A0A096MX20_PAPAN Loading...

G protein subunit alpha transducin 2

AlphaFold DB (A0A2K6R4N5), UniProt , Accession A0A096MX20, Species PAPAN (Papio anubis, Olive baboon), Gene GNAT2, Length 354 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	42.7	Very low	67.9	Low	243 Å²	243	112.3 Å²	112.3	100%	1.197	70%	0.697	S	S	*	*				0	110.1	0	-74	-162.9	-85.8	0	0	106.9
2	G	47.3	Very low	69.4	Low	92 Å²	92	112.2 Å²	112.2	95%	0.948	69%	0.688	S	S	*	*			trans	-74.5	123	-162.6	0	0	0	0	0	112.9
3	S	58.9	Low	70.8	Confident	120 Å²	120	108.2 Å²	108.2	84%	0.839	67%	0.673	S	S	*	*			trans	-118.3	119.9	-177.2	52.7	0	0	0	0	110.1
4	G	56.2	Low	72.2	Confident	72 Å²	72	110.1 Å²	110.1	74%	0.742	67%	0.667	S	S	*	*			trans	109.5	88.7	163.1	0	0	0	0	0	113.6	S6	G4-S6 PolarHBondContact O-N 3.13Å
5	A	60.3	Low	73.5	Confident	61 Å²	61	114.7 Å²	114.7	50%	0.504	67%	0.667	S	S	.	*			trans	-51.4	125.2	152.7	0	0	0	0	0	107.2	D9	A5-D9 HydrophobicContact CB-CB 3.97Å
6	S	75.7	Confident	74.6	Confident	46 Å²	46	111.4 Å²	111.4	32%	0.322	65%	0.653	S	S	.	*			trans	-59.3	159.8	-177.6	69.9	0	0	0	0	109.9	G4 E8 D9 K10	G4-S6 PolarHBondContact O-N 3.13Å; S6-E8 PolarHBondContact O-N 3.4Å; S6-D9 WeakPolarHBondContact CB-OD2 3.46Å; S6-D9 PolarHBondContact N-OD2 3.44Å; S6-D9 PolarHBondContact O-N 3.22Å; S6-D9 PolarHBondContact OG-N 3.03Å; S6-D9 VanDerWaalsContact OG-N 3.09Å; S6-D9 PolarHBondContact OG-OD2 3.26Å; S6-K10 PolarHBondContact O-N 2.92Å; S6-K10 VanDerWaalsContact O-N 3.14Å
7	A	75.4	Confident	75.7	Confident	84 Å²	84	114.1 Å²	114.1	69%	0.694	66%	0.655	S	S	*	*	H	α-helix	trans	-55.1	-33.5	174.5	0	0	0	0	0	111.3	K10 E11	A7-K10 PolarHBondContact O-N 3.08Å; A7-E11 WeakPolarHBondContact O-CB 3.41Å; A7-E11 PolarHBondContact O-N 3.49Å
8	E	78.1	Confident	76.7	Confident	146 Å²	146	113.3 Å²	113.3	68%	0.682	65%	0.645	S	S	*	*	H	α-helix	trans	-64.5	-43.7	173.7	-63.5	-179.7	158.9	0	0	112.1	S6 K10 E11 L12	S6-E8 PolarHBondContact O-N 3.4Å; E8-K10 VanDerWaalsContact C-N 3.3Å; E8-K10 PolarHBondContact O-N 3.27Å; E8-E11 PolarHBondContact O-N 3.42Å; E8-L12 WeakPolarHBondContact O-CB 3.4Å; E8-L12 VanDerWaalsContact O-CG 3.29Å; E8-L12 WeakPolarHBondContact O-CG 3.45Å; E8-L12 PolarHBondContact O-N 3.04Å
9	D	82.7	Confident	77.5	Confident	82 Å²	82	112.7 Å²	112.7	44%	0.439	64%	0.639	S	S	.	*	H	α-helix	trans	-62.9	-36.9	177.5	-63.6	-42.3	0	0	0	112.1	A5 S6 A13	A5-D9 HydrophobicContact CB-CB 3.97Å; S6-D9 WeakPolarHBondContact CB-OD2 3.46Å; S6-D9 PolarHBondContact N-OD2 3.44Å; S6-D9 PolarHBondContact O-N 3.22Å; S6-D9 PolarHBondContact OG-N 3.03Å; S6-D9 VanDerWaalsContact OG-N 3.09Å; S6-D9 PolarHBondContact OG-OD2 3.26Å; D9-A13 VanDerWaalsContact O-CB 3.3Å; D9-A13 WeakPolarHBondContact O-CB 3.27Å; D9-A13 PolarHBondContact O-N 3.39Å
10	K	83.3	Confident	78.3	Confident	146 Å²	146	113.2 Å²	113.2	64%	0.635	64%	0.635	S	S	*	*	H	α-helix	trans	-70.2	-38.3	176	-71.6	-177.4	-180	176.3	0	112.1	S6 A7 E8 K14	S6-K10 PolarHBondContact O-N 2.92Å; S6-K10 VanDerWaalsContact O-N 3.14Å; A7-K10 PolarHBondContact O-N 3.08Å; E8-K10 VanDerWaalsContact C-N 3.3Å; E8-K10 PolarHBondContact O-N 3.27Å; K10-K14 WeakPolarHBondContact O-CB 3.45Å; K10-K14 PolarHBondContact O-N 3.41Å
11	E	86.1	Confident	79.1	Confident	143 Å²	143	114 Å²	114	67%	0.668	63%	0.632	S	S	*	*	H	α-helix	trans	-69.5	-41.7	177.4	-166.6	172.7	173	0	0	111.5	A7 E8 K14 R15	A7-E11 WeakPolarHBondContact O-CB 3.41Å; A7-E11 PolarHBondContact O-N 3.49Å; E8-E11 PolarHBondContact O-N 3.42Å; E11-K14 PolarHBondContact O-N 3.01Å; E11-R15 WeakPolarHBondContact O-CB 3.45Å; E11-R15 PolarHBondContact O-N 3.13Å
12	L	86.1	Confident	81.4	Confident	111 Å²	111	109 Å²	109	58%	0.581	60%	0.603	S	S	*	*	H	α-helix	trans	-61.3	-44.8	172.3	-73.1	170.2	0	0	0	111.9	E8 K14 R15 S16	E8-L12 WeakPolarHBondContact O-CB 3.4Å; E8-L12 VanDerWaalsContact O-CG 3.29Å; E8-L12 WeakPolarHBondContact O-CG 3.45Å; E8-L12 PolarHBondContact O-N 3.04Å; L12-K14 VanDerWaalsContact C-N 3.33Å; L12-K14 PolarHBondContact O-N 3.2Å; L12-R15 PolarHBondContact O-N 3.36Å; L12-S16 WeakPolarHBondContact O-CB 3.5Å; L12-S16 PolarHBondContact O-N 2.94Å
