A0A096MWB2_PAPAN Loading...

Histone H2A

AlphaFold DB (Q8IUE6), UniProt , Accession A0A096MWB2, Species PAPAN (Papio anubis, Olive baboon), Gene H2AC21, Length 130 aa.

						>A0A096MWB2_PAPAN|A0A096MWB2|H2AC21
MSGRGKQGGKARAKAKSRSSRAGLQFPVGRVHRLLRKGNYAERVGAGAPVYLAAVLEYLTAEILELAGNAARDNKKTRIIPRHLQLAVRNDEELNKLLGGVTIAQGGVLPNIQAVLLPKKTESHKPGKNK
					

Structure Viewer

Loading PAE data...

(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	54	Low	61	Low	251 Å²	251	145.4 Å²	145.4	100%	1.236	86%	0.859	S	S	*	*				0	144	0	-85.8	-176.3	166.2	0	0	109.5
2	S	58.8	Low	62.4	Low	113 Å²	113	153.4 Å²	153.4	79%	0.79	86%	0.863	S	S	*	*			trans	-51.2	136.8	-156.8	59.4	0	0	0	0	118	R4	S2-R4 PolarHBondContact O-N 2.95Å; S2-R4 VanDerWaalsContact O-N 3.13Å
3	G	57.9	Low	63.9	Low	84 Å²	84	148.5 Å²	148.5	87%	0.866	85%	0.853	S	S	*	*			trans	-59.2	109.1	165.7	0	0	0	0	0	111.2	G5	G3-G5 PolarHBondContact O-N 3.25Å
4	R	63.3	Low	65.4	Low	248 Å²	248	152.4 Å²	152.4	94%	0.936	86%	0.855	S	S	*	*			trans	-77.2	106.9	178.2	-161.4	149.5	176.8	150.9	-4.5	108.2	S2 K6	S2-R4 PolarHBondContact O-N 2.95Å; S2-R4 VanDerWaalsContact O-N 3.13Å; R4-K6 PolarHBondContact O-N 2.95Å
5	G	59.7	Low	67	Low	61 Å²	61	148.5 Å²	148.5	63%	0.629	85%	0.85	S	S	*	*			trans	-49.3	131.5	-177.1	0	0	0	0	0	112.5	G3 Q7	G3-G5 PolarHBondContact O-N 3.25Å; G5-Q7 PolarHBondContact O-N 3.05Å
6	K	58.2	Low	68.6	Low	211 Å²	211	148.9 Å²	148.9	92%	0.917	84%	0.839	S	S	*	*			trans	-62.9	83	170.9	-166.9	178	-173.8	-180	0	107.7	R4 G8	R4-K6 PolarHBondContact O-N 2.95Å; K6-G8 PolarHBondContact O-N 2.82Å; K6-G8 VanDerWaalsContact O-N 3.15Å
7	Q	56.7	Low	70.2	Confident	184 Å²	184	143.9 Å²	143.9	86%	0.86	82%	0.816	S	S	*	*			trans	-50.4	122.8	174.1	-82.7	178.8	-11.5	0	0	107.9	G5 G9	G5-Q7 PolarHBondContact O-N 3.05Å; Q7-G9 PolarHBondContact O-N 3.02Å
8	G	55.3	Low	71.6	Confident	73 Å²	73	141.4 Å²	141.4	75%	0.753	79%	0.791	S	S	*	*			trans	-44.9	107.7	-177.8	0	0	0	0	0	110	K6 K10	K6-G8 PolarHBondContact O-N 2.82Å; K6-G8 VanDerWaalsContact O-N 3.15Å; G8-K10 PolarHBondContact O-N 3.39Å
9	G	62.7	Low	73	Confident	73 Å²	73	134.8 Å²	134.8	75%	0.753	76%	0.756	S	S	*	*			trans	-61.6	109.7	-177.7	0	0	0	0	0	107.8	Q7 A11	Q7-G9 PolarHBondContact O-N 3.02Å; G9-A11 PolarHBondContact O-N 2.98Å; G9-A11 VanDerWaalsContact O-N 3.13Å
10	K	69.3	Low	74.2	Confident	200 Å²	200	131.5 Å²	131.5	87%	0.87	74%	0.742	S	S	*	*			trans	-43.2	125.6	167.5	-71	-179.8	177.9	178.3	0	107.1	G8 R12	G8-K10 PolarHBondContact O-N 3.39Å; K10-R12 PolarHBondContact O-N 3.35Å
11	A	75.3	Confident	75.3	Confident	101 Å²	101	133.9 Å²	133.9	84%	0.835	74%	0.739	S	S	*	*			trans	-49.1	109.6	-179	0	0	0	0	0	108.3	G9 A13	G9-A11 PolarHBondContact O-N 2.98Å; G9-A11 VanDerWaalsContact O-N 3.13Å; A11-A13 PolarHBondContact O-N 3.45Å; A11-A13 VanDerWaalsContact O-N 3.1Å
12	R	77.4	Confident	77.4	Confident	242 Å²	242	124 Å²	124	91%	0.913	70%	0.697	S	S	*	*	P	Polyproline II helix	trans	-60.2	121.2	-174.9	-172.6	177.1	-178.9	178.7	1.6	106.9	K10 K14	K10-R12 PolarHBondContact O-N 3.35Å; R12-K14 PolarHBondContact O-N 3.12Å
13	A	82	Confident	79.2	Confident	89 Å²	89	121.6 Å²	121.6	74%	0.736	69%	0.69	S	S	*	*	P	Polyproline II helix	trans	-51.3	132.4	177	0	0	0	0	0	109.3	A11 A15	A11-A13 PolarHBondContact O-N 3.45Å; A11-A13 VanDerWaalsContact O-N 3.1Å; A13-A15 PolarHBondContact O-N 2.88Å
14	K	84.7	Confident	81.1	Confident	203 Å²	203	118.8 Å²	118.8	88%	0.883	66%	0.656	S	S	*	*	P	Polyproline II helix	trans	-54.4	128.8	-179.7	-74.4	-177.8	179.9	176.4	0	108.9	R12 K16	R12-K14 PolarHBondContact O-N 3.12Å; K14-K16 PolarHBondContact O-N 3.28Å; K14-K16 VanDerWaalsContact O-N 3.15Å
15	A	89.3	Confident	82.8	Confident	94 Å²	94	115.1 Å²	115.1	78%	0.777	65%	0.649	S	S	*	*	P	Polyproline II helix	trans	-61.4	120.3	178.7	0	0	0	0	0	109.7	A13 S17	A13-A15 PolarHBondContact O-N 2.88Å; A15-S17 PolarHBondContact O-N 3.03Å
16	K	93.1	Very high	84.7	Confident	156 Å²	156	115 Å²	115	68%	0.678	63%	0.632	S	S	*	*	P	Polyproline II helix	trans	-60.3	127.8	172.8	-68.6	-173.1	179.8	-176.6	0	109.6	K14 R21	K14-K16 PolarHBondContact O-N 3.28Å; K14-K16 VanDerWaalsContact O-N 3.15Å; K16-R21 HydrophobicContact CB-CG 4.15Å; K16-R21 PolarHBondContact O-NE 3.06Å; K16-R21 VanDerWaalsContact O-NE 3.16Å; K16-R21 PolarHBondContact O-NH2 3.29Å
17	S	95.7	Very high	86.6	Confident	63 Å²	63	107 Å²	107	44%	0.441	60%	0.601	S	S	.	*	P	Polyproline II helix	trans	-64.5	155.5	177.7	75.8	0	0	0	0	111.2	A15 S19 S20 R21	A15-S17 PolarHBondContact O-N 3.03Å; S17-S19 VanDerWaalsContact C-N 3.26Å; S17-S19 PolarHBondContact O-N 3.04Å; S17-S20 PolarHBondContact N-OG 3.14Å; S17-S20 PolarHBondContact O-N 2.86Å; S17-S20 PolarHBondContact O-OG 3.36Å; S17-S20 WeakPolarHBondContact OG-CB 3.37Å; S17-S20 PolarHBondContact OG-N 2.72Å; S17-S20 PolarHBondContact OG-OG 3.15Å; S17-R21 WeakPolarHBondContact O-CG 3.26Å; S17-R21 PolarHBondContact O-N 3.28Å
18	R	96.1	Very high	88.6	Confident	99 Å²	99	98.3 Å²	98.3	37%	0.374	56%	0.56	S	S	.	*	H	α-helix	trans	-59.4	-37.7	174.3	-73.8	-170	-77.3	162.4	-4.2	112.4	R21 A22 V28 H32	R18-R21 PolarHBondContact O-N 3.49Å; R18-A22 WeakPolarHBondContact O-CB 3.39Å; R18-A22 PolarHBondContact O-N 2.86Å; R18-V28 HydrophobicContact CB-CB 4.11Å; R18-V28 HydrophobicContact CB-CG1 3.87Å; R18-H32 PolarHBondContact NH1-ND1 2.85Å; R18-H32 PolarHBondContact NH2-ND1 3.23Å; R18-H32 VanDerWaalsContact NH2-ND1 3.17Å
19	S	98	Very high	90.6	Very high	17 Å²	17	96.4 Å²	96.4	12%	0.119	54%	0.541	C	S	.	.	H	α-helix	trans	-59.7	-50.7	174	-62.9	0	0	0	0	111.7	S17 R21 A22 G23 L24 F26 P27 V28	S17-S19 VanDerWaalsContact C-N 3.26Å; S17-S19 PolarHBondContact O-N 3.04Å; S19-R21 PolarHBondContact O-N 3.34Å; S19-A22 CarbonylContact O-C 3.47Å; S19-A22 PolarHBondContact O-N 3.43Å; S19-G23 PolarHBondContact O-N 3.31Å; S19-L24 CarbonylContact C-O 3.5Å; S19-L24 WeakPolarHBondContact CB-O 3.49Å; S19-L24 PolarHBondContact O-N 3.1Å; S19-F26 WeakPolarHBondContact CB-O 3.29Å; S19-F26 PolarHBondContact OG-O 3.25Å; S19-P27 WeakPolarHBondContact OG-CA 3.35Å; S19-V28 PolarHBondContact OG-N 3.26Å
20	S	96.9	Very high	92.3	Very high	68 Å²	68	100 Å²	100	48%	0.476	53%	0.531	S	S	.	.	H	α-helix	trans	-63	-27.6	177.7	63.2	0	0	0	0	113.9	S17	S17-S20 PolarHBondContact N-OG 3.14Å; S17-S20 PolarHBondContact O-N 2.86Å; S17-S20 PolarHBondContact O-OG 3.36Å; S17-S20 WeakPolarHBondContact OG-CB 3.37Å; S17-S20 PolarHBondContact OG-N 2.72Å; S17-S20 PolarHBondContact OG-OG 3.15Å
21	R	96.7	Very high	93.7	Very high	181 Å²	181	91.3 Å²	91.3	68%	0.683	50%	0.495	S	S	*	.	H	α-helix	trans	-77.4	-30.7	174	-67.4	177	-164.9	-165.1	-1.5	112.3	K16 S17 R18 S19	K16-R21 HydrophobicContact CB-CG 4.15Å; K16-R21 PolarHBondContact O-NE 3.06Å; K16-R21 VanDerWaalsContact O-NE 3.16Å; K16-R21 PolarHBondContact O-NH2 3.29Å; S17-R21 WeakPolarHBondContact O-CG 3.26Å; S17-R21 PolarHBondContact O-N 3.28Å; R18-R21 PolarHBondContact O-N 3.49Å; S19-R21 PolarHBondContact O-N 3.34Å
22	A	97.4	Very high	94.8	Very high	43 Å²	43	88 Å²	88	36%	0.355	46%	0.463	S	S	.	.	H	α-helix	trans	-86	-7.4	178	0	0	0	0	0	113.3	R18 S19 L24 V28 V50	R18-A22 WeakPolarHBondContact O-CB 3.39Å; R18-A22 PolarHBondContact O-N 2.86Å; S19-A22 CarbonylContact O-C 3.47Å; S19-A22 PolarHBondContact O-N 3.43Å; A22-L24 VanDerWaalsContact C-N 3.32Å; A22-L24 HydrophobicContact CB-CD1 3.97Å; A22-L24 HydrophobicContact CB-CG 4.03Å; A22-V28 HydrophobicContact CB-CG2 4.47Å; A22-V50 HydrophobicContact CB-CG1 3.87Å
