact CG1-CB 4.06Å; V31-L52 HydrophobicContact CG1-CB 4.12Å; V31-L52 HydrophobicContact CG1-CD2 3.82Å; V31-L52 HydrophobicContact CG1-CG 4.04Å; V31-A53 HydrophobicContact CG2-CB 4.09Å
32	H	98.5	Very high	98.1	Very high	34 Å²	34	86.1 Å²	86.1	16%	0.157	44%	0.438	C	S	.	.	H	α-helix	trans	-58.8	-43.6	175.8	-170.4	-168.6	0	0	0	112.8	R18 V28 R30 L35 R36 P49	R18-H32 PolarHBondContact NH1-ND1 3.29Å; R18-H32 VanDerWaalsContact NH2-CB 3.3Å; R18-H32 PolarHBondContact NH2-ND1 3.39Å; V28-H32 PolarHBondContact O-N 2.79Å; R30-H32 VanDerWaalsContact C-N 3.3Å; R30-H32 PolarHBondContact O-N 2.81Å; H32-L35 PolarHBondContact O-N 3.41Å; H32-R36 PolarHBondContact NE2-NE 3.13Å; H32-R36 PolarHBondContact O-N 2.94Å; H32-P49 HydrophobicContact CB-CB 3.6Å; H32-P49 HydrophobicContact CB-CG 3.72Å
33	R	98.5	Very high	98.2	Very high	144 Å²	144	94.1 Å²	94.1	54%	0.543	46%	0.459	S	S	.	.	H	α-helix	trans	-64.7	-42.9	178.3	-176.9	-178.4	64	90.3	1.4	111.5	G29 R30 V31 R36 K37	G29-R33 PolarHBondContact O-N 3.29Å; R30-R33 PolarHBondContact O-N 3.24Å; R30-R33 VanDerWaalsContact O-N 3.1Å; V31-R33 VanDerWaalsContact C-N 3.34Å; V31-R33 PolarHBondContact O-N 2.84Å; R33-R36 PolarHBondContact O-N 3.41Å; R33-K37 WeakPolarHBondContact O-CB 3.05Å; R33-K37 PolarHBondContact O-N 3.19Å
34	L	98.6	Very high	98.1	Very high	89 Å²	89	92 Å²	92	47%	0.466	43%	0.433	S	S	.	.	H	α-helix	trans	-64.9	-41.6	178.5	-68.7	174.6	0	0	0	111.7	R30 V31 R36 K37 G38	R30-L34 HydrophobicContact CG-CD1 4.09Å; R30-L34 HydrophobicContact CG-CG 4.39Å; R30-L34 WeakPolarHBondContact O-CG 3.38Å; R30-L34 PolarHBondContact O-N 2.99Å; V31-L34 PolarHBondContact O-N 3.33Å; L34-R36 VanDerWaalsContact C-N 3.32Å; L34-R36 PolarHBondContact O-N 2.91Å; L34-K37 PolarHBondContact O-N 3.31Å; L34-G38 PolarHBondContact O-N 3.01Å
35	L	98.4	Very high	98.1	Very high	29 Å²	29	92.9 Å²	92.9	15%	0.152	45%	0.449	C	S	.	.	H	α-helix	trans	-58.4	-42	174.4	-74.7	171.4	0	0	0	112.3	V31 H32 Y40 V44 P49 L52	V31-L35 HydrophobicContact CG1-CD1 4.13Å; V31-L35 HydrophobicContact CG1-CG 4.43Å; V31-L35 WeakPolarHBondContact O-CG 3.29Å; V31-L35 PolarHBondContact O-N 3.17Å; H32-L35 PolarHBondContact O-N 3.41Å; L35-Y40 HydrophobicContact CD2-CD2 3.91Å; L35-Y40 HydrophobicContact CD2-CE2 4.14Å; L35-Y40 WeakPolarHBondContact O-CD2 3.35Å; L35-V44 HydrophobicContact CB-CG1 4.11Å; L35-V44 HydrophobicContact CB-CG2 4.17Å; L35-V44 HydrophobicContact CD1-CG1 3.99Å; L35-P49 HydrophobicContact CD1-CB 4.15Å; L35-L52 HydrophobicContact CD1-CD2 4.21Å; L35-L52 HydrophobicContact CD2-CD2 3.85Å; L35-L52 HydrophobicContact CG-CD2 4.24Å
36	R	97.6	Very high	98	Very high	125 Å²	125	88.5 Å²	88.5	47%	0.472	44%	0.442	S	S	.	.	H	α-helix	trans	-69	-43.2	176.2	-72.6	-175.4	173.2	-86.6	-3.8	112.6	H32 R33 L34 G38 H39 V44	H32-R36 PolarHBondContact NE2-NE 3.13Å; H32-R36 PolarHBondContact O-N 2.94Å; R33-R36 PolarHBondContact O-N 3.41Å; L34-R36 VanDerWaalsContact C-N 3.32Å; L34-R36 PolarHBondContact O-N 2.91Å; R36-G38 VanDerWaalsContact C-N 3.26Å; R36-G38 PolarHBondContact O-N 2.86Å; R36-H39 PolarHBondContact O-CD2 3.41Å; R36-H39 PolarHBondContact O-N 2.79Å; R36-V44 HydrophobicContact CG-CB 4.27Å; R36-V44 HydrophobicContact CG-CG2 3.9Å; R36-V44 PolarHBondContact NH2-O 3.4Å
37	K	98.1	Very high	98	Very high	154 Å²	154	88.1 Å²	88.1	67%	0.67	45%	0.454	S	S	*	.	H	α-helix	trans	-66.4	-28.3	178.5	-173.9	177.4	177	-176.1	0	112.4	R33 L34 H39	R33-K37 WeakPolarHBondContact O-CB 3.05Å; R33-K37 PolarHBondContact O-N 3.19Å; L34-K37 PolarHBondContact O-N 3.31Å; K37-H39 PolarHBondContact O-N 3.33Å
38	G	98	Very high	98	Very high	34 Å²	34	88 Å²	88	35%	0.351	46%	0.457	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76	-5.6	179.5	0	0	0	0	0	115	L34 R36 Y40	L34-G38 PolarHBondContact O-N 3.01Å; R36-G38 VanDerWaalsContact C-N 3.26Å; R36-G38 PolarHBondContact O-N 2.86Å; G38-Y40 PolarHBondContact O-N 3.31Å; G38-Y40 VanDerWaalsContact O-N 3.16Å
39	H	97.1	Very high	98	Very high	162 Å²	162	88 Å²	88	75%	0.75	46%	0.457	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.6	33.5	-179.4	-55.3	157.9	0	0	0	114.3	R36 K37 A41	R36-H39 PolarHBondContact O-CD2 3.41Å; R36-H39 PolarHBondContact O-N 2.79Å; K37-H39 PolarHBondContact O-N 3.33Å; H39-A41 VanDerWaalsContact C-N 3.28Å; H39-A41 PolarHBondContact O-N 2.99Å
40	Y	97.6	Very high	98.1	Very high	178 Å²	178	88.5 Å²	88.5	70%	0.698	45%	0.453	S	S	*	.	S	Bend	trans	-68.6	-25.3	179.4	-57.5	-68.2	0	0	0	113.6	L35 G38	L35-Y40 HydrophobicContact CD2-CD2 3.91Å; L35-Y40 HydrophobicContact CD2-CE2 4.14Å; L35-Y40 WeakPolarHBondContact O-CD2 3.35Å; G38-Y40 PolarHBondContact O-N 3.31Å; G38-Y40 VanDerWaalsContact O-N 3.16Å
41	A	97.6	Very high	98.1	Very high	60 Å²	60	89.5 Å²	89.5	50%	0.496	46%	0.458	S	S	.	.			trans	-161	158.2	176.1	0	0	0	0	0	109.8	H39 R43	H39-A41 VanDerWaalsContact C-N 3.28Å; H39-A41 PolarHBondContact O-N 2.99Å; A41-R43 VanDerWaalsContact C-N 3.27Å; A41-R43 PolarHBondContact O-N 3.38Å
42	E	97.3	Very high	98.1	Very high	184 Å²	184	92 Å²	92	86%	0.86	47%	0.47	S	S	*	.	S	Bend	trans	-59.6	-38.7	175.5	-169.1	-166.2	159	0	0	112
43	R	98	Very high	98.1	Very high	209 Å²	209	90.3 Å²	90.3	79%	0.789	46%	0.463	S	S	*	.			trans	-126.3	136.8	-179.8	-61.4	177.2	70.7	150.4	0.2	110.6	A41	A41-R43 VanDerWaalsContact C-N 3.27Å; A41-R43 PolarHBondContact O-N 3.38Å
44	V	97.8	Very high	98.1	Very high	20 Å²	20	85.3 Å²	85.3	12%	0.121	45%	0.452	C	S	.	.			trans	-110.6	116	172.7	-178.9	0	0	0	0	108.5	L35 R36 A48	L35-V44 HydrophobicContact CB-CG1 4.11Å; L35-V44 HydrophobicContact CB-CG2 4.17Å; L35-V44 HydrophobicContact CD1-CG1 3.99Å; R36-V44 HydrophobicContact CG-CB 4.27Å; R36-V44 HydrophobicContact CG-CG2 3.9Å; R36-V44 PolarHBondContact NH2-O 3.4Å; V44-A48 HydrophobicContact CG1-CB 4.21Å
