A0A096NQ36_PAPAN Loading...

Histone H2A

Core component of nucleosome. 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.

AlphaFold DB (C0HKE2), UniProt , Accession A0A096NQ36, Species PAPAN (Papio anubis, Olive baboon), Gene n/a, Length 130 aa.

						>A0A096NQ36_PAPAN|A0A096NQ36
MSGRGKQGGKARAKAKTRSSRAGLQFPVGRVHRLLRKGNYSERVGAGAPVYLAAVLEYLTAEILELAGNAARDNKKTRIIPRHLQLAIRNDEELNKLLGRVTIAQGGVLPNIQAVLLPKKTESHHKAKGK
					

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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	59.7	Low	62	Low	251 Å²	251	144 Å²	144	100%	1.236	85%	0.853	S	S	*	*				0	114.7	0	-78	-177.7	168	0	0	109.1
2	S	62.5	Low	63.3	Low	131 Å²	131	151.9 Å²	151.9	92%	0.916	86%	0.857	S	S	*	*			trans	-160.2	103.3	163.5	171.8	0	0	0	0	103.7
3	G	59.8	Low	64.7	Low	72 Å²	72	147.2 Å²	147.2	74%	0.742	85%	0.849	S	S	*	*				115.7	60	63.1	0	0	0	0	0	106.3	G5	G3-G5 VanDerWaalsContact C-N 3.29Å; G3-G5 PolarHBondContact O-N 2.92Å
4	R	59.9	Low	66.2	Low	245 Å²	245	150.9 Å²	150.9	93%	0.925	85%	0.85	S	S	*	*			trans	-69.6	81.1	-172.3	-169.8	162.3	179.1	154.1	-4.1	109.8	K6	R4-K6 VanDerWaalsContact C-N 3.27Å; R4-K6 PolarHBondContact O-N 2.87Å
5	G	61.9	Low	67.8	Low	67 Å²	67	147.1 Å²	147.1	69%	0.691	85%	0.845	S	S	*	*			trans	-69.9	83.2	170	0	0	0	0	0	110.2	G3 Q7	G3-G5 VanDerWaalsContact C-N 3.29Å; G3-G5 PolarHBondContact O-N 2.92Å; G5-Q7 PolarHBondContact O-N 2.89Å
6	K	59	Low	69.3	Low	194 Å²	194	147.6 Å²	147.6	84%	0.843	83%	0.834	S	S	*	*			trans	-70.4	75	166.7	-164.9	-179.8	-175.4	-175.6	0	107	R4 G8	R4-K6 VanDerWaalsContact C-N 3.27Å; R4-K6 PolarHBondContact O-N 2.87Å; K6-G8 PolarHBondContact O-N 2.9Å; K6-G8 VanDerWaalsContact O-N 3.12Å
7	Q	58.2	Low	70.9	Confident	180 Å²	180	143.9 Å²	143.9	84%	0.841	82%	0.816	S	S	*	*			trans	-52.2	121.9	172.9	-83.1	-178.8	-6.8	0	0	107.6	G5 G9	G5-Q7 PolarHBondContact O-N 2.89Å; Q7-G9 PolarHBondContact O-N 3.1Å; Q7-G9 VanDerWaalsContact O-N 3.12Å
8	G	55.4	Low	72.3	Confident	68 Å²	68	141.6 Å²	141.6	70%	0.701	79%	0.792	S	S	*	*			trans	-42.8	119.6	-177.8	0	0	0	0	0	110.1	K6 K10	K6-G8 PolarHBondContact O-N 2.9Å; K6-G8 VanDerWaalsContact O-N 3.12Å; G8-K10 VanDerWaalsContact C-N 3.29Å; G8-K10 PolarHBondContact O-N 2.73Å
9	G	62.4	Low	73.6	Confident	77 Å²	77	135 Å²	135	79%	0.794	76%	0.756	S	S	*	*			trans	-64.7	89.9	-173.6	0	0	0	0	0	109.8	Q7 A11	Q7-G9 PolarHBondContact O-N 3.1Å; Q7-G9 VanDerWaalsContact O-N 3.12Å; G9-A11 PolarHBondContact O-N 3.07Å; G9-A11 VanDerWaalsContact O-N 3.11Å
10	K	68	Low	74.8	Confident	198 Å²	198	131.7 Å²	131.7	86%	0.861	74%	0.742	S	S	*	*			trans	-48.4	123.1	160.9	-73.3	-177.8	178.5	177.9	0	105.8	G8 R12	G8-K10 VanDerWaalsContact C-N 3.29Å; G8-K10 PolarHBondContact O-N 2.73Å; K10-R12 PolarHBondContact O-N 2.95Å
11	A	75	Confident	75.8	Confident	101 Å²	101	134 Å²	134	84%	0.835	74%	0.74	S	S	*	*			trans	-47.5	111.2	-179.5	0	0	0	0	0	108	G9 A13	G9-A11 PolarHBondContact O-N 3.07Å; G9-A11 VanDerWaalsContact O-N 3.11Å; A11-A13 PolarHBondContact O-N 3.3Å
12	R	77.2	Confident	77.6	Confident	239 Å²	239	124.1 Å²	124.1	90%	0.902	70%	0.697	S	S	*	*	P	Polyproline II helix	trans	-58.1	119.5	-174.7	-174.4	177.8	-178.9	179.7	1.6	106.9	K10 K14	K10-R12 PolarHBondContact O-N 2.95Å; R12-K14 PolarHBondContact O-N 2.87Å
13	A	82.4	Confident	79.3	Confident	90 Å²	90	120.9 Å²	120.9	74%	0.744	69%	0.685	S	S	*	*	P	Polyproline II helix	trans	-50.6	132.2	177.2	0	0	0	0	0	109.1	A11 A15	A11-A13 PolarHBondContact O-N 3.3Å; A13-A15 PolarHBondContact O-N 3.4Å
14	K	85.3	Confident	81.1	Confident	200 Å²	200	118.6 Å²	118.6	87%	0.87	66%	0.655	S	S	*	*	P	Polyproline II helix	trans	-54	131.9	-179.4	-71	-176.7	-179.5	177.1	0	109	R12 K16	R12-K14 PolarHBondContact O-N 2.87Å; K14-K16 PolarHBondContact O-N 3.31Å; K14-K16 VanDerWaalsContact O-N 3.14Å
15	A	89.5	Confident	83	Confident	94 Å²	94	114.9 Å²	114.9	78%	0.777	65%	0.649	S	S	*	*	P	Polyproline II helix	trans	-60.5	119.8	178.5	0	0	0	0	0	109.7	A13 T17	A13-A15 PolarHBondContact O-N 3.4Å; A15-T17 PolarHBondContact O-N 3.29Å
16	K	93.1	Very high	84.7	Confident	155 Å²	155	114.7 Å²	114.7	67%	0.674	63%	0.629	S	S	*	*	P	Polyproline II helix	trans	-63.2	130.2	173.1	-67.7	-172.5	179.9	-176.3	0	109.6	K14 R21	K14-K16 PolarHBondContact O-N 3.31Å; K14-K16 VanDerWaalsContact O-N 3.14Å; K16-R21 HydrophobicContact CB-CG 4.12Å; K16-R21 PolarHBondContact O-NE 3.14Å
17	T	95.5	Very high	86.6	Confident	84 Å²	84	107.6 Å²	107.6	52%	0.515	60%	0.603	S	S	.	*	P	Polyproline II helix	trans	-68.1	156.1	177.5	70.1	0	0	0	0	110.8	A15 S19 S20 R21	A15-T17 PolarHBondContact O-N 3.29Å; T17-S19 VanDerWaalsContact C-N 3.26Å; T17-S19 PolarHBondContact O-N 2.98Å; T17-S20 PolarHBondContact N-OG 2.88Å; T17-S20 PolarHBondContact O-N 2.86Å; T17-S20 PolarHBondContact O-OG 3.36Å; T17-S20 WeakPolarHBondContact OG1-CB 3.5Å; T17-S20 PolarHBondContact OG1-N 3.12Å; T17-S20 PolarHBondContact OG1-OG 3.31Å; T17-S20 VanDerWaalsContact OG1-OG 3.04Å; T17-R21 WeakPolarHBondContact O-CG 3.35Å; T17-R21 PolarHBondContact O-N 3.26Å
18	R	96.2	Very high	88.5	Confident	102 Å²	102	99 Å²	99	39%	0.385	56%	0.563	S	S	.	*	H	α-helix	trans	-58.5	-38.4	173.7	-73.8	-169.8	-78.5	167.3	-3.1	112.3	R21 A22 V28 H32	R18-R21 PolarHBondContact O-N 2.95Å; R18-A22 WeakPolarHBondContact O-CB 3.41Å; R18-A22 PolarHBondContact O-N 3.25Å; R18-V28 HydrophobicContact CB-CB 4.11Å; R18-V28 HydrophobicContact CB-CG1 3.87Å; R18-H32 PolarHBondContact NH1-ND1 3.27Å; R18-H32 PolarHBondContact NH2-ND1 3.25Å
19	S	97.9	Very high	90.5	Very high	17 Å²	17	97.4 Å²	97.4	12%	0.119	55%	0.545	C	S	.	.	H	α-helix	trans	-59	-51.6	173.7	-64	0	0	0	0	111.8	T17 R21 A22 G23 L24 F26 P27 V28	T17-S19 VanDerWaalsContact C-N 3.26Å; T17-S19 PolarHBondContact O-N 2.98Å; S19-R21 PolarHBondContact O-N 3.31Å; S19-A22 CarbonylContact O-C 3.53Å; S19-A22 PolarHBondContact O-N 3.25Å; S19-G23 PolarHBondContact O-N 3.49Å; S19-L24 CarbonylContact C-O 3.51Å; S19-L24 WeakPolarHBondContact CB-O 3.38Å; S19-L24 PolarHBondContact O-N 3.29Å; S19-L24 VanDerWaalsContact O-N 3.07Å; S19-F26 WeakPolarHBondContact CB-O 3.48Å; S19-F26 PolarHBondContact OG-O 3.35Å; S19-P27 WeakPolarHBondContact OG-CA 3.38Å; S19-V28 PolarHBondContact OG-N 3.06Å
20	S	96.9	Very high	92.2	Very high	68 Å²	68	100.8 Å²	100.8	48%	0.476	53%	0.534	S	S	.	.	H	α-helix	trans	-62.8	-27.6	178.2	64.4	0	0	0	0	114	T17	T17-S20 PolarHBondContact N-OG 2.88Å; T17-S20 PolarHBondContact O-N 2.86Å; T17-S20 PolarHBondContact O-OG 3.36Å; T17-S20 WeakPolarHBondContact OG1-CB 3.5Å; T17-S20 PolarHBondContact OG1-N 3.12Å; T17-S20 PolarHBondContact OG1-OG 3.31Å; T17-S20 VanDerWaalsContact OG1-OG 3.04Å
21	R	96.7	Very high	93.7	Very high	182 Å²	182	92.2 Å²	92.2	69%	0.687	50%	0.498	S	S	*	.	H	α-helix	trans	-76.9	-31.3	174.3	-69.4	176.6	-174.1	-172.6	-1.4	112.4	K16 T17 R18 S19	K16-R21 HydrophobicContact CB-CG 4.12Å; K16-R21 PolarHBondContact O-NE 3.14Å; T17-R21 WeakPolarHBondContact O-CG 3.35Å; T17-R21 PolarHBondContact O-N 3.26Å; R18-R21 PolarHBondContact O-N 2.95Å; S19-R21 PolarHBondContact O-N 3.31Å
22	A	97.3	Very high	94.8	Very high	42 Å²	42	89 Å²	89	35%	0.347	47%	0.466	S	S	.	.	H	α-helix	trans	-86	-7.6	178	0	0	0	0	0	113.3	R18 S19 L24 V50	R18-A22 WeakPolarHBondContact O-CB 3.41Å; R18-A22 PolarHBondContact O-N 3.25Å; S19-A22 CarbonylContact O-C 3.53Å; S19-A22 PolarHBondContact O-N 3.25Å; A22-L24 VanDerWaalsContact C-N 3.32Å; A22-L24 HydrophobicContact CB-CD1 3.96Å; A22-L24 HydrophobicContact CB-CG 4.02Å; A22-V50 HydrophobicContact CB-CG1 3.86Å