23	G	97.8	Very high	95.8	Very high	63 Å²	63	84.6 Å²	84.6	65%	0.649	45%	0.45	S	S	*	.	T	Hydrogen-bonded Turn	trans	73.2	22.5	-175.6	0	0	0	0	0	114.1	S19	S19-G23 PolarHBondContact O-N 3.31Å
24	L	98.4	Very high	96.5	Very high	26 Å²	26	84.8 Å²	84.8	14%	0.136	44%	0.438	C	S	.	.			trans	-107.3	140.2	-175.7	-62.4	175.2	0	0	0	111	S19 A22 V28 V50 A53 A54 E57	S19-L24 CarbonylContact C-O 3.5Å; S19-L24 WeakPolarHBondContact CB-O 3.49Å; S19-L24 PolarHBondContact O-N 3.1Å; A22-L24 VanDerWaalsContact C-N 3.32Å; A22-L24 HydrophobicContact CB-CD1 3.97Å; A22-L24 HydrophobicContact CB-CG 4.03Å; L24-V28 HydrophobicContact CD1-CG2 3.8Å; L24-V50 HydrophobicContact CD1-CG1 4.26Å; L24-A53 HydrophobicContact CD1-CB 3.97Å; L24-A54 HydrophobicContact CD1-CB 4Å; L24-A54 HydrophobicContact CD2-CB 3.85Å; L24-E57 WeakPolarHBondContact CA-OE2 3.48Å; L24-E57 WeakPolarHBondContact CB-OE2 3.05Å
25	Q	98.4	Very high	97.2	Very high	171 Å²	171	76.7 Å²	76.7	80%	0.799	40%	0.404	S	S	*	.	S	Bend	trans	-74.2	-32.6	165.3	-61.9	-56.8	-36.7	0	0	111.3	E57	Q25-E57 VanDerWaalsContact N-CD 3.35Å; Q25-E57 PolarHBondContact N-OE1 3.32Å; Q25-E57 PolarHBondContact N-OE2 3.17Å
26	F	98.5	Very high	97.5	Very high	59 Å²	59	78.9 Å²	78.9	26%	0.259	39%	0.392	S	S	.	.	S	Bend	trans	-71.6	144.9	-176.3	-84.7	36.6	0	0	0	111.2	S19 V28 A53 L56 E57 T60	S19-F26 WeakPolarHBondContact CB-O 3.29Å; S19-F26 PolarHBondContact OG-O 3.25Å; F26-V28 PolarHBondContact O-N 3.27Å; F26-A53 HydrophobicContact CB-CB 4.28Å; F26-L56 HydrophobicContact CD2-CB 3.76Å; F26-L56 VanDerWaalsContact CE2-C 3.48Å; F26-L56 HydrophobicContact CE2-CB 3.81Å; F26-L56 WeakPolarHBondContact CE2-O 3.15Å; F26-E57 HydrophobicContact CB-CB 4.08Å; F26-E57 WeakPolarHBondContact CB-OE2 3.3Å; F26-E57 HydrophobicContact CD1-CB 3.77Å; F26-E57 HydrophobicContact CD1-CG 3.78Å; F26-E57 HydrophobicContact CD2-CB 3.99Å; F26-E57 HydrophobicContact CE1-CB 4.22Å; F26-E57 HydrophobicContact CE1-CG 4.17Å; F26-E57 HydrophobicContact CE2-CB 4.41Å; F26-E57 HydrophobicContact CG-CB 3.67Å; F26-E57 HydrophobicContact CG-CG 4.19Å; F26-E57 PolarHBondContact N-OE2 2.83Å; F26-T60 HydrophobicContact CZ-CG2 3.85Å; F26-T60 WeakPolarHBondContact CZ-OG1 3.17Å
27	P	98.3	Very high	97.7	Very high	43 Å²	43	79.6 Å²	79.6	28%	0.279	40%	0.395	S	S	.	.			trans	-82	83	-167.4	33.3	-37.9	0	0	0	112.7	S19 G29 R30 V31	S19-P27 WeakPolarHBondContact OG-CA 3.35Å; P27-G29 PolarHBondContact O-N 3.26Å; P27-R30 HydrophobicContact CB-CB 3.83Å; P27-R30 HydrophobicContact CG-CB 3.95Å; P27-R30 WeakPolarHBondContact O-CA 3.44Å; P27-R30 WeakPolarHBondContact O-CB 3.42Å; P27-R30 PolarHBondContact O-N 3.12Å; P27-V31 PolarHBondContact O-N 2.98Å
28	V	98.6	Very high	97.8	Very high	0 Å²	0	78.2 Å²	78.2	0%	0	39%	0.391	C	S	.	.	H	α-helix	trans	-47	-40	174.1	176.8	0	0	0	0	112	R18 S19 A22 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 3.26Å; A22-V28 HydrophobicContact CB-CG2 4.47Å; L24-V28 HydrophobicContact CD1-CG2 3.8Å; F26-V28 PolarHBondContact O-N 3.27Å; V28-R30 PolarHBondContact O-N 2.92Å; V28-V31 PolarHBondContact O-N 3.25Å; V28-H32 PolarHBondContact O-N 3.06Å; V28-P49 HydrophobicContact CG1-CB 4.23Å; V28-P49 HydrophobicContact CG1-CG 4.43Å; V28-V50 HydrophobicContact CG1-CG2 3.73Å; V28-A53 HydrophobicContact CG2-CB 3.88Å
29	G	98	Very high	97.8	Very high	33 Å²	33	80.2 Å²	80.2	34%	0.34	41%	0.409	S	S	.	.	H	α-helix	trans	-58.5	-45.1	177.3	0	0	0	0	0	113.4	P27 R33	P27-G29 PolarHBondContact O-N 3.26Å; G29-R33 PolarHBondContact O-N 3.38Å
30	R	98.4	Very high	97.7	Very high	148 Å²	148	88.1 Å²	88.1	56%	0.558	44%	0.438	S	S	*	.	H	α-helix	trans	-71.5	-43.7	179.8	-173.2	-176.1	-63.1	154.9	1	110.8	P27 V28 H32 R33 L34	P27-R30 HydrophobicContact CB-CB 3.83Å; P27-R30 HydrophobicContact CG-CB 3.95Å; P27-R30 WeakPolarHBondContact O-CA 3.44Å; P27-R30 WeakPolarHBondContact O-CB 3.42Å; P27-R30 PolarHBondContact O-N 3.12Å; V28-R30 PolarHBondContact O-N 2.92Å; R30-H32 VanDerWaalsContact C-N 3.33Å; R30-H32 PolarHBondContact O-N 3.22Å; R30-R33 PolarHBondContact O-N 3.24Å; R30-L34 HydrophobicContact CG-CD1 4.16Å; R30-L34 WeakPolarHBondContact O-CG 3.35Å; R30-L34 PolarHBondContact O-N 2.95Å
31	V	98.4	Very high	97.6	Very high	18 Å²	18	87.8 Å²	87.8	11%	0.109	44%	0.439	C	S	.	.	H	α-helix	trans	-57.8	-46.2	176.6	177.8	0	0	0	0	110.6	P27 V28 R33 L34 L35 P49 L52 A53	P27-V31 PolarHBondContact O-N 2.98Å; V28-V31 PolarHBondContact O-N 3.25Å; V31-R33 VanDerWaalsContact C-N 3.34Å; V31-R33 PolarHBondContact O-N 2.96Å; V31-L34 PolarHBondContact O-N 2.98Å; V31-L35 HydrophobicContact CG1-CD1 4Å; V31-L35 HydrophobicContact CG1-CG 4.3Å; V31-L35 WeakPolarHBondContact O-CG 3.49Å; V31-L35 PolarHBondContact O-N 3.47Å; V31-P49 HydrophobicContact CB-CB 4.25Å; V31-P49 HydrophobicContact CG1-CB 4.03Å; V31-L52 HydrophobicContact CG1-CB 4.14Å; V31-L52 HydrophobicContact CG1-CD2 3.79Å; V31-L52 HydrophobicContact CG1-CG 4.08Å; V31-A53 HydrophobicContact CG2-CB 4.18Å
32	H	98.3	Very high	97.6	Very high	33 Å²	33	88.7 Å²	88.7	15%	0.153	45%	0.451	C	S	.	.	H	α-helix	trans	-58.8	-44.1	176.6	-173.1	-148.7	0	0	0	113	R18 V28 R30 L34 L35 R36 P49	R18-H32 PolarHBondContact NH1-ND1 2.85Å; R18-H32 PolarHBondContact NH2-ND1 3.23Å; R18-H32 VanDerWaalsContact NH2-ND1 3.17Å; V28-H32 PolarHBondContact O-N 3.06Å; R30-H32 VanDerWaalsContact C-N 3.33Å; R30-H32 PolarHBondContact O-N 3.22Å; H32-L34 VanDerWaalsContact C-N 3.34Å; H32-L35 PolarHBondContact O-N 3.36Å; H32-R36 PolarHBondContact CE1-NE 3.27Å; H32-R36 PolarHBondContact NE2-NE 2.91Å; H32-R36 PolarHBondContact O-N 2.74Å; H32-R36 VanDerWaalsContact O-N 3.15Å; H32-P49 HydrophobicContact CB-CB 3.62Å; H32-P49 HydrophobicContact CB-CG 3.72Å
33	R	98.1	Very high	97.6	Very high	169 Å²	169	97.1 Å²	97.1	64%	0.638	47%	0.474	S	S	*	.	H	α-helix	trans	-63.3	-42.4	178.6	-175.2	-177.9	66.9	176.3	2.7	111.1	G29 R30 V31 R36 K37	G29-R33 PolarHBondContact O-N 3.38Å; R30-R33 PolarHBondContact O-N 3.24Å; V31-R33 VanDerWaalsContact C-N 3.34Å; V31-R33 PolarHBondContact O-N 2.96Å; R33-R36 PolarHBondContact O-N 3.26Å; R33-K37 WeakPolarHBondContact O-CB 3.49Å; R33-K37 PolarHBondContact O-N 3.37Å
34	L	98.3	Very high	97.6	Very high	94 Å²	94	95.2 Å²	95.2	49%	0.492	45%	0.449	S	S	.	.	H	α-helix	trans	-67.9	-41.8	178.6	-69.9	175.3	0	0	0	112.3	R30 V31 H32 R36 K37 G38	R30-L34 HydrophobicContact CG-CD1 4.16Å; R30-L34 WeakPolarHBondContact O-CG 3.35Å; R30-L34 PolarHBondContact O-N 2.95Å; V31-L34 PolarHBondContact O-N 2.98Å; H32-L34 VanDerWaalsContact C-N 3.34Å; L34-R36 VanDerWaalsContact C-N 3.3Å; L34-R36 PolarHBondContact O-N 3.41Å; L34-K37 PolarHBondContact O-N 2.96Å; L34-G38 PolarHBondContact O-N 3.33Å
35	L	98	Very high	97.5	Very high	32 Å²	32	96.2 Å²	96.2	17%	0.168	47%	0.466	C	S	.	.	H	α-helix	trans	-58.5	-41.5	175	-74.2	172.7	0	0	0	112.1	V31 H32 Y40 V44 P49 L52	V31-L35 HydrophobicContact CG1-CD1 4Å; V31-L35 HydrophobicContact CG1-CG 4.3Å; V31-L35 WeakPolarHBondContact O-CG 3.49Å; V31-L35 PolarHBondContact O-N 3.47Å; H32-L35 PolarHBondContact O-N 3.36Å; L35-Y40 HydrophobicContact CD2-CD2 4.06Å; L35-Y40 HydrophobicContact CD2-CE2 4.31Å; L35-V44 HydrophobicContact CB-CG1 4.09Å; L35-V44 HydrophobicContact CB-CG2 4.28Å; L35-V44 HydrophobicContact CD1-CG1 4.1Å; L35-P49 HydrophobicContact CD1-CB 4.13Å; L35-L52 HydrophobicContact CD1-CD2 4.29Å; L35-L52 HydrophobicContact CD2-CD2 3.92Å; L35-L52 HydrophobicContact CG-CD2 4.35Å