13	A	87.8	Confident	83.6	Confident	60 Å²	60	109.6 Å²	109.6	50%	0.496	58%	0.584	S	S	.	*	H	α-helix	trans	-62.6	-39.3	176.5	0	0	0	0	0	112.2	D9 K17	D9-A13 VanDerWaalsContact O-CB 3.3Å; D9-A13 WeakPolarHBondContact O-CB 3.27Å; D9-A13 PolarHBondContact O-N 3.39Å; A13-K17 WeakPolarHBondContact O-CB 2.96Å; A13-K17 PolarHBondContact O-N 2.98Å
14	K	90.8	Very high	85.1	Confident	136 Å²	136	109.3 Å²	109.3	59%	0.591	57%	0.57	S	S	*	*	H	α-helix	trans	-64.3	-47.1	175.3	-172.3	-176.2	175.8	-167	0	111.3	K10 E11 L12 S16 K17 E18	K10-K14 WeakPolarHBondContact O-CB 3.45Å; K10-K14 PolarHBondContact O-N 3.41Å; E11-K14 PolarHBondContact O-N 3.01Å; L12-K14 VanDerWaalsContact C-N 3.33Å; L12-K14 PolarHBondContact O-N 3.2Å; K14-S16 VanDerWaalsContact C-N 3.34Å; K14-S16 PolarHBondContact O-N 3.39Å; K14-K17 PolarHBondContact O-N 3.14Å; K14-E18 VanDerWaalsContact CE-OE1 3.23Å; K14-E18 WeakPolarHBondContact CE-OE1 3.19Å; K14-E18 WeakPolarHBondContact O-CG 3.19Å; K14-E18 PolarHBondContact O-N 2.84Å
15	R	91.3	Very high	86.7	Confident	178 Å²	178	110.3 Å²	110.3	67%	0.672	56%	0.555	S	S	*	*	H	α-helix	trans	-63.6	-39.5	178	-167.2	174.7	-178.7	177.5	-0.1	111.9	E11 L12 E18 L19	E11-R15 WeakPolarHBondContact O-CB 3.45Å; E11-R15 PolarHBondContact O-N 3.13Å; L12-R15 PolarHBondContact O-N 3.36Å; R15-E18 PolarHBondContact O-N 3.07Å; R15-L19 WeakPolarHBondContact O-CB 3.43Å; R15-L19 PolarHBondContact O-N 3.04Å
16	S	91.8	Very high	87.9	Confident	63 Å²	63	112.3 Å²	112.3	44%	0.441	56%	0.558	S	S	.	*	H	α-helix	trans	-60.6	-47.1	174.1	-165.1	0	0	0	0	111.1	L12 K14 E18 L19 E20	L12-S16 WeakPolarHBondContact O-CB 3.5Å; L12-S16 PolarHBondContact O-N 2.94Å; K14-S16 VanDerWaalsContact C-N 3.34Å; K14-S16 PolarHBondContact O-N 3.39Å; S16-E18 PolarHBondContact O-N 3.29Å; S16-L19 PolarHBondContact O-N 3.15Å; S16-L19 VanDerWaalsContact O-N 3.16Å; S16-E20 WeakPolarHBondContact O-CG 3.34Å; S16-E20 PolarHBondContact O-N 2.87Å
17	K	93.1	Very high	88.3	Confident	156 Å²	156	112.5 Å²	112.5	68%	0.678	56%	0.562	S	S	*	*	H	α-helix	trans	-65.1	-37.7	178.7	-168.7	176.5	-177.8	178.2	0	112.8	A13 K14 L19 K21	A13-K17 WeakPolarHBondContact O-CB 2.96Å; A13-K17 PolarHBondContact O-N 2.98Å; K14-K17 PolarHBondContact O-N 3.14Å; K17-L19 VanDerWaalsContact C-N 3.32Å; K17-K21 WeakPolarHBondContact O-CB 3.27Å; K17-K21 PolarHBondContact O-N 3.14Å
18	E	93.4	Very high	88.7	Confident	101 Å²	101	112.3 Å²	112.3	47%	0.472	55%	0.549	S	S	.	.	H	α-helix	trans	-65.2	-37.1	173.5	-74.6	173.2	-174.1	0	0	111.8	K14 R15 S16 K21 K22	K14-E18 VanDerWaalsContact CE-OE1 3.23Å; K14-E18 WeakPolarHBondContact CE-OE1 3.19Å; K14-E18 WeakPolarHBondContact O-CG 3.19Å; K14-E18 PolarHBondContact O-N 2.84Å; R15-E18 PolarHBondContact O-N 3.07Å; S16-E18 PolarHBondContact O-N 3.29Å; E18-K21 PolarHBondContact O-N 2.53Å; E18-K22 WeakPolarHBondContact O-CG 3.46Å; E18-K22 PolarHBondContact O-N 3.12Å
19	L	92.5	Very high	88.9	Confident	102 Å²	102	111.2 Å²	111.2	53%	0.534	54%	0.542	S	S	.	.	H	α-helix	trans	-72.6	-42.3	178.8	-153.4	133.7	0	0	0	111.5	R15 S16 K17 K21 K22 L23	R15-L19 WeakPolarHBondContact O-CB 3.43Å; R15-L19 PolarHBondContact O-N 3.04Å; S16-L19 PolarHBondContact O-N 3.15Å; S16-L19 VanDerWaalsContact O-N 3.16Å; K17-L19 VanDerWaalsContact C-N 3.32Å; L19-K21 VanDerWaalsContact C-N 3.33Å; L19-K21 PolarHBondContact O-N 3.38Å; L19-K22 PolarHBondContact O-N 2.97Å; L19-L23 HydrophobicContact CD2-CD1 3.84Å; L19-L23 HydrophobicContact CD2-CG 4.3Å; L19-L23 WeakPolarHBondContact O-CB 3.46Å; L19-L23 WeakPolarHBondContact O-CG 3.44Å; L19-L23 PolarHBondContact O-N 3.3Å