23	G	97.8	Very high	95.8	Very high	63 Å²	63	85.5 Å²	85.5	65%	0.649	45%	0.453	S	S	*	.	T	Hydrogen-bonded Turn	trans	73.4	21.9	-175.3	0	0	0	0	0	114.1	S19	S19-G23 PolarHBondContact O-N 3.49Å
24	L	98.4	Very high	96.5	Very high	24 Å²	24	85.6 Å²	85.6	13%	0.126	44%	0.441	C	S	.	.			trans	-105.9	139.3	-175.7	-63.1	175.1	0	0	0	111.1	S19 A22 V28 V50 A53 A54 E57	S19-L24 CarbonylContact C-O 3.51Å; S19-L24 WeakPolarHBondContact CB-O 3.38Å; S19-L24 PolarHBondContact O-N 3.29Å; S19-L24 VanDerWaalsContact O-N 3.07Å; A22-L24 VanDerWaalsContact C-N 3.32Å; A22-L24 HydrophobicContact CB-CD1 3.96Å; A22-L24 HydrophobicContact CB-CG 4.02Å; L24-V28 HydrophobicContact CD1-CG2 3.78Å; L24-V50 HydrophobicContact CD1-CG1 4.26Å; L24-A53 HydrophobicContact CD1-CB 3.95Å; L24-A54 HydrophobicContact CD1-CB 4.03Å; L24-A54 HydrophobicContact CD2-CB 3.85Å; L24-E57 WeakPolarHBondContact CA-OE2 3.45Å; L24-E57 WeakPolarHBondContact CB-OE2 3.29Å
25	Q	98.3	Very high	97.1	Very high	168 Å²	168	77.7 Å²	77.7	79%	0.785	41%	0.407	S	S	*	.	S	Bend	trans	-74.4	-32	165.3	-62	-56.6	-38.1	0	0	111.3	E57	Q25-E57 PolarHBondContact N-OE1 3.29Å; Q25-E57 VanDerWaalsContact N-OE1 3.16Å; Q25-E57 PolarHBondContact N-OE2 3.18Å
26	F	98.4	Very high	97.4	Very high	62 Å²	62	79.5 Å²	79.5	27%	0.272	39%	0.394	S	S	.	.	S	Bend	trans	-71	144.8	-177.1	-84.9	35.4	0	0	0	111.4	S19 V28 A53 L56 E57 T60	S19-F26 WeakPolarHBondContact CB-O 3.48Å; S19-F26 PolarHBondContact OG-O 3.35Å; F26-V28 PolarHBondContact O-N 3.4Å; F26-A53 HydrophobicContact CB-CB 4.28Å; F26-L56 HydrophobicContact CD2-CB 3.76Å; F26-L56 VanDerWaalsContact CE2-C 3.47Å; F26-L56 HydrophobicContact CE2-CB 3.79Å; F26-L56 WeakPolarHBondContact CE2-O 3.24Å; F26-E57 HydrophobicContact CB-CB 4.09Å; F26-E57 WeakPolarHBondContact CB-OE2 3.3Å; F26-E57 HydrophobicContact CD1-CB 3.81Å; F26-E57 HydrophobicContact CD1-CG 3.82Å; F26-E57 HydrophobicContact CD2-CB 3.98Å; F26-E57 HydrophobicContact CE1-CB 4.26Å; F26-E57 HydrophobicContact CE1-CG 4.22Å; F26-E57 HydrophobicContact CE2-CB 4.4Å; F26-E57 HydrophobicContact CG-CB 3.69Å; F26-E57 HydrophobicContact CG-CG 4.19Å; F26-E57 PolarHBondContact N-OE2 2.71Å; F26-T60 HydrophobicContact CZ-CG2 3.88Å; F26-T60 WeakPolarHBondContact CZ-OG1 3.47Å
27	P	98.3	Very high	97.6	Very high	46 Å²	46	80.3 Å²	80.3	30%	0.299	40%	0.398	S	S	.	.			trans	-81.7	84.4	-168.1	33	-37.5	0	0	0	112.7	S19 G29 R30 V31	S19-P27 WeakPolarHBondContact OG-CA 3.38Å; P27-G29 PolarHBondContact O-N 2.85Å; P27-G29 VanDerWaalsContact O-N 3.09Å; P27-R30 HydrophobicContact CB-CB 3.81Å; P27-R30 HydrophobicContact CG-CB 3.94Å; P27-R30 WeakPolarHBondContact O-CA 3.17Å; P27-R30 WeakPolarHBondContact O-CB 3.29Å; P27-R30 PolarHBondContact O-N 3.06Å; P27-V31 PolarHBondContact O-N 3.34Å
28	V	98.6	Very high	97.7	Very high	0 Å²	0	77.9 Å²	77.9	0%	0	39%	0.39	C	S	.	.	H	α-helix	trans	-48.1	-40.7	175.4	176.1	0	0	0	0	112.1	R18 S19 L24 F26 R30 V31 H32 P49 V50 A53	R18-V28 HydrophobicContact CB-CB 4.11Å; R18-V28 HydrophobicContact CB-CG1 3.87Å; S19-V28 PolarHBondContact OG-N 3.06Å; L24-V28 HydrophobicContact CD1-CG2 3.78Å; F26-V28 PolarHBondContact O-N 3.4Å; V28-R30 VanDerWaalsContact C-N 3.34Å; V28-R30 PolarHBondContact O-N 3.11Å; V28-V31 PolarHBondContact O-N 3.05Å; V28-H32 PolarHBondContact O-N 3.18Å; V28-P49 HydrophobicContact CG1-CB 4.24Å; V28-P49 HydrophobicContact CG1-CG 4.44Å; V28-V50 HydrophobicContact CG1-CG2 3.72Å; V28-A53 HydrophobicContact CG2-CB 3.91Å
29	G	97.9	Very high	97.6	Very high	33 Å²	33	79.6 Å²	79.6	34%	0.34	41%	0.406	S	S	.	.	H	α-helix	trans	-61.3	-41.3	178.3	0	0	0	0	0	113.5	P27 R33	P27-G29 PolarHBondContact O-N 2.85Å; P27-G29 VanDerWaalsContact O-N 3.09Å; G29-R33 PolarHBondContact O-N 2.72Å
30	R	98.3	Very high	97.5	Very high	149 Å²	149	87.4 Å²	87.4	56%	0.562	43%	0.434	S	S	*	.	H	α-helix	trans	-71.2	-43.8	178.5	-173.4	-176	-63.8	158.3	0.2	110.7	P27 V28 H32 R33 L34	P27-R30 HydrophobicContact CB-CB 3.81Å; P27-R30 HydrophobicContact CG-CB 3.94Å; P27-R30 WeakPolarHBondContact O-CA 3.17Å; P27-R30 WeakPolarHBondContact O-CB 3.29Å; P27-R30 PolarHBondContact O-N 3.06Å; V28-R30 VanDerWaalsContact C-N 3.34Å; V28-R30 PolarHBondContact O-N 3.11Å; R30-H32 VanDerWaalsContact C-N 3.33Å; R30-H32 PolarHBondContact O-N 3.15Å; R30-R33 PolarHBondContact O-N 3.04Å; R30-L34 HydrophobicContact CG-CD1 4.21Å; R30-L34 WeakPolarHBondContact O-CG 3.43Å; R30-L34 PolarHBondContact O-N 2.92Å
31	V	98.3	Very high	97.4	Very high	17 Å²	17	87.3 Å²	87.3	10%	0.103	43%	0.434	C	S	.	.	H	α-helix	trans	-57.8	-46.4	176.3	177.4	0	0	0	0	110.5	P27 V28 R33 L34 L35 P49 L52 A53	P27-V31 PolarHBondContact O-N 3.34Å; V28-V31 PolarHBondContact O-N 3.05Å; V31-R33 VanDerWaalsContact C-N 3.34Å; V31-R33 PolarHBondContact O-N 2.83Å; V31-L34 PolarHBondContact O-N 3.36Å; V31-L35 HydrophobicContact CG1-CD1 4.02Å; V31-L35 HydrophobicContact CG1-CG 4.3Å; V31-L35 WeakPolarHBondContact O-CG 3.33Å; V31-L35 PolarHBondContact O-N 2.79Å; V31-P49 HydrophobicContact CB-CB 4.25Å; V31-P49 HydrophobicContact CG1-CB 4.02Å; V31-L52 HydrophobicContact CG1-CB 4.14Å; V31-L52 HydrophobicContact CG1-CD2 3.82Å; V31-L52 HydrophobicContact CG1-CG 4.1Å; V31-A53 HydrophobicContact CG2-CB 4.18Å
32	H	98.1	Very high	97.3	Very high	33 Å²	33	87.9 Å²	87.9	15%	0.153	44%	0.444	C	S	.	.	H	α-helix	trans	-58	-44.5	176.2	-174.2	-135.6	0	0	0	113	R18 V28 R30 L34 L35 R36 P49	R18-H32 PolarHBondContact NH1-ND1 3.27Å; R18-H32 PolarHBondContact NH2-ND1 3.25Å; V28-H32 PolarHBondContact O-N 3.18Å; R30-H32 VanDerWaalsContact C-N 3.33Å; R30-H32 PolarHBondContact O-N 3.15Å; H32-L34 VanDerWaalsContact C-N 3.34Å; H32-L35 PolarHBondContact O-N 2.92Å; H32-R36 PolarHBondContact CE1-NE 3.42Å; H32-R36 VanDerWaalsContact CE1-NE 3.27Å; H32-R36 PolarHBondContact NE2-NE 2.99Å; H32-R36 PolarHBondContact O-N 3.41Å; H32-R36 VanDerWaalsContact O-N 3.14Å; H32-P49 HydrophobicContact CB-CB 3.63Å; H32-P49 HydrophobicContact CB-CG 3.74Å
33	R	97.9	Very high	97.3	Very high	166 Å²	166	96.3 Å²	96.3	63%	0.626	47%	0.467	S	S	*	.	H	α-helix	trans	-62.9	-42.5	178.4	-175.4	-177.3	65.8	175.2	3.1	111.2	G29 R30 V31 R36 K37	G29-R33 PolarHBondContact O-N 2.72Å; R30-R33 PolarHBondContact O-N 3.04Å; V31-R33 VanDerWaalsContact C-N 3.34Å; V31-R33 PolarHBondContact O-N 2.83Å; R33-R36 PolarHBondContact O-N 2.83Å; R33-K37 PolarHBondContact O-N 3.34Å
34	L	98.1	Very high	97.2	Very high	93 Å²	93	94.2 Å²	94.2	49%	0.487	44%	0.442	S	S	.	.	H	α-helix	trans	-68.4	-41.3	179.1	-68.9	175.4	0	0	0	112.2	R30 V31 H32 R36 K37 G38	R30-L34 HydrophobicContact CG-CD1 4.21Å; R30-L34 WeakPolarHBondContact O-CG 3.43Å; R30-L34 PolarHBondContact O-N 2.92Å; V31-L34 PolarHBondContact O-N 3.36Å; H32-L34 VanDerWaalsContact C-N 3.34Å; L34-R36 VanDerWaalsContact C-N 3.3Å; L34-R36 PolarHBondContact O-N 3.25Å; L34-K37 PolarHBondContact O-N 2.97Å; L34-K37 VanDerWaalsContact O-N 3.17Å; L34-G38 PolarHBondContact O-N 3.27Å
35	L	97.6	Very high	97.2	Very high	33 Å²	33	95.2 Å²	95.2	17%	0.173	46%	0.458	C	S	.	.	H	α-helix	trans	-58.4	-42	174.6	-74	172.9	0	0	0	112	V31 H32 G38 Y40 V44 P49 L52	V31-L35 HydrophobicContact CG1-CD1 4.02Å; V31-L35 HydrophobicContact CG1-CG 4.3Å; V31-L35 WeakPolarHBondContact O-CG 3.33Å; V31-L35 PolarHBondContact O-N 2.79Å; H32-L35 PolarHBondContact O-N 2.92Å; L35-G38 PolarHBondContact O-N 2.96Å; L35-Y40 HydrophobicContact CD2-CD2 4.1Å; L35-Y40 HydrophobicContact CD2-CE2 4.27Å; L35-Y40 WeakPolarHBondContact O-CD2 3.41Å; L35-V44 HydrophobicContact CB-CG1 4.13Å; L35-V44 HydrophobicContact CB-CG2 4.32Å; L35-V44 HydrophobicContact CD1-CG1 4.12Å; L35-P49 HydrophobicContact CD1-CB 4.14Å; L35-L52 HydrophobicContact CD1-CD2 4.31Å; L35-L52 HydrophobicContact CD2-CD2 3.92Å; L35-L52 HydrophobicContact CG-CD2 4.36Å