45	G	97.9	Very high	98.1	Very high	47 Å²	47	83.6 Å²	83.6	49%	0.485	45%	0.445	S	S	.	.			trans	-63	149.7	177.1	0	0	0	0	0	112.3	G47 A48 P49	G45-G47 VanDerWaalsContact C-N 3.28Å; G45-G47 PolarHBondContact O-N 2.87Å; G45-A48 WeakPolarHBondContact O-CB 3.46Å; G45-A48 PolarHBondContact O-N 3.42Å; G45-P49 WeakPolarHBondContact O-CD 3.18Å
46	A	97.3	Very high	98.1	Very high	79 Å²	79	85.4 Å²	85.4	65%	0.653	46%	0.455	S	S	*	.	S	Bend	trans	-64.7	-29.2	-173.6	0	0	0	0	0	114	P49	A46-P49 WeakPolarHBondContact O-CD 3.43Å; A46-P49 WeakPolarHBondContact O-CG 3.34Å
47	G	98.2	Very high	98.2	Very high	49 Å²	49	81.5 Å²	81.5	51%	0.505	44%	0.441	S	S	.	.	S	Bend	trans	-80.3	-26.2	177.5	0	0	0	0	0	114.5	G45 V50 Y51	G45-G47 VanDerWaalsContact C-N 3.28Å; G45-G47 PolarHBondContact O-N 2.87Å; G47-V50 WeakPolarHBondContact O-CB 3.41Å; G47-V50 PolarHBondContact O-N 2.92Å; G47-Y51 PolarHBondContact O-N 2.82Å
48	A	98.6	Very high	98.2	Very high	47 Å²	47	80.8 Å²	80.8	39%	0.388	44%	0.436	S	S	.	.	H	α-helix	trans	-53.6	-48.7	179.8	0	0	0	0	0	114	V44 G45 V50 Y51 L52	V44-A48 HydrophobicContact CG1-CB 4.21Å; G45-A48 WeakPolarHBondContact O-CB 3.46Å; G45-A48 PolarHBondContact O-N 3.42Å; A48-V50 VanDerWaalsContact C-N 3.26Å; A48-V50 PolarHBondContact O-N 2.88Å; A48-Y51 PolarHBondContact O-N 3.07Å; A48-L52 WeakPolarHBondContact O-CB 3.39Å; A48-L52 PolarHBondContact O-N 3.06Å
49	P	98.7	Very high	98.3	Very high	0 Å²	0	81.8 Å²	81.8	0%	0	43%	0.433	C	S	.	.	H	α-helix	trans	-70.7	-19.6	177.4	28.8	-37.4	0	0	0	114.1	V28 V31 H32 L35 G45 A46 A53	V28-P49 HydrophobicContact CG1-CB 4.3Å; V28-P49 HydrophobicContact CG1-CG 4.5Å; V31-P49 HydrophobicContact CB-CB 4.3Å; V31-P49 HydrophobicContact CG1-CB 4.06Å; H32-P49 HydrophobicContact CB-CB 3.6Å; H32-P49 HydrophobicContact CB-CG 3.72Å; L35-P49 HydrophobicContact CD1-CB 4.15Å; G45-P49 WeakPolarHBondContact O-CD 3.18Å; A46-P49 WeakPolarHBondContact O-CD 3.43Å; A46-P49 WeakPolarHBondContact O-CG 3.34Å; P49-A53 WeakPolarHBondContact O-CB 3.38Å; P49-A53 PolarHBondContact O-N 3.26Å
50	V	98.7	Very high	98.3	Very high	49 Å²	49	76.7 Å²	76.7	30%	0.297	41%	0.413	S	S	.	.	H	α-helix	trans	-73.5	-51.4	174	-179.7	0	0	0	0	108.7	A22 L24 V28 G47 A48 L52 A53 A54	A22-V50 HydrophobicContact CB-CG1 3.73Å; L24-V50 HydrophobicContact CD1-CG1 4.31Å; V28-V50 HydrophobicContact CG1-CG2 3.77Å; G47-V50 WeakPolarHBondContact O-CB 3.41Å; G47-V50 PolarHBondContact O-N 2.92Å; A48-V50 VanDerWaalsContact C-N 3.26Å; A48-V50 PolarHBondContact O-N 2.88Å; V50-L52 PolarHBondContact O-N 2.73Å; V50-A53 PolarHBondContact O-N 3.12Å; V50-A54 PolarHBondContact O-N 3.38Å
51	Y	98.8	Very high	98.4	Very high	173 Å²	173	71 Å²	71	68%	0.678	40%	0.402	S	S	*	.	H	α-helix	trans	-59.5	-49.9	179.3	-166.9	-84.4	0	0	0	111.5	G47 A48 A53 A54 V55	G47-Y51 PolarHBondContact O-N 2.82Å; A48-Y51 PolarHBondContact O-N 3.07Å; Y51-A53 VanDerWaalsContact C-N 3.33Å; Y51-A53 PolarHBondContact O-N 3.2Å; Y51-A54 WeakPolarHBondContact O-CB 3.4Å; Y51-A54 PolarHBondContact O-N 3.22Å; Y51-A54 VanDerWaalsContact O-N 3.16Å; Y51-V55 HydrophobicContact CD1-CG2 3.91Å; Y51-V55 HydrophobicContact CE1-CG2 3.62Å; Y51-V55 WeakPolarHBondContact O-CG2 3.49Å; Y51-V55 PolarHBondContact O-N 2.94Å
52	L	98.7	Very high	98.4	Very high	65 Å²	65	71.3 Å²	71.3	34%	0.34	39%	0.394	S	S	.	.	H	α-helix	trans	-63.4	-38.9	179.1	-178.9	59.3	0	0	0	112.2	V31 L35 A48 V50 A54 V55 L56	V31-L52 HydrophobicContact CG1-CB 4.12Å; V31-L52 HydrophobicContact CG1-CD2 3.82Å; V31-L52 HydrophobicContact CG1-CG 4.04Å; L35-L52 HydrophobicContact CD1-CD2 4.21Å; L35-L52 HydrophobicContact CD2-CD2 3.85Å; L35-L52 HydrophobicContact CG-CD2 4.24Å; A48-L52 WeakPolarHBondContact O-CB 3.39Å; A48-L52 PolarHBondContact O-N 3.06Å; V50-L52 PolarHBondContact O-N 2.73Å; L52-A54 VanDerWaalsContact C-N 3.32Å; L52-A54 PolarHBondContact O-N 3.02Å; L52-V55 PolarHBondContact O-N 3.5Å; L52-L56 HydrophobicContact CD1-CD1 4.29Å; L52-L56 HydrophobicContact CD1-CG 4.13Å; L52-L56 HydrophobicContact CG-CD1 4.07Å; L52-L56 HydrophobicContact CG-CG 4.37Å; L52-L56 WeakPolarHBondContact O-CB 3.47Å; L52-L56 VanDerWaalsContact O-CG 3.23Å; L52-L56 WeakPolarHBondContact O-CG 3.46Å; L52-L56 PolarHBondContact O-N 2.9Å
53	A	98.8	Very high	98.5	Very high	0 Å²	0	64.3 Å²	64.3	0%	0	36%	0.362	C	S	.	.	H	α-helix	trans	-62	-40.7	175.2	0	0	0	0	0	111.8	L24 F26 V28 V31 P49 V50 Y51 L56 E57	L24-A53 HydrophobicContact CD1-CB 3.9Å; F26-A53 HydrophobicContact CB-CB 4.19Å; V28-A53 HydrophobicContact CG2-CB 3.87Å; V31-A53 HydrophobicContact CG2-CB 4.09Å; P49-A53 WeakPolarHBondContact O-CB 3.38Å; P49-A53 PolarHBondContact O-N 3.26Å; V50-A53 PolarHBondContact O-N 3.12Å; Y51-A53 VanDerWaalsContact C-N 3.33Å; Y51-A53 PolarHBondContact O-N 3.2Å; A53-L56 PolarHBondContact O-N 3.15Å; A53-E57 WeakPolarHBondContact O-CB 3.22Å; A53-E57 PolarHBondContact O-N 3.23Å
54	A	98.8	Very high	98.5	Very high	39 Å²	39	58.6 Å²	58.6	32%	0.322	35%	0.346	S	S	.	.	H	α-helix	trans	-63.8	-44.3	176.8	0	0	0	0	0	112.2	L24 V50 Y51 L52 E57 Y58	L24-A54 HydrophobicContact CD1-CB 4.05Å; L24-A54 HydrophobicContact CD2-CB 3.78Å; V50-A54 PolarHBondContact O-N 3.38Å; Y51-A54 WeakPolarHBondContact O-CB 3.4Å; Y51-A54 PolarHBondContact O-N 3.22Å; Y51-A54 VanDerWaalsContact O-N 3.16Å; L52-A54 VanDerWaalsContact C-N 3.32Å; L52-A54 PolarHBondContact O-N 3.02Å; A54-E57 PolarHBondContact O-N 3.38Å; A54-Y58 WeakPolarHBondContact O-CB 3.34Å; A54-Y58 PolarHBondContact O-N 3.39Å
55	V	98.7	Very high	98.6	Very high	52 Å²	52	62.9 Å²	62.9	32%	0.315	37%	0.365	S	S	.	.	H	α-helix	trans	-63.7	-42.5	177.2	173.7	0	0	0	0	111.5	Y51 L52 E57 Y58 L59	Y51-V55 HydrophobicContact CD1-CG2 3.91Å; Y51-V55 HydrophobicContact CE1-CG2 3.62Å; Y51-V55 WeakPolarHBondContact O-CG2 3.49Å; Y51-V55 PolarHBondContact O-N 2.94Å; L52-V55 PolarHBondContact O-N 3.5Å; V55-E57 VanDerWaalsContact C-N 3.33Å; V55-E57 PolarHBondContact O-N 3.12Å; V55-Y58 PolarHBondContact O-N 3.24Å; V55-L59 HydrophobicContact CG1-CD1 4.11Å; V55-L59 WeakPolarHBondContact O-CG 3.31Å; V55-L59 PolarHBondContact O-N 3.16Å