36	R	96.8	Very high	97.4	Very high	141 Å²	141	91.9 Å²	91.9	53%	0.532	46%	0.46	S	S	.	.	H	α-helix	trans	-67.9	-41.4	174.8	-73.7	-175.3	175.4	-97.1	-4.8	112.6	H32 R33 L34 G38 N39 V44	H32-R36 PolarHBondContact CE1-NE 3.27Å; H32-R36 PolarHBondContact NE2-NE 2.91Å; H32-R36 PolarHBondContact O-N 2.74Å; H32-R36 VanDerWaalsContact O-N 3.15Å; R33-R36 PolarHBondContact O-N 3.26Å; L34-R36 VanDerWaalsContact C-N 3.3Å; L34-R36 PolarHBondContact O-N 3.41Å; R36-G38 VanDerWaalsContact C-N 3.28Å; R36-G38 PolarHBondContact O-N 3.15Å; R36-N39 PolarHBondContact O-N 3.41Å; R36-N39 PolarHBondContact O-OD1 2.88Å; R36-V44 HydrophobicContact CG-CB 4.29Å; R36-V44 HydrophobicContact CG-CG2 4.12Å
37	K	97.5	Very high	97.4	Very high	170 Å²	170	91.4 Å²	91.4	74%	0.739	47%	0.471	S	S	*	.	H	α-helix	trans	-65.6	-32.7	178.1	-173.7	-179.5	177.3	-174.7	0	112.3	R33 L34 N39	R33-K37 WeakPolarHBondContact O-CB 3.49Å; R33-K37 PolarHBondContact O-N 3.37Å; L34-K37 PolarHBondContact O-N 2.96Å; K37-N39 PolarHBondContact O-N 2.95Å
38	G	97.3	Very high	97.4	Very high	34 Å²	34	91.6 Å²	91.6	35%	0.351	48%	0.476	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.8	-6.4	179.9	0	0	0	0	0	114.8	L34 R36 Y40	L34-G38 PolarHBondContact O-N 3.33Å; R36-G38 VanDerWaalsContact C-N 3.28Å; R36-G38 PolarHBondContact O-N 3.15Å; G38-Y40 PolarHBondContact O-N 2.79Å; G38-Y40 VanDerWaalsContact O-N 3.11Å
39	N	95.4	Very high	97.4	Very high	141 Å²	141	91.6 Å²	91.6	75%	0.754	48%	0.476	S	S	*	.	T	Hydrogen-bonded Turn	trans	50.7	33.9	179.5	-62.6	-27.4	0	0	0	114.2	R36 K37 A41	R36-N39 PolarHBondContact O-N 3.41Å; R36-N39 PolarHBondContact O-OD1 2.88Å; K37-N39 PolarHBondContact O-N 2.95Å; N39-A41 PolarHBondContact O-N 3.4Å
40	Y	95.4	Very high	97.4	Very high	183 Å²	183	92.4 Å²	92.4	72%	0.718	48%	0.475	S	S	*	.	S	Bend	trans	-68.4	-19	-178.1	-58.7	-70	0	0	0	114	L35 G38	L35-Y40 HydrophobicContact CD2-CD2 4.06Å; L35-Y40 HydrophobicContact CD2-CE2 4.31Å; G38-Y40 PolarHBondContact O-N 2.79Å; G38-Y40 VanDerWaalsContact O-N 3.11Å
41	A	96.2	Very high	97.4	Very high	62 Å²	62	93.8 Å²	93.8	51%	0.512	48%	0.481	S	S	.	.	S	Bend	trans	-161.3	156	177.3	0	0	0	0	0	109.5	N39 R43	N39-A41 PolarHBondContact O-N 3.4Å; A41-R43 PolarHBondContact O-N 2.92Å
42	E	96.3	Very high	97.4	Very high	200 Å²	200	96 Å²	96	94%	0.935	49%	0.492	S	S	*	.	S	Bend	trans	-59	-36.8	175.9	-63.4	-177.8	172.5	0	0	112.5
43	R	97.4	Very high	97.4	Very high	220 Å²	220	94.5 Å²	94.5	83%	0.83	49%	0.485	S	S	*	.			trans	-130.3	127.6	-179.2	-61.7	179.7	72.7	162.6	1.6	110.3	A41	A41-R43 PolarHBondContact O-N 2.92Å
44	V	97.1	Very high	97.5	Very high	22 Å²	22	88.2 Å²	88.2	13%	0.133	47%	0.469	C	S	.	.			trans	-102.6	112.3	171.4	-178.5	0	0	0	0	108.8	L35 R36 A48	L35-V44 HydrophobicContact CB-CG1 4.09Å; L35-V44 HydrophobicContact CB-CG2 4.28Å; L35-V44 HydrophobicContact CD1-CG1 4.1Å; R36-V44 HydrophobicContact CG-CB 4.29Å; R36-V44 HydrophobicContact CG-CG2 4.12Å; V44-A48 HydrophobicContact CG1-CB 4.12Å
45	G	97.4	Very high	97.5	Very high	47 Å²	47	86.2 Å²	86.2	49%	0.485	46%	0.461	S	S	.	.			trans	-65.3	153.2	176.9	0	0	0	0	0	112.7	G47 A48 P49	G45-G47 VanDerWaalsContact C-N 3.26Å; G45-G47 PolarHBondContact O-N 2.78Å; G45-A48 WeakPolarHBondContact O-CB 3.37Å; G45-A48 PolarHBondContact O-N 3.01Å; G45-P49 WeakPolarHBondContact O-CD 3.46Å
46	A	95.5	Very high	97.5	Very high	81 Å²	81	88.2 Å²	88.2	67%	0.669	47%	0.471	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64	-29	-175.5	0	0	0	0	0	113.8	P49	A46-P49 WeakPolarHBondContact O-CD 3.47Å; A46-P49 WeakPolarHBondContact O-CG 3.24Å
47	G	97.8	Very high	97.6	Very high	48 Å²	48	83.4 Å²	83.4	50%	0.495	46%	0.455	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.6	-28.6	177.1	0	0	0	0	0	114.2	G45 V50 Y51	G45-G47 VanDerWaalsContact C-N 3.26Å; G45-G47 PolarHBondContact O-N 2.78Å; G47-V50 WeakPolarHBondContact O-CB 3.43Å; G47-V50 PolarHBondContact O-N 3.23Å; G47-Y51 PolarHBondContact O-N 3.42Å
48	A	98.4	Very high	97.6	Very high	47 Å²	47	82 Å²	82	39%	0.388	45%	0.446	S	S	.	.	H	α-helix	trans	-53.8	-49.7	-179	0	0	0	0	0	113.9	V44 G45 V50 Y51 L52	V44-A48 HydrophobicContact CG1-CB 4.12Å; G45-A48 WeakPolarHBondContact O-CB 3.37Å; G45-A48 PolarHBondContact O-N 3.01Å; A48-V50 VanDerWaalsContact C-N 3.29Å; A48-V50 PolarHBondContact O-N 3.26Å; A48-Y51 PolarHBondContact O-N 3.12Å; A48-L52 WeakPolarHBondContact O-CB 3.34Å; A48-L52 PolarHBondContact O-N 3.12Å
49	P	98.5	Very high	97.7	Very high	0 Å²	0	82.8 Å²	82.8	0%	0	44%	0.442	C	S	.	.	H	α-helix	trans	-70.2	-22.2	176.7	28.8	-37.7	0	0	0	114.3	V28 V31 H32 L35 G45 A46 A53	V28-P49 HydrophobicContact CG1-CB 4.23Å; V28-P49 HydrophobicContact CG1-CG 4.43Å; V31-P49 HydrophobicContact CB-CB 4.25Å; V31-P49 HydrophobicContact CG1-CB 4.03Å; H32-P49 HydrophobicContact CB-CB 3.62Å; H32-P49 HydrophobicContact CB-CG 3.72Å; L35-P49 HydrophobicContact CD1-CB 4.13Å; G45-P49 WeakPolarHBondContact O-CD 3.46Å; A46-P49 WeakPolarHBondContact O-CD 3.47Å; A46-P49 WeakPolarHBondContact O-CG 3.24Å; P49-A53 WeakPolarHBondContact O-CB 3.43Å; P49-A53 PolarHBondContact O-N 2.93Å
50	V	98.6	Very high	97.8	Very high	51 Å²	51	78.5 Å²	78.5	31%	0.309	42%	0.421	S	S	.	.	H	α-helix	trans	-72.9	-51.1	174.8	178.3	0	0	0	0	108.9	A22 L24 V28 G47 A48 A53 A54	A22-V50 HydrophobicContact CB-CG1 3.87Å; L24-V50 HydrophobicContact CD1-CG1 4.26Å; V28-V50 HydrophobicContact CG1-CG2 3.73Å; G47-V50 WeakPolarHBondContact O-CB 3.43Å; G47-V50 PolarHBondContact O-N 3.23Å; A48-V50 VanDerWaalsContact C-N 3.29Å; A48-V50 PolarHBondContact O-N 3.26Å; V50-A53 PolarHBondContact O-N 3.3Å; V50-A54 WeakPolarHBondContact O-CB 3.11Å; V50-A54 PolarHBondContact O-N 2.8Å
51	Y	98.7	Very high	98	Very high	177 Å²	177	72.4 Å²	72.4	69%	0.694	41%	0.408	S	S	*	.	H	α-helix	trans	-58.2	-50.8	178.4	-177.5	-97.2	0	0	0	111.6	G47 A48 A53 A54 V55	G47-Y51 PolarHBondContact O-N 3.42Å; A48-Y51 PolarHBondContact O-N 3.12Å; Y51-A53 VanDerWaalsContact C-N 3.35Å; Y51-A53 PolarHBondContact O-N 3.12Å; Y51-A54 WeakPolarHBondContact O-CB 3.32Å; Y51-A54 PolarHBondContact O-N 2.92Å; Y51-V55 HydrophobicContact CD1-CG2 4.29Å; Y51-V55 HydrophobicContact CE1-CG2 3.89Å; Y51-V55 HydrophobicContact CE2-CG2 4.4Å; Y51-V55 WeakPolarHBondContact O-CG2 3.29Å; Y51-V55 PolarHBondContact O-N 3.38Å
52	L	98.6	Very high	98.1	Very high	65 Å²	65	72.6 Å²	72.6	34%	0.34	40%	0.399	S	S	.	.	H	α-helix	trans	-63.1	-40.2	179.4	-179.4	59	0	0	0	112.2	V31 L35 A48 A54 V55 L56	V31-L52 HydrophobicContact CG1-CB 4.14Å; V31-L52 HydrophobicContact CG1-CD2 3.79Å; V31-L52 HydrophobicContact CG1-CG 4.08Å; L35-L52 HydrophobicContact CD1-CD2 4.29Å; L35-L52 HydrophobicContact CD2-CD2 3.92Å; L35-L52 HydrophobicContact CG-CD2 4.35Å; A48-L52 WeakPolarHBondContact O-CB 3.34Å; A48-L52 PolarHBondContact O-N 3.12Å; L52-A54 VanDerWaalsContact C-N 3.33Å; L52-A54 PolarHBondContact O-N 3.24Å; L52-V55 PolarHBondContact O-N 3.44Å; L52-L56 HydrophobicContact CD1-CD1 4.21Å; L52-L56 HydrophobicContact CD1-CG 4.17Å; L52-L56 HydrophobicContact CG-CD1 4.09Å; L52-L56 HydrophobicContact CG-CG 4.49Å; L52-L56 WeakPolarHBondContact O-CB 3.34Å; L52-L56 VanDerWaalsContact O-CG 3.22Å; L52-L56 WeakPolarHBondContact O-CG 3.29Å; L52-L56 PolarHBondContact O-N 2.95Å