36	R	96.4	Very high	97	Very high	133 Å²	133	91 Å²	91	50%	0.502	45%	0.452	S	S	.	.	H	α-helix	trans	-67.2	-41	174.8	-73.9	-175.9	174.6	-96.3	-3.6	112.6	H32 R33 L34 G38 N39 V44	H32-R36 PolarHBondContact CE1-NE 3.42Å; H32-R36 VanDerWaalsContact CE1-NE 3.27Å; H32-R36 PolarHBondContact NE2-NE 2.99Å; H32-R36 PolarHBondContact O-N 3.41Å; H32-R36 VanDerWaalsContact O-N 3.14Å; R33-R36 PolarHBondContact O-N 2.83Å; L34-R36 VanDerWaalsContact C-N 3.3Å; L34-R36 PolarHBondContact O-N 3.25Å; R36-G38 VanDerWaalsContact C-N 3.27Å; R36-G38 PolarHBondContact O-N 2.89Å; R36-N39 PolarHBondContact O-N 3.42Å; R36-N39 PolarHBondContact O-OD1 2.93Å; R36-V44 HydrophobicContact CG-CB 4.33Å; R36-V44 HydrophobicContact CG-CG2 4.11Å
37	K	97.2	Very high	97	Very high	171 Å²	171	90.4 Å²	90.4	74%	0.743	46%	0.463	S	S	*	.	H	α-helix	trans	-65.2	-31.9	177.5	-174.2	179.2	177.4	-175.9	0	112.3	R33 L34 N39	R33-K37 PolarHBondContact O-N 3.34Å; L34-K37 PolarHBondContact O-N 2.97Å; L34-K37 VanDerWaalsContact O-N 3.17Å; K37-N39 PolarHBondContact O-N 3.28Å
38	G	96.9	Very high	97	Very high	34 Å²	34	90.3 Å²	90.3	35%	0.351	47%	0.466	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.8	-7.3	179.4	0	0	0	0	0	114.8	L34 L35 R36 Y40	L34-G38 PolarHBondContact O-N 3.27Å; L35-G38 PolarHBondContact O-N 2.96Å; R36-G38 VanDerWaalsContact C-N 3.27Å; R36-G38 PolarHBondContact O-N 2.89Å; G38-Y40 PolarHBondContact O-N 3.26Å; G38-Y40 VanDerWaalsContact O-N 3.11Å
39	N	94.8	Very high	97	Very high	137 Å²	137	90.3 Å²	90.3	73%	0.733	47%	0.466	S	S	*	.	T	Hydrogen-bonded Turn	trans	50.5	33.9	179.7	-62.7	-28	0	0	0	114.1	R36 K37 S41	R36-N39 PolarHBondContact O-N 3.42Å; R36-N39 PolarHBondContact O-OD1 2.93Å; K37-N39 PolarHBondContact O-N 3.28Å; N39-S41 PolarHBondContact O-N 3.03Å
40	Y	94.5	Very high	97	Very high	181 Å²	181	91.2 Å²	91.2	71%	0.71	47%	0.465	S	S	*	.	S	Bend	trans	-68.5	-20.7	-178.9	-58.5	-69.6	0	0	0	113.6	L35 G38	L35-Y40 HydrophobicContact CD2-CD2 4.1Å; L35-Y40 HydrophobicContact CD2-CE2 4.27Å; L35-Y40 WeakPolarHBondContact O-CD2 3.41Å; G38-Y40 PolarHBondContact O-N 3.26Å; G38-Y40 VanDerWaalsContact O-N 3.11Å
41	S	95	Very high	97	Very high	66 Å²	66	92.3 Å²	92.3	46%	0.462	47%	0.47	S	S	.	.			trans	-159.3	158.7	175.8	65.8	0	0	0	0	110	N39 R43	N39-S41 PolarHBondContact O-N 3.03Å; S41-R43 PolarHBondContact O-N 3.02Å; S41-R43 PolarHBondContact OG-O 3.29Å
42	E	95.3	Very high	97	Very high	195 Å²	195	94.6 Å²	94.6	91%	0.911	48%	0.482	S	S	*	.	S	Bend	trans	-61.2	-34.8	173.9	-63.3	-178.7	174.8	0	0	112.2
43	R	96.9	Very high	97	Very high	219 Å²	219	93 Å²	93	83%	0.826	47%	0.474	S	S	*	.			trans	-130.7	126.2	-178.2	-60.4	180	74.1	165.1	2.4	110.4	S41	S41-R43 PolarHBondContact O-N 3.02Å; S41-R43 PolarHBondContact OG-O 3.29Å
44	V	96.6	Very high	97.1	Very high	18 Å²	18	86.8 Å²	86.8	11%	0.109	46%	0.458	C	S	.	.			trans	-102.8	113.4	171.4	-179.2	0	0	0	0	108.7	L35 R36 A48	L35-V44 HydrophobicContact CB-CG1 4.13Å; L35-V44 HydrophobicContact CB-CG2 4.32Å; L35-V44 HydrophobicContact CD1-CG1 4.12Å; R36-V44 HydrophobicContact CG-CB 4.33Å; R36-V44 HydrophobicContact CG-CG2 4.11Å; V44-A48 HydrophobicContact CG1-CB 4.14Å
45	G	96.9	Very high	97.1	Very high	46 Å²	46	84.9 Å²	84.9	47%	0.474	45%	0.45	S	S	.	.			trans	-64.3	151.7	177	0	0	0	0	0	112.5	G47 A48 P49	G45-G47 VanDerWaalsContact C-N 3.26Å; G45-G47 PolarHBondContact O-N 3.42Å; G45-A48 WeakPolarHBondContact O-CB 3.46Å; G45-A48 PolarHBondContact O-N 3.16Å; G45-P49 WeakPolarHBondContact O-CD 3.44Å
46	A	95.2	Very high	97.2	Very high	80 Å²	80	86.9 Å²	86.9	66%	0.661	46%	0.461	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64	-29	-175.5	0	0	0	0	0	113.8	P49	A46-P49 WeakPolarHBondContact O-CD 3.43Å; A46-P49 WeakPolarHBondContact O-CG 3.49Å
47	G	97.6	Very high	97.3	Very high	48 Å²	48	82.4 Å²	82.4	50%	0.495	45%	0.445	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.7	-28.1	177	0	0	0	0	0	114.2	G45 V50 Y51	G45-G47 VanDerWaalsContact C-N 3.26Å; G45-G47 PolarHBondContact O-N 3.42Å; G47-V50 WeakPolarHBondContact O-CB 3.1Å; G47-V50 PolarHBondContact O-N 3.2Å; G47-Y51 PolarHBondContact O-N 2.86Å
48	A	98.2	Very high	97.3	Very high	44 Å²	44	81 Å²	81	36%	0.364	44%	0.436	S	S	.	.	H	α-helix	trans	-54	-49.6	-179.1	0	0	0	0	0	113.9	V44 G45 V50 Y51 L52	V44-A48 HydrophobicContact CG1-CB 4.14Å; G45-A48 WeakPolarHBondContact O-CB 3.46Å; G45-A48 PolarHBondContact O-N 3.16Å; A48-V50 VanDerWaalsContact C-N 3.29Å; A48-V50 PolarHBondContact O-N 2.94Å; A48-Y51 PolarHBondContact O-N 3.38Å; A48-L52 WeakPolarHBondContact O-CB 3.3Å; A48-L52 PolarHBondContact O-N 2.95Å
49	P	98.4	Very high	97.4	Very high	0 Å²	0	81.9 Å²	81.9	0%	0	43%	0.433	C	S	.	.	H	α-helix	trans	-69.9	-22.4	176.6	29	-38	0	0	0	114.2	V28 V31 H32 L35 G45 A46 A53	V28-P49 HydrophobicContact CG1-CB 4.24Å; V28-P49 HydrophobicContact CG1-CG 4.44Å; V31-P49 HydrophobicContact CB-CB 4.25Å; V31-P49 HydrophobicContact CG1-CB 4.02Å; H32-P49 HydrophobicContact CB-CB 3.63Å; H32-P49 HydrophobicContact CB-CG 3.74Å; L35-P49 HydrophobicContact CD1-CB 4.14Å; G45-P49 WeakPolarHBondContact O-CD 3.44Å; A46-P49 WeakPolarHBondContact O-CD 3.43Å; A46-P49 WeakPolarHBondContact O-CG 3.49Å; P49-A53 WeakPolarHBondContact O-CB 3.49Å; P49-A53 PolarHBondContact O-N 3.23Å
50	V	98.6	Very high	97.6	Very high	52 Å²	52	78 Å²	78	32%	0.315	41%	0.414	S	S	.	.	H	α-helix	trans	-72.9	-50.9	174.9	178.7	0	0	0	0	109.1	A22 L24 V28 G47 A48 L52 A53 A54	A22-V50 HydrophobicContact CB-CG1 3.86Å; L24-V50 HydrophobicContact CD1-CG1 4.26Å; V28-V50 HydrophobicContact CG1-CG2 3.72Å; G47-V50 WeakPolarHBondContact O-CB 3.1Å; G47-V50 PolarHBondContact O-N 3.2Å; A48-V50 VanDerWaalsContact C-N 3.29Å; A48-V50 PolarHBondContact O-N 2.94Å; V50-L52 PolarHBondContact O-N 3.14Å; V50-A53 PolarHBondContact O-N 3.37Å; V50-A54 WeakPolarHBondContact O-CB 3.32Å; V50-A54 PolarHBondContact O-N 3.22Å
51	Y	98.7	Very high	97.8	Very high	173 Å²	173	72 Å²	72	68%	0.678	40%	0.402	S	S	*	.	H	α-helix	trans	-58.1	-50.8	178.2	-179.1	-97.2	0	0	0	111.6	G47 A48 A53 A54 V55	G47-Y51 PolarHBondContact O-N 2.86Å; A48-Y51 PolarHBondContact O-N 3.38Å; Y51-A53 VanDerWaalsContact C-N 3.34Å; Y51-A53 PolarHBondContact O-N 3.26Å; Y51-A54 WeakPolarHBondContact O-CB 3.34Å; Y51-A54 PolarHBondContact O-N 2.75Å; Y51-V55 HydrophobicContact CD1-CG2 4.32Å; Y51-V55 HydrophobicContact CE1-CG2 3.9Å; Y51-V55 HydrophobicContact CE2-CG2 4.35Å; Y51-V55 WeakPolarHBondContact O-CG2 3.29Å; Y51-V55 PolarHBondContact O-N 3.08Å
52	L	98.6	Very high	97.9	Very high	65 Å²	65	72.1 Å²	72.1	34%	0.34	40%	0.395	S	S	.	.	H	α-helix	trans	-63.6	-39.9	179.8	-179	58.8	0	0	0	112.1	V31 L35 A48 V50 A54 V55 L56	V31-L52 HydrophobicContact CG1-CB 4.14Å; V31-L52 HydrophobicContact CG1-CD2 3.82Å; V31-L52 HydrophobicContact CG1-CG 4.1Å; L35-L52 HydrophobicContact CD1-CD2 4.31Å; L35-L52 HydrophobicContact CD2-CD2 3.92Å; L35-L52 HydrophobicContact CG-CD2 4.36Å; A48-L52 WeakPolarHBondContact O-CB 3.3Å; A48-L52 PolarHBondContact O-N 2.95Å; V50-L52 PolarHBondContact O-N 3.14Å; L52-A54 VanDerWaalsContact C-N 3.33Å; L52-A54 PolarHBondContact O-N 2.91Å; L52-V55 PolarHBondContact O-N 3.16Å; L52-L56 HydrophobicContact CD1-CD1 4.25Å; L52-L56 HydrophobicContact CD1-CG 4.19Å; L52-L56 HydrophobicContact CG-CD1 4.11Å; L52-L56 HydrophobicContact CG-CG 4.49Å; L52-L56 WeakPolarHBondContact O-CB 3.21Å; L52-L56 VanDerWaalsContact O-CG 3.23Å; L52-L56 WeakPolarHBondContact O-CG 3.32Å; L52-L56 PolarHBondContact O-N 3.22Å