20	E	93.2	Very high	88.8	Confident	121 Å²	121	111.8 Å²	111.8	57%	0.565	54%	0.542	S	S	*	.	H	α-helix	trans	-58.8	-43.1	170.7	-76.4	173.7	-174.7	0	0	111.8	S16 K22 L23 Q24	S16-E20 WeakPolarHBondContact O-CG 3.34Å; S16-E20 PolarHBondContact O-N 2.87Å; E20-K22 PolarHBondContact O-N 3.1Å; E20-L23 PolarHBondContact O-N 3.25Å; E20-Q24 PolarHBondContact O-N 3.39Å
21	K	93.7	Very high	88.6	Confident	130 Å²	130	109.1 Å²	109.1	57%	0.565	55%	0.547	S	S	*	.	H	α-helix	trans	-60.9	-45.1	176	-168.8	-178.2	-174.8	-97.8	0	111.4	K17 E18 L19 Q24 E25	K17-K21 WeakPolarHBondContact O-CB 3.27Å; K17-K21 PolarHBondContact O-N 3.14Å; E18-K21 PolarHBondContact O-N 2.53Å; L19-K21 VanDerWaalsContact C-N 3.33Å; L19-K21 PolarHBondContact O-N 3.38Å; K21-Q24 PolarHBondContact O-N 3.3Å; K21-E25 WeakPolarHBondContact CE-OE1 3.42Å; K21-E25 IonicContact NZ-OE1 3.16Å; K21-E25 PolarHBondContact NZ-OE1 3.37Å; K21-E25 WeakPolarHBondContact O-CG 3.4Å; K21-E25 PolarHBondContact O-N 2.97Å
22	K	92.6	Very high	88.4	Confident	138 Å²	138	109.5 Å²	109.5	60%	0.6	55%	0.546	S	S	*	.	H	α-helix	trans	-63.1	-43	176.1	-77.9	-176.1	177.2	-176.4	0	112.2	E18 L19 E20 Q24 E25 D26	E18-K22 WeakPolarHBondContact O-CG 3.46Å; E18-K22 PolarHBondContact O-N 3.12Å; L19-K22 PolarHBondContact O-N 2.97Å; E20-K22 PolarHBondContact O-N 3.1Å; K22-Q24 VanDerWaalsContact C-N 3.3Å; K22-Q24 PolarHBondContact O-N 3.42Å; K22-E25 PolarHBondContact O-N 2.91Å; K22-D26 WeakPolarHBondContact O-CB 3.41Å; K22-D26 PolarHBondContact O-N 3.06Å
23	L	91.9	Very high	88.5	Confident	105 Å²	105	105.1 Å²	105.1	55%	0.55	53%	0.525	S	S	.	.	H	α-helix	trans	-60.9	-40.7	176.8	-75	171.6	0	0	0	111.7	L19 E20 A27	L19-L23 HydrophobicContact CD2-CD1 3.84Å; L19-L23 HydrophobicContact CD2-CG 4.3Å; L19-L23 WeakPolarHBondContact O-CB 3.46Å; L19-L23 WeakPolarHBondContact O-CG 3.44Å; L19-L23 PolarHBondContact O-N 3.3Å; E20-L23 PolarHBondContact O-N 3.25Å; L23-A27 VanDerWaalsContact O-CB 3.25Å; L23-A27 WeakPolarHBondContact O-CB 3.41Å; L23-A27 PolarHBondContact O-N 3.4Å
24	Q	91.4	Very high	88.6	Confident	114 Å²	114	102.5 Å²	102.5	53%	0.533	50%	0.502	S	S	.	.	H	α-helix	trans	-67.1	-43.9	176	-171.6	63.1	46.1	0	0	111.7	E20 K21 K22 D26 A27 D28	E20-Q24 PolarHBondContact O-N 3.39Å; K21-Q24 PolarHBondContact O-N 3.3Å; K22-Q24 VanDerWaalsContact C-N 3.3Å; K22-Q24 PolarHBondContact O-N 3.42Å; Q24-D26 VanDerWaalsContact C-N 3.34Å; Q24-D26 PolarHBondContact O-N 3.49Å; Q24-A27 PolarHBondContact O-N 3.21Å; Q24-D28 PolarHBondContact NE2-OD1 3.31Å; Q24-D28 WeakPolarHBondContact O-CB 3.39Å; Q24-D28 VanDerWaalsContact O-CG 3.24Å; Q24-D28 PolarHBondContact O-N 3.19Å
25	E	88.7	Confident	88.7	Confident	94 Å²	94	97.9 Å²	97.9	44%	0.439	48%	0.482	S	S	.	.	H	α-helix	trans	-61	-42.5	176.4	-73.8	171.7	-179.7	0	0	111.8	K21 K22 D28 K29	K21-E25 WeakPolarHBondContact CE-OE1 3.42Å; K21-E25 IonicContact NZ-OE1 3.16Å; K21-E25 PolarHBondContact NZ-OE1 3.37Å; K21-E25 WeakPolarHBondContact O-CG 3.4Å; K21-E25 PolarHBondContact O-N 2.97Å; K22-E25 PolarHBondContact O-N 2.91Å; E25-D28 PolarHBondContact O-N 3.48Å; E25-K29 WeakPolarHBondContact O-CB 3.47Å; E25-K29 PolarHBondContact O-N 2.99Å
26	D	85.8	Confident	88.9	Confident	103 Å²	103	89.4 Å²	89.4	55%	0.551	45%	0.45	S	S	*	.	H	α-helix	trans	-66.8	-40.7	176.5	-74.7	-23.7	0	0	0	111.3	K22 Q24 K29 E30	K22-D26 WeakPolarHBondContact O-CB 3.41Å; K22-D26 PolarHBondContact O-N 3.06Å; Q24-D26 VanDerWaalsContact C-N 3.34Å; Q24-D26 PolarHBondContact O-N 3.49Å; D26-K29 PolarHBondContact O-N 3.33Å; D26-E30 WeakPolarHBondContact O-CB 3.31Å; D26-E30 PolarHBondContact O-N 3.23Å
27	A	84.8	Confident	89.1	Confident	50 Å²	50	86.4 Å²	86.4	41%	0.413	43%	0.429	S	S	.	.	H	α-helix	trans	-63.7	-44.5	175.6	0	0	0	0	0	111.9	L23 Q24 K29 E30 A31	L23-A27 VanDerWaalsContact O-CB 3.25Å; L23-A27 WeakPolarHBondContact O-CB 3.41Å; L23-A27 PolarHBondContact O-N 3.4Å; Q24-A27 PolarHBondContact O-N 3.21Å; A27-K29 VanDerWaalsContact C-N 3.3Å; A27-K29 PolarHBondContact O-N 3.01Å; A27-E30 PolarHBondContact O-N 2.92Å; A27-A31 WeakPolarHBondContact O-CB 3.39Å; A27-A31 PolarHBondContact O-N 2.84Å