53	A	98.8	Very high	98.2	Very high	0 Å²	0	64.9 Å²	64.9	0%	0	36%	0.363	C	S	.	.	H	α-helix	trans	-63.1	-40.7	175.5	0	0	0	0	0	111.9	L24 F26 V28 V31 P49 V50 Y51 L56 E57	L24-A53 HydrophobicContact CD1-CB 3.97Å; F26-A53 HydrophobicContact CB-CB 4.28Å; V28-A53 HydrophobicContact CG2-CB 3.88Å; V31-A53 HydrophobicContact CG2-CB 4.18Å; P49-A53 WeakPolarHBondContact O-CB 3.43Å; P49-A53 PolarHBondContact O-N 2.93Å; V50-A53 PolarHBondContact O-N 3.3Å; Y51-A53 VanDerWaalsContact C-N 3.35Å; Y51-A53 PolarHBondContact O-N 3.12Å; A53-L56 PolarHBondContact O-N 3.49Å; A53-E57 VanDerWaalsContact O-CB 3.32Å; A53-E57 WeakPolarHBondContact O-CB 3.46Å; A53-E57 PolarHBondContact O-N 2.94Å
54	A	98.8	Very high	98.2	Very high	37 Å²	37	58.5 Å²	58.5	31%	0.306	35%	0.345	S	S	.	.	H	α-helix	trans	-63.6	-45.4	177.9	0	0	0	0	0	112.1	L24 V50 Y51 L52 L56 E57 Y58	L24-A54 HydrophobicContact CD1-CB 4Å; L24-A54 HydrophobicContact CD2-CB 3.85Å; V50-A54 WeakPolarHBondContact O-CB 3.11Å; V50-A54 PolarHBondContact O-N 2.8Å; Y51-A54 WeakPolarHBondContact O-CB 3.32Å; Y51-A54 PolarHBondContact O-N 2.92Å; L52-A54 VanDerWaalsContact C-N 3.33Å; L52-A54 PolarHBondContact O-N 3.24Å; A54-L56 PolarHBondContact O-N 2.86Å; A54-E57 PolarHBondContact O-N 3.39Å; A54-Y58 WeakPolarHBondContact O-CB 3.3Å; A54-Y58 PolarHBondContact O-N 3.35Å
55	V	98.6	Very high	98.3	Very high	52 Å²	52	62.9 Å²	62.9	32%	0.315	36%	0.364	S	S	.	.	H	α-helix	trans	-62.4	-44.3	177.4	173	0	0	0	0	111.1	Y51 L52 E57 Y58 L59	Y51-V55 HydrophobicContact CD1-CG2 4.29Å; Y51-V55 HydrophobicContact CE1-CG2 3.89Å; Y51-V55 HydrophobicContact CE2-CG2 4.4Å; Y51-V55 WeakPolarHBondContact O-CG2 3.29Å; Y51-V55 PolarHBondContact O-N 3.38Å; L52-V55 PolarHBondContact O-N 3.44Å; V55-E57 VanDerWaalsContact C-N 3.34Å; V55-E57 PolarHBondContact O-N 3.16Å; V55-Y58 PolarHBondContact O-N 3.46Å; V55-L59 HydrophobicContact CG1-CD1 4.04Å; V55-L59 WeakPolarHBondContact O-CG 3.36Å; V55-L59 PolarHBondContact O-N 2.77Å
56	L	98.7	Very high	98.4	Very high	75 Å²	75	62.9 Å²	62.9	39%	0.393	35%	0.353	S	S	.	.	H	α-helix	trans	-63.8	-39.7	177	-69.2	173	0	0	0	112.1	F26 L52 A53 A54 T60	F26-L56 HydrophobicContact CD2-CB 3.76Å; F26-L56 VanDerWaalsContact CE2-C 3.48Å; F26-L56 HydrophobicContact CE2-CB 3.81Å; F26-L56 WeakPolarHBondContact CE2-O 3.15Å; L52-L56 HydrophobicContact CD1-CD1 4.21Å; L52-L56 HydrophobicContact CD1-CG 4.17Å; L52-L56 HydrophobicContact CG-CD1 4.09Å; L52-L56 HydrophobicContact CG-CG 4.49Å; L52-L56 WeakPolarHBondContact O-CB 3.34Å; L52-L56 VanDerWaalsContact O-CG 3.22Å; L52-L56 WeakPolarHBondContact O-CG 3.29Å; L52-L56 PolarHBondContact O-N 2.95Å; A53-L56 PolarHBondContact O-N 3.49Å; A54-L56 PolarHBondContact O-N 2.86Å; L56-T60 VanDerWaalsContact O-CB 3.3Å; L56-T60 WeakPolarHBondContact O-CB 3.3Å; L56-T60 PolarHBondContact O-N 3.27Å; L56-T60 PolarHBondContact O-OG1 2.93Å
57	E	98.7	Very high	98.5	Very high	40 Å²	40	59 Å²	59	19%	0.187	32%	0.321	C	S	.	.	H	α-helix	trans	-64.8	-48	176.7	-175.8	166.4	146.8	0	0	111.3	L24 Q25 F26 A53 A54 V55 T60 A61	L24-E57 WeakPolarHBondContact CA-OE2 3.48Å; L24-E57 WeakPolarHBondContact CB-OE2 3.05Å; Q25-E57 VanDerWaalsContact N-CD 3.35Å; Q25-E57 PolarHBondContact N-OE1 3.32Å; Q25-E57 PolarHBondContact N-OE2 3.17Å; F26-E57 HydrophobicContact CB-CB 4.08Å; F26-E57 WeakPolarHBondContact CB-OE2 3.3Å; F26-E57 HydrophobicContact CD1-CB 3.77Å; F26-E57 HydrophobicContact CD1-CG 3.78Å; F26-E57 HydrophobicContact CD2-CB 3.99Å; F26-E57 HydrophobicContact CE1-CB 4.22Å; F26-E57 HydrophobicContact CE1-CG 4.17Å; F26-E57 HydrophobicContact CE2-CB 4.41Å; F26-E57 HydrophobicContact CG-CB 3.67Å; F26-E57 HydrophobicContact CG-CG 4.19Å; F26-E57 PolarHBondContact N-OE2 2.83Å; A53-E57 VanDerWaalsContact O-CB 3.32Å; A53-E57 WeakPolarHBondContact O-CB 3.46Å; A53-E57 PolarHBondContact O-N 2.94Å; A54-E57 PolarHBondContact O-N 3.39Å; V55-E57 VanDerWaalsContact C-N 3.34Å; V55-E57 PolarHBondContact O-N 3.16Å; E57-T60 PolarHBondContact O-N 2.71Å; E57-A61 VanDerWaalsContact O-CB 3.32Å; E57-A61 WeakPolarHBondContact O-CB 3.2Å; E57-A61 PolarHBondContact O-N 3.49Å
58	Y	98.2	Very high	98.6	Very high	139 Å²	139	58 Å²	58	55%	0.545	31%	0.311	S	S	.	.	H	α-helix	trans	-56.2	-54.1	176.9	170.8	-100.4	0	0	0	111.8	A54 V55 T60 A61 E62	A54-Y58 WeakPolarHBondContact O-CB 3.3Å; A54-Y58 PolarHBondContact O-N 3.35Å; V55-Y58 PolarHBondContact O-N 3.46Å; Y58-T60 VanDerWaalsContact C-N 3.29Å; Y58-T60 PolarHBondContact O-N 3.49Å; Y58-A61 PolarHBondContact O-N 2.99Å; Y58-E62 PolarHBondContact O-N 3.15Å
59	L	98.3	Very high	98.6	Very high	51 Å²	51	57.7 Å²	57.7	27%	0.267	30%	0.303	S	S	.	.	H	α-helix	trans	-61.4	-38.9	179.7	-69.6	173.5	0	0	0	112.1	V55 I63 L97	V55-L59 HydrophobicContact CG1-CD1 4.04Å; V55-L59 WeakPolarHBondContact O-CG 3.36Å; V55-L59 PolarHBondContact O-N 2.77Å; L59-I63 WeakPolarHBondContact O-CD1 3.47Å; L59-I63 VanDerWaalsContact O-CG1 3.27Å; L59-I63 WeakPolarHBondContact O-CG1 3.29Å; L59-I63 PolarHBondContact O-N 3.38Å; L59-I63 VanDerWaalsContact O-N 3.17Å; L59-L97 HydrophobicContact CD1-CD2 4.44Å; L59-L97 HydrophobicContact CD2-CD2 3.76Å
60	T	98.6	Very high	98.6	Very high	52 Å²	52	58.4 Å²	58.4	32%	0.319	31%	0.308	S	S	.	.	H	α-helix	trans	-68.3	-42.8	178.3	-57.1	0	0	0	0	111.2	F26 L56 E57 Y58 I63 L64	F26-T60 HydrophobicContact CZ-CG2 3.85Å; F26-T60 WeakPolarHBondContact CZ-OG1 3.17Å; L56-T60 VanDerWaalsContact O-CB 3.3Å; L56-T60 WeakPolarHBondContact O-CB 3.3Å; L56-T60 PolarHBondContact O-N 3.27Å; L56-T60 PolarHBondContact O-OG1 2.93Å; E57-T60 PolarHBondContact O-N 2.71Å; Y58-T60 VanDerWaalsContact C-N 3.29Å; Y58-T60 PolarHBondContact O-N 3.49Å; T60-I63 PolarHBondContact O-N 2.83Å; T60-L64 HydrophobicContact CG2-CD1 3.65Å; T60-L64 HydrophobicContact CG2-CG 4.07Å; T60-L64 VanDerWaalsContact O-CB 3.29Å; T60-L64 WeakPolarHBondContact O-CB 3.36Å; T60-L64 WeakPolarHBondContact O-CG 3.37Å; T60-L64 PolarHBondContact O-N 3.29Å
61	A	98.4	Very high	98.6	Very high	54 Å²	54	56.1 Å²	56.1	45%	0.446	30%	0.295	S	S	.	.	H	α-helix	trans	-60.4	-46.5	178.3	0	0	0	0	0	111.1	E57 Y58 L64 E65	E57-A61 VanDerWaalsContact O-CB 3.32Å; E57-A61 WeakPolarHBondContact O-CB 3.2Å; E57-A61 PolarHBondContact O-N 3.49Å; Y58-A61 PolarHBondContact O-N 2.99Å; A61-L64 PolarHBondContact O-N 3.29Å; A61-E65 WeakPolarHBondContact O-CB 3.3Å; A61-E65 PolarHBondContact O-N 2.91Å
62	E	98.3	Very high	98.6	Very high	67 Å²	67	55.4 Å²	55.4	31%	0.313	29%	0.291	S	S	.	.	H	α-helix	trans	-60.3	-49.3	179.2	-167.5	59	-145.2	0	0	112	Y58 L64 E65 L66 L94	Y58-E62 PolarHBondContact O-N 3.15Å; E62-L64 VanDerWaalsContact C-N 3.33Å; E62-L64 PolarHBondContact O-N 3.49Å; E62-E65 PolarHBondContact O-N 3.03Å; E62-L66 WeakPolarHBondContact O-CG 3.44Å; E62-L66 PolarHBondContact O-N 3.01Å; E62-L66 VanDerWaalsContact O-N 3.16Å; E62-L94 HydrophobicContact CG-CD1 4.36Å
63	I	98.6	Very high	98.5	Very high	37 Å²	37	57.7 Å²	57.7	19%	0.19	30%	0.304	C	S	.	.	H	α-helix	trans	-61.9	-41.9	178.2	-67.2	167	0	0	0	111	L59 T60 A67 L84 L94 L98	L59-I63 WeakPolarHBondContact O-CD1 3.47Å; L59-I63 VanDerWaalsContact O-CG1 3.27Å; L59-I63 WeakPolarHBondContact O-CG1 3.29Å; L59-I63 PolarHBondContact O-N 3.38Å; L59-I63 VanDerWaalsContact O-N 3.17Å; T60-I63 PolarHBondContact O-N 2.83Å; I63-A67 WeakPolarHBondContact O-CB 3.27Å; I63-A67 PolarHBondContact O-N 3.22Å; I63-L84 HydrophobicContact CG2-CD2 3.8Å; I63-L94 HydrophobicContact CD1-CD2 4.25Å; I63-L94 HydrophobicContact CG1-CD1 3.85Å; I63-L94 HydrophobicContact CG1-CD2 3.8Å; I63-L94 HydrophobicContact CG1-CG 4.49Å; I63-L98 HydrophobicContact CD1-CD1 4.39Å