53	A	98.7	Very high	98.1	Very high	0 Å²	0	64.4 Å²	64.4	0%	0	36%	0.36	C	S	.	.	H	α-helix	trans	-62.8	-41.2	175.3	0	0	0	0	0	111.8	L24 F26 V28 V31 P49 V50 Y51 L56 E57	L24-A53 HydrophobicContact CD1-CB 3.95Å; F26-A53 HydrophobicContact CB-CB 4.28Å; V28-A53 HydrophobicContact CG2-CB 3.91Å; V31-A53 HydrophobicContact CG2-CB 4.18Å; P49-A53 WeakPolarHBondContact O-CB 3.49Å; P49-A53 PolarHBondContact O-N 3.23Å; V50-A53 PolarHBondContact O-N 3.37Å; Y51-A53 VanDerWaalsContact C-N 3.34Å; Y51-A53 PolarHBondContact O-N 3.26Å; A53-L56 PolarHBondContact O-N 3.4Å; A53-E57 VanDerWaalsContact O-CB 3.31Å; A53-E57 WeakPolarHBondContact O-CB 3.31Å; A53-E57 PolarHBondContact O-N 3.11Å
54	A	98.8	Very high	98.2	Very high	35 Å²	35	58.2 Å²	58.2	29%	0.289	34%	0.343	S	S	.	.	H	α-helix	trans	-63.3	-45.2	177.8	0	0	0	0	0	112.2	L24 V50 Y51 L52 L56 E57 Y58	L24-A54 HydrophobicContact CD1-CB 4.03Å; L24-A54 HydrophobicContact CD2-CB 3.85Å; V50-A54 WeakPolarHBondContact O-CB 3.32Å; V50-A54 PolarHBondContact O-N 3.22Å; Y51-A54 WeakPolarHBondContact O-CB 3.34Å; Y51-A54 PolarHBondContact O-N 2.75Å; L52-A54 VanDerWaalsContact C-N 3.33Å; L52-A54 PolarHBondContact O-N 2.91Å; A54-L56 PolarHBondContact O-N 3.17Å; A54-E57 PolarHBondContact O-N 3.48Å; A54-Y58 WeakPolarHBondContact O-CB 3.29Å; A54-Y58 PolarHBondContact O-N 3.27Å
55	V	98.6	Very high	98.3	Very high	53 Å²	53	62.8 Å²	62.8	32%	0.321	36%	0.363	S	S	.	.	H	α-helix	trans	-62.6	-44.4	177.4	173	0	0	0	0	111.3	Y51 L52 E57 Y58 L59	Y51-V55 HydrophobicContact CD1-CG2 4.32Å; Y51-V55 HydrophobicContact CE1-CG2 3.9Å; Y51-V55 HydrophobicContact CE2-CG2 4.35Å; Y51-V55 WeakPolarHBondContact O-CG2 3.29Å; Y51-V55 PolarHBondContact O-N 3.08Å; L52-V55 PolarHBondContact O-N 3.16Å; V55-E57 VanDerWaalsContact C-N 3.34Å; V55-E57 PolarHBondContact O-N 2.99Å; V55-Y58 PolarHBondContact O-N 3.04Å; V55-L59 HydrophobicContact CG1-CD1 4.04Å; V55-L59 WeakPolarHBondContact O-CG 3.35Å; V55-L59 PolarHBondContact O-N 2.83Å
56	L	98.7	Very high	98.3	Very high	75 Å²	75	62.9 Å²	62.9	39%	0.393	35%	0.352	S	S	.	.	H	α-helix	trans	-64.2	-39.5	177.2	-69	173.4	0	0	0	112	F26 L52 A53 A54 T60	F26-L56 HydrophobicContact CD2-CB 3.76Å; F26-L56 VanDerWaalsContact CE2-C 3.47Å; F26-L56 HydrophobicContact CE2-CB 3.79Å; F26-L56 WeakPolarHBondContact CE2-O 3.24Å; L52-L56 HydrophobicContact CD1-CD1 4.25Å; L52-L56 HydrophobicContact CD1-CG 4.19Å; L52-L56 HydrophobicContact CG-CD1 4.11Å; L52-L56 HydrophobicContact CG-CG 4.49Å; L52-L56 WeakPolarHBondContact O-CB 3.21Å; L52-L56 VanDerWaalsContact O-CG 3.23Å; L52-L56 WeakPolarHBondContact O-CG 3.32Å; L52-L56 PolarHBondContact O-N 3.22Å; A53-L56 PolarHBondContact O-N 3.4Å; A54-L56 PolarHBondContact O-N 3.17Å; L56-T60 VanDerWaalsContact O-CB 3.31Å; L56-T60 WeakPolarHBondContact O-CB 3.06Å; L56-T60 PolarHBondContact O-N 2.77Å; L56-T60 PolarHBondContact O-OG1 3.01Å
57	E	98.7	Very high	98.5	Very high	38 Å²	38	59 Å²	59	18%	0.178	32%	0.321	C	S	.	.	H	α-helix	trans	-64.6	-48.2	176.6	-175.5	166.2	148.6	0	0	111.3	L24 Q25 F26 A53 A54 V55 T60 A61	L24-E57 WeakPolarHBondContact CA-OE2 3.45Å; L24-E57 WeakPolarHBondContact CB-OE2 3.29Å; Q25-E57 PolarHBondContact N-OE1 3.29Å; Q25-E57 VanDerWaalsContact N-OE1 3.16Å; Q25-E57 PolarHBondContact N-OE2 3.18Å; F26-E57 HydrophobicContact CB-CB 4.09Å; F26-E57 WeakPolarHBondContact CB-OE2 3.3Å; F26-E57 HydrophobicContact CD1-CB 3.81Å; F26-E57 HydrophobicContact CD1-CG 3.82Å; F26-E57 HydrophobicContact CD2-CB 3.98Å; F26-E57 HydrophobicContact CE1-CB 4.26Å; F26-E57 HydrophobicContact CE1-CG 4.22Å; F26-E57 HydrophobicContact CE2-CB 4.4Å; F26-E57 HydrophobicContact CG-CB 3.69Å; F26-E57 HydrophobicContact CG-CG 4.19Å; F26-E57 PolarHBondContact N-OE2 2.71Å; A53-E57 VanDerWaalsContact O-CB 3.31Å; A53-E57 WeakPolarHBondContact O-CB 3.31Å; A53-E57 PolarHBondContact O-N 3.11Å; A54-E57 PolarHBondContact O-N 3.48Å; V55-E57 VanDerWaalsContact C-N 3.34Å; V55-E57 PolarHBondContact O-N 2.99Å; E57-T60 PolarHBondContact O-N 3.21Å; E57-A61 WeakPolarHBondContact O-CB 3.37Å; E57-A61 PolarHBondContact O-N 2.83Å
58	Y	98.3	Very high	98.6	Very high	141 Å²	141	58 Å²	58	55%	0.553	31%	0.31	S	S	*	.	H	α-helix	trans	-56	-54	177	171.2	-100.3	0	0	0	111.9	A54 V55 T60 A61 E62	A54-Y58 WeakPolarHBondContact O-CB 3.29Å; A54-Y58 PolarHBondContact O-N 3.27Å; V55-Y58 PolarHBondContact O-N 3.04Å; Y58-T60 VanDerWaalsContact C-N 3.29Å; Y58-T60 PolarHBondContact O-N 2.95Å; Y58-A61 PolarHBondContact O-N 3.42Å; Y58-E62 PolarHBondContact O-N 3.36Å
59	L	98.3	Very high	98.6	Very high	54 Å²	54	57.9 Å²	57.9	28%	0.283	30%	0.304	S	S	.	.	H	α-helix	trans	-61.6	-38.3	179.8	-69.2	172.8	0	0	0	112.1	V55 I63 L97	V55-L59 HydrophobicContact CG1-CD1 4.04Å; V55-L59 WeakPolarHBondContact O-CG 3.35Å; V55-L59 PolarHBondContact O-N 2.83Å; L59-I63 WeakPolarHBondContact O-CD1 3.38Å; L59-I63 VanDerWaalsContact O-CG1 3.26Å; L59-I63 WeakPolarHBondContact O-CG1 3.32Å; L59-I63 PolarHBondContact O-N 3.46Å; L59-I63 VanDerWaalsContact O-N 3.17Å; L59-L97 HydrophobicContact CD1-CD2 4.38Å; L59-L97 HydrophobicContact CD2-CD2 3.8Å
60	T	98.6	Very high	98.6	Very high	54 Å²	54	58.5 Å²	58.5	33%	0.331	31%	0.309	S	S	.	.	H	α-helix	trans	-68.7	-43.1	178.2	-57.2	0	0	0	0	111.1	F26 L56 E57 Y58 I63 L64	F26-T60 HydrophobicContact CZ-CG2 3.88Å; F26-T60 WeakPolarHBondContact CZ-OG1 3.47Å; L56-T60 VanDerWaalsContact O-CB 3.31Å; L56-T60 WeakPolarHBondContact O-CB 3.06Å; L56-T60 PolarHBondContact O-N 2.77Å; L56-T60 PolarHBondContact O-OG1 3.01Å; E57-T60 PolarHBondContact O-N 3.21Å; Y58-T60 VanDerWaalsContact C-N 3.29Å; Y58-T60 PolarHBondContact O-N 2.95Å; T60-I63 PolarHBondContact O-N 2.84Å; T60-L64 HydrophobicContact CG2-CD1 3.69Å; T60-L64 HydrophobicContact CG2-CG 4.11Å; T60-L64 VanDerWaalsContact O-CB 3.32Å; T60-L64 WeakPolarHBondContact O-CB 3.43Å; T60-L64 WeakPolarHBondContact O-CG 3.31Å; T60-L64 PolarHBondContact O-N 3.47Å
61	A	98.4	Very high	98.6	Very high	55 Å²	55	56.2 Å²	56.2	46%	0.455	30%	0.295	S	S	.	.	H	α-helix	trans	-60.1	-46.2	178.1	0	0	0	0	0	111.1	E57 Y58 L64 E65	E57-A61 WeakPolarHBondContact O-CB 3.37Å; E57-A61 PolarHBondContact O-N 2.83Å; Y58-A61 PolarHBondContact O-N 3.42Å; A61-L64 PolarHBondContact O-N 3.31Å; A61-E65 WeakPolarHBondContact O-CB 3.46Å; A61-E65 PolarHBondContact O-N 3.04Å
62	E	98.4	Very high	98.6	Very high	69 Å²	69	55.8 Å²	55.8	32%	0.322	29%	0.292	S	S	.	.	H	α-helix	trans	-60.6	-49.1	179.2	-167.8	59.3	-146.4	0	0	112	Y58 L64 E65 L66 L94	Y58-E62 PolarHBondContact O-N 3.36Å; E62-L64 VanDerWaalsContact C-N 3.32Å; E62-L64 PolarHBondContact O-N 2.9Å; E62-E65 PolarHBondContact O-N 3.01Å; E62-L66 HydrophobicContact CG-CD1 4.5Å; E62-L66 WeakPolarHBondContact O-CG 3.26Å; E62-L66 PolarHBondContact O-N 2.96Å; E62-L66 VanDerWaalsContact O-N 3.14Å; E62-L94 HydrophobicContact CG-CD1 4.34Å
63	I	98.6	Very high	98.5	Very high	34 Å²	34	58.1 Å²	58.1	17%	0.174	31%	0.305	C	S	.	.	H	α-helix	trans	-61.4	-42	177.8	-67.4	168	0	0	0	111	L59 T60 A67 L84 I88 L94 L98	L59-I63 WeakPolarHBondContact O-CD1 3.38Å; L59-I63 VanDerWaalsContact O-CG1 3.26Å; L59-I63 WeakPolarHBondContact O-CG1 3.32Å; L59-I63 PolarHBondContact O-N 3.46Å; L59-I63 VanDerWaalsContact O-N 3.17Å; T60-I63 PolarHBondContact O-N 2.84Å; I63-A67 WeakPolarHBondContact O-CB 3.23Å; I63-A67 PolarHBondContact O-N 3Å; I63-L84 HydrophobicContact CG2-CD2 3.77Å; I63-I88 HydrophobicContact CG2-CD1 4.27Å; I63-I88 HydrophobicContact CG2-CG1 4.41Å; I63-L94 HydrophobicContact CD1-CD2 4.24Å; I63-L94 HydrophobicContact CG1-CD1 3.86Å; I63-L94 HydrophobicContact CG1-CD2 3.81Å; I63-L94 HydrophobicContact CG1-CG 4.5Å; I63-L98 HydrophobicContact CD1-CD1 4.28Å