28	D	83.4	Confident	89.2	Confident	80 Å²	80	79 Å²	79	43%	0.428	40%	0.397	S	S	.	.	H	α-helix	trans	-64.6	-36.8	177.1	-70.5	-9.1	0	0	0	111.4	Q24 E25 K32	Q24-D28 PolarHBondContact NE2-OD1 3.31Å; Q24-D28 WeakPolarHBondContact O-CB 3.39Å; Q24-D28 VanDerWaalsContact O-CG 3.24Å; Q24-D28 PolarHBondContact O-N 3.19Å; E25-D28 PolarHBondContact O-N 3.48Å; D28-K32 WeakPolarHBondContact O-CG 3.48Å; D28-K32 PolarHBondContact O-N 2.83Å
29	K	81.4	Confident	89.4	Confident	123 Å²	123	74.1 Å²	74.1	54%	0.535	37%	0.374	S	S	.	.	H	α-helix	trans	-69.2	-42.7	175.3	-171.8	176.5	-179.6	177.9	0	111.4	E25 D26 A27 K32 T33	E25-K29 WeakPolarHBondContact O-CB 3.47Å; E25-K29 PolarHBondContact O-N 2.99Å; D26-K29 PolarHBondContact O-N 3.33Å; A27-K29 VanDerWaalsContact C-N 3.3Å; A27-K29 PolarHBondContact O-N 3.01Å; K29-K32 PolarHBondContact O-N 3.44Å; K29-T33 PolarHBondContact O-N 2.92Å; K29-T33 PolarHBondContact O-OG1 2.73Å
30	E	81.3	Confident	89.6	Confident	94 Å²	94	69.3 Å²	69.3	44%	0.439	35%	0.349	S	S	.	.	H	α-helix	trans	-66.2	-39.1	177.5	-177.8	152.2	-156.8	0	0	111.8	D26 A27 K32 T33 K35 R197	D26-E30 WeakPolarHBondContact O-CB 3.31Å; D26-E30 PolarHBondContact O-N 3.23Å; A27-E30 PolarHBondContact O-N 2.92Å; E30-K32 PolarHBondContact O-N 3.01Å; E30-T33 WeakPolarHBondContact O-CB 3.42Å; E30-T33 PolarHBondContact O-N 3.22Å; E30-K35 IonicContact OE1-NZ 2.69Å; E30-K35 PolarHBondContact OE1-NZ 3.23Å; E30-R197 IonicContact OE1-NH1 2.75Å
31	A	79.2	Confident	89.6	Confident	89 Å²	89	64 Å²	64	74%	0.736	33%	0.326	S	S	*	.	H	α-helix	trans	-60.7	-27.9	174.9	0	0	0	0	0	113.2	A27	A27-A31 WeakPolarHBondContact O-CB 3.39Å; A27-A31 PolarHBondContact O-N 2.84Å
32	K	81.3	Confident	89.5	Confident	151 Å²	151	59 Å²	59	66%	0.657	31%	0.311	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.7	3.1	177.2	-65.6	175.4	-176.1	176.1	0	113.6	D28 K29 E30	D28-K32 WeakPolarHBondContact O-CG 3.48Å; D28-K32 PolarHBondContact O-N 2.83Å; K29-K32 PolarHBondContact O-N 3.44Å; E30-K32 PolarHBondContact O-N 3.01Å
33	T	89	Confident	89.4	Confident	20 Å²	20	54.4 Å²	54.4	12%	0.123	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.3	123	-177.1	-64	0	0	0	0	110.5	K29 E30 K35 N195 R197	K29-T33 PolarHBondContact O-N 2.92Å; K29-T33 PolarHBondContact O-OG1 2.73Å; E30-T33 WeakPolarHBondContact O-CB 3.42Å; E30-T33 PolarHBondContact O-N 3.22Å; T33-K35 PolarHBondContact O-N 2.92Å; T33-N195 CarbonylContact C-O 3.43Å; T33-N195 WeakPolarHBondContact CA-O 3.37Å; T33-R197 HydrophobicContact CG2-CB 4.16Å; T33-R197 VanDerWaalsContact CG2-CD 3.44Å; T33-R197 HydrophobicContact CG2-CG 3.5Å; T33-R197 VanDerWaalsContact CG2-CG 3.5Å
34	V	90.8	Very high	89.6	Confident	4 Å²	4	49.5 Å²	49.5	2%	0.024	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80	118.4	175.6	179	0	0	0	0	109.2	L36 N195 F196 R197 T219 I343	V34-L36 HydrophobicContact CG1-CD2 3.8Å; V34-L36 HydrophobicContact CG1-CG 4.24Å; V34-N195 PolarHBondContact N-O 3.42Å; V34-F196 HydrophobicContact CB-CD1 3.71Å; V34-F196 HydrophobicContact CB-CE1 3.78Å; V34-F196 HydrophobicContact CB-CG 4.34Å; V34-F196 HydrophobicContact CB-CZ 4.44Å; V34-F196 HydrophobicContact CG1-CD1 3.68Å; V34-F196 HydrophobicContact CG1-CE1 3.58Å; V34-F196 HydrophobicContact CG2-CE1 4.21Å; V34-F196 HydrophobicContact CG2-CZ 4.44Å; V34-F196 CarbonylContact O-C 3.56Å; V34-F196 WeakPolarHBondContact O-CA 3.39Å; V34-R197 PolarHBondContact O-N 3.33Å; V34-T219 HydrophobicContact CG1-CG2 4.09Å; V34-I343 HydrophobicContact CG1-CG2 3.87Å; V34-I343 HydrophobicContact CG2-CG2 4.36Å