64	L	98.6	Very high	98.5	Very high	87 Å²	87	61.3 Å²	61.3	46%	0.455	32%	0.323	S	S	.	.	H	α-helix	trans	-72.1	-34.3	-178.4	-72.3	179.9	0	0	0	112.9	T60 A61 E62 G68 I79	T60-L64 HydrophobicContact CG2-CD1 3.65Å; T60-L64 HydrophobicContact CG2-CG 4.07Å; T60-L64 VanDerWaalsContact O-CB 3.29Å; T60-L64 WeakPolarHBondContact O-CB 3.36Å; T60-L64 WeakPolarHBondContact O-CG 3.37Å; T60-L64 PolarHBondContact O-N 3.29Å; A61-L64 PolarHBondContact O-N 3.29Å; E62-L64 VanDerWaalsContact C-N 3.33Å; E62-L64 PolarHBondContact O-N 3.49Å; L64-G68 WeakPolarHBondContact O-CA 3.27Å; L64-G68 PolarHBondContact O-N 3.01Å; L64-I79 HydrophobicContact CD2-CD1 4.03Å
65	E	98.5	Very high	98.4	Very high	113 Å²	113	68.8 Å²	68.8	53%	0.528	35%	0.348	S	S	.	.	H	α-helix	trans	-62.4	-55.1	175	176.7	55.7	-144.8	0	0	110.1	A61 E62 A67 G68 N69	A61-E65 WeakPolarHBondContact O-CB 3.3Å; A61-E65 PolarHBondContact O-N 2.91Å; E62-E65 PolarHBondContact O-N 3.03Å; E65-A67 PolarHBondContact O-N 3.33Å; E65-G68 PolarHBondContact O-N 3.18Å; E65-G68 VanDerWaalsContact O-N 3.15Å; E65-N69 PolarHBondContact O-N 2.95Å; E65-N69 PolarHBondContact O-ND2 2.83Å; E65-N69 PolarHBondContact OE1-ND2 3.35Å
66	L	98.7	Very high	98.4	Very high	47 Å²	47	72.3 Å²	72.3	25%	0.246	36%	0.36	C	S	.	.	H	α-helix	trans	-62.9	-41.2	179.3	-64.9	175.5	0	0	0	112.2	E62 G68 N69 A70 A87 D91 L94	E62-L66 WeakPolarHBondContact O-CG 3.44Å; E62-L66 PolarHBondContact O-N 3.01Å; E62-L66 VanDerWaalsContact O-N 3.16Å; L66-G68 VanDerWaalsContact C-N 3.33Å; L66-N69 PolarHBondContact O-N 3.43Å; L66-A70 PolarHBondContact O-N 3.02Å; L66-A87 HydrophobicContact CB-CB 3.64Å; L66-D91 HydrophobicContact CD1-CB 3.89Å; L66-L94 HydrophobicContact CD1-CD1 3.75Å
67	A	98.8	Very high	98.3	Very high	0 Å²	0	76.3 Å²	76.3	0%	0	39%	0.387	C	S	.	.	H	α-helix	trans	-70.1	-31.3	176.7	0	0	0	0	0	112.4	I63 E65 A71 I79 H83 L84 A87	I63-A67 WeakPolarHBondContact O-CB 3.27Å; I63-A67 PolarHBondContact O-N 3.22Å; E65-A67 PolarHBondContact O-N 3.33Å; A67-A71 WeakPolarHBondContact O-CB 3.06Å; A67-A71 PolarHBondContact O-N 3.2Å; A67-I79 HydrophobicContact CB-CD1 4.12Å; A67-I79 HydrophobicContact CB-CG1 4.48Å; A67-I79 HydrophobicContact CB-CG2 3.98Å; A67-H83 HydrophobicContact CB-CB 4.42Å; A67-L84 HydrophobicContact CB-CD2 3.83Å; A67-A87 HydrophobicContact CB-CB 3.96Å
68	G	98.7	Very high	98.3	Very high	28 Å²	28	83.5 Å²	83.5	29%	0.289	41%	0.413	S	S	.	.	H	α-helix	trans	-64.3	-45	171.9	0	0	0	0	0	111.5	L64 E65 L66 A71 R72	L64-G68 WeakPolarHBondContact O-CA 3.27Å; L64-G68 PolarHBondContact O-N 3.01Å; E65-G68 PolarHBondContact O-N 3.18Å; E65-G68 VanDerWaalsContact O-N 3.15Å; L66-G68 VanDerWaalsContact C-N 3.33Å; G68-A71 WeakPolarHBondContact O-CB 3.36Å; G68-A71 PolarHBondContact O-N 3.48Å; G68-R72 PolarHBondContact O-N 3.45Å
69	N	98.6	Very high	98.4	Very high	40 Å²	40	79.9 Å²	79.9	21%	0.214	40%	0.402	C	S	.	.	H	α-helix	trans	-59.3	-49.9	173.2	-70.6	-37	0	0	0	111.1	E65 L66 A71 R72 D73	E65-N69 PolarHBondContact O-N 2.95Å; E65-N69 PolarHBondContact O-ND2 2.83Å; E65-N69 PolarHBondContact OE1-ND2 3.35Å; L66-N69 PolarHBondContact O-N 3.43Å; N69-A71 VanDerWaalsContact C-N 3.29Å; N69-A71 PolarHBondContact O-N 3.38Å; N69-R72 WeakPolarHBondContact O-CB 3.4Å; N69-R72 PolarHBondContact O-N 3.11Å; N69-R72 VanDerWaalsContact O-N 3.12Å; N69-R72 PolarHBondContact OD1-NH1 2.76Å; N69-R72 PolarHBondContact OD1-NH2 3.17Å; N69-D73 VanDerWaalsContact O-CG 3.25Å; N69-D73 PolarHBondContact O-N 2.77Å
70	A	98.4	Very high	98.4	Very high	14 Å²	14	81 Å²	81	12%	0.116	41%	0.408	C	S	.	.	H	α-helix	trans	-60.8	-34.6	176.5	0	0	0	0	0	113.4	L66 N74 H83 L86	L66-A70 PolarHBondContact O-N 3.02Å; A70-N74 PolarHBondContact O-N 3.38Å; A70-N74 PolarHBondContact O-ND2 2.87Å; A70-H83 HydrophobicContact CB-CB 4.22Å; A70-L86 HydrophobicContact CB-CB 4.21Å; A70-L86 HydrophobicContact CB-CD1 4.49Å
71	A	98.7	Very high	98.4	Very high	4 Å²	4	81.1 Å²	81.1	3%	0.033	41%	0.409	C	S	.	.	H	α-helix	trans	-66.3	-45.1	174.8	0	0	0	0	0	111.7	A67 G68 N69 N74 K75 K76 I79 H83	A67-A71 WeakPolarHBondContact O-CB 3.06Å; A67-A71 PolarHBondContact O-N 3.2Å; G68-A71 WeakPolarHBondContact O-CB 3.36Å; G68-A71 PolarHBondContact O-N 3.48Å; N69-A71 VanDerWaalsContact C-N 3.29Å; N69-A71 PolarHBondContact O-N 3.38Å; A71-N74 CarbonylContact O-C 3.56Å; A71-N74 PolarHBondContact O-N 3.36Å; A71-K75 PolarHBondContact O-N 3.06Å; A71-K76 CarbonylContact C-O 3.32Å; A71-K76 WeakPolarHBondContact O-CA 3.4Å; A71-K76 PolarHBondContact O-N 2.99Å; A71-K76 VanDerWaalsContact O-O 3.08Å; A71-I79 HydrophobicContact CB-CG1 4.24Å; A71-H83 VanDerWaalsContact CA-CE1 3.46Å; A71-H83 WeakPolarHBondContact CA-CE1 3.31Å; A71-H83 WeakPolarHBondContact CA-ND1 3.29Å; A71-H83 HydrophobicContact CB-CB 4.49Å; A71-H83 WeakPolarHBondContact CB-ND1 3.32Å
72	R	98.5	Very high	98.4	Very high	162 Å²	162	81.6 Å²	81.6	61%	0.611	40%	0.399	S	S	*	.	H	α-helix	trans	-61.6	-43.1	177.8	-175.5	178.8	65.1	-146	-7.7	111.5	G68 N69 N74 K75	G68-R72 PolarHBondContact O-N 3.45Å; N69-R72 WeakPolarHBondContact O-CB 3.4Å; N69-R72 PolarHBondContact O-N 3.11Å; N69-R72 VanDerWaalsContact O-N 3.12Å; N69-R72 PolarHBondContact OD1-NH1 2.76Å; N69-R72 PolarHBondContact OD1-NH2 3.17Å; R72-N74 VanDerWaalsContact C-N 3.26Å; R72-N74 PolarHBondContact O-N 3.03Å; R72-K75 WeakPolarHBondContact O-CA 3.43Å; R72-K75 PolarHBondContact O-N 3Å
73	D	97.6	Very high	98.4	Very high	113 Å²	113	78.5 Å²	78.5	60%	0.604	39%	0.385	S	S	*	.	H	α-helix	trans	-62.9	-35.2	178.6	-64.2	-14.9	0	0	0	111.7	N69 K75	N69-D73 VanDerWaalsContact O-CG 3.25Å; N69-D73 PolarHBondContact O-N 2.77Å; D73-K75 PolarHBondContact O-N 2.96Å
74	N	97.2	Very high	98.4	Very high	75 Å²	75	79.3 Å²	79.3	40%	0.401	39%	0.389	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.1	10.7	172.1	-68.7	-29.7	0	0	0	113.9	A70 A71 R72 K76 H83	A70-N74 PolarHBondContact O-N 3.38Å; A70-N74 PolarHBondContact O-ND2 2.87Å; A71-N74 CarbonylContact O-C 3.56Å; A71-N74 PolarHBondContact O-N 3.36Å; R72-N74 VanDerWaalsContact C-N 3.26Å; R72-N74 PolarHBondContact O-N 3.03Å; N74-K76 HydrophobicContact CB-CG 4.29Å; N74-K76 WeakPolarHBondContact O-CG 3.22Å; N74-K76 PolarHBondContact O-N 3.18Å; N74-H83 PolarHBondContact ND2-CD2 3.49Å; N74-H83 VanDerWaalsContact ND2-CD2 3.27Å; N74-H83 PolarHBondContact ND2-NE2 3.36Å
75	K	98.2	Very high	98.4	Very high	194 Å²	194	75.9 Å²	75.9	84%	0.843	37%	0.371	S	S	*	.	T	Hydrogen-bonded Turn	trans	55.6	37.8	-178.6	-53.4	176.7	-177.8	178	0	112.4	A71 R72 D73	A71-K75 PolarHBondContact O-N 3.06Å; R72-K75 WeakPolarHBondContact O-CA 3.43Å; R72-K75 PolarHBondContact O-N 3Å; D73-K75 PolarHBondContact O-N 2.96Å
76	K	98.4	Very high	98.4	Very high	127 Å²	127	71.9 Å²	71.9	55%	0.552	35%	0.353	S	S	*	.			trans	-115.8	145.1	176.7	-57.8	-57.3	179.5	-178.1	0	110.3	A71 N74	A71-K76 CarbonylContact C-O 3.32Å; A71-K76 WeakPolarHBondContact O-CA 3.4Å; A71-K76 PolarHBondContact O-N 2.99Å; A71-K76 VanDerWaalsContact O-O 3.08Å; N74-K76 HydrophobicContact CB-CG 4.29Å; N74-K76 WeakPolarHBondContact O-CG 3.22Å; N74-K76 PolarHBondContact O-N 3.18Å
77	T	97.3	Very high	98.3	Very high	158 Å²	158	70 Å²	70	97%	0.969	34%	0.344	S	S	*	.	S	Bend	trans	-94	-7.6	173.5	54.7	0	0	0	0	113
78	R	98.7	Very high	98.3	Very high	191 Å²	191	70.1 Å²	70.1	72%	0.721	35%	0.345	S	S	*	.	S	Bend	trans	-116.6	129.5	-178	-177.3	175.8	-65.3	141.5	1.9	110.3	I80 H83	R78-I80 HydrophobicContact CG-CG2 4.46Å; R78-I80 PolarHBondContact O-N 3.01Å; R78-H83 PolarHBondContact O-CE1 2.68Å; R78-H83 PolarHBondContact O-ND1 2.89Å