56	L	98.8	Very high	98.6	Very high	68 Å²	68	62.8 Å²	62.8	36%	0.356	35%	0.353	S	S	.	.	H	α-helix	trans	-64.9	-38.1	176.6	-68.4	173.7	0	0	0	112	F26 L52 A53 T60	F26-L56 HydrophobicContact CD1-CB 3.73Å; F26-L56 HydrophobicContact CE1-CB 3.69Å; L52-L56 HydrophobicContact CD1-CD1 4.29Å; L52-L56 HydrophobicContact CD1-CG 4.13Å; L52-L56 HydrophobicContact CG-CD1 4.07Å; L52-L56 HydrophobicContact CG-CG 4.37Å; L52-L56 WeakPolarHBondContact O-CB 3.47Å; L52-L56 VanDerWaalsContact O-CG 3.23Å; L52-L56 WeakPolarHBondContact O-CG 3.46Å; L52-L56 PolarHBondContact O-N 2.9Å; A53-L56 PolarHBondContact O-N 3.15Å; L56-T60 WeakPolarHBondContact O-CB 3.34Å; L56-T60 PolarHBondContact O-N 2.76Å; L56-T60 PolarHBondContact O-OG1 3.42Å
57	E	98.8	Very high	98.7	Very high	42 Å²	42	59 Å²	59	20%	0.196	32%	0.322	C	S	.	.	H	α-helix	trans	-64.3	-46.1	174.7	-173.2	165.3	157.4	0	0	111.4	L24 Q25 F26 A53 A54 V55 T60 A61	L24-E57 WeakPolarHBondContact CA-OE2 3.12Å; L24-E57 WeakPolarHBondContact CB-OE2 3.31Å; Q25-E57 PolarHBondContact N-OE1 2.92Å; Q25-E57 VanDerWaalsContact N-OE1 3.12Å; Q25-E57 PolarHBondContact N-OE2 2.96Å; F26-E57 HydrophobicContact CB-CB 4.12Å; F26-E57 HydrophobicContact CD1-CB 4.49Å; F26-E57 HydrophobicContact CD2-CB 3.57Å; F26-E57 HydrophobicContact CD2-CG 3.71Å; F26-E57 HydrophobicContact CE2-CB 4.11Å; F26-E57 HydrophobicContact CE2-CG 4.23Å; F26-E57 HydrophobicContact CG-CB 3.8Å; F26-E57 HydrophobicContact CG-CG 4.38Å; F26-E57 PolarHBondContact N-OE2 3.03Å; A53-E57 WeakPolarHBondContact O-CB 3.22Å; A53-E57 PolarHBondContact O-N 3.23Å; A54-E57 PolarHBondContact O-N 3.38Å; V55-E57 VanDerWaalsContact C-N 3.33Å; V55-E57 PolarHBondContact O-N 3.12Å; E57-T60 PolarHBondContact O-N 3.15Å; E57-A61 WeakPolarHBondContact O-CB 3.23Å; E57-A61 PolarHBondContact O-N 3.04Å
58	Y	98.6	Very high	98.7	Very high	139 Å²	139	58 Å²	58	55%	0.545	31%	0.312	S	S	.	.	H	α-helix	trans	-57.3	-53.9	175.8	168.4	-110.4	0	0	0	112.2	A54 V55 T60 A61 E62	A54-Y58 WeakPolarHBondContact O-CB 3.34Å; A54-Y58 PolarHBondContact O-N 3.39Å; V55-Y58 PolarHBondContact O-N 3.24Å; Y58-T60 VanDerWaalsContact C-N 3.26Å; Y58-T60 PolarHBondContact O-N 3.04Å; Y58-A61 WeakPolarHBondContact O-CB 3.33Å; Y58-A61 PolarHBondContact O-N 3.16Å; Y58-A61 VanDerWaalsContact O-N 3.12Å; Y58-E62 PolarHBondContact O-N 3.01Å
59	L	98.6	Very high	98.7	Very high	55 Å²	55	57.5 Å²	57.5	29%	0.288	30%	0.303	S	S	.	.	H	α-helix	trans	-62.2	-34.8	179.8	-69.2	173.3	0	0	0	112.4	V55 I63 L97	V55-L59 HydrophobicContact CG1-CD1 4.11Å; V55-L59 WeakPolarHBondContact O-CG 3.31Å; V55-L59 PolarHBondContact O-N 3.16Å; L59-I63 WeakPolarHBondContact O-CG1 3.44Å; L59-I63 PolarHBondContact O-N 3Å; L59-I63 VanDerWaalsContact O-N 3.15Å; L59-L97 HydrophobicContact CD2-CD2 4.27Å
60	T	98.8	Very high	98.7	Very high	55 Å²	55	58 Å²	58	34%	0.337	31%	0.307	S	S	.	.	H	α-helix	trans	-67.5	-43	175.6	-58.3	0	0	0	0	111.1	F26 L56 E57 Y58 L64	F26-T60 HydrophobicContact CE2-CG2 4.36Å; F26-T60 HydrophobicContact CZ-CG2 4.1Å; F26-T60 VanDerWaalsContact CZ-OG1 3.26Å; F26-T60 WeakPolarHBondContact CZ-OG1 3.4Å; L56-T60 WeakPolarHBondContact O-CB 3.34Å; L56-T60 PolarHBondContact O-N 2.76Å; L56-T60 PolarHBondContact O-OG1 3.42Å; E57-T60 PolarHBondContact O-N 3.15Å; Y58-T60 VanDerWaalsContact C-N 3.26Å; Y58-T60 PolarHBondContact O-N 3.04Å; T60-L64 HydrophobicContact CG2-CD1 3.89Å; T60-L64 HydrophobicContact CG2-CG 4.37Å; T60-L64 WeakPolarHBondContact O-CB 3.44Å; T60-L64 VanDerWaalsContact O-CG 3.22Å; T60-L64 WeakPolarHBondContact O-CG 3.13Å; T60-L64 PolarHBondContact O-N 2.82Å
61	A	98.7	Very high	98.7	Very high	58 Å²	58	55.9 Å²	55.9	48%	0.479	29%	0.294	S	S	.	.	H	α-helix	trans	-61.6	-45.2	176.7	0	0	0	0	0	111.3	E57 Y58 I63 L64 E65	E57-A61 WeakPolarHBondContact O-CB 3.23Å; E57-A61 PolarHBondContact O-N 3.04Å; Y58-A61 WeakPolarHBondContact O-CB 3.33Å; Y58-A61 PolarHBondContact O-N 3.16Å; Y58-A61 VanDerWaalsContact O-N 3.12Å; A61-I63 PolarHBondContact O-N 3.09Å; A61-L64 PolarHBondContact O-N 2.82Å; A61-E65 WeakPolarHBondContact O-CB 3.38Å; A61-E65 PolarHBondContact O-N 2.9Å
62	E	98.4	Very high	98.7	Very high	68 Å²	68	55.3 Å²	55.3	32%	0.318	29%	0.291	S	S	.	.	H	α-helix	trans	-59.4	-49.7	179.2	-166.9	60	-143.1	0	0	112	Y58 L64 E65 L66	Y58-E62 PolarHBondContact O-N 3.01Å; E62-L64 VanDerWaalsContact C-N 3.31Å; E62-L64 PolarHBondContact O-N 3.12Å; E62-E65 PolarHBondContact O-N 3.38Å; E62-L66 WeakPolarHBondContact O-CG 3.43Å; E62-L66 PolarHBondContact O-N 3.31Å; E62-L66 VanDerWaalsContact O-N 3.13Å
63	I	98.6	Very high	98.7	Very high	36 Å²	36	57.7 Å²	57.7	19%	0.185	30%	0.304	C	S	.	.	H	α-helix	trans	-62.4	-40.3	177.9	-67.5	168.1	0	0	0	111	L59 A61 A67 L84 I88 L94 L98	L59-I63 WeakPolarHBondContact O-CG1 3.44Å; L59-I63 PolarHBondContact O-N 3Å; L59-I63 VanDerWaalsContact O-N 3.15Å; A61-I63 PolarHBondContact O-N 3.09Å; I63-A67 WeakPolarHBondContact O-CB 3.42Å; I63-A67 PolarHBondContact O-N 3.29Å; I63-L84 HydrophobicContact CG2-CD2 3.76Å; I63-I88 HydrophobicContact CG2-CD1 4.35Å; I63-L94 HydrophobicContact CD1-CD2 4.23Å; I63-L94 HydrophobicContact CG1-CD1 3.89Å; I63-L94 HydrophobicContact CG1-CD2 3.79Å; I63-L98 HydrophobicContact CD1-CD1 4.4Å
64	L	98.8	Very high	98.6	Very high	89 Å²	89	61.3 Å²	61.3	47%	0.466	32%	0.323	S	S	.	.	H	α-helix	trans	-70.7	-35.6	-179.9	-73.8	177.4	0	0	0	112.8	T60 A61 E62 G68 I79	T60-L64 HydrophobicContact CG2-CD1 3.89Å; T60-L64 HydrophobicContact CG2-CG 4.37Å; T60-L64 WeakPolarHBondContact O-CB 3.44Å; T60-L64 VanDerWaalsContact O-CG 3.22Å; T60-L64 WeakPolarHBondContact O-CG 3.13Å; T60-L64 PolarHBondContact O-N 2.82Å; A61-L64 PolarHBondContact O-N 2.82Å; E62-L64 VanDerWaalsContact C-N 3.31Å; E62-L64 PolarHBondContact O-N 3.12Å; L64-G68 PolarHBondContact O-N 3.13Å; L64-I79 HydrophobicContact CD2-CD1 4.07Å