35	K	92.5	Very high	89.8	Confident	39 Å²	39	44.6 Å²	44.6	17%	0.17	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.2	112.9	178.3	-67.5	178.9	-179.1	174.4	0	109.5	E30 T33 R197 F199 G217 T219 C220	E30-K35 IonicContact OE1-NZ 2.69Å; E30-K35 PolarHBondContact OE1-NZ 3.23Å; T33-K35 PolarHBondContact O-N 2.92Å; K35-R197 CarbonylContact C-O 3.46Å; K35-R197 WeakPolarHBondContact CA-O 3.48Å; K35-R197 HydrophobicContact CG-CB 4.46Å; K35-F199 HydrophobicContact CB-CE2 4.25Å; K35-F199 HydrophobicContact CG-CE2 4.27Å; K35-G217 WeakPolarHBondContact CD-O 3.23Å; K35-T219 PolarHBondContact N-OG1 3.41Å; K35-T219 PolarHBondContact O-N 3.13Å; K35-C220 PolarHBondContact O-N 3.22Å
36	L	94.6	Very high	90.1	Very high	0 Å²	0	40.6 Å²	40.6	0%	0	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.5	127.5	177.9	-57.8	-178.6	0	0	0	110.3	V34 F196 R197 M198 F199 C220 I222 F336 I343	V34-L36 HydrophobicContact CG1-CD2 3.8Å; V34-L36 HydrophobicContact CG1-CG 4.24Å; L36-F196 HydrophobicContact CD1-CD1 3.64Å; L36-F196 HydrophobicContact CD1-CE1 4.18Å; L36-F196 HydrophobicContact CD2-CD1 4.49Å; L36-F196 HydrophobicContact CG-CD1 3.98Å; L36-R197 PolarHBondContact N-O 3.41Å; L36-M198 HydrophobicContact CB-CB 4.43Å; L36-M198 HydrophobicContact CB-CG 4.43Å; L36-M198 HydrophobicContact CD1-CE 3.75Å; L36-M198 CarbonylContact O-C 3.56Å; L36-M198 WeakPolarHBondContact O-CA 3.45Å; L36-F199 PolarHBondContact O-N 2.76Å; L36-C220 WeakPolarHBondContact CA-O 3.29Å; L36-C220 HydrophobicContact CD2-CB 3.84Å; L36-I222 HydrophobicContact CD1-CD1 4.2Å; L36-F336 HydrophobicContact CD1-CE2 3.79Å; L36-F336 HydrophobicContact CD1-CZ 3.79Å; L36-I343 HydrophobicContact CD2-CD1 3.63Å
37	L	95.8	Very high	90.6	Very high	0 Å²	0	37.1 Å²	37.1	0%	0	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	117.6	176.2	-177.2	60.2	0	0	0	110.6	L39 F199 V201 C214 F215 V218 C220 I221 I222 F259	L37-L39 HydrophobicContact CD1-CD2 4.25Å; L37-L39 HydrophobicContact CD2-CD1 4.01Å; L37-L39 HydrophobicContact CD2-CD2 4.03Å; L37-L39 HydrophobicContact CD2-CG 4.11Å; L37-L39 HydrophobicContact CG-CD1 4.33Å; L37-L39 HydrophobicContact CG-CD2 3.89Å; L37-L39 HydrophobicContact CG-CG 3.91Å; L37-F199 HydrophobicContact CD1-CB 3.87Å; L37-V201 HydrophobicContact CD1-CG1 4.26Å; L37-C214 HydrophobicContact CD1-CB 3.63Å; L37-C214 HydrophobicContact CD2-CB 4.47Å; L37-F215 HydrophobicContact CD2-CD1 3.65Å; L37-F215 HydrophobicContact CD2-CE1 3.77Å; L37-V218 HydrophobicContact CB-CG1 3.79Å; L37-V218 HydrophobicContact CB-CG2 4.01Å; L37-V218 HydrophobicContact CD2-CG2 4.11Å; L37-C220 PolarHBondContact N-O 2.83Å; L37-C220 VanDerWaalsContact N-O 3.07Å; L37-I221 WeakPolarHBondContact O-CA 3.45Å; L37-I222 PolarHBondContact O-N 3.5Å; L37-F259 HydrophobicContact CD2-CZ 4.13Å
38	L	96.3	Very high	91.1	Very high	0 Å²	0	36 Å²	36	0%	0	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.2	115.8	175.2	-77.1	162	0	0	0	110.3	K46 I49 V50 M198 F199 D200 V201 I222	L38-K46 HydrophobicContact CB-CB 4.33Å; L38-K46 HydrophobicContact CB-CD 4.28Å; L38-K46 HydrophobicContact CB-CG 4.32Å; L38-I49 HydrophobicContact CD2-CB 4.42Å; L38-I49 HydrophobicContact CD2-CG2 4.18Å; L38-V50 HydrophobicContact CD1-CG2 3.39Å; L38-M198 HydrophobicContact CD1-CG 3.62Å; L38-M198 HydrophobicContact CD1-SD 3.49Å; L38-M198 WeakPolarHBondContact CD1-SD 3.3Å; L38-M198 HydrophobicContact CG-CG 4.12Å; L38-M198 HydrophobicContact CG-SD 4.23Å; L38-F199 WeakPolarHBondContact CB-O 3.28Å; L38-F199 PolarHBondContact N-O 3.06Å; L38-D200 HydrophobicContact CD1-CB 4.19Å; L38-V201 WeakPolarHBondContact O-CG2 3.46Å; L38-I222 CarbonylContact C-O 3.54Å; L38-I222 WeakPolarHBondContact CA-O 3.32Å; L38-I222 HydrophobicContact CD2-CB 3.82Å; L38-I222 HydrophobicContact CD2-CG2 3.71Å