79	I	98.7	Very high	98.3	Very high	63 Å²	63	70.8 Å²	70.8	32%	0.323	34%	0.339	S	S	.	.			trans	-69.3	127.5	168.4	-63.3	173.8	0	0	0	108.5	L64 A67 A71 H83 L84	L64-I79 HydrophobicContact CD2-CD1 4.03Å; A67-I79 HydrophobicContact CB-CD1 4.12Å; A67-I79 HydrophobicContact CB-CG1 4.48Å; A67-I79 HydrophobicContact CB-CG2 3.98Å; A71-I79 HydrophobicContact CB-CG1 4.24Å; I79-H83 HydrophobicContact CG2-CB 4.21Å; I79-L84 HydrophobicContact CG2-CD2 4.09Å; I79-L84 HydrophobicContact CG2-CG 4.09Å
80	I	98.4	Very high	98.2	Very high	76 Å²	76	74.3 Å²	74.3	39%	0.39	36%	0.358	S	S	.	.			trans	-121.9	166.9	174.3	62.8	163.8	0	0	0	108.9	R78 R82 H83 L84	R78-I80 HydrophobicContact CG-CG2 4.46Å; R78-I80 PolarHBondContact O-N 3.01Å; I80-R82 HydrophobicContact CD1-CB 3.96Å; I80-R82 HydrophobicContact CG1-CB 4.11Å; I80-R82 PolarHBondContact O-N 2.92Å; I80-H83 PolarHBondContact N-ND1 3.29Å; I80-H83 WeakPolarHBondContact O-CB 3.46Å; I80-H83 PolarHBondContact O-N 3.49Å; I80-L84 PolarHBondContact O-N 3.17Å
81	P	98.6	Very high	98.2	Very high	53 Å²	53	75.6 Å²	75.6	34%	0.344	36%	0.363	S	S	.	.	H	α-helix	trans	-53	-32.9	-178.4	-30.3	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 3.44Å; P81-L84 PolarHBondContact O-N 3.45Å; P81-Q85 PolarHBondContact O-N 2.88Å; P81-I103 HydrophobicContact CB-CG2 4.44Å; P81-A104 VanDerWaalsContact CB-O 3.29Å; P81-A104 WeakPolarHBondContact CB-O 3.36Å; P81-Q105 HydrophobicContact CB-CB 4.04Å; P81-Q105 HydrophobicContact CG-CB 4.19Å
82	R	98.4	Very high	98.1	Very high	64 Å²	64	83.4 Å²	83.4	24%	0.242	40%	0.398	C	S	.	.	H	α-helix	trans	-57.1	-41.8	172.3	179	55.5	178.1	176.9	-2.1	113	I80 Q85 L86 G106 V108	I80-R82 HydrophobicContact CD1-CB 3.96Å; I80-R82 HydrophobicContact CG1-CB 4.11Å; I80-R82 PolarHBondContact O-N 2.92Å; R82-Q85 PolarHBondContact O-N 3.45Å; R82-L86 HydrophobicContact CG-CD1 4.28Å; R82-L86 WeakPolarHBondContact O-CG 3.28Å; R82-L86 PolarHBondContact O-N 3.45Å; R82-G106 WeakPolarHBondContact CD-O 3.48Å; R82-G106 PolarHBondContact NH1-O 3.08Å; R82-V108 PolarHBondContact NH1-O 3.47Å; R82-V108 PolarHBondContact NH2-O 3.01Å; R82-V108 VanDerWaalsContact NH2-O 3.14Å
83	H	98.7	Very high	98.1	Very high	3 Å²	3	82.5 Å²	82.5	1%	0.014	40%	0.401	C	S	.	.	H	α-helix	trans	-69.2	-37.1	-179.7	-54.7	152.4	0	0	0	111.3	A67 A70 A71 N74 R78 I79 I80 P81 L86 A87	A67-H83 HydrophobicContact CB-CB 4.42Å; A70-H83 HydrophobicContact CB-CB 4.22Å; A71-H83 VanDerWaalsContact CA-CE1 3.46Å; A71-H83 WeakPolarHBondContact CA-CE1 3.31Å; A71-H83 WeakPolarHBondContact CA-ND1 3.29Å; A71-H83 HydrophobicContact CB-CB 4.49Å; A71-H83 WeakPolarHBondContact CB-ND1 3.32Å; N74-H83 PolarHBondContact ND2-CD2 3.49Å; N74-H83 VanDerWaalsContact ND2-CD2 3.27Å; N74-H83 PolarHBondContact ND2-NE2 3.36Å; R78-H83 PolarHBondContact O-CE1 2.68Å; R78-H83 PolarHBondContact O-ND1 2.89Å; I79-H83 HydrophobicContact CG2-CB 4.21Å; I80-H83 PolarHBondContact N-ND1 3.29Å; I80-H83 WeakPolarHBondContact O-CB 3.46Å; I80-H83 PolarHBondContact O-N 3.49Å; P81-H83 VanDerWaalsContact C-N 3.32Å; P81-H83 PolarHBondContact O-N 3.44Å; H83-L86 PolarHBondContact O-N 3.18Å; H83-A87 VanDerWaalsContact O-CB 3.32Å; H83-A87 WeakPolarHBondContact O-CB 3.37Å; H83-A87 PolarHBondContact O-N 3.3Å
84	L	98.4	Very high	98.1	Very high	53 Å²	53	77.4 Å²	77.4	28%	0.277	37%	0.374	S	S	.	.	H	α-helix	trans	-63.3	-42.7	172.3	-64.5	173.5	0	0	0	111.6	I63 A67 I79 I80 P81 A87 V88 I103	I63-L84 HydrophobicContact CG2-CD2 3.8Å; A67-L84 HydrophobicContact CB-CD2 3.83Å; I79-L84 HydrophobicContact CG2-CD2 4.09Å; I79-L84 HydrophobicContact CG2-CG 4.09Å; I80-L84 PolarHBondContact O-N 3.17Å; P81-L84 PolarHBondContact O-N 3.45Å; L84-A87 PolarHBondContact O-N 3.4Å; L84-V88 WeakPolarHBondContact O-CB 3.49Å; L84-V88 VanDerWaalsContact O-CG2 3.29Å; L84-V88 WeakPolarHBondContact O-CG2 3.44Å; L84-V88 PolarHBondContact O-N 2.99Å; L84-I103 HydrophobicContact CB-CG2 4.44Å
85	Q	98.4	Very high	98.2	Very high	16 Å²	16	76.9 Å²	76.9	8%	0.075	37%	0.371	C	S	.	.	H	α-helix	trans	-62	-45.9	176.3	-178.5	75.1	18.2	0	0	111.8	P81 R82 R89 G106 G107	P81-Q85 PolarHBondContact O-N 2.88Å; R82-Q85 PolarHBondContact O-N 3.45Å; Q85-R89 HydrophobicContact CG-CG 4.27Å; Q85-R89 WeakPolarHBondContact O-CB 3.37Å; Q85-R89 VanDerWaalsContact O-CG 3.3Å; Q85-R89 WeakPolarHBondContact O-CG 3.4Å; Q85-R89 PolarHBondContact O-N 2.98Å; Q85-G106 WeakPolarHBondContact CB-O 3.44Å; Q85-G106 WeakPolarHBondContact CG-O 3.39Å; Q85-G107 VanDerWaalsContact CD-O 3.25Å; Q85-G107 WeakPolarHBondContact CG-O 3.17Å; Q85-G107 PolarHBondContact NE2-O 2.9Å
86	L	98.1	Very high	98.1	Very high	29 Å²	29	76.4 Å²	76.4	15%	0.152	37%	0.369	C	S	.	.	H	α-helix	trans	-62.9	-43.4	178	-69.5	175.6	0	0	0	111.2	A70 R82 H83 N90 L109	A70-L86 HydrophobicContact CB-CB 4.21Å; A70-L86 HydrophobicContact CB-CD1 4.49Å; R82-L86 HydrophobicContact CG-CD1 4.28Å; R82-L86 WeakPolarHBondContact O-CG 3.28Å; R82-L86 PolarHBondContact O-N 3.45Å; H83-L86 PolarHBondContact O-N 3.18Å; L86-N90 VanDerWaalsContact O-CB 3.29Å; L86-N90 WeakPolarHBondContact O-CB 3.32Å; L86-N90 PolarHBondContact O-N 3.48Å; L86-N90 PolarHBondContact O-ND2 2.87Å; L86-L109 HydrophobicContact CD2-CD2 3.89Å
87	A	98.2	Very high	98.1	Very high	7 Å²	7	75.4 Å²	75.4	6%	0.058	37%	0.369	C	S	.	.	H	α-helix	trans	-61.3	-55.3	176.8	0	0	0	0	0	111.8	L66 A67 H83 L84 R89 D91	L66-A87 HydrophobicContact CB-CB 3.64Å; A67-A87 HydrophobicContact CB-CB 3.96Å; H83-A87 VanDerWaalsContact O-CB 3.32Å; H83-A87 WeakPolarHBondContact O-CB 3.37Å; H83-A87 PolarHBondContact O-N 3.3Å; L84-A87 PolarHBondContact O-N 3.4Å; A87-R89 PolarHBondContact O-N 3.05Å; A87-D91 WeakPolarHBondContact O-CB 3.4Å; A87-D91 PolarHBondContact O-N 3.48Å
88	V	98.3	Very high	98.1	Very high	3 Å²	3	69.8 Å²	69.8	2%	0.018	33%	0.333	C	S	.	.	H	α-helix	trans	-66.1	-37.7	-174.2	169.2	0	0	0	0	112.6	L84 N95 L98 I103	L84-V88 WeakPolarHBondContact O-CB 3.49Å; L84-V88 VanDerWaalsContact O-CG2 3.29Å; L84-V88 WeakPolarHBondContact O-CG2 3.44Å; L84-V88 PolarHBondContact O-N 2.99Å; V88-N95 VanDerWaalsContact O-CA 3.3Å; V88-N95 WeakPolarHBondContact O-CA 3.42Å; V88-N95 VanDerWaalsContact O-CB 3.3Å; V88-N95 WeakPolarHBondContact O-CB 3.48Å; V88-N95 PolarHBondContact O-N 2.98Å; V88-N95 VanDerWaalsContact O-N 3.12Å; V88-L98 HydrophobicContact CB-CD1 4.37Å; V88-L98 HydrophobicContact CG1-CB 3.85Å; V88-L98 HydrophobicContact CG1-CD1 3.64Å; V88-L98 HydrophobicContact CG1-CG 4.31Å; V88-L98 HydrophobicContact CG2-CD1 3.72Å; V88-I103 HydrophobicContact CB-CD1 4.12Å; V88-I103 HydrophobicContact CG1-CD1 4.34Å; V88-I103 HydrophobicContact CG2-CD1 4.17Å
89	R	97.9	Very high	98	Very high	41 Å²	41	63.3 Å²	63.3	16%	0.155	33%	0.325	C	S	.	.	H	α-helix	trans	-85.8	-23.4	-175.4	-59.7	-52.5	172.6	-151.9	-4.1	114.7	Q85 A87 N95 L98 V101 L109	Q85-R89 HydrophobicContact CG-CG 4.27Å; Q85-R89 WeakPolarHBondContact O-CB 3.37Å; Q85-R89 VanDerWaalsContact O-CG 3.3Å; Q85-R89 WeakPolarHBondContact O-CG 3.4Å; Q85-R89 PolarHBondContact O-N 2.98Å; A87-R89 PolarHBondContact O-N 3.05Å; R89-N95 WeakPolarHBondContact CD-OD1 3.43Å; R89-N95 PolarHBondContact NH1-OD1 3.15Å; R89-N95 VanDerWaalsContact NH1-OD1 3.12Å; R89-L98 PolarHBondContact NH1-O 3.28Å; R89-V101 PolarHBondContact NH2-O 3.01Å; R89-L109 HydrophobicContact CB-CD1 3.64Å; R89-L109 HydrophobicContact CB-CD2 3.94Å; R89-L109 HydrophobicContact CB-CG 3.64Å; R89-L109 HydrophobicContact CG-CG 4.43Å