65	E	98.6	Very high	98.6	Very high	111 Å²	111	69 Å²	69	52%	0.519	35%	0.35	S	S	.	.	H	α-helix	trans	-62	-54.1	175.6	177.5	54.7	-144.9	0	0	110.1	A61 E62 A67 G68 N69	A61-E65 WeakPolarHBondContact O-CB 3.38Å; A61-E65 PolarHBondContact O-N 2.9Å; E62-E65 PolarHBondContact O-N 3.38Å; E65-A67 PolarHBondContact O-N 3.06Å; E65-G68 PolarHBondContact O-N 2.95Å; E65-N69 PolarHBondContact O-N 3.19Å; E65-N69 PolarHBondContact O-ND2 3.36Å; E65-N69 PolarHBondContact OE1-ND2 2.93Å
66	L	98.7	Very high	98.6	Very high	44 Å²	44	71.8 Å²	71.8	23%	0.23	36%	0.357	C	S	.	.	H	α-helix	trans	-64.3	-39.2	179	-63.1	178.4	0	0	0	112.3	E62 G68 N69 A70 A87 D91 L94	E62-L66 WeakPolarHBondContact O-CG 3.43Å; E62-L66 PolarHBondContact O-N 3.31Å; E62-L66 VanDerWaalsContact O-N 3.13Å; L66-G68 VanDerWaalsContact C-N 3.33Å; L66-N69 PolarHBondContact O-N 2.81Å; L66-A70 PolarHBondContact O-N 2.93Å; L66-A87 HydrophobicContact CB-CB 3.64Å; L66-D91 HydrophobicContact CD1-CB 3.96Å; L66-L94 HydrophobicContact CD1-CD1 3.68Å
67	A	98.8	Very high	98.5	Very high	0 Å²	0	76 Å²	76	0%	0	39%	0.386	C	S	.	.	H	α-helix	trans	-69.6	-31.6	176	0	0	0	0	0	112.6	I63 E65 A71 I79 L84 A87	I63-A67 WeakPolarHBondContact O-CB 3.42Å; I63-A67 PolarHBondContact O-N 3.29Å; E65-A67 PolarHBondContact O-N 3.06Å; A67-A71 WeakPolarHBondContact O-CB 3.45Å; A67-A71 PolarHBondContact O-N 2.98Å; A67-I79 HydrophobicContact CB-CD1 4.17Å; A67-I79 HydrophobicContact CB-CG2 4.03Å; A67-L84 HydrophobicContact CB-CD2 3.79Å; A67-L84 HydrophobicContact CB-CG 4.49Å; A67-A87 HydrophobicContact CB-CB 4.11Å
68	G	98.8	Very high	98.5	Very high	28 Å²	28	83 Å²	83	29%	0.289	41%	0.411	S	S	.	.	H	α-helix	trans	-64.2	-45.6	170.6	0	0	0	0	0	111.4	L64 E65 L66 A71 R72	L64-G68 PolarHBondContact O-N 3.13Å; E65-G68 PolarHBondContact O-N 2.95Å; L66-G68 VanDerWaalsContact C-N 3.33Å; G68-A71 WeakPolarHBondContact O-CB 3.37Å; G68-A71 PolarHBondContact O-N 2.75Å; G68-R72 PolarHBondContact O-N 3.29Å
69	N	98.7	Very high	98.6	Very high	37 Å²	37	79.5 Å²	79.5	20%	0.198	40%	0.401	C	S	.	.	H	α-helix	trans	-59.3	-48.7	173.4	-70.9	-38.5	0	0	0	111.1	E65 L66 A71 R72 D73	E65-N69 PolarHBondContact O-N 3.19Å; E65-N69 PolarHBondContact O-ND2 3.36Å; E65-N69 PolarHBondContact OE1-ND2 2.93Å; L66-N69 PolarHBondContact O-N 2.81Å; N69-A71 VanDerWaalsContact C-N 3.3Å; N69-A71 PolarHBondContact O-N 3.3Å; N69-R72 WeakPolarHBondContact O-CB 3.22Å; N69-R72 PolarHBondContact O-N 3Å; N69-R72 VanDerWaalsContact O-N 3.13Å; N69-R72 VanDerWaalsContact OD1-CZ 3.3Å; N69-R72 PolarHBondContact OD1-NH1 2.68Å; N69-R72 PolarHBondContact OD1-NH2 3Å; N69-D73 PolarHBondContact O-N 2.95Å
70	A	98.6	Very high	98.6	Very high	11 Å²	11	80.1 Å²	80.1	9%	0.091	40%	0.404	C	S	.	.	H	α-helix	trans	-60.5	-36.9	175.7	0	0	0	0	0	113	L66 N74 H83 L86	L66-A70 PolarHBondContact O-N 2.93Å; A70-N74 WeakPolarHBondContact O-CB 3.27Å; A70-N74 PolarHBondContact O-N 2.71Å; A70-N74 VanDerWaalsContact O-N 3.16Å; A70-N74 PolarHBondContact O-ND2 3.14Å; A70-H83 HydrophobicContact CB-CB 4.19Å; A70-L86 HydrophobicContact CB-CB 4.21Å
71	A	98.8	Very high	98.6	Very high	3 Å²	3	80.1 Å²	80.1	3%	0.025	40%	0.404	C	S	.	.	H	α-helix	trans	-63.8	-46.3	174.5	0	0	0	0	0	111.6	A67 G68 N69 D73 N74 K75 K76 I79 H83	A67-A71 WeakPolarHBondContact O-CB 3.45Å; A67-A71 PolarHBondContact O-N 2.98Å; G68-A71 WeakPolarHBondContact O-CB 3.37Å; G68-A71 PolarHBondContact O-N 2.75Å; N69-A71 VanDerWaalsContact C-N 3.3Å; N69-A71 PolarHBondContact O-N 3.3Å; A71-D73 PolarHBondContact O-N 3.37Å; A71-N74 CarbonylContact O-C 3.53Å; A71-N74 PolarHBondContact O-N 2.85Å; A71-K75 PolarHBondContact O-N 2.9Å; A71-K76 CarbonylContact C-O 3.22Å; A71-K76 VanDerWaalsContact C-O 3.22Å; A71-K76 PolarHBondContact O-N 3.18Å; A71-I79 HydrophobicContact CB-CG1 4.36Å; A71-H83 VanDerWaalsContact CB-ND1 3.27Å; A71-H83 WeakPolarHBondContact CB-ND1 3.34Å
72	R	98.6	Very high	98.6	Very high	161 Å²	161	80.3 Å²	80.3	61%	0.608	39%	0.393	S	S	*	.	H	α-helix	trans	-59.7	-45.4	177.5	-176	-178.3	64.8	-153.2	-7.9	111.5	G68 N69 N74 K75	G68-R72 PolarHBondContact O-N 3.29Å; N69-R72 WeakPolarHBondContact O-CB 3.22Å; N69-R72 PolarHBondContact O-N 3Å; N69-R72 VanDerWaalsContact O-N 3.13Å; N69-R72 VanDerWaalsContact OD1-CZ 3.3Å; N69-R72 PolarHBondContact OD1-NH1 2.68Å; N69-R72 PolarHBondContact OD1-NH2 3Å; R72-N74 PolarHBondContact O-N 3.36Å; R72-K75 WeakPolarHBondContact O-CA 3.33Å; R72-K75 PolarHBondContact O-N 2.97Å
73	D	98	Very high	98.6	Very high	115 Å²	115	77.2 Å²	77.2	62%	0.615	38%	0.378	S	S	*	.	H	α-helix	trans	-63.8	-30.7	178.9	-62.8	-13.5	0	0	0	111.9	N69 A71 K75	N69-D73 PolarHBondContact O-N 2.95Å; A71-D73 PolarHBondContact O-N 3.37Å; D73-K75 PolarHBondContact O-N 2.78Å
74	N	97.8	Very high	98.6	Very high	76 Å²	76	77.8 Å²	77.8	41%	0.406	38%	0.382	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.9	14	173.1	-75.3	-88.8	0	0	0	113.5	A70 A71 R72 K76	A70-N74 WeakPolarHBondContact O-CB 3.27Å; A70-N74 PolarHBondContact O-N 2.71Å; A70-N74 VanDerWaalsContact O-N 3.16Å; A70-N74 PolarHBondContact O-ND2 3.14Å; A71-N74 CarbonylContact O-C 3.53Å; A71-N74 PolarHBondContact O-N 2.85Å; R72-N74 PolarHBondContact O-N 3.36Å; N74-K76 VanDerWaalsContact C-N 3.26Å; N74-K76 WeakPolarHBondContact O-CG 3.35Å; N74-K76 PolarHBondContact O-N 3.35Å
75	K	98.4	Very high	98.6	Very high	202 Å²	202	74.5 Å²	74.5	88%	0.878	36%	0.364	S	S	*	.	T	Hydrogen-bonded Turn	trans	55.6	38.7	179.6	-53.5	-179.2	-178.7	-177	0	112.8	A71 R72 D73	A71-K75 PolarHBondContact O-N 2.9Å; R72-K75 WeakPolarHBondContact O-CA 3.33Å; R72-K75 PolarHBondContact O-N 2.97Å; D73-K75 PolarHBondContact O-N 2.78Å
76	K	98.4	Very high	98.6	Very high	110 Å²	110	70.2 Å²	70.2	48%	0.478	34%	0.344	S	S	.	.			trans	-125	146.6	179.5	-68.4	175.5	-166.1	-58.4	0	110.5	A71 N74	A71-K76 CarbonylContact C-O 3.22Å; A71-K76 VanDerWaalsContact C-O 3.22Å; A71-K76 PolarHBondContact O-N 3.18Å; N74-K76 VanDerWaalsContact C-N 3.26Å; N74-K76 WeakPolarHBondContact O-CG 3.35Å; N74-K76 PolarHBondContact O-N 3.35Å