39	L	96.9	Very high	91.7	Very high	0 Å²	0	32.3 Å²	32.3	0%	0	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	163	177.7	-61.4	-179.6	0	0	0	111.1	L37 V201 W211 I221 I222 F223 C224 I253 F259	L37-L39 HydrophobicContact CD1-CD2 4.25Å; L37-L39 HydrophobicContact CD2-CD1 4.01Å; L37-L39 HydrophobicContact CD2-CD2 4.03Å; L37-L39 HydrophobicContact CD2-CG 4.11Å; L37-L39 HydrophobicContact CG-CD1 4.33Å; L37-L39 HydrophobicContact CG-CD2 3.89Å; L37-L39 HydrophobicContact CG-CG 3.91Å; L39-V201 HydrophobicContact CD2-CG2 3.68Å; L39-W211 HydrophobicContact CD2-CD2 3.82Å; L39-W211 HydrophobicContact CD2-CE3 3.66Å; L39-W211 HydrophobicContact CD2-CG 4.35Å; L39-W211 HydrophobicContact CD2-CH2 4.34Å; L39-W211 HydrophobicContact CD2-CZ2 4.49Å; L39-W211 HydrophobicContact CD2-CZ3 3.92Å; L39-I221 HydrophobicContact CB-CG2 4.4Å; L39-I221 HydrophobicContact CD1-CG2 3.91Å; L39-I221 HydrophobicContact CG-CG2 4.23Å; L39-I222 PolarHBondContact N-O 2.97Å; L39-F223 HydrophobicContact CB-CD2 3.97Å; L39-F223 CarbonylContact O-C 3.56Å; L39-F223 WeakPolarHBondContact O-CA 3.5Å; L39-C224 PolarHBondContact O-N 3.37Å; L39-I253 HydrophobicContact CD1-CD1 3.85Å; L39-I253 HydrophobicContact CD1-CG1 4.05Å; L39-I253 HydrophobicContact CD1-CG2 3.72Å; L39-F259 HydrophobicContact CD1-CE2 4.48Å
40	G	96.6	Very high	92.4	Very high	0 Å²	0	27.1 Å²	27.1	0%	0	16%	0.158	C	C	.	.			trans	140	162.5	179.7	0	0	0	0	0	112.5	K46 G203 C224	G40-K46 PolarHBondContact O-NZ 3.42Å; G40-G203 VanDerWaalsContact O-CA 3.32Å; G40-G203 WeakPolarHBondContact O-CA 3.18Å; G40-C224 WeakPolarHBondContact CA-O 3.47Å
41	A	94.5	Very high	93.1	Very high	9 Å²	9	23.9 Å²	23.9	7%	0.074	14%	0.143	C	C	.	.	S	Bend	trans	-59.2	167.2	-178.8	0	0	0	0	0	112.4	S44 K46 L249	A41-S44 WeakPolarHBondContact O-CB 3.18Å; A41-S44 PolarHBondContact O-N 3.24Å; A41-S44 PolarHBondContact O-OG 3.43Å; A41-K46 PolarHBondContact O-NZ 2.93Å; A41-L249 HydrophobicContact CB-CD2 4.49Å
42	G	90.2	Very high	93.9	Very high	25 Å²	25	19.6 Å²	19.6	26%	0.258	11%	0.108	S	C	.	.	T	Hydrogen-bonded Turn	trans	-51.4	143.7	170.6	0	0	0	0	0	111	S44 G203	G42-S44 PolarHBondContact O-N 3.3Å; G42-G203 PolarHBondContact N-O 2.88Å
43	E	90.8	Very high	94.5	Very high	43 Å²	43	12.4 Å²	12.4	20%	0.201	8%	0.076	C	C	.	.	T	Hydrogen-bonded Turn	trans	62.4	11.4	174.8	-45.2	177.6	-177	0	0	116	G45 R178 R242 K270	E43-G45 PolarHBondContact O-N 2.81Å; E43-R178 VanDerWaalsContact CG-NH1 3.3Å; E43-R178 IonicContact OE1-CZ 3.54Å; E43-R178 IonicContact OE1-NH1 2.8Å; E43-R178 PolarHBondContact OE1-NH1 3.34Å; E43-R178 IonicContact OE1-NH2 3.41Å; E43-R178 PolarHBondContact OE1-NH2 3.1Å; E43-R178 IonicContact OE2-NH1 2.62Å; E43-R178 PolarHBondContact OE2-NH1 3.07Å; E43-R242 IonicContact OE1-NH2 2.65Å; E43-R242 IonicContact OE2-CZ 3.12Å; E43-R242 IonicContact OE2-NH1 3.77Å; E43-R242 PolarHBondContact OE2-NH1 3.01Å; E43-R242 IonicContact OE2-NH2 2.63Å; E43-R242 PolarHBondContact OE2-NH2 3.18Å; E43-K270 WeakPolarHBondContact O-CE 3.42Å; E43-K270 PolarHBondContact O-NZ 3.32Å
44	S	95.6	Very high	94.8	Very high	2 Å²	2	13.3 Å²	13.3	1%	0.014	8%	0.079	C	C	.	.	S	Bend	trans	-68.9	-9.8	175.7	48	0	0	0	0	114.7	A41 G42 K46 C224 N269	A41-S44 WeakPolarHBondContact O-CB 3.18Å; A41-S44 PolarHBondContact O-N 3.24Å; A41-S44 PolarHBondContact O-OG 3.43Å; G42-S44 PolarHBondContact O-N 3.3Å; S44-K46 PolarHBondContact OG-NZ 3.02Å; S44-C224 WeakPolarHBondContact CB-O 3.47Å; S44-C224 PolarHBondContact OG-O 3.42Å; S44-N269 PolarHBondContact O-ND2 2.93Å
45	G	95.5	Very high	95	Very high	11 Å²	11	14.3 Å²	14.3	11%	0.113	8%	0.084	C	C	.	.	S	Bend	trans	96.9	14.1	178.9	0	0	0	0	0	115.9	E43 S47 T48 I49	E43-G45 PolarHBondContact O-N 2.81Å; G45-S47 PolarHBondContact O-N 2.81Å; G45-T48 WeakPolarHBondContact O-CB 3.4Å; G45-T48 PolarHBondContact O-N 2.78Å; G45-T48 VanDerWaalsContact O-N 3.17Å; G45-I49 PolarHBondContact O-N 3.01Å