90	N	97	Very high	97.8	Very high	114 Å²	114	64.3 Å²	64.3	61%	0.61	35%	0.351	S	S	*	.	H	α-helix	trans	-85.4	-18.9	175.5	-71.1	-54.7	0	0	0	112.5	L86	L86-N90 VanDerWaalsContact O-CB 3.29Å; L86-N90 WeakPolarHBondContact O-CB 3.32Å; L86-N90 PolarHBondContact O-N 3.48Å; L86-N90 PolarHBondContact O-ND2 2.87Å
91	D	98	Very high	97.7	Very high	42 Å²	42	64.1 Å²	64.1	23%	0.225	35%	0.353	C	S	.	.	S	Bend	trans	-89.6	128.1	172.7	-178.4	80.1	0	0	0	111.3	L66 A87 E93 L94 N95	L66-D91 HydrophobicContact CD1-CB 3.89Å; A87-D91 WeakPolarHBondContact O-CB 3.4Å; A87-D91 PolarHBondContact O-N 3.48Å; D91-E93 PolarHBondContact OD2-N 3.21Å; D91-E93 VanDerWaalsContact OD2-N 3.15Å; D91-L94 HydrophobicContact CB-CB 4.09Å; D91-L94 HydrophobicContact CB-CD1 4.09Å; D91-L94 HydrophobicContact CB-CG 4.3Å; D91-L94 VanDerWaalsContact OD2-CB 3.31Å; D91-L94 WeakPolarHBondContact OD2-CB 3.43Å; D91-L94 VanDerWaalsContact OD2-CG 3.27Å; D91-L94 WeakPolarHBondContact OD2-CG 3.36Å; D91-L94 PolarHBondContact OD2-N 3.15Å; D91-N95 WeakPolarHBondContact O-CB 3.41Å; D91-N95 PolarHBondContact O-N 3.16Å
92	E	97.7	Very high	97.6	Very high	167 Å²	167	67.8 Å²	67.8	78%	0.78	38%	0.375	S	S	*	.	H	α-helix	trans	-66.2	-45.3	-173.9	-174.7	-179.2	167.2	0	0	112.3	N95 K96	E92-N95 PolarHBondContact O-N 3.22Å; E92-K96 WeakPolarHBondContact O-CB 3.15Å; E92-K96 PolarHBondContact O-N 3.27Å
93	E	98	Very high	97.6	Very high	144 Å²	144	66.4 Å²	66.4	67%	0.673	37%	0.372	S	S	*	.	H	α-helix	trans	-70.8	-45.6	-175	-61.3	-166.8	141.1	0	0	111.1	D91 K96 L97	D91-E93 PolarHBondContact OD2-N 3.21Å; D91-E93 VanDerWaalsContact OD2-N 3.15Å; E93-K96 PolarHBondContact O-N 3.27Å; E93-L97 VanDerWaalsContact O-CB 3.28Å; E93-L97 WeakPolarHBondContact O-CB 3.38Å; E93-L97 PolarHBondContact O-N 3.23Å
94	L	98.2	Very high	97.6	Very high	6 Å²	6	69.9 Å²	69.9	3%	0.031	40%	0.401	C	S	.	.	H	α-helix	trans	-66	-39.1	175.5	-67.5	178	0	0	0	111.5	E62 I63 L66 D91 K96 L97 L98	E62-L94 HydrophobicContact CG-CD1 4.36Å; I63-L94 HydrophobicContact CD1-CD2 4.25Å; I63-L94 HydrophobicContact CG1-CD1 3.85Å; I63-L94 HydrophobicContact CG1-CD2 3.8Å; I63-L94 HydrophobicContact CG1-CG 4.49Å; L66-L94 HydrophobicContact CD1-CD1 3.75Å; D91-L94 HydrophobicContact CB-CB 4.09Å; D91-L94 HydrophobicContact CB-CD1 4.09Å; D91-L94 HydrophobicContact CB-CG 4.3Å; D91-L94 VanDerWaalsContact OD2-CB 3.31Å; D91-L94 WeakPolarHBondContact OD2-CB 3.43Å; D91-L94 VanDerWaalsContact OD2-CG 3.27Å; D91-L94 WeakPolarHBondContact OD2-CG 3.36Å; D91-L94 PolarHBondContact OD2-N 3.15Å; L94-K96 VanDerWaalsContact C-N 3.3Å; L94-K96 PolarHBondContact O-N 3.33Å; L94-L97 HydrophobicContact CD2-CD2 4.47Å; L94-L97 PolarHBondContact O-N 3.04Å; L94-L98 VanDerWaalsContact O-CB 3.29Å; L94-L98 WeakPolarHBondContact O-CB 3.45Å; L94-L98 PolarHBondContact O-N 3.41Å
95	N	97.7	Very high	97.5	Very high	64 Å²	64	75.6 Å²	75.6	34%	0.342	43%	0.427	S	S	.	.	H	α-helix	trans	-64.4	-39.5	177	-172.8	44.9	0	0	0	111.1	V88 R89 D91 E92 L98 G99	V88-N95 VanDerWaalsContact O-CA 3.3Å; V88-N95 WeakPolarHBondContact O-CA 3.42Å; V88-N95 VanDerWaalsContact O-CB 3.3Å; V88-N95 WeakPolarHBondContact O-CB 3.48Å; V88-N95 PolarHBondContact O-N 2.98Å; V88-N95 VanDerWaalsContact O-N 3.12Å; R89-N95 WeakPolarHBondContact CD-OD1 3.43Å; R89-N95 PolarHBondContact NH1-OD1 3.15Å; R89-N95 VanDerWaalsContact NH1-OD1 3.12Å; D91-N95 WeakPolarHBondContact O-CB 3.41Å; D91-N95 PolarHBondContact O-N 3.16Å; E92-N95 PolarHBondContact O-N 3.22Å; N95-L98 CarbonylContact O-C 3.51Å; N95-G99 WeakPolarHBondContact O-CA 3.4Å; N95-G99 PolarHBondContact O-N 3.25Å
96	K	98	Very high	97.5	Very high	183 Å²	183	74.9 Å²	74.9	80%	0.796	42%	0.424	S	S	*	.	H	α-helix	trans	-66.1	-47.6	174.2	-176.2	177.8	-179	178.3	0	111.5	E92 E93 L94 L98 G99	E92-K96 WeakPolarHBondContact O-CB 3.15Å; E92-K96 PolarHBondContact O-N 3.27Å; E93-K96 PolarHBondContact O-N 3.27Å; L94-K96 VanDerWaalsContact C-N 3.3Å; L94-K96 PolarHBondContact O-N 3.33Å; K96-L98 VanDerWaalsContact C-N 3.29Å; K96-L98 PolarHBondContact O-N 3.06Å; K96-G99 PolarHBondContact O-N 3.06Å
97	L	97.8	Very high	97.4	Very high	106 Å²	106	75.9 Å²	75.9	56%	0.555	44%	0.441	S	S	*	.	H	α-helix	trans	-60.2	-38.7	178.5	179.7	63.2	0	0	0	112	L59 E93 L94	L59-L97 HydrophobicContact CD1-CD2 4.44Å; L59-L97 HydrophobicContact CD2-CD2 3.76Å; E93-L97 VanDerWaalsContact O-CB 3.28Å; E93-L97 WeakPolarHBondContact O-CB 3.38Å; E93-L97 PolarHBondContact O-N 3.23Å; L94-L97 HydrophobicContact CD2-CD2 4.47Å; L94-L97 PolarHBondContact O-N 3.04Å
98	L	97.4	Very high	97.3	Very high	41 Å²	41	80.8 Å²	80.8	22%	0.215	47%	0.47	C	S	.	.	T	Hydrogen-bonded Turn	trans	-108.6	26.4	-175.5	-57.5	177.1	0	0	0	112.8	I63 V88 R89 L94 N95 K96 G100 V101	I63-L98 HydrophobicContact CD1-CD1 4.39Å; V88-L98 HydrophobicContact CB-CD1 4.37Å; V88-L98 HydrophobicContact CG1-CB 3.85Å; V88-L98 HydrophobicContact CG1-CD1 3.64Å; V88-L98 HydrophobicContact CG1-CG 4.31Å; V88-L98 HydrophobicContact CG2-CD1 3.72Å; R89-L98 PolarHBondContact NH1-O 3.28Å; L94-L98 VanDerWaalsContact O-CB 3.29Å; L94-L98 WeakPolarHBondContact O-CB 3.45Å; L94-L98 PolarHBondContact O-N 3.41Å; N95-L98 CarbonylContact O-C 3.51Å; K96-L98 VanDerWaalsContact C-N 3.29Å; K96-L98 PolarHBondContact O-N 3.06Å; L98-G100 VanDerWaalsContact C-N 3.31Å; L98-G100 PolarHBondContact O-N 2.75Å; L98-V101 HydrophobicContact CB-CB 4.28Å; L98-V101 HydrophobicContact CB-CG2 4.37Å; L98-V101 HydrophobicContact CD2-CG2 4.07Å; L98-V101 PolarHBondContact O-N 2.97Å; L98-V101 VanDerWaalsContact O-N 3.12Å
99	G	95	Very high	97.2	Very high	54 Å²	54	83.3 Å²	83.3	56%	0.557	48%	0.483	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.2	-35.2	-173.4	0	0	0	0	0	114.1	N95 K96	N95-G99 WeakPolarHBondContact O-CA 3.4Å; N95-G99 PolarHBondContact O-N 3.25Å; K96-G99 PolarHBondContact O-N 3.06Å
100	G	95	Very high	97	Very high	84 Å²	84	86.5 Å²	86.5	87%	0.866	51%	0.509	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.3	2.4	177.6	0	0	0	0	0	115.1	L98	L98-G100 VanDerWaalsContact C-N 3.31Å; L98-G100 PolarHBondContact O-N 2.75Å
101	V	97	Very high	96.9	Very high	72 Å²	72	87.1 Å²	87.1	44%	0.436	51%	0.512	S	S	.	.			trans	-94.6	126.3	-173.2	178.2	0	0	0	0	110.2	R89 L98	R89-V101 PolarHBondContact NH2-O 3.01Å; L98-V101 HydrophobicContact CB-CB 4.28Å; L98-V101 HydrophobicContact CB-CG2 4.37Å; L98-V101 HydrophobicContact CD2-CG2 4.07Å; L98-V101 PolarHBondContact O-N 2.97Å; L98-V101 VanDerWaalsContact O-N 3.12Å
102	T	97.2	Very high	96.8	Very high	131 Å²	131	90.1 Å²	90.1	80%	0.804	53%	0.527	S	S	*	.			trans	-87.3	123	171.5	-63.8	0	0	0	0	110.3	A104	T102-A104 PolarHBondContact O-N 3.37Å
103	I	97.5	Very high	96.6	Very high	34 Å²	34	87.7 Å²	87.7	17%	0.174	52%	0.516	C	S	.	.			trans	-93	98.3	172.5	-56.7	173.8	0	0	0	107.7	P81 L84 V88 Q105 G106	P81-I103 HydrophobicContact CB-CG2 4.44Å; L84-I103 HydrophobicContact CB-CG2 4.44Å; V88-I103 HydrophobicContact CB-CD1 4.12Å; V88-I103 HydrophobicContact CG1-CD1 4.34Å; V88-I103 HydrophobicContact CG2-CD1 4.17Å; I103-Q105 PolarHBondContact O-N 2.99Å; I103-G106 PolarHBondContact O-N 3.41Å
104	A	98	Very high	96.4	Very high	76 Å²	76	84.5 Å²	84.5	63%	0.628	51%	0.514	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.3	136.9	177.9	0	0	0	0	0	110.8	P81 T102 G106	P81-A104 VanDerWaalsContact CB-O 3.29Å; P81-A104 WeakPolarHBondContact CB-O 3.36Å; T102-A104 PolarHBondContact O-N 3.37Å; A104-G106 PolarHBondContact O-N 3.17Å; A104-G106 VanDerWaalsContact O-N 3.15Å