77	T	98.2	Very high	98.6	Very high	156 Å²	156	68.5 Å²	68.5	96%	0.957	34%	0.337	S	S	*	.	S	Bend	trans	-97.7	-8.5	176.9	55.9	0	0	0	0	113.2
78	R	98.8	Very high	98.6	Very high	190 Å²	190	68.9 Å²	68.9	72%	0.717	34%	0.338	S	S	*	.	S	Bend	trans	-113.7	128.6	-178.7	-175.2	179.8	-64.5	136.8	1.3	110.7	H83	R78-H83 PolarHBondContact O-CE1 3.17Å; R78-H83 PolarHBondContact O-ND1 3.15Å
79	I	98.8	Very high	98.5	Very high	65 Å²	65	69.5 Å²	69.5	33%	0.333	33%	0.332	S	S	.	.			trans	-68.5	129	170	-61.6	174.4	0	0	0	109.2	L64 A67 A71 H83 L84	L64-I79 HydrophobicContact CD2-CD1 4.07Å; A67-I79 HydrophobicContact CB-CD1 4.17Å; A67-I79 HydrophobicContact CB-CG2 4.03Å; A71-I79 HydrophobicContact CB-CG1 4.36Å; I79-H83 HydrophobicContact CG2-CB 4.33Å; I79-L84 HydrophobicContact CG2-CD2 4.24Å; I79-L84 HydrophobicContact CG2-CG 4.13Å
80	I	98.7	Very high	98.5	Very high	68 Å²	68	73.3 Å²	73.3	35%	0.349	35%	0.353	S	S	.	.			trans	-125	167.4	173.5	65	169.5	0	0	0	109	R82 H83 L84	I80-R82 HydrophobicContact CD1-CB 3.98Å; I80-R82 HydrophobicContact CG1-CB 4.05Å; I80-R82 PolarHBondContact O-N 3Å; I80-R82 VanDerWaalsContact O-N 3.07Å; I80-H83 PolarHBondContact N-ND1 3.05Å; I80-H83 WeakPolarHBondContact O-CB 3.26Å; I80-H83 PolarHBondContact O-N 3.28Å; I80-L84 PolarHBondContact O-N 3.29Å
81	P	98.8	Very high	98.5	Very high	54 Å²	54	74.9 Å²	74.9	35%	0.351	36%	0.359	S	S	.	.	H	α-helix	trans	-54.9	-31.4	-178.1	-28.4	36.4	0	0	0	114.8	H83 L84 Q85 I103 A104 Q105	P81-H83 VanDerWaalsContact C-N 3.34Å; P81-H83 PolarHBondContact O-N 2.99Å; P81-L84 PolarHBondContact O-N 3.39Å; P81-Q85 PolarHBondContact O-N 3.5Å; P81-I103 HydrophobicContact CB-CG2 4.33Å; P81-A104 WeakPolarHBondContact CB-O 3.04Å; P81-Q105 HydrophobicContact CB-CB 4Å; P81-Q105 HydrophobicContact CG-CB 4.2Å
82	R	98.7	Very high	98.5	Very high	63 Å²	63	82.8 Å²	82.8	24%	0.238	40%	0.396	C	S	.	.	H	α-helix	trans	-57.8	-42.4	171.7	179	55.6	177.5	175.2	-2.6	113	I80 Q85 L86 G106 V108	I80-R82 HydrophobicContact CD1-CB 3.98Å; I80-R82 HydrophobicContact CG1-CB 4.05Å; I80-R82 PolarHBondContact O-N 3Å; I80-R82 VanDerWaalsContact O-N 3.07Å; R82-Q85 PolarHBondContact O-N 2.85Å; R82-L86 HydrophobicContact CG-CD1 4.24Å; R82-L86 HydrophobicContact CG-CG 4.45Å; R82-L86 WeakPolarHBondContact O-CG 3.46Å; R82-L86 PolarHBondContact O-N 3.46Å; R82-G106 WeakPolarHBondContact CD-O 3.4Å; R82-G106 PolarHBondContact NH1-O 3.16Å; R82-V108 VanDerWaalsContact CZ-O 3.22Å; R82-V108 PolarHBondContact NH1-O 3.5Å; R82-V108 PolarHBondContact NH2-O 3.25Å
83	H	98.8	Very high	98.5	Very high	2 Å²	2	82.2 Å²	82.2	1%	0.009	40%	0.4	C	S	.	.	H	α-helix	trans	-69.1	-37	-179.2	-54	152.8	0	0	0	111.4	A70 A71 R78 I79 I80 P81 L86 A87	A70-H83 HydrophobicContact CB-CB 4.19Å; A71-H83 VanDerWaalsContact CB-ND1 3.27Å; A71-H83 WeakPolarHBondContact CB-ND1 3.34Å; R78-H83 PolarHBondContact O-CE1 3.17Å; R78-H83 PolarHBondContact O-ND1 3.15Å; I79-H83 HydrophobicContact CG2-CB 4.33Å; I80-H83 PolarHBondContact N-ND1 3.05Å; I80-H83 WeakPolarHBondContact O-CB 3.26Å; I80-H83 PolarHBondContact O-N 3.28Å; P81-H83 VanDerWaalsContact C-N 3.34Å; P81-H83 PolarHBondContact O-N 2.99Å; H83-L86 PolarHBondContact O-N 3.39Å; H83-A87 VanDerWaalsContact O-CB 3.29Å; H83-A87 WeakPolarHBondContact O-CB 3.32Å; H83-A87 PolarHBondContact O-N 3.36Å
84	L	98.8	Very high	98.5	Very high	49 Å²	49	77.1 Å²	77.1	26%	0.257	37%	0.372	S	S	.	.	H	α-helix	trans	-61.5	-45.7	172.3	-65.9	170.1	0	0	0	111.2	I63 A67 I79 I80 P81 A87 I88 I103	I63-L84 HydrophobicContact CG2-CD2 3.76Å; A67-L84 HydrophobicContact CB-CD2 3.79Å; A67-L84 HydrophobicContact CB-CG 4.49Å; I79-L84 HydrophobicContact CG2-CD2 4.24Å; I79-L84 HydrophobicContact CG2-CG 4.13Å; I80-L84 PolarHBondContact O-N 3.29Å; P81-L84 PolarHBondContact O-N 3.39Å; L84-A87 PolarHBondContact O-N 3.05Å; L84-I88 WeakPolarHBondContact O-CB 3.42Å; L84-I88 WeakPolarHBondContact O-CD1 3.48Å; L84-I88 VanDerWaalsContact O-CG1 3.31Å; L84-I88 WeakPolarHBondContact O-CG1 3.45Å; L84-I88 PolarHBondContact O-N 3.45Å; L84-I103 HydrophobicContact CB-CD1 4.42Å
85	Q	98.6	Very high	98.5	Very high	20 Å²	20	76.6 Å²	76.6	9%	0.093	37%	0.37	C	S	.	.	H	α-helix	trans	-61.6	-45.8	176.5	-177.7	77.9	8.1	0	0	112	P81 R82 R89 I103 G106 G107	P81-Q85 PolarHBondContact O-N 3.5Å; R82-Q85 PolarHBondContact O-N 2.85Å; Q85-R89 HydrophobicContact CG-CG 4.16Å; Q85-R89 WeakPolarHBondContact O-CB 3.42Å; Q85-R89 VanDerWaalsContact O-CG 3.23Å; Q85-R89 WeakPolarHBondContact O-CG 3.32Å; Q85-R89 PolarHBondContact O-N 2.98Å; Q85-I103 HydrophobicContact CB-CD1 4.43Å; Q85-G106 WeakPolarHBondContact CB-O 3.16Å; Q85-G106 WeakPolarHBondContact CG-O 3.44Å; Q85-G107 WeakPolarHBondContact CG-O 3.39Å; Q85-G107 PolarHBondContact NE2-O 2.92Å
86	L	98.6	Very high	98.5	Very high	21 Å²	21	75.6 Å²	75.6	11%	0.11	37%	0.365	C	S	.	.	H	α-helix	trans	-61.9	-45	178.3	-71.6	178.6	0	0	0	111.4	A70 R82 H83 N90 L109	A70-L86 HydrophobicContact CB-CB 4.21Å; R82-L86 HydrophobicContact CG-CD1 4.24Å; R82-L86 HydrophobicContact CG-CG 4.45Å; R82-L86 WeakPolarHBondContact O-CG 3.46Å; R82-L86 PolarHBondContact O-N 3.46Å; H83-L86 PolarHBondContact O-N 3.39Å; L86-N90 VanDerWaalsContact O-CB 3.31Å; L86-N90 WeakPolarHBondContact O-CB 3.15Å; L86-N90 PolarHBondContact O-N 2.96Å; L86-N90 VanDerWaalsContact O-N 3.15Å; L86-N90 PolarHBondContact O-ND2 3.36Å; L86-L109 HydrophobicContact CD2-CD2 3.76Å
87	A	98.6	Very high	98.5	Very high	8 Å²	8	75.4 Å²	75.4	7%	0.066	37%	0.369	C	S	.	.	H	α-helix	trans	-59.7	-53.8	177	0	0	0	0	0	111.7	L66 A67 H83 L84 R89 D91	L66-A87 HydrophobicContact CB-CB 3.64Å; A67-A87 HydrophobicContact CB-CB 4.11Å; H83-A87 VanDerWaalsContact O-CB 3.29Å; H83-A87 WeakPolarHBondContact O-CB 3.32Å; H83-A87 PolarHBondContact O-N 3.36Å; L84-A87 PolarHBondContact O-N 3.05Å; A87-R89 PolarHBondContact O-N 3.45Å; A87-D91 PolarHBondContact O-N 3.2Å