46	K	95.7	Very high	95.1	Very high	9 Å²	9	14.1 Å²	14.1	4%	0.039	8%	0.084	C	C	.	.	H	α-helix	trans	-51.7	-55.9	175.8	-64.6	-178.1	-63.4	-64.5	0	113.1	L38 G40 A41 S44 T48 I49 V50 D200 V201 C224	L38-K46 HydrophobicContact CB-CB 4.33Å; L38-K46 HydrophobicContact CB-CD 4.28Å; L38-K46 HydrophobicContact CB-CG 4.32Å; G40-K46 PolarHBondContact O-NZ 3.42Å; A41-K46 PolarHBondContact O-NZ 2.93Å; S44-K46 PolarHBondContact OG-NZ 3.02Å; K46-T48 PolarHBondContact O-N 3.08Å; K46-I49 WeakPolarHBondContact O-CA 3.41Å; K46-I49 WeakPolarHBondContact O-CB 3.38Å; K46-I49 PolarHBondContact O-N 3.32Å; K46-V50 PolarHBondContact O-N 3.02Å; K46-V50 VanDerWaalsContact O-N 3.11Å; K46-D200 VanDerWaalsContact CB-OD1 3.28Å; K46-D200 WeakPolarHBondContact CB-OD1 3.5Å; K46-V201 WeakPolarHBondContact CE-O 3.42Å; K46-C224 HydrophobicContact CG-CB 4.04Å
47	S	95.7	Very high	95	Very high	31 Å²	31	16.3 Å²	16.3	22%	0.217	9%	0.094	C	C	.	.	H	α-helix	trans	-64.4	-27.7	-179.3	-47.1	0	0	0	0	112.4	G45 V50 K51 T181 D200	G45-S47 PolarHBondContact O-N 2.81Å; S47-V50 PolarHBondContact O-N 2.91Å; S47-K51 VanDerWaalsContact O-CG 3.3Å; S47-K51 WeakPolarHBondContact O-CG 3.29Å; S47-K51 PolarHBondContact O-N 3.41Å; S47-T181 PolarHBondContact OG-OG1 3.25Å; S47-D200 WeakPolarHBondContact CA-OD2 3.28Å; S47-D200 WeakPolarHBondContact CB-OD2 3.43Å; S47-D200 PolarHBondContact OG-OD2 3.34Å
48	T	96.6	Very high	94.8	Very high	27 Å²	27	19.5 Å²	19.5	17%	0.166	11%	0.109	C	C	.	.	H	α-helix	trans	-66.6	-40.6	171.9	-47.8	0	0	0	0	111.2	G45 K46 V50 K51 Q52 L175 A326 T327	G45-T48 WeakPolarHBondContact O-CB 3.4Å; G45-T48 PolarHBondContact O-N 2.78Å; G45-T48 VanDerWaalsContact O-N 3.17Å; K46-T48 PolarHBondContact O-N 3.08Å; T48-V50 VanDerWaalsContact C-N 3.32Å; T48-V50 PolarHBondContact O-N 3.49Å; T48-K51 PolarHBondContact O-N 3.34Å; T48-Q52 VanDerWaalsContact O-CG 3.32Å; T48-Q52 WeakPolarHBondContact O-CG 3.28Å; T48-Q52 PolarHBondContact O-N 3.3Å; T48-L175 HydrophobicContact CG2-CD2 4.06Å; T48-A326 HydrophobicContact CG2-CB 3.7Å; T48-A326 WeakPolarHBondContact CG2-O 3.47Å; T48-T327 HydrophobicContact CG2-CG2 4.3Å
49	I	96.3	Very high	94.6	Very high	1 Å²	1	27.8 Å²	27.8	1%	0.005	15%	0.153	C	C	.	.	H	α-helix	trans	-61.6	-40.2	173.1	-62.9	-62.8	0	0	0	111.2	L38 G45 K46 Q52 M53 F267 A326 V332	L38-I49 HydrophobicContact CD2-CB 4.42Å; L38-I49 HydrophobicContact CD2-CG2 4.18Å; G45-I49 PolarHBondContact O-N 3.01Å; K46-I49 WeakPolarHBondContact O-CA 3.41Å; K46-I49 WeakPolarHBondContact O-CB 3.38Å; K46-I49 PolarHBondContact O-N 3.32Å; I49-Q52 WeakPolarHBondContact O-CB 3.39Å; I49-Q52 PolarHBondContact O-N 3.34Å; I49-M53 WeakPolarHBondContact O-CG 3.25Å; I49-M53 PolarHBondContact O-N 2.83Å; I49-M53 VanDerWaalsContact O-N 3.1Å; I49-F267 HydrophobicContact CD1-CD2 4.11Å; I49-F267 HydrophobicContact CD1-CE2 4.1Å; I49-F267 HydrophobicContact CG1-CD2 4.23Å; I49-F267 HydrophobicContact CG1-CE2 4.37Å; I49-F267 HydrophobicContact CG2-CE2 4.36Å; I49-A326 HydrophobicContact CD1-CB 3.7Å; I49-A326 HydrophobicContact CG1-CB 4.23Å; I49-V332 HydrophobicContact CD1-CG1 4.17Å; I49-V332 HydrophobicContact CD1-CG2 3.92Å
50	V	94.9	Very high	94.4	Very high	15 Å²	15	28.1 Å²	28.1	9%	0.091	16%	0.157	C	C	.	.	H	α-helix	trans	-61.5	-47.6	174.7	-178.6	0	0	0	0	111.5	L38 K46 S47 T48 Q52 M53 K54 T187 M198 D200	L38-V50 HydrophobicContact CD1-CG2 3.39Å; K46-V50 PolarHBondContact O-N 3.02Å; K46-V50 VanDerWaalsContact O-N 3.11Å; S47-V50 PolarHBondContact O-N 2.91Å; T48-V50 VanDerWaalsContact C-N 3.32Å; T48-V50 PolarHBondContact O-N 3.49Å; V50-Q52 PolarHBondContact O-N 3.47Å; V50-M53 WeakPolarHBondContact O-CB 3.42Å; V50-M53 PolarHBondContact O-N 2.77Å; V50-K54 PolarHBondContact O-N 2.93Å; V50-T187 HydrophobicContact CG1-CG2 4.29Å; V50-T187 VanDerWaalsContact CG1-OG1 3.28Å; V50-T187 WeakPolarHBondContact CG1-OG1 3.34Å; V50-M198 HydrophobicContact CG2-SD 4.08Å; V50-D200 HydrophobicContact CG2-CB 3.55Å