64	L	98.6	Very high	98.4	Very high	89 Å²	89	61.9 Å²	61.9	47%	0.466	33%	0.325	S	S	.	.	H	α-helix	trans	-71.7	-35.2	-178.5	-72.5	179.1	0	0	0	112.8	T60 A61 E62 G68 I79	T60-L64 HydrophobicContact CG2-CD1 3.69Å; T60-L64 HydrophobicContact CG2-CG 4.11Å; T60-L64 VanDerWaalsContact O-CB 3.32Å; T60-L64 WeakPolarHBondContact O-CB 3.43Å; T60-L64 WeakPolarHBondContact O-CG 3.31Å; T60-L64 PolarHBondContact O-N 3.47Å; A61-L64 PolarHBondContact O-N 3.31Å; E62-L64 VanDerWaalsContact C-N 3.32Å; E62-L64 PolarHBondContact O-N 2.9Å; L64-G68 WeakPolarHBondContact O-CA 3.27Å; L64-G68 PolarHBondContact O-N 2.91Å; L64-I79 HydrophobicContact CD2-CD1 4.03Å
65	E	98.5	Very high	98.4	Very high	113 Å²	113	69.4 Å²	69.4	53%	0.528	35%	0.352	S	S	.	.	H	α-helix	trans	-61.9	-55.2	175.1	178	57	-144.9	0	0	110.1	A61 E62 A67 G68 N69	A61-E65 WeakPolarHBondContact O-CB 3.46Å; A61-E65 PolarHBondContact O-N 3.04Å; E62-E65 PolarHBondContact O-N 3.01Å; E65-A67 PolarHBondContact O-N 2.8Å; E65-G68 PolarHBondContact O-N 3.16Å; E65-G68 VanDerWaalsContact O-N 3.16Å; E65-N69 PolarHBondContact O-N 3.45Å; E65-N69 PolarHBondContact O-ND2 2.77Å; E65-N69 PolarHBondContact OE1-ND2 3.33Å
66	L	98.7	Very high	98.4	Very high	48 Å²	48	73 Å²	73	25%	0.251	36%	0.363	S	S	.	.	H	α-helix	trans	-63.2	-41.4	179.4	-64.1	176.8	0	0	0	112.3	E62 G68 N69 A70 A87 D91 L94	E62-L66 HydrophobicContact CG-CD1 4.5Å; E62-L66 WeakPolarHBondContact O-CG 3.26Å; E62-L66 PolarHBondContact O-N 2.96Å; E62-L66 VanDerWaalsContact O-N 3.14Å; L66-G68 VanDerWaalsContact C-N 3.33Å; L66-N69 PolarHBondContact O-N 2.87Å; L66-A70 PolarHBondContact O-N 3.3Å; L66-A87 HydrophobicContact CB-CB 3.66Å; L66-D91 HydrophobicContact CD1-CB 3.96Å; L66-L94 HydrophobicContact CD1-CD1 3.8Å
67	A	98.8	Very high	98.3	Very high	0 Å²	0	77 Å²	77	0%	0	39%	0.391	C	S	.	.	H	α-helix	trans	-69.7	-31.4	176.5	0	0	0	0	0	112.5	I63 E65 A71 I79 H83 L84 A87	I63-A67 WeakPolarHBondContact O-CB 3.23Å; I63-A67 PolarHBondContact O-N 3Å; E65-A67 PolarHBondContact O-N 2.8Å; A67-A71 WeakPolarHBondContact O-CB 3.03Å; A67-A71 PolarHBondContact O-N 2.71Å; A67-I79 HydrophobicContact CB-CD1 4.15Å; A67-I79 HydrophobicContact CB-CG1 4.46Å; A67-I79 HydrophobicContact CB-CG2 3.99Å; A67-H83 HydrophobicContact CB-CB 4.45Å; A67-L84 HydrophobicContact CB-CD2 3.81Å; A67-A87 HydrophobicContact CB-CB 4.03Å
68	G	98.7	Very high	98.3	Very high	27 Å²	27	84.3 Å²	84.3	28%	0.278	42%	0.417	S	S	.	.	H	α-helix	trans	-64.1	-45.1	171.8	0	0	0	0	0	111.5	L64 E65 L66 A71 R72	L64-G68 WeakPolarHBondContact O-CA 3.27Å; L64-G68 PolarHBondContact O-N 2.91Å; E65-G68 PolarHBondContact O-N 3.16Å; E65-G68 VanDerWaalsContact O-N 3.16Å; L66-G68 VanDerWaalsContact C-N 3.33Å; G68-A71 WeakPolarHBondContact O-CB 3.37Å; G68-A71 PolarHBondContact O-N 3.45Å; G68-R72 PolarHBondContact O-N 3.03Å
69	N	98.5	Very high	98.4	Very high	41 Å²	41	80.8 Å²	80.8	22%	0.219	41%	0.406	C	S	.	.	H	α-helix	trans	-59.4	-49.5	173.2	-71	-40.4	0	0	0	111.1	E65 L66 A71 R72 D73	E65-N69 PolarHBondContact O-N 3.45Å; E65-N69 PolarHBondContact O-ND2 2.77Å; E65-N69 PolarHBondContact OE1-ND2 3.33Å; L66-N69 PolarHBondContact O-N 2.87Å; N69-A71 VanDerWaalsContact C-N 3.28Å; N69-A71 PolarHBondContact O-N 3.49Å; N69-R72 WeakPolarHBondContact O-CB 3.32Å; N69-R72 PolarHBondContact O-N 3.45Å; N69-R72 VanDerWaalsContact O-N 3.12Å; N69-R72 PolarHBondContact OD1-NH2 2.91Å; N69-D73 VanDerWaalsContact O-CG 3.24Å; N69-D73 PolarHBondContact O-N 3.02Å
70	A	98.4	Very high	98.4	Very high	13 Å²	13	81.9 Å²	81.9	11%	0.107	41%	0.412	C	S	.	.	H	α-helix	trans	-61	-34.1	176.4	0	0	0	0	0	113.5	L66 N74 H83 L86	L66-A70 PolarHBondContact O-N 3.3Å; A70-N74 PolarHBondContact O-N 3.42Å; A70-N74 PolarHBondContact O-ND2 2.95Å; A70-H83 HydrophobicContact CB-CB 4.23Å; A70-L86 HydrophobicContact CB-CB 4.32Å
71	A	98.7	Very high	98.4	Very high	4 Å²	4	81.9 Å²	81.9	3%	0.033	41%	0.413	C	S	.	.	H	α-helix	trans	-66.8	-44.8	174.8	0	0	0	0	0	111.7	A67 G68 N69 N74 K75 K76 I79 H83	A67-A71 WeakPolarHBondContact O-CB 3.03Å; A67-A71 PolarHBondContact O-N 2.71Å; G68-A71 WeakPolarHBondContact O-CB 3.37Å; G68-A71 PolarHBondContact O-N 3.45Å; N69-A71 VanDerWaalsContact C-N 3.28Å; N69-A71 PolarHBondContact O-N 3.49Å; A71-N74 CarbonylContact O-C 3.58Å; A71-N74 PolarHBondContact O-N 3.5Å; A71-K75 PolarHBondContact O-N 3.05Å; A71-K76 CarbonylContact C-O 3.5Å; A71-K76 PolarHBondContact O-N 3.44Å; A71-K76 VanDerWaalsContact O-O 3.09Å; A71-I79 HydrophobicContact CB-CG1 4.25Å; A71-H83 VanDerWaalsContact CA-CE1 3.48Å; A71-H83 WeakPolarHBondContact CA-CE1 3.49Å; A71-H83 WeakPolarHBondContact CA-ND1 3.41Å; A71-H83 HydrophobicContact CB-CB 4.49Å; A71-H83 WeakPolarHBondContact CB-ND1 3.46Å
72	R	98.5	Very high	98.4	Very high	164 Å²	164	82.4 Å²	82.4	62%	0.619	40%	0.403	S	S	*	.	H	α-helix	trans	-61.5	-43.4	177.6	-175.4	179.5	65.7	-148	-8.4	111.5	G68 N69 N74 K75	G68-R72 PolarHBondContact O-N 3.03Å; N69-R72 WeakPolarHBondContact O-CB 3.32Å; N69-R72 PolarHBondContact O-N 3.45Å; N69-R72 VanDerWaalsContact O-N 3.12Å; N69-R72 PolarHBondContact OD1-NH2 2.91Å; R72-N74 VanDerWaalsContact C-N 3.26Å; R72-N74 PolarHBondContact O-N 3.09Å; R72-K75 WeakPolarHBondContact O-CA 3.39Å; R72-K75 PolarHBondContact O-N 3.19Å
73	D	97.6	Very high	98.4	Very high	114 Å²	114	79.2 Å²	79.2	61%	0.61	39%	0.388	S	S	*	.	H	α-helix	trans	-62.9	-35.3	178.8	-63.8	-14.9	0	0	0	111.7	N69 K75	N69-D73 VanDerWaalsContact O-CG 3.24Å; N69-D73 PolarHBondContact O-N 3.02Å; D73-K75 PolarHBondContact O-N 3.19Å
74	N	96.9	Very high	98.4	Very high	78 Å²	78	80 Å²	80	42%	0.417	39%	0.392	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.3	11.1	172	-68.4	-32.1	0	0	0	113.9	A70 A71 R72 K76 H83	A70-N74 PolarHBondContact O-N 3.42Å; A70-N74 PolarHBondContact O-ND2 2.95Å; A71-N74 CarbonylContact O-C 3.58Å; A71-N74 PolarHBondContact O-N 3.5Å; R72-N74 VanDerWaalsContact C-N 3.26Å; R72-N74 PolarHBondContact O-N 3.09Å; N74-K76 VanDerWaalsContact C-N 3.25Å; N74-K76 HydrophobicContact CB-CG 4.35Å; N74-K76 WeakPolarHBondContact O-CG 3.08Å; N74-K76 PolarHBondContact O-N 2.89Å; N74-H83 PolarHBondContact ND2-CD2 3.28Å; N74-H83 VanDerWaalsContact ND2-CD2 3.29Å; N74-H83 PolarHBondContact ND2-NE2 3.43Å
75	K	98.1	Very high	98.4	Very high	194 Å²	194	76.5 Å²	76.5	84%	0.843	37%	0.374	S	S	*	.	T	Hydrogen-bonded Turn	trans	55.7	38	-179.2	-53.5	177.3	-177.8	178.6	0	112.5	A71 R72 D73	A71-K75 PolarHBondContact O-N 3.05Å; R72-K75 WeakPolarHBondContact O-CA 3.39Å; R72-K75 PolarHBondContact O-N 3.19Å; D73-K75 PolarHBondContact O-N 3.19Å
76	K	98.3	Very high	98.3	Very high	127 Å²	127	72.5 Å²	72.5	55%	0.552	36%	0.356	S	S	*	.			trans	-116.5	145.5	176.7	-58.1	-57.5	179.7	-177.8	0	110.5	A71 N74	A71-K76 CarbonylContact C-O 3.5Å; A71-K76 PolarHBondContact O-N 3.44Å; A71-K76 VanDerWaalsContact O-O 3.09Å; N74-K76 VanDerWaalsContact C-N 3.25Å; N74-K76 HydrophobicContact CB-CG 4.35Å; N74-K76 WeakPolarHBondContact O-CG 3.08Å; N74-K76 PolarHBondContact O-N 2.89Å
77	T	97.3	Very high	98.3	Very high	160 Å²	160	70.6 Å²	70.6	98%	0.982	35%	0.347	S	S	*	.	S	Bend	trans	-93.8	-6	173.7	54.6	0	0	0	0	113.1