88	I	98.6	Very high	98.5	Very high	7 Å²	7	69.7 Å²	69.7	4%	0.036	33%	0.333	C	S	.	.	H	α-helix	trans	-66.2	-37.9	-175	-71.6	162.4	0	0	0	112.2	I63 L84 L94 N95 L98 I103	I63-I88 HydrophobicContact CG2-CD1 4.35Å; L84-I88 WeakPolarHBondContact O-CB 3.42Å; L84-I88 WeakPolarHBondContact O-CD1 3.48Å; L84-I88 VanDerWaalsContact O-CG1 3.31Å; L84-I88 WeakPolarHBondContact O-CG1 3.45Å; L84-I88 PolarHBondContact O-N 3.45Å; I88-L94 HydrophobicContact CG1-CD1 4.47Å; I88-L94 HydrophobicContact CG2-CB 4.38Å; I88-N95 WeakPolarHBondContact O-CA 3.47Å; I88-N95 WeakPolarHBondContact O-CB 3.38Å; I88-N95 PolarHBondContact O-N 3.39Å; I88-N95 VanDerWaalsContact O-N 3.13Å; I88-L98 HydrophobicContact CD1-CD1 3.55Å; I88-L98 HydrophobicContact CG1-CD1 3.88Å; I88-L98 HydrophobicContact CG2-CB 3.96Å; I88-L98 HydrophobicContact CG2-CD1 3.79Å; I88-L98 HydrophobicContact CG2-CG 4.43Å; I88-I103 HydrophobicContact CD1-CD1 3.47Å; I88-I103 VanDerWaalsContact CD1-CD1 3.47Å
89	R	98.5	Very high	98.5	Very high	41 Å²	41	63.3 Å²	63.3	16%	0.155	33%	0.326	C	S	.	.	H	α-helix	trans	-83.5	-23.2	-175.9	-59.6	-56.6	170.2	-153.9	-4.7	113.9	Q85 A87 N95 L98 V101 L109	Q85-R89 HydrophobicContact CG-CG 4.16Å; Q85-R89 WeakPolarHBondContact O-CB 3.42Å; Q85-R89 VanDerWaalsContact O-CG 3.23Å; Q85-R89 WeakPolarHBondContact O-CG 3.32Å; Q85-R89 PolarHBondContact O-N 2.98Å; A87-R89 PolarHBondContact O-N 3.45Å; R89-N95 WeakPolarHBondContact CD-OD1 3.38Å; R89-N95 PolarHBondContact NH1-OD1 2.91Å; R89-L98 PolarHBondContact NH1-O 3.43Å; R89-L98 PolarHBondContact NH2-O 3.41Å; R89-L98 VanDerWaalsContact NH2-O 3.15Å; R89-V101 PolarHBondContact NH2-O 3.34Å; R89-L109 HydrophobicContact CB-CD1 3.64Å; R89-L109 HydrophobicContact CB-CD2 3.89Å; R89-L109 HydrophobicContact CB-CG 3.6Å
90	N	98	Very high	98.4	Very high	118 Å²	118	64.3 Å²	64.3	63%	0.631	35%	0.352	S	S	*	.	H	α-helix	trans	-85	-17.6	174.5	-73.5	-55.6	0	0	0	113	L86 L109	L86-N90 VanDerWaalsContact O-CB 3.31Å; L86-N90 WeakPolarHBondContact O-CB 3.15Å; L86-N90 PolarHBondContact O-N 2.96Å; L86-N90 VanDerWaalsContact O-N 3.15Å; L86-N90 PolarHBondContact O-ND2 3.36Å; N90-L109 WeakPolarHBondContact ND2-CD2 3.23Å
91	D	98.4	Very high	98.4	Very high	44 Å²	44	64.4 Å²	64.4	24%	0.235	36%	0.355	C	S	.	.	S	Bend	trans	-92.5	130.1	174.7	179.5	70.8	0	0	0	111.5	L66 A87 E93 L94 N95	L66-D91 HydrophobicContact CD1-CB 3.96Å; A87-D91 PolarHBondContact O-N 3.2Å; D91-E93 PolarHBondContact OD2-N 3.49Å; D91-L94 HydrophobicContact CB-CB 4.13Å; D91-L94 HydrophobicContact CB-CD1 4.18Å; D91-L94 HydrophobicContact CB-CG 4.36Å; D91-L94 VanDerWaalsContact OD2-CB 3.27Å; D91-L94 WeakPolarHBondContact OD2-CB 3.19Å; D91-L94 WeakPolarHBondContact OD2-CG 3.47Å; D91-L94 PolarHBondContact OD2-N 3.05Å; D91-N95 WeakPolarHBondContact O-CB 3.4Å; D91-N95 PolarHBondContact O-N 2.99Å
92	E	98.2	Very high	98.4	Very high	169 Å²	169	68.3 Å²	68.3	79%	0.79	38%	0.378	S	S	*	.	H	α-helix	trans	-66.2	-44.6	-174.4	-173.8	-179.5	166.7	0	0	112	K96	E92-K96 WeakPolarHBondContact O-CB 3.44Å; E92-K96 PolarHBondContact O-N 3.1Å
93	E	98.3	Very high	98.4	Very high	149 Å²	149	66.9 Å²	66.9	70%	0.696	38%	0.375	S	S	*	.	H	α-helix	trans	-71.6	-45.6	-174.2	-60	-167.5	133.7	0	0	111.2	D91 K96 L97	D91-E93 PolarHBondContact OD2-N 3.49Å; E93-K96 PolarHBondContact O-N 2.87Å; E93-L97 WeakPolarHBondContact O-CB 3.47Å; E93-L97 PolarHBondContact O-N 3.3Å
94	L	98.5	Very high	98.4	Very high	7 Å²	7	70.5 Å²	70.5	4%	0.037	41%	0.406	C	S	.	.	H	α-helix	trans	-67.5	-38.5	176	-67.5	178.4	0	0	0	111.7	I63 L66 I88 D91 K96 L97 L98	I63-L94 HydrophobicContact CD1-CD2 4.23Å; I63-L94 HydrophobicContact CG1-CD1 3.89Å; I63-L94 HydrophobicContact CG1-CD2 3.79Å; L66-L94 HydrophobicContact CD1-CD1 3.68Å; I88-L94 HydrophobicContact CG1-CD1 4.47Å; I88-L94 HydrophobicContact CG2-CB 4.38Å; D91-L94 HydrophobicContact CB-CB 4.13Å; D91-L94 HydrophobicContact CB-CD1 4.18Å; D91-L94 HydrophobicContact CB-CG 4.36Å; D91-L94 VanDerWaalsContact OD2-CB 3.27Å; D91-L94 WeakPolarHBondContact OD2-CB 3.19Å; D91-L94 WeakPolarHBondContact OD2-CG 3.47Å; D91-L94 PolarHBondContact OD2-N 3.05Å; L94-K96 VanDerWaalsContact C-N 3.29Å; L94-K96 PolarHBondContact O-N 2.99Å; L94-L97 HydrophobicContact CD2-CD2 4.48Å; L94-L97 PolarHBondContact O-N 3.02Å; L94-L98 VanDerWaalsContact O-CB 3.32Å; L94-L98 WeakPolarHBondContact O-CB 3.42Å; L94-L98 PolarHBondContact O-N 3.09Å
95	N	98.3	Very high	98.4	Very high	65 Å²	65	76.4 Å²	76.4	35%	0.348	43%	0.432	S	S	.	.	H	α-helix	trans	-63.8	-39.2	176.4	-174	45.3	0	0	0	111.1	I88 R89 D91 L98 G99	I88-N95 WeakPolarHBondContact O-CA 3.47Å; I88-N95 WeakPolarHBondContact O-CB 3.38Å; I88-N95 PolarHBondContact O-N 3.39Å; I88-N95 VanDerWaalsContact O-N 3.13Å; R89-N95 WeakPolarHBondContact CD-OD1 3.38Å; R89-N95 PolarHBondContact NH1-OD1 2.91Å; D91-N95 WeakPolarHBondContact O-CB 3.4Å; D91-N95 PolarHBondContact O-N 2.99Å; N95-L98 CarbonylContact O-C 3.43Å; N95-G99 WeakPolarHBondContact O-CA 3.38Å; N95-G99 PolarHBondContact O-N 2.78Å
96	K	98.4	Very high	98.3	Very high	181 Å²	181	75.6 Å²	75.6	79%	0.787	43%	0.429	S	S	*	.	H	α-helix	trans	-67	-47.9	174.1	-174.5	176.4	-177.6	176.6	0	111.7	E92 E93 L94 L98 G99	E92-K96 WeakPolarHBondContact O-CB 3.44Å; E92-K96 PolarHBondContact O-N 3.1Å; E93-K96 PolarHBondContact O-N 2.87Å; L94-K96 VanDerWaalsContact C-N 3.29Å; L94-K96 PolarHBondContact O-N 2.99Å; K96-L98 VanDerWaalsContact C-N 3.28Å; K96-L98 PolarHBondContact O-N 2.99Å; K96-G99 PolarHBondContact O-N 3.02Å
97	L	98.3	Very high	98.3	Very high	107 Å²	107	77.1 Å²	77.1	56%	0.56	45%	0.449	S	S	*	.	H	α-helix	trans	-60	-38.3	178.9	-179.5	62.6	0	0	0	112.1	L59 E93 L94	L59-L97 HydrophobicContact CD2-CD2 4.27Å; E93-L97 WeakPolarHBondContact O-CB 3.47Å; E93-L97 PolarHBondContact O-N 3.3Å; L94-L97 HydrophobicContact CD2-CD2 4.48Å; L94-L97 PolarHBondContact O-N 3.02Å