105	Q	97.9	Very high	96.2	Very high	174 Å²	174	90.5 Å²	90.5	81%	0.813	55%	0.551	S	S	*	*	T	Hydrogen-bonded Turn	trans	62.1	11.3	-176.6	-53	-62.2	-28.5	0	0	115.1	P81 I103	P81-Q105 HydrophobicContact CB-CB 4.04Å; P81-Q105 HydrophobicContact CG-CB 4.19Å; I103-Q105 PolarHBondContact O-N 2.99Å
106	G	97.6	Very high	96.1	Very high	1 Å²	1	93.5 Å²	93.5	1%	0.01	57%	0.566	C	S	.	*			trans	-79.7	-23.2	177.8	0	0	0	0	0	114.8	R82 Q85 I103 A104	R82-G106 WeakPolarHBondContact CD-O 3.48Å; R82-G106 PolarHBondContact NH1-O 3.08Å; Q85-G106 WeakPolarHBondContact CB-O 3.44Å; Q85-G106 WeakPolarHBondContact CG-O 3.39Å; I103-G106 PolarHBondContact O-N 3.41Å; A104-G106 PolarHBondContact O-N 3.17Å; A104-G106 VanDerWaalsContact O-N 3.15Å
107	G	96.4	Very high	95.9	Very high	49 Å²	49	89.1 Å²	89.1	51%	0.505	55%	0.551	S	S	.	*			trans	65.6	-155.2	-168.5	0	0	0	0	0	111.8	Q85	Q85-G107 VanDerWaalsContact CD-O 3.25Å; Q85-G107 WeakPolarHBondContact CG-O 3.17Å; Q85-G107 PolarHBondContact NE2-O 2.9Å
108	V	95.9	Very high	95.6	Very high	111 Å²	111	89.8 Å²	89.8	67%	0.673	56%	0.561	S	S	*	*			trans	-126.4	161.5	179.5	-63	0	0	0	0	111.1	R82	R82-V108 PolarHBondContact NH1-O 3.47Å; R82-V108 PolarHBondContact NH2-O 3.01Å; R82-V108 VanDerWaalsContact NH2-O 3.14Å
109	L	95.4	Very high	95	Very high	56 Å²	56	97.4 Å²	97.4	29%	0.293	59%	0.593	S	S	.	*			trans	-58.2	132.8	167.7	-70.7	-175.7	0	0	0	108.7	L86 R89 N111	L86-L109 HydrophobicContact CD2-CD2 3.89Å; R89-L109 HydrophobicContact CB-CD1 3.64Å; R89-L109 HydrophobicContact CB-CD2 3.94Å; R89-L109 HydrophobicContact CB-CG 3.64Å; R89-L109 HydrophobicContact CG-CG 4.43Å; L109-N111 PolarHBondContact O-N 3.39Å; L109-N111 VanDerWaalsContact O-N 3.1Å
110	P	93.9	Very high	94.4	Very high	107 Å²	107	104.7 Å²	104.7	70%	0.695	61%	0.609	S	S	*	*			trans	-57.6	120.1	176.4	-21.5	33.9	0	0	0	109.3
111	N	94.8	Very high	93.3	Very high	127 Å²	127	106.9 Å²	106.9	68%	0.679	61%	0.606	S	S	*	*			trans	-149	133.6	177.6	-178.9	42.3	0	0	0	108.5	L109	L109-N111 PolarHBondContact O-N 3.39Å; L109-N111 VanDerWaalsContact O-N 3.1Å
112	I	95.5	Very high	92	Very high	105 Å²	105	112.3 Å²	112.3	54%	0.538	63%	0.626	S	S	.	*			trans	-119.7	123.7	174.3	-174.5	161.5	0	0	0	108.8	L116 L117	I112-L116 HydrophobicContact CD1-CB 4.43Å; I112-L116 HydrophobicContact CG1-CB 4.14Å; I112-L117 HydrophobicContact CD1-CD2 3.68Å; I112-L117 HydrophobicContact CG1-CD2 4.19Å; I112-L117 HydrophobicContact CG2-CD2 4.28Å
113	Q	94.1	Very high	90.5	Very high	116 Å²	116	110.9 Å²	110.9	54%	0.542	62%	0.622	S	S	.	*			trans	-68.2	135	175.2	-65	-64.5	-16.8	0	0	109.4	V115 L116	Q113-V115 HydrophobicContact CB-CG1 4.04Å; Q113-V115 PolarHBondContact O-N 2.98Å; Q113-L116 HydrophobicContact CB-CD1 4.27Å; Q113-L116 HydrophobicContact CB-CG 4.29Å; Q113-L116 WeakPolarHBondContact O-CB 3.4Å; Q113-L116 PolarHBondContact O-N 3.23Å
114	A	93.5	Very high	88.6	Confident	78 Å²	78	118 Å²	118	65%	0.645	65%	0.654	S	S	*	*	G	3₁₀ helix	trans	-56.9	-29.5	-175.3	0	0	0	0	0	113.4	L116 L117	A114-L116 PolarHBondContact O-N 3.32Å; A114-L117 WeakPolarHBondContact O-CB 3.43Å; A114-L117 PolarHBondContact O-N 3.15Å; A114-L117 VanDerWaalsContact O-N 3.12Å
115	V	95.1	Very high	86.7	Confident	132 Å²	132	123.2 Å²	123.2	80%	0.8	66%	0.663	S	S	*	*	G	3₁₀ helix	trans	-62.7	-25.2	175.6	69.4	0	0	0	0	113.6	Q113 L117	Q113-V115 HydrophobicContact CB-CG1 4.04Å; Q113-V115 PolarHBondContact O-N 2.98Å; V115-L117 VanDerWaalsContact C-N 3.32Å
116	L	94.5	Very high	84.8	Confident	126 Å²	126	120.6 Å²	120.6	66%	0.66	66%	0.66	S	S	*	*	G	3₁₀ helix	trans	-84.5	-9.1	178.6	-58.3	177	0	0	0	112.4	I112 Q113 A114	I112-L116 HydrophobicContact CD1-CB 4.43Å; I112-L116 HydrophobicContact CG1-CB 4.14Å; Q113-L116 HydrophobicContact CB-CD1 4.27Å; Q113-L116 HydrophobicContact CB-CG 4.29Å; Q113-L116 WeakPolarHBondContact O-CB 3.4Å; Q113-L116 PolarHBondContact O-N 3.23Å; A114-L116 PolarHBondContact O-N 3.32Å
117	L	93.7	Very high	83.2	Confident	91 Å²	91	123.7 Å²	123.7	48%	0.476	69%	0.692	S	S	.	*	S	Bend	trans	-76.5	141.8	175.3	-62.1	174.5	0	0	0	109.9	I112 A114 V115 K119	I112-L117 HydrophobicContact CD1-CD2 3.68Å; I112-L117 HydrophobicContact CG1-CD2 4.19Å; I112-L117 HydrophobicContact CG2-CD2 4.28Å; A114-L117 WeakPolarHBondContact O-CB 3.43Å; A114-L117 PolarHBondContact O-N 3.15Å; A114-L117 VanDerWaalsContact O-N 3.12Å; V115-L117 VanDerWaalsContact C-N 3.32Å; L117-K119 PolarHBondContact O-N 2.84Å
118	P	92.5	Very high	81.3	Confident	120 Å²	120	131.3 Å²	131.3	78%	0.779	71%	0.712	S	S	*	*	P	Polyproline II helix	trans	-59.4	134.8	176.3	23.3	-32	0	0	0	110.5	K120	P118-K120 PolarHBondContact O-N 2.91Å
119	K	85.4	Confident	79.5	Confident	202 Å²	202	133.7 Å²	133.7	88%	0.878	72%	0.721	S	S	*	*	P	Polyproline II helix	trans	-62.2	129.1	172.2	-67.9	-177.8	179.4	179.9	0	108	L117 T121	L117-K119 PolarHBondContact O-N 2.84Å; K119-T121 PolarHBondContact O-N 2.94Å
120	K	80.9	Confident	77.3	Confident	207 Å²	207	144.3 Å²	144.3	90%	0.9	77%	0.765	S	S	*	*			trans	-55.5	111.6	171.1	-77.5	-177.6	176.8	179.6	0	108.1	P118 E122	P118-K120 PolarHBondContact O-N 2.91Å; K120-E122 PolarHBondContact O-N 3.13Å
121	T	73.4	Confident	76.5	Confident	130 Å²	130	146.2 Å²	146.2	80%	0.798	77%	0.768	S	S	*	*			trans	-68.1	124.5	162.7	41.5	0	0	0	0	107.2	K119 S123	K119-T121 PolarHBondContact O-N 2.94Å; T121-S123 PolarHBondContact O-N 3.1Å
122	E	69.2	Low	75.5	Confident	185 Å²	185	147.2 Å²	147.2	86%	0.864	77%	0.773	S	S	*	*			trans	-54.5	116.1	170.4	-67	-167.7	161.5	0	0	108.2	K120 H124	K120-E122 PolarHBondContact O-N 3.13Å; E122-H124 PolarHBondContact O-N 3.27Å
123	S	64.7	Low	74.4	Confident	101 Å²	101	149.6 Å²	149.6	71%	0.706	79%	0.786	S	S	*	*			trans	-57.5	109.9	171.4	54	0	0	0	0	107.4	T121 K125	T121-S123 PolarHBondContact O-N 3.1Å; S123-K125 VanDerWaalsContact C-N 3.35Å; S123-K125 PolarHBondContact O-N 3.2Å
124	H	57.2	Low	73.3	Confident	184 Å²	184	151.5 Å²	151.5	85%	0.852	80%	0.8	S	S	*	*			trans	-55.5	99.8	174.4	-145.5	73.4	0	0	0	107.2	E122 P126	E122-H124 PolarHBondContact O-N 3.27Å; H124-P126 VanDerWaalsContact O-CD 3.26Å; H124-P126 WeakPolarHBondContact O-CD 3.47Å
125	K	59.3	Low	72	Confident	186 Å²	186	156.1 Å²	156.1	81%	0.809	81%	0.81	S	S	*	*	P	Polyproline II helix	trans	-63.9	117.2	171.4	-81.4	-175.9	176.8	175.4	0	105.3	S123 G127	S123-K125 VanDerWaalsContact C-N 3.35Å; S123-K125 PolarHBondContact O-N 3.2Å; K125-G127 PolarHBondContact O-N 3.44Å
126	P	58.6	Low	70.5	Confident	118 Å²	118	157.7 Å²	157.7	77%	0.766	81%	0.81	S	S	*	*	P	Polyproline II helix	trans	-61.7	118.7	175	25	-29.9	0	0	0	106.8	H124 K128	H124-P126 VanDerWaalsContact O-CD 3.26Å; H124-P126 WeakPolarHBondContact O-CD 3.47Å; P126-K128 PolarHBondContact O-N 3.13Å
127	G	63.4	Low	68.7	Low	66 Å²	66	160 Å²	160	68%	0.68	82%	0.821	S	S	*	*	P	Polyproline II helix	trans	-51.8	127.9	177.4	0	0	0	0	0	109.2	K125 N129	K125-G127 PolarHBondContact O-N 3.44Å; G127-N129 PolarHBondContact O-N 2.78Å
128	K	56.3	Low	66.8	Low	209 Å²	209	165.3 Å²	165.3	91%	0.909	85%	0.848	S	S	*	*			trans	-56.8	106.2	166.8	-77.3	-178.1	173.7	-177.6	0	107	P126	P126-K128 PolarHBondContact O-N 3.13Å
129	N	57.7	Low	64.7	Low	161 Å²	161	169.1 Å²	169.1	86%	0.861	85%	0.853	S	S	*	*			trans	-67.3	139.6	165.3	-90.3	-12.5	0	0	0	108.6	G127	G127-N129 PolarHBondContact O-N 2.78Å
130	K	49.9	Very low	62.8	Low	280 Å²	280	166.1 Å²	166.1	100%	1.217	85%	0.851	S	S	*	*			trans	-46.8	0	-173.6	-67	169.8	175.5	177	0	114.4

Retrieved 130 of 130 residues in 23.8 ms (Link to these results)

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