78	R	98.7	Very high	98.3	Very high	192 Å²	192	71 Å²	71	73%	0.725	35%	0.349	S	S	*	.	S	Bend	trans	-118.2	129.3	-177.5	-177.2	176.7	-65.7	146.2	1.6	110.4	I80 H83	R78-I80 HydrophobicContact CG-CG2 4.42Å; R78-I80 PolarHBondContact O-N 3.17Å; R78-H83 PolarHBondContact O-CE1 3.01Å; R78-H83 VanDerWaalsContact O-CE1 3.31Å; R78-H83 PolarHBondContact O-ND1 3.14Å
79	I	98.7	Very high	98.3	Very high	66 Å²	66	71.6 Å²	71.6	34%	0.338	34%	0.343	S	S	.	.			trans	-69.1	127.4	168.2	-63.9	172.7	0	0	0	108.6	L64 A67 A71 H83 L84	L64-I79 HydrophobicContact CD2-CD1 4.03Å; A67-I79 HydrophobicContact CB-CD1 4.15Å; A67-I79 HydrophobicContact CB-CG1 4.46Å; A67-I79 HydrophobicContact CB-CG2 3.99Å; A71-I79 HydrophobicContact CB-CG1 4.25Å; I79-H83 HydrophobicContact CG2-CB 4.27Å; I79-L84 HydrophobicContact CG2-CD2 4.1Å; I79-L84 HydrophobicContact CG2-CG 4.1Å
80	I	98.4	Very high	98.2	Very high	77 Å²	77	75.1 Å²	75.1	40%	0.395	36%	0.361	S	S	.	.			trans	-122.4	167.1	174.6	68.1	172.3	0	0	0	108.8	R78 R82 H83 L84	R78-I80 HydrophobicContact CG-CG2 4.42Å; R78-I80 PolarHBondContact O-N 3.17Å; I80-R82 HydrophobicContact CD1-CB 4.04Å; I80-R82 HydrophobicContact CG1-CB 4.03Å; I80-R82 PolarHBondContact O-N 3.38Å; I80-H83 PolarHBondContact N-ND1 3.4Å; I80-H83 WeakPolarHBondContact O-CB 3.36Å; I80-H83 PolarHBondContact O-N 3.11Å; I80-L84 PolarHBondContact O-N 2.86Å
81	P	98.6	Very high	98.2	Very high	54 Å²	54	76.6 Å²	76.6	35%	0.351	37%	0.367	S	S	.	.	H	α-helix	trans	-53.2	-33	-178.6	-30.1	37.5	0	0	0	114.7	H83 L84 Q85 I103 A104 Q105	P81-H83 VanDerWaalsContact C-N 3.32Å; P81-H83 PolarHBondContact O-N 3.26Å; P81-L84 PolarHBondContact O-N 3.05Å; P81-Q85 PolarHBondContact O-N 3.21Å; P81-I103 HydrophobicContact CB-CG2 4.37Å; P81-A104 VanDerWaalsContact CB-O 3.29Å; P81-A104 WeakPolarHBondContact CB-O 3.48Å; P81-Q105 HydrophobicContact CB-CB 4.06Å; P81-Q105 HydrophobicContact CG-CB 4.2Å
82	R	98.4	Very high	98.1	Very high	67 Å²	67	84.5 Å²	84.5	25%	0.253	40%	0.404	S	S	.	.	H	α-helix	trans	-57.6	-41.7	172.4	179.5	55.5	177.6	176	-1.8	113	I80 Q85 L86 G106 V108	I80-R82 HydrophobicContact CD1-CB 4.04Å; I80-R82 HydrophobicContact CG1-CB 4.03Å; I80-R82 PolarHBondContact O-N 3.38Å; R82-Q85 PolarHBondContact O-N 2.76Å; R82-L86 HydrophobicContact CG-CD1 4.28Å; R82-L86 WeakPolarHBondContact O-CG 3.38Å; R82-L86 PolarHBondContact O-N 3.36Å; R82-G106 WeakPolarHBondContact CD-O 3.39Å; R82-G106 PolarHBondContact NH1-O 3.04Å; R82-V108 PolarHBondContact NH1-O 3.36Å; R82-V108 PolarHBondContact NH2-O 3.11Å
83	H	98.7	Very high	98.1	Very high	2 Å²	2	83.7 Å²	83.7	1%	0.009	41%	0.407	C	S	.	.	H	α-helix	trans	-68.7	-37.9	-179.9	-55.1	152.2	0	0	0	111.2	A67 A70 A71 N74 R78 I79 I80 P81 L86 A87	A67-H83 HydrophobicContact CB-CB 4.45Å; A70-H83 HydrophobicContact CB-CB 4.23Å; A71-H83 VanDerWaalsContact CA-CE1 3.48Å; A71-H83 WeakPolarHBondContact CA-CE1 3.49Å; A71-H83 WeakPolarHBondContact CA-ND1 3.41Å; A71-H83 HydrophobicContact CB-CB 4.49Å; A71-H83 WeakPolarHBondContact CB-ND1 3.46Å; N74-H83 PolarHBondContact ND2-CD2 3.28Å; N74-H83 VanDerWaalsContact ND2-CD2 3.29Å; N74-H83 PolarHBondContact ND2-NE2 3.43Å; R78-H83 PolarHBondContact O-CE1 3.01Å; R78-H83 VanDerWaalsContact O-CE1 3.31Å; R78-H83 PolarHBondContact O-ND1 3.14Å; I79-H83 HydrophobicContact CG2-CB 4.27Å; I80-H83 PolarHBondContact N-ND1 3.4Å; I80-H83 WeakPolarHBondContact O-CB 3.36Å; I80-H83 PolarHBondContact O-N 3.11Å; P81-H83 VanDerWaalsContact C-N 3.32Å; P81-H83 PolarHBondContact O-N 3.26Å; H83-L86 PolarHBondContact O-N 3.07Å; H83-A87 VanDerWaalsContact O-CB 3.31Å; H83-A87 WeakPolarHBondContact O-CB 3.23Å; H83-A87 PolarHBondContact O-N 3.02Å
84	L	98.5	Very high	98.1	Very high	50 Å²	50	78.5 Å²	78.5	26%	0.262	38%	0.379	S	S	.	.	H	α-helix	trans	-62.6	-43.6	172.7	-64.7	173.4	0	0	0	111.5	I63 A67 I79 I80 P81 A87 I88 I103	I63-L84 HydrophobicContact CG2-CD2 3.77Å; A67-L84 HydrophobicContact CB-CD2 3.81Å; I79-L84 HydrophobicContact CG2-CD2 4.1Å; I79-L84 HydrophobicContact CG2-CG 4.1Å; I80-L84 PolarHBondContact O-N 2.86Å; P81-L84 PolarHBondContact O-N 3.05Å; L84-A87 PolarHBondContact O-N 3Å; L84-I88 HydrophobicContact CB-CD1 4.42Å; L84-I88 VanDerWaalsContact O-CB 3.3Å; L84-I88 WeakPolarHBondContact O-CB 3.31Å; L84-I88 WeakPolarHBondContact O-CD1 3.36Å; L84-I88 WeakPolarHBondContact O-CG1 3.37Å; L84-I88 PolarHBondContact O-N 3.3Å; L84-I103 HydrophobicContact CB-CG2 4.49Å
85	Q	98.4	Very high	98.2	Very high	16 Å²	16	77.9 Å²	77.9	8%	0.075	38%	0.376	C	S	.	.	H	α-helix	trans	-61.6	-46.6	176.9	-178	76	21.7	0	0	111.8	P81 R82 R89 I103 G106 G107	P81-Q85 PolarHBondContact O-N 3.21Å; R82-Q85 PolarHBondContact O-N 2.76Å; Q85-R89 HydrophobicContact CG-CG 4.29Å; Q85-R89 WeakPolarHBondContact O-CB 3.4Å; Q85-R89 VanDerWaalsContact O-CG 3.29Å; Q85-R89 WeakPolarHBondContact O-CG 3.49Å; Q85-R89 PolarHBondContact O-N 3.24Å; Q85-I103 HydrophobicContact CB-CD1 4.49Å; Q85-G106 WeakPolarHBondContact CB-O 3.43Å; Q85-G106 WeakPolarHBondContact CG-O 3.39Å; Q85-G107 VanDerWaalsContact CD-O 3.23Å; Q85-G107 WeakPolarHBondContact CG-O 3.19Å; Q85-G107 PolarHBondContact NE2-O 3.47Å
86	L	98.1	Very high	98.2	Very high	29 Å²	29	77.1 Å²	77.1	15%	0.152	37%	0.373	C	S	.	.	H	α-helix	trans	-62.9	-43.9	178.6	-69.6	176.8	0	0	0	111.3	A70 R82 H83 N90 L109	A70-L86 HydrophobicContact CB-CB 4.32Å; R82-L86 HydrophobicContact CG-CD1 4.28Å; R82-L86 WeakPolarHBondContact O-CG 3.38Å; R82-L86 PolarHBondContact O-N 3.36Å; H83-L86 PolarHBondContact O-N 3.07Å; L86-N90 VanDerWaalsContact O-CB 3.29Å; L86-N90 WeakPolarHBondContact O-CB 3.4Å; L86-N90 PolarHBondContact O-N 2.98Å; L86-N90 PolarHBondContact O-ND2 3.5Å; L86-L109 HydrophobicContact CD2-CD2 3.92Å
87	A	98.2	Very high	98.1	Very high	7 Å²	7	76 Å²	76	6%	0.058	37%	0.372	C	S	.	.	H	α-helix	trans	-62.2	-55	177.4	0	0	0	0	0	111.9	L66 A67 H83 L84 R89 D91	L66-A87 HydrophobicContact CB-CB 3.66Å; A67-A87 HydrophobicContact CB-CB 4.03Å; H83-A87 VanDerWaalsContact O-CB 3.31Å; H83-A87 WeakPolarHBondContact O-CB 3.23Å; H83-A87 PolarHBondContact O-N 3.02Å; L84-A87 PolarHBondContact O-N 3Å; A87-R89 PolarHBondContact O-N 3.5Å; A87-D91 PolarHBondContact O-N 2.98Å
88	I	98.3	Very high	98.1	Very high	9 Å²	9	70.2 Å²	70.2	5%	0.046	34%	0.335	C	S	.	.	H	α-helix	trans	-67.4	-35.6	-173.1	-70.6	162.9	0	0	0	112.3	I63 L84 L94 N95 L98 I103	I63-I88 HydrophobicContact CG2-CD1 4.27Å; I63-I88 HydrophobicContact CG2-CG1 4.41Å; L84-I88 HydrophobicContact CB-CD1 4.42Å; L84-I88 VanDerWaalsContact O-CB 3.3Å; L84-I88 WeakPolarHBondContact O-CB 3.31Å; L84-I88 WeakPolarHBondContact O-CD1 3.36Å; L84-I88 WeakPolarHBondContact O-CG1 3.37Å; L84-I88 PolarHBondContact O-N 3.3Å; I88-L94 HydrophobicContact CG2-CB 4.43Å; I88-N95 VanDerWaalsContact O-CA 3.29Å; I88-N95 WeakPolarHBondContact O-CA 3.47Å; I88-N95 VanDerWaalsContact O-CB 3.3Å; I88-N95 WeakPolarHBondContact O-CB 3.31Å; I88-N95 PolarHBondContact O-N 2.93Å; I88-N95 VanDerWaalsContact O-N 3.11Å; I88-L98 HydrophobicContact CD1-CD1 3.68Å; I88-L98 HydrophobicContact CG1-CD1 3.97Å; I88-L98 HydrophobicContact CG2-CB 3.93Å; I88-L98 HydrophobicContact CG2-CD1 3.75Å; I88-L98 HydrophobicContact CG2-CG 4.4Å; I88-I103 HydrophobicContact CB-CD1 4.31Å; I88-I103 HydrophobicContact CD1-CD1 3.59Å; I88-I103 HydrophobicContact CG2-CD1 4.48Å