98	L	98.3	Very high	98.3	Very high	36 Å²	36	82.1 Å²	82.1	19%	0.188	48%	0.479	C	S	.	.	T	Hydrogen-bonded Turn	trans	-110.4	27.4	-175.5	-56.5	177.8	0	0	0	112.6	I63 I88 R89 L94 N95 K96 G100 V101	I63-L98 HydrophobicContact CD1-CD1 4.4Å; I88-L98 HydrophobicContact CD1-CD1 3.55Å; I88-L98 HydrophobicContact CG1-CD1 3.88Å; I88-L98 HydrophobicContact CG2-CB 3.96Å; I88-L98 HydrophobicContact CG2-CD1 3.79Å; I88-L98 HydrophobicContact CG2-CG 4.43Å; R89-L98 PolarHBondContact NH1-O 3.43Å; R89-L98 PolarHBondContact NH2-O 3.41Å; R89-L98 VanDerWaalsContact NH2-O 3.15Å; L94-L98 VanDerWaalsContact O-CB 3.32Å; L94-L98 WeakPolarHBondContact O-CB 3.42Å; L94-L98 PolarHBondContact O-N 3.09Å; N95-L98 CarbonylContact O-C 3.43Å; K96-L98 VanDerWaalsContact C-N 3.28Å; K96-L98 PolarHBondContact O-N 2.99Å; L98-G100 VanDerWaalsContact C-N 3.29Å; L98-G100 PolarHBondContact O-N 3Å; L98-V101 HydrophobicContact CB-CB 4.22Å; L98-V101 HydrophobicContact CB-CG2 4.33Å; L98-V101 HydrophobicContact CD2-CG2 4.03Å; L98-V101 PolarHBondContact O-N 2.97Å
99	G	97.6	Very high	98.3	Very high	55 Å²	55	84.5 Å²	84.5	57%	0.567	49%	0.491	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.7	-33.7	-176.9	0	0	0	0	0	113.5	N95 K96	N95-G99 WeakPolarHBondContact O-CA 3.38Å; N95-G99 PolarHBondContact O-N 2.78Å; K96-G99 PolarHBondContact O-N 3.02Å
100	G	98.2	Very high	98.2	Very high	86 Å²	86	87.8 Å²	87.8	89%	0.887	52%	0.518	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.9	8.8	177.2	0	0	0	0	0	115.2	L98	L98-G100 VanDerWaalsContact C-N 3.29Å; L98-G100 PolarHBondContact O-N 3Å
101	V	98.5	Very high	98.2	Very high	70 Å²	70	87.9 Å²	87.9	42%	0.424	52%	0.519	S	S	.	.			trans	-105.8	127	-173.2	178.7	0	0	0	0	110.9	R89 L98	R89-V101 PolarHBondContact NH2-O 3.34Å; L98-V101 HydrophobicContact CB-CB 4.22Å; L98-V101 HydrophobicContact CB-CG2 4.33Å; L98-V101 HydrophobicContact CD2-CG2 4.03Å; L98-V101 PolarHBondContact O-N 2.97Å
102	T	98.6	Very high	98.1	Very high	136 Å²	136	91.1 Å²	91.1	83%	0.834	54%	0.535	S	S	*	.			trans	-93.4	122.8	172.6	-61.3	0	0	0	0	110.7
103	I	98.3	Very high	98.1	Very high	33 Å²	33	88.8 Å²	88.8	17%	0.169	52%	0.524	C	S	.	.			trans	-91.6	110.2	173.9	-54.1	-178.9	0	0	0	108.7	P81 L84 Q85 I88 Q105 G106	P81-I103 HydrophobicContact CB-CG2 4.33Å; L84-I103 HydrophobicContact CB-CD1 4.42Å; Q85-I103 HydrophobicContact CB-CD1 4.43Å; I88-I103 HydrophobicContact CD1-CD1 3.47Å; I88-I103 VanDerWaalsContact CD1-CD1 3.47Å; I103-Q105 PolarHBondContact O-N 3.03Å; I103-G106 PolarHBondContact O-N 3.19Å
104	A	98.6	Very high	97.9	Very high	79 Å²	79	85.5 Å²	85.5	65%	0.653	52%	0.522	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56	133.4	175.3	0	0	0	0	0	110.3	P81 G106	P81-A104 WeakPolarHBondContact CB-O 3.04Å; A104-G106 PolarHBondContact O-N 3.49Å
105	Q	98.3	Very high	97.8	Very high	173 Å²	173	91.3 Å²	91.3	81%	0.808	56%	0.558	S	S	*	*	T	Hydrogen-bonded Turn	trans	62	19.3	-177	-56.7	-65.4	-40.9	0	0	115	P81 I103	P81-Q105 HydrophobicContact CB-CB 4Å; P81-Q105 HydrophobicContact CG-CB 4.2Å; I103-Q105 PolarHBondContact O-N 3.03Å
106	G	98.3	Very high	97.6	Very high	2 Å²	2	94.3 Å²	94.3	2%	0.021	57%	0.573	C	S	.	*			trans	-79.5	-30.3	179.2	0	0	0	0	0	115.1	R82 Q85 I103 A104	R82-G106 WeakPolarHBondContact CD-O 3.4Å; R82-G106 PolarHBondContact NH1-O 3.16Å; Q85-G106 WeakPolarHBondContact CB-O 3.16Å; Q85-G106 WeakPolarHBondContact CG-O 3.44Å; I103-G106 PolarHBondContact O-N 3.19Å; A104-G106 PolarHBondContact O-N 3.49Å
107	G	98.2	Very high	97.4	Very high	53 Å²	53	90.3 Å²	90.3	55%	0.546	56%	0.56	S	S	.	*			trans	64.8	-157.7	-167.6	0	0	0	0	0	112.4	Q85	Q85-G107 WeakPolarHBondContact CG-O 3.39Å; Q85-G107 PolarHBondContact NE2-O 2.92Å
108	V	98.1	Very high	97.2	Very high	114 Å²	114	90.8 Å²	90.8	69%	0.691	57%	0.569	S	S	*	*			trans	-125.9	160.3	-179	-62.1	0	0	0	0	111.6	R82	R82-V108 VanDerWaalsContact CZ-O 3.22Å; R82-V108 PolarHBondContact NH1-O 3.5Å; R82-V108 PolarHBondContact NH2-O 3.25Å
109	L	97.6	Very high	96.5	Very high	56 Å²	56	97.9 Å²	97.9	29%	0.293	60%	0.599	S	S	.	*			trans	-60.8	134.2	170.6	-71.6	-176.7	0	0	0	109.5	L86 R89 N90 N111	L86-L109 HydrophobicContact CD2-CD2 3.76Å; R89-L109 HydrophobicContact CB-CD1 3.64Å; R89-L109 HydrophobicContact CB-CD2 3.89Å; R89-L109 HydrophobicContact CB-CG 3.6Å; N90-L109 WeakPolarHBondContact ND2-CD2 3.23Å; L109-N111 PolarHBondContact O-N 3.37Å; L109-N111 VanDerWaalsContact O-N 3.12Å
110	P	97.3	Very high	95.4	Very high	110 Å²	110	105.6 Å²	105.6	71%	0.714	62%	0.617	S	S	*	*			trans	-61.4	115.9	172.6	-20	33.5	0	0	0	109.4
111	N	97.4	Very high	93.7	Very high	121 Å²	121	106.6 Å²	106.6	65%	0.647	61%	0.606	S	S	*	*			trans	-150.6	127.8	177.8	-178.5	44.2	0	0	0	109.3	L109	L109-N111 PolarHBondContact O-N 3.37Å; L109-N111 VanDerWaalsContact O-N 3.12Å
112	I	97.3	Very high	91.2	Very high	112 Å²	112	107.6 Å²	107.6	57%	0.574	62%	0.616	S	S	*	*			trans	-120	121.4	174.3	-60	175.5	0	0	0	106.8	A114 L116 L117	I112-A114 PolarHBondContact O-N 2.88Å; I112-L116 HydrophobicContact CG2-CB 3.91Å; I112-L117 HydrophobicContact CB-CD2 4.37Å; I112-L117 HydrophobicContact CG2-CD2 3.84Å; I112-L117 HydrophobicContact CG2-CG 4.41Å
113	Q	96.9	Very high	88.7	Confident	120 Å²	120	106.8 Å²	106.8	56%	0.561	62%	0.623	S	S	*	*			trans	-58.9	134.5	176.2	-64.8	-64	-18.6	0	0	109.8	V115 L116	Q113-V115 HydrophobicContact CB-CG1 4.18Å; Q113-V115 PolarHBondContact O-N 3.4Å; Q113-L116 HydrophobicContact CB-CD1 4.27Å; Q113-L116 HydrophobicContact CB-CG 4.32Å; Q113-L116 WeakPolarHBondContact O-CB 3.48Å; Q113-L116 PolarHBondContact O-N 3.27Å
114	A	94.9	Very high	86.1	Confident	80 Å²	80	110.1 Å²	110.1	66%	0.661	65%	0.645	S	S	*	*	G	3₁₀ helix	trans	-55.7	-29.9	-171.8	0	0	0	0	0	113.8	I112 L116 L117	I112-A114 PolarHBondContact O-N 2.88Å; A114-L116 PolarHBondContact O-N 2.96Å; A114-L117 WeakPolarHBondContact O-CB 3.47Å; A114-L117 PolarHBondContact O-N 3.39Å