89	R	98	Very high	98	Very high	39 Å²	39	63.5 Å²	63.5	15%	0.147	33%	0.326	C	S	.	.	H	α-helix	trans	-85.3	-23.6	-176.9	-60.2	-52.7	173.5	-150.3	-4.1	114.5	Q85 A87 N95 L98 V101 L109	Q85-R89 HydrophobicContact CG-CG 4.29Å; Q85-R89 WeakPolarHBondContact O-CB 3.4Å; Q85-R89 VanDerWaalsContact O-CG 3.29Å; Q85-R89 WeakPolarHBondContact O-CG 3.49Å; Q85-R89 PolarHBondContact O-N 3.24Å; A87-R89 PolarHBondContact O-N 3.5Å; R89-N95 WeakPolarHBondContact CD-OD1 3.48Å; R89-N95 PolarHBondContact NH1-OD1 3.38Å; R89-L98 PolarHBondContact NH1-O 3.17Å; R89-V101 PolarHBondContact NH2-O 3.31Å; R89-L109 HydrophobicContact CB-CD1 3.61Å; R89-L109 HydrophobicContact CB-CD2 3.96Å; R89-L109 HydrophobicContact CB-CG 3.63Å; R89-L109 HydrophobicContact CG-CG 4.42Å
90	N	97.1	Very high	97.9	Very high	115 Å²	115	72.3 Å²	72.3	62%	0.615	36%	0.355	S	S	*	.	H	α-helix	trans	-84.8	-19.8	175.5	-72.5	-46.2	0	0	0	112.5	L86	L86-N90 VanDerWaalsContact O-CB 3.29Å; L86-N90 WeakPolarHBondContact O-CB 3.4Å; L86-N90 PolarHBondContact O-N 2.98Å; L86-N90 PolarHBondContact O-ND2 3.5Å
91	D	98	Very high	97.8	Very high	44 Å²	44	72.1 Å²	72.1	24%	0.235	36%	0.357	C	S	.	.	S	Bend	trans	-87.8	128.7	172.8	-179	-98.1	0	0	0	111.5	L66 A87 E93 L94 N95	L66-D91 HydrophobicContact CD1-CB 3.96Å; A87-D91 PolarHBondContact O-N 2.98Å; D91-E93 PolarHBondContact OD1-N 3.4Å; D91-L94 HydrophobicContact CB-CB 4.11Å; D91-L94 HydrophobicContact CB-CD1 4.12Å; D91-L94 HydrophobicContact CB-CG 4.35Å; D91-L94 VanDerWaalsContact OD1-CB 3.27Å; D91-L94 WeakPolarHBondContact OD1-CB 3.15Å; D91-L94 VanDerWaalsContact OD1-CG 3.23Å; D91-L94 WeakPolarHBondContact OD1-CG 3.45Å; D91-L94 PolarHBondContact OD1-N 3.25Å; D91-N95 WeakPolarHBondContact O-CB 3.43Å; D91-N95 PolarHBondContact O-N 3.17Å
92	E	97.7	Very high	97.7	Very high	170 Å²	170	75.9 Å²	75.9	79%	0.794	38%	0.379	S	S	*	.	H	α-helix	trans	-65.3	-46	-173.9	-174.8	-178.8	166.9	0	0	112.3	K96	E92-K96 WeakPolarHBondContact O-CB 3.42Å; E92-K96 PolarHBondContact O-N 3.47Å
93	E	98	Very high	97.7	Very high	147 Å²	147	74.1 Å²	74.1	69%	0.687	37%	0.374	S	S	*	.	H	α-helix	trans	-71.6	-46.2	-174.4	-61.8	-167.5	155.7	0	0	111.3	D91 K96 L97	D91-E93 PolarHBondContact OD1-N 3.4Å; E93-K96 PolarHBondContact O-N 3.01Å; E93-L97 VanDerWaalsContact O-CB 3.31Å; E93-L97 WeakPolarHBondContact O-CB 3.44Å; E93-L97 PolarHBondContact O-N 2.88Å
94	L	98.3	Very high	97.7	Very high	6 Å²	6	77.7 Å²	77.7	3%	0.031	40%	0.404	C	S	.	.	H	α-helix	trans	-65.8	-38.7	176	-67.9	177	0	0	0	111.4	E62 I63 L66 I88 D91 K96 L97 L98	E62-L94 HydrophobicContact CG-CD1 4.34Å; I63-L94 HydrophobicContact CD1-CD2 4.24Å; I63-L94 HydrophobicContact CG1-CD1 3.86Å; I63-L94 HydrophobicContact CG1-CD2 3.81Å; I63-L94 HydrophobicContact CG1-CG 4.5Å; L66-L94 HydrophobicContact CD1-CD1 3.8Å; I88-L94 HydrophobicContact CG2-CB 4.43Å; D91-L94 HydrophobicContact CB-CB 4.11Å; D91-L94 HydrophobicContact CB-CD1 4.12Å; D91-L94 HydrophobicContact CB-CG 4.35Å; D91-L94 VanDerWaalsContact OD1-CB 3.27Å; D91-L94 WeakPolarHBondContact OD1-CB 3.15Å; D91-L94 VanDerWaalsContact OD1-CG 3.23Å; D91-L94 WeakPolarHBondContact OD1-CG 3.45Å; D91-L94 PolarHBondContact OD1-N 3.25Å; L94-K96 VanDerWaalsContact C-N 3.3Å; L94-K96 PolarHBondContact O-N 3.25Å; L94-L97 PolarHBondContact O-N 2.98Å; L94-L98 VanDerWaalsContact O-CB 3.32Å; L94-L98 WeakPolarHBondContact O-CB 3.38Å; L94-L98 PolarHBondContact O-N 3.36Å
95	N	97.8	Very high	97.6	Very high	64 Å²	64	83.5 Å²	83.5	34%	0.342	43%	0.43	S	S	.	.	H	α-helix	trans	-64.2	-39.9	176.5	-173.7	44.6	0	0	0	111	I88 R89 D91 L98 G99	I88-N95 VanDerWaalsContact O-CA 3.29Å; I88-N95 WeakPolarHBondContact O-CA 3.47Å; I88-N95 VanDerWaalsContact O-CB 3.3Å; I88-N95 WeakPolarHBondContact O-CB 3.31Å; I88-N95 PolarHBondContact O-N 2.93Å; I88-N95 VanDerWaalsContact O-N 3.11Å; R89-N95 WeakPolarHBondContact CD-OD1 3.48Å; R89-N95 PolarHBondContact NH1-OD1 3.38Å; D91-N95 WeakPolarHBondContact O-CB 3.43Å; D91-N95 PolarHBondContact O-N 3.17Å; N95-L98 CarbonylContact O-C 3.34Å; N95-G99 WeakPolarHBondContact O-CA 3.45Å; N95-G99 PolarHBondContact O-N 2.99Å
96	K	98.1	Very high	97.6	Very high	179 Å²	179	82.8 Å²	82.8	78%	0.778	43%	0.427	S	S	*	.	H	α-helix	trans	-65.7	-47.4	174.4	-176.9	176.8	-179.8	178.6	0	111.5	E92 E93 L94 L98 G99	E92-K96 WeakPolarHBondContact O-CB 3.42Å; E92-K96 PolarHBondContact O-N 3.47Å; E93-K96 PolarHBondContact O-N 3.01Å; L94-K96 VanDerWaalsContact C-N 3.3Å; L94-K96 PolarHBondContact O-N 3.25Å; K96-L98 VanDerWaalsContact C-N 3.32Å; K96-L98 PolarHBondContact O-N 3.14Å; K96-G99 PolarHBondContact O-N 3.49Å
97	L	97.9	Very high	97.5	Very high	104 Å²	104	84 Å²	84	55%	0.545	45%	0.446	S	S	.	.	H	α-helix	trans	-60.6	-40.7	179.1	-180	62.9	0	0	0	111.9	L59 E93 L94	L59-L97 HydrophobicContact CD1-CD2 4.38Å; L59-L97 HydrophobicContact CD2-CD2 3.8Å; E93-L97 VanDerWaalsContact O-CB 3.31Å; E93-L97 WeakPolarHBondContact O-CB 3.44Å; E93-L97 PolarHBondContact O-N 2.88Å; L94-L97 PolarHBondContact O-N 2.98Å
98	L	97.4	Very high	97.4	Very high	38 Å²	38	88.8 Å²	88.8	20%	0.199	48%	0.475	C	S	.	.	T	Hydrogen-bonded Turn	trans	-108	24	-175.1	-57.6	177.4	0	0	0	112.8	I63 I88 R89 L94 N95 K96 R100 V101	I63-L98 HydrophobicContact CD1-CD1 4.28Å; I88-L98 HydrophobicContact CD1-CD1 3.68Å; I88-L98 HydrophobicContact CG1-CD1 3.97Å; I88-L98 HydrophobicContact CG2-CB 3.93Å; I88-L98 HydrophobicContact CG2-CD1 3.75Å; I88-L98 HydrophobicContact CG2-CG 4.4Å; R89-L98 PolarHBondContact NH1-O 3.17Å; L94-L98 VanDerWaalsContact O-CB 3.32Å; L94-L98 WeakPolarHBondContact O-CB 3.38Å; L94-L98 PolarHBondContact O-N 3.36Å; N95-L98 CarbonylContact O-C 3.34Å; K96-L98 VanDerWaalsContact C-N 3.32Å; K96-L98 PolarHBondContact O-N 3.14Å; L98-R100 PolarHBondContact O-N 3.43Å; L98-R100 VanDerWaalsContact O-N 3.16Å; L98-V101 HydrophobicContact CB-CB 4.28Å; L98-V101 HydrophobicContact CB-CG2 4.35Å; L98-V101 HydrophobicContact CD2-CG2 4.04Å; L98-V101 PolarHBondContact O-N 3.45Å; L98-V101 VanDerWaalsContact O-N 3.08Å
99	G	95.3	Very high	97.3	Very high	51 Å²	51	91 Å²	91	53%	0.526	49%	0.486	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.4	-24.5	-172.2	0	0	0	0	0	114.5	N95 K96	N95-G99 WeakPolarHBondContact O-CA 3.45Å; N95-G99 PolarHBondContact O-N 2.99Å; K96-G99 PolarHBondContact O-N 3.49Å
100	R	96.3	Very high	97.1	Very high	251 Å²	251	94.3 Å²	94.3	95%	0.947	51%	0.512	S	S	*	.	T	Hydrogen-bonded Turn	trans	-105.3	7	177.9	-61.2	-177.6	-177.4	171.8	0.8	113.9	L98	L98-R100 PolarHBondContact O-N 3.43Å; L98-R100 VanDerWaalsContact O-N 3.16Å
101	V	96.8	Very high	97	Very high	73 Å²	73	94.4 Å²	94.4	44%	0.442	51%	0.513	S	S	.	.			trans	-94.4	127.6	-179.2	177.6	0	0	0	0	109.3	R89 L98	R89-V101 PolarHBondContact NH2-O 3.31Å; L98-V101 HydrophobicContact CB-CB 4.28Å; L98-V101 HydrophobicContact CB-CG2 4.35Å; L98-V101 HydrophobicContact CD2-CG2 4.04Å; L98-V101 PolarHBondContact O-N 3.45Å; L98-V101 VanDerWaalsContact O-N 3.08Å
102	T	97.2	Very high	96.9	Very high	133 Å²	133	97.9 Å²	97.9	82%	0.816	53%	0.531	S	S	*	.			trans	-88.3	125.7	171.7	-63.1	0	0	0	0	109.9
103	I	97.4	Very high	96.7	Very high	30 Å²	30	95.3 Å²	95.3	15%	0.154	52%	0.518	C	S	.	.			trans	-95.5	100	173.6	-55.3	175	0	0	0	107.5	P81 L84 Q85 I88 Q105 G106	P81-I103 HydrophobicContact CB-CG2 4.37Å; L84-I103 HydrophobicContact CB-CG2 4.49Å; Q85-I103 HydrophobicContact CB-CD1 4.49Å; I88-I103 HydrophobicContact CB-CD1 4.31Å; I88-I103 HydrophobicContact CD1-CD1 3.59Å; I88-I103 HydrophobicContact CG2-CD1 4.48Å; I103-Q105 PolarHBondContact O-N 3.21Å; I103-G106 PolarHBondContact O-N 3.33Å
104	A	98.1	Very high	96.5	Very high	76 Å²	76	92 Å²	92	63%	0.628	52%	0.516	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.5	136	177.5	0	0	0	0	0	110.3	P81 G106	P81-A104 VanDerWaalsContact CB-O 3.29Å; P81-A104 WeakPolarHBondContact CB-O 3.48Å; A104-G106 PolarHBondContact O-N 3.02Å; A104-G106 VanDerWaalsContact O-N 3.15Å
105	Q	98	Very high	96.3	Very high	172 Å²	172	98 Å²	98	80%	0.804	55%	0.553	S	S	*	*	T	Hydrogen-bonded Turn	trans	62.2	11.5	-176.9	-53.5	-62.6	-26.7	0	0	115.2	P81 I103	P81-Q105 HydrophobicContact CB-CB 4.06Å; P81-Q105 HydrophobicContact CG-CB 4.2Å; I103-Q105 PolarHBondContact O-N 3.21Å
106	G	97.7	Very high	96.2	Very high	2 Å²	2	101.1 Å²	101.1	2%	0.021	57%	0.569	C	S	.	*			trans	-79.3	-23.5	177.9	0	0	0	0	0	114.8	R82 Q85 I103 A104	R82-G106 WeakPolarHBondContact CD-O 3.39Å; R82-G106 PolarHBondContact NH1-O 3.04Å; Q85-G106 WeakPolarHBondContact CB-O 3.43Å; Q85-G106 WeakPolarHBondContact CG-O 3.39Å; I103-G106 PolarHBondContact O-N 3.33Å; A104-G106 PolarHBondContact O-N 3.02Å; A104-G106 VanDerWaalsContact O-N 3.15Å
107	G	96.4	Very high	96	Very high	53 Å²	53	97.2 Å²	97.2	55%	0.546	56%	0.556	S	S	.	*			trans	65.8	-155.7	-168	0	0	0	0	0	111.8	Q85	Q85-G107 VanDerWaalsContact CD-O 3.23Å; Q85-G107 WeakPolarHBondContact CG-O 3.19Å; Q85-G107 PolarHBondContact NE2-O 3.47Å
108	V	95.9	Very high	95.7	Very high	109 Å²	109	98 Å²	98	66%	0.661	57%	0.567	S	S	*	*			trans	-125.9	161.4	179.2	-62.9	0	0	0	0	111	R82	R82-V108 PolarHBondContact NH1-O 3.36Å; R82-V108 PolarHBondContact NH2-O 3.11Å
109	L	95.2	Very high	95.2	Very high	55 Å²	55	105.7 Å²	105.7	29%	0.288	60%	0.599	S	S	.	*			trans	-57.9	133.4	167.8	-72.6	-177.2	0	0	0	108.6	L86 R89 N111	L86-L109 HydrophobicContact CD2-CD2 3.92Å; R89-L109 HydrophobicContact CB-CD1 3.61Å; R89-L109 HydrophobicContact CB-CD2 3.96Å; R89-L109 HydrophobicContact CB-CG 3.63Å; R89-L109 HydrophobicContact CG-CG 4.42Å; L109-N111 PolarHBondContact O-N 3.12Å; L109-N111 VanDerWaalsContact O-N 3.11Å
110	P	94.1	Very high	94.6	Very high	108 Å²	108	113.2 Å²	113.2	70%	0.701	62%	0.617	S	S	*	*			trans	-57.4	120.1	175.4	-21.6	33.9	0	0	0	109.4
111	N	95	Very high	93.7	Very high	117 Å²	117	107.6 Å²	107.6	63%	0.626	61%	0.611	S	S	*	*			trans	-149.8	133.2	177.9	-178.8	46.1	0	0	0	109	L109 Q113	L109-N111 PolarHBondContact O-N 3.12Å; L109-N111 VanDerWaalsContact O-N 3.11Å; N111-Q113 PolarHBondContact ND2-NE2 3.12Å
112	I	95.6	Very high	92.6	Very high	118 Å²	118	112 Å²	112	61%	0.605	63%	0.627	S	S	*	*			trans	-115.3	119.7	175.5	-59.9	174.6	0	0	0	107.3	L116 L117	I112-L116 HydrophobicContact CG2-CB 4.26Å; I112-L117 HydrophobicContact CG2-CD2 3.86Å; I112-L117 HydrophobicContact CG2-CG 4.35Å
113	Q	94	Very high	91.3	Very high	115 Å²	115	110.3 Å²	110.3	54%	0.537	62%	0.62	S	S	.	*			trans	-67	136.2	175.3	-62.6	-64.1	-16	0	0	109.7	N111 V115 L116	N111-Q113 PolarHBondContact ND2-NE2 3.12Å; Q113-V115 HydrophobicContact CB-CG1 4.05Å; Q113-V115 PolarHBondContact O-N 2.75Å; Q113-L116 HydrophobicContact CB-CD1 4.3Å; Q113-L116 HydrophobicContact CB-CG 4.32Å; Q113-L116 WeakPolarHBondContact O-CB 3.39Å; Q113-L116 PolarHBondContact O-N 2.82Å
114	A	93.7	Very high	89.7	Confident	78 Å²	78	117 Å²	117	65%	0.645	65%	0.651	S	S	*	*	G	3₁₀ helix	trans	-56.2	-29.9	-176	0	0	0	0	0	113.5	L116 L117	A114-L116 PolarHBondContact O-N 3.47Å; A114-L117 WeakPolarHBondContact O-CB 3.46Å; A114-L117 PolarHBondContact O-N 2.9Å; A114-L117 VanDerWaalsContact O-N 3.14Å
115	V	95	Very high	87.9	Confident	131 Å²	131	121.6 Å²	121.6	79%	0.794	66%	0.659	S	S	*	*	G	3₁₀ helix	trans	-63.2	-25.1	175.9	69.5	0	0	0	0	113.6	Q113 L117	Q113-V115 HydrophobicContact CB-CG1 4.05Å; Q113-V115 PolarHBondContact O-N 2.75Å; V115-L117 VanDerWaalsContact C-N 3.33Å
116	L	94.7	Very high	86	Confident	130 Å²	130	122.3 Å²	122.3	68%	0.681	66%	0.659	S	S	*	*	G	3₁₀ helix	trans	-85.1	-9	178.7	-59.1	177.1	0	0	0	112.5	I112 Q113 A114	I112-L116 HydrophobicContact CG2-CB 4.26Å; Q113-L116 HydrophobicContact CB-CD1 4.3Å; Q113-L116 HydrophobicContact CB-CG 4.32Å; Q113-L116 WeakPolarHBondContact O-CB 3.39Å; Q113-L116 PolarHBondContact O-N 2.82Å; A114-L116 PolarHBondContact O-N 3.47Å
117	L	93.8	Very high	84.3	Confident	98 Å²	98	126.7 Å²	126.7	51%	0.513	70%	0.696	S	S	.	*	S	Bend	trans	-76.1	145.5	175.7	-62.1	175.7	0	0	0	110	I112 A114 V115 K119	I112-L117 HydrophobicContact CG2-CD2 3.86Å; I112-L117 HydrophobicContact CG2-CG 4.35Å; A114-L117 WeakPolarHBondContact O-CB 3.46Å; A114-L117 PolarHBondContact O-N 2.9Å; A114-L117 VanDerWaalsContact O-N 3.14Å; V115-L117 VanDerWaalsContact C-N 3.33Å; L117-K119 PolarHBondContact O-N 3.28Å
118	P	92.7	Very high	82.4	Confident	120 Å²	120	134.2 Å²	134.2	78%	0.779	71%	0.713	S	S	*	*	P	Polyproline II helix	trans	-55.2	136.2	174.7	-22.7	32.2	0	0	0	111.2	K120	P118-K120 PolarHBondContact O-N 3.02Å
119	K	86.2	Confident	80.8	Confident	200 Å²	200	132.4 Å²	132.4	87%	0.87	72%	0.717	S	S	*	*	P	Polyproline II helix	trans	-61.7	128.7	169.3	-68.2	-175.2	179.6	-179.1	0	107.9	L117 T121	L117-K119 PolarHBondContact O-N 3.28Å; K119-T121 PolarHBondContact O-N 3.22Å
120	K	83	Confident	78.8	Confident	209 Å²	209	143.2 Å²	143.2	91%	0.909	76%	0.761	S	S	*	*	P	Polyproline II helix	trans	-55.9	116.6	171.6	-73.8	-177.5	176.9	-179.1	0	108	P118	P118-K120 PolarHBondContact O-N 3.02Å
121	T	77.8	Confident	78.1	Confident	133 Å²	133	145 Å²	145	82%	0.816	76%	0.764	S	S	*	*	P	Polyproline II helix	trans	-70.8	131	165.1	34	0	0	0	0	107.9	K119 S123	K119-T121 PolarHBondContact O-N 3.22Å; T121-S123 PolarHBondContact O-N 3.27Å; T121-S123 VanDerWaalsContact O-N 3.1Å
122	E	73.9	Confident	77.2	Confident	166 Å²	166	146.4 Å²	146.4	78%	0.776	77%	0.772	S	S	*	*	P	Polyproline II helix	trans	-59.5	117.5	168.8	-68.2	-172.4	169.8	0	0	107.6	H124	E122-H124 PolarHBondContact O-N 2.75Å
123	S	69.3	Low	76.2	Confident	97 Å²	97	148 Å²	148	68%	0.678	78%	0.781	S	S	*	*			trans	-63.4	105.8	170.7	55.3	0	0	0	0	107	T121 H125	T121-S123 PolarHBondContact O-N 3.27Å; T121-S123 VanDerWaalsContact O-N 3.1Å; S123-H125 PolarHBondContact O-N 2.91Å
124	H	62.9	Low	75.1	Confident	170 Å²	170	149.9 Å²	149.9	79%	0.787	80%	0.795	S	S	*	*			trans	-66.6	69.2	167.8	-72	-67.7	0	0	0	109.6	E122 K126	E122-H124 PolarHBondContact O-N 2.75Å; H124-K126 PolarHBondContact O-N 3.31Å
125	H	61	Low	74	Confident	173 Å²	173	154.4 Å²	154.4	80%	0.801	81%	0.805	S	S	*	*			trans	-71	80.4	154	-88.4	-58.9	0	0	0	106.5	S123 A127	S123-H125 PolarHBondContact O-N 2.91Å; H125-A127 PolarHBondContact O-N 2.84Å
126	K	58.1	Low	72.5	Confident	186 Å²	186	156 Å²	156	81%	0.809	81%	0.805	S	S	*	*			trans	-58.1	100.2	154.6	-97.6	-176.4	174.9	176.8	0	105.6	H124 K128	H124-K126 PolarHBondContact O-N 3.31Å; K126-K128 VanDerWaalsContact C-N 3.34Å; K126-K128 PolarHBondContact O-N 3.27Å
127	A	61.4	Low	71	Confident	95 Å²	95	157.9 Å²	157.9	79%	0.785	81%	0.814	S	S	*	*			trans	-52.4	106.1	159.8	0	0	0	0	0	106.3	H125 G129	H125-A127 PolarHBondContact O-N 2.84Å; A127-G129 PolarHBondContact O-N 3.36Å
128	K	57.2	Low	69.2	Low	210 Å²	210	162.5 Å²	162.5	91%	0.913	84%	0.837	S	S	*	*			trans	-70.4	79.3	164.8	-80.2	-175.1	176	178.2	0	106.4	K126	K126-K128 VanDerWaalsContact C-N 3.34Å; K126-K128 PolarHBondContact O-N 3.27Å
129	G	61.3	Low	67.3	Low	72 Å²	72	166 Å²	166	74%	0.742	84%	0.842	S	S	*	*			trans	-81.4	102.8	157.6	0	0	0	0	0	107.4	A127	A127-G129 PolarHBondContact O-N 3.36Å
130	K	55.1	Low	65.5	Low	281 Å²	281	162.9 Å²	162.9	100%	1.222	84%	0.84	S	S	*	*			trans	-123.4	0	153.8	-96.7	-167.2	175.2	-170.1	0	106.3

Retrieved 130 of 130 residues in 33.1 ms (Link to these results)

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