115	V	95.4	Very high	83.6	Confident	129 Å²	129	112.8 Å²	112.8	78%	0.782	65%	0.653	S	S	*	*	G	3₁₀ helix	trans	-63.7	-24.3	176.2	69	0	0	0	0	113.8	Q113 L117	Q113-V115 HydrophobicContact CB-CG1 4.18Å; Q113-V115 PolarHBondContact O-N 3.4Å; V115-L117 VanDerWaalsContact C-N 3.34Å
116	L	95.8	Very high	81.5	Confident	128 Å²	128	107.5 Å²	107.5	67%	0.67	65%	0.645	S	S	*	*	G	3₁₀ helix	trans	-87.7	-6.3	179.7	-56.2	178	0	0	0	112.6	I112 Q113 A114	I112-L116 HydrophobicContact CG2-CB 3.91Å; Q113-L116 HydrophobicContact CB-CD1 4.27Å; Q113-L116 HydrophobicContact CB-CG 4.32Å; Q113-L116 WeakPolarHBondContact O-CB 3.48Å; Q113-L116 PolarHBondContact O-N 3.27Å; A114-L116 PolarHBondContact O-N 2.96Å
117	L	94.2	Very high	79.2	Confident	96 Å²	96	113.5 Å²	113.5	50%	0.503	68%	0.683	S	S	.	*	S	Bend	trans	-76.9	143.8	177.4	-61.8	175.9	0	0	0	110	I112 A114 V115 K119	I112-L117 HydrophobicContact CB-CD2 4.37Å; I112-L117 HydrophobicContact CG2-CD2 3.84Å; I112-L117 HydrophobicContact CG2-CG 4.41Å; A114-L117 WeakPolarHBondContact O-CB 3.47Å; A114-L117 PolarHBondContact O-N 3.39Å; V115-L117 VanDerWaalsContact C-N 3.34Å; L117-K119 PolarHBondContact O-N 3.35Å
118	P	93.3	Very high	76.8	Confident	117 Å²	117	120.9 Å²	120.9	76%	0.76	70%	0.7	S	S	*	*	P	Polyproline II helix	trans	-52.8	132.8	171.6	-24.2	33.2	0	0	0	110.2	K120	P118-K120 PolarHBondContact O-N 3.03Å
119	K	83.7	Confident	74.8	Confident	186 Å²	186	119.7 Å²	119.7	81%	0.809	70%	0.702	S	S	*	*	P	Polyproline II helix	trans	-55.1	128.5	170.9	-74.1	-179.2	177.7	177.8	0	107.4	L117 T121	L117-K119 PolarHBondContact O-N 3.35Å; K119-T121 HydrophobicContact CB-CG2 4.34Å; K119-T121 PolarHBondContact O-N 2.84Å
120	K	75	Confident	72.6	Confident	216 Å²	216	123 Å²	123	94%	0.939	73%	0.727	S	S	*	*			trans	-68.6	62.5	170.7	-72.1	-176.4	178	179.7	0	109.9	P118	P118-K120 PolarHBondContact O-N 3.03Å
121	T	60.8	Low	70.3	Confident	108 Å²	108	123.7 Å²	123.7	66%	0.663	74%	0.735	S	S	*	*			trans	-94	91.2	165.6	47.2	0	0	0	0	106.5	K119	K119-T121 HydrophobicContact CB-CG2 4.34Å; K119-T121 PolarHBondContact O-N 2.84Å
122	S	46.7	Very low	68.1	Low	91 Å²	91	121.5 Å²	121.5	64%	0.636	74%	0.741	S	S	*	*			trans	39.3	105.2	152.3	48.9	0	0	0	0	116.8	T124	S122-T124 WeakPolarHBondContact CB-OG1 3.37Å; S122-T124 PolarHBondContact O-N 3.27Å; S122-T124 PolarHBondContact O-OG1 3.25Å; S122-T124 PolarHBondContact OG-OG1 3.46Å
123	A	47.4	Very low	65.6	Low	118 Å²	118	119.8 Å²	119.8	98%	0.975	75%	0.751	S	S	*	*			trans	-64.3	73.9	151.9	0	0	0	0	0	108.9
124	T	43.6	Very low	63.4	Low	103 Å²	103	123.8 Å²	123.8	63%	0.632	77%	0.766	S	S	*	*			trans	-82.8	126.4	163.6	-26.7	0	0	0	0	105.9	S122	S122-T124 WeakPolarHBondContact CB-OG1 3.37Å; S122-T124 PolarHBondContact O-N 3.27Å; S122-T124 PolarHBondContact O-OG1 3.25Å; S122-T124 PolarHBondContact OG-OG1 3.46Å
125	V	46.1	Very low	61.1	Low	135 Å²	135	130.5 Å²	130.5	82%	0.818	78%	0.781	S	S	*	*			trans	81.9	68.5	166.6	-155.8	0	0	0	0	117
126	G	52.5	Low	59	Low	63 Å²	63	129 Å²	129	65%	0.649	78%	0.782	S	S	*	*			trans	-91.7	140.7	137	0	0	0	0	0	108.3	K128	G126-K128 PolarHBondContact O-N 3.45Å; G126-K128 VanDerWaalsContact O-N 3.16Å
127	P	51.4	Low	56.8	Low	127 Å²	127	128.9 Å²	128.9	83%	0.825	79%	0.787	S	S	*	*			trans	-61.8	122.7	-179	25.3	-31.2	0	0	0	109.3	A129	P127-A129 PolarHBondContact O-N 3.36Å
128	K	48.1	Very low	54.7	Low	208 Å²	208	133.3 Å²	133.3	90%	0.904	81%	0.805	S	S	*	*			trans	-53.7	108.2	164.3	-87.3	179.8	172.5	176.6	0	107.3	G126	G126-K128 PolarHBondContact O-N 3.45Å; G126-K128 VanDerWaalsContact O-N 3.16Å
129	A	55.3	Low	52.8	Low	89 Å²	89	132.2 Å²	132.2	74%	0.736	81%	0.805	S	S	*	*			trans	-58.1	130.8	166.3	0	0	0	0	0	108.1	P127 S131	P127-A129 PolarHBondContact O-N 3.36Å; A129-S131 PolarHBondContact O-N 3.16Å
130	P	52.1	Low	51.3	Low	125 Å²	125	128.6 Å²	128.6	81%	0.812	80%	0.804	S	S	*	*			trans	-65.5	134.4	176.3	24.4	-28.1	0	0	0	109.4	G132	P130-G132 PolarHBondContact O-N 3.39Å
131	S	48.7	Very low	50.3	Low	125 Å²	125	127.6 Å²	127.6	87%	0.874	80%	0.803	S	S	*	*			trans	-60.5	92.8	175.4	56.9	0	0	0	0	110.6	A129	A129-S131 PolarHBondContact O-N 3.16Å
132	G	50.6	Low	49.9	Very low	75 Å²	75	131 Å²	131	77%	0.773	81%	0.811	S	S	*	*			trans	-89.9	95.5	168.6	0	0	0	0	0	109.8	P130 K134	P130-G132 PolarHBondContact O-N 3.39Å; G132-K134 PolarHBondContact O-N 3.4Å
133	G	44.6	Very low	50.3	Low	76 Å²	76	141.2 Å²	141.2	78%	0.784	84%	0.838	S	S	*	*			trans	-68.7	125	170.1	0	0	0	0	0	111
134	K	51.8	Low	50.5	Low	205 Å²	205	142.4 Å²	142.4	89%	0.891	83%	0.831	S	S	*	*			trans	-144.1	110.6	148.8	-87.4	-173.6	-179.4	174.2	0	108.7	G132 A136	G132-K134 PolarHBondContact O-N 3.4Å; K134-A136 PolarHBondContact O-N 3.37Å
135	K	46	Very low	50.8	Low	220 Å²	220	144.4 Å²	144.4	96%	0.957	84%	0.841	S	S	*	*			trans	-58.6	125.3	160	-80.9	175.3	170.3	177.7	0	108.3
136	A	51.3	Low	51.1	Low	99 Å²	99	144.9 Å²	144.9	82%	0.818	84%	0.842	S	S	*	*			trans	-146	121.3	153.7	0	0	0	0	0	108.4	K134	K134-A136 PolarHBondContact O-N 3.37Å
137	T	50.1	Low	51	Low	124 Å²	124	149.8 Å²	149.8	76%	0.761	85%	0.854	S	S	*	*			trans	-74.3	168.5	178.7	37.6	0	0	0	0	112.8
138	Q	50.6	Low	51	Low	189 Å²	189	151.2 Å²	151.2	88%	0.883	86%	0.856	S	S	*	*			trans	83.1	135.9	163.7	-63.2	171.1	-10.9	0	0	114.4
139	A	53.2	Low	51.2	Low	94 Å²	94	147.4 Å²	147.4	78%	0.777	85%	0.852	S	S	*	*			cis	-159.2	156.3	3.3	0	0	0	0	0	108.8
140	S	50.6	Low	50.9	Low	111 Å²	111	151.6 Å²	151.6	78%	0.776	86%	0.861	S	S	*	*			trans	-47.2	147.1	165.7	42.8	0	0	0	0	115.5
141	Q	55.3	Low	50.8	Low	195 Å²	195	153.6 Å²	153.6	91%	0.911	86%	0.864	S	S	*	*			trans	-152	123.4	137.3	-104.3	176	31	0	0	109.8
142	E	52.4	Low	50.9	Low	178 Å²	178	156 Å²	156	83%	0.832	86%	0.864	S	S	*	*			trans	-69.5	145.3	171.7	-63.7	170.6	140.4	0	0	111
143	Y	54.8	Low	51	Low	306 Å²	306	163.4 Å²	163.4	100%	1.2	87%	0.872	S	S	*	*			trans	-152.3	0	135.2	-93.8	-77.4	0	0	0	108

Retrieved 143 of 143 residues in 631.1 ms (Link to these results)

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