51	K	95.7	Very high	94.4	Very high	25 Å²	25	29.8 Å²	29.8	11%	0.109	16%	0.163	C	C	.	.	H	α-helix	trans	-57.7	-38.1	176.9	-69.1	175.2	175.4	-178.4	0	111.2	S47 T48 M53 K54 I55 Y61 V174 L175 S177	S47-K51 VanDerWaalsContact O-CG 3.3Å; S47-K51 WeakPolarHBondContact O-CG 3.29Å; S47-K51 PolarHBondContact O-N 3.41Å; T48-K51 PolarHBondContact O-N 3.34Å; K51-M53 VanDerWaalsContact C-N 3.34Å; K51-M53 PolarHBondContact O-N 3Å; K51-K54 WeakPolarHBondContact O-CB 3.46Å; K51-K54 PolarHBondContact O-N 2.83Å; K51-I55 PolarHBondContact O-N 3.05Å; K51-Y61 VanDerWaalsContact CA-OH 3.31Å; K51-Y61 WeakPolarHBondContact CA-OH 3.1Å; K51-Y61 VanDerWaalsContact CB-OH 3.29Å; K51-Y61 WeakPolarHBondContact CB-OH 3.31Å; K51-Y61 VanDerWaalsContact CG-OH 3.3Å; K51-Y61 WeakPolarHBondContact CG-OH 3.47Å; K51-V174 HydrophobicContact CD-CG1 4.4Å; K51-V174 WeakPolarHBondContact CD-O 3.23Å; K51-V174 PolarHBondContact NZ-O 2.98Å; K51-L175 HydrophobicContact CB-CD2 3.75Å; K51-S177 PolarHBondContact NZ-O 3.27Å; K51-S177 PolarHBondContact NZ-OG 3.47Å
52	Q	96.4	Very high	94.5	Very high	0 Å²	0	31.3 Å²	31.3	0%	0	17%	0.173	C	C	.	.	H	α-helix	trans	-64	-35.7	174.2	-69.5	-75.5	15.6	0	0	112.9	T48 I49 V50 K54 I55 I56 L175 A326 T329 V332	T48-Q52 VanDerWaalsContact O-CG 3.32Å; T48-Q52 WeakPolarHBondContact O-CG 3.28Å; T48-Q52 PolarHBondContact O-N 3.3Å; I49-Q52 WeakPolarHBondContact O-CB 3.39Å; I49-Q52 PolarHBondContact O-N 3.34Å; V50-Q52 PolarHBondContact O-N 3.47Å; Q52-K54 PolarHBondContact O-N 3Å; Q52-I55 PolarHBondContact O-N 2.79Å; Q52-I55 VanDerWaalsContact O-N 3.15Å; Q52-I56 HydrophobicContact CB-CD1 4.14Å; Q52-I56 WeakPolarHBondContact O-CB 3.39Å; Q52-I56 WeakPolarHBondContact O-CD1 3.47Å; Q52-I56 WeakPolarHBondContact O-CG1 3.26Å; Q52-I56 PolarHBondContact O-N 2.83Å; Q52-L175 HydrophobicContact CG-CD2 3.67Å; Q52-L175 VanDerWaalsContact NE2-CD1 3.33Å; Q52-A326 WeakPolarHBondContact CG-O 3.37Å; Q52-A326 PolarHBondContact NE2-O 2.95Å; Q52-T329 PolarHBondContact NE2-OG1 3.25Å; Q52-T329 PolarHBondContact OE1-OG1 3.44Å; Q52-V332 HydrophobicContact CB-CB 4.35Å; Q52-V332 HydrophobicContact CB-CG1 3.75Å; Q52-V332 HydrophobicContact CG-CB 4.26Å; Q52-V332 HydrophobicContact CG-CG1 4.12Å; Q52-V332 HydrophobicContact CG-CG2 4.11Å
53	M	94.6	Very high	94.8	Very high	0 Å²	0	33.6 Å²	33.6	0%	0	18%	0.183	C	C	.	.	H	α-helix	trans	-62.6	-34.9	176.4	-62.6	-58.5	94.2	0	0	111.9	I49 V50 K51 I56 H57 F189 M198 V332 F336	I49-M53 WeakPolarHBondContact O-CG 3.25Å; I49-M53 PolarHBondContact O-N 2.83Å; I49-M53 VanDerWaalsContact O-N 3.1Å; V50-M53 WeakPolarHBondContact O-CB 3.42Å; V50-M53 PolarHBondContact O-N 2.77Å; K51-M53 VanDerWaalsContact C-N 3.34Å; K51-M53 PolarHBondContact O-N 3Å; M53-I56 HydrophobicContact CE-CD1 4.14Å; M53-H57 WeakPolarHBondContact O-CA 3.4Å; M53-H57 WeakPolarHBondContact O-CB 3.2Å; M53-H57 PolarHBondContact O-N 3.28Å; M53-F189 HydrophobicContact CB-CD1 4.05Å; M53-F189 HydrophobicContact CB-CE1 3.91Å; M53-F189 HydrophobicContact CB-CZ 4.24Å; M53-F189 HydrophobicContact CG-CD1 4.44Å; M53-F189 HydrophobicContact CG-CE1 3.79Å; M53-F189 HydrophobicContact CG-CZ 3.84Å; M53-F189 HydrophobicContact SD-CE1 4.23Å; M53-F189 HydrophobicContact SD-CE2 3.97Å; M53-F189 HydrophobicContact SD-CZ 3.64Å; M53-M198 HydrophobicContact CG-CE 3.61Å; M53-M198 HydrophobicContact CG-SD 3.76Å; M53-M198 HydrophobicContact SD-CE 3.95Å; M53-V332 HydrophobicContact CE-CG1 3.81Å; M53-F336 HydrophobicContact CE-CB 4.28Å; M53-F336 HydrophobicContact CE-CD2 3.92Å; M53-F336 HydrophobicContact CE-CE2 4.46Å; M53-F336 HydrophobicContact CE-CG 3.97Å; M53-F336 HydrophobicContact SD-CD1 4.09Å; M53-F336 HydrophobicContact SD-CD2 3.67Å; M53-F336 HydrophobicContact SD-CE1 4.05Å; M53-F336 HydrophobicContact SD-CE2 3.61Å; M53-F336 HydrophobicContact SD-CG 3.92Å; M53-F336 HydrophobicContact SD-CZ 3.82Å
54	K	94.2	Very high	95	Very high	39 Å²	39	37.5 Å²	37.5	17%	0.17	20%	0.202	C	C	.	.	H	α-helix	trans	-65.1	-45.7	172.5	174.7	155.3	176	156.1	0	111.7	V50 K51 Q52 I56 Q58 G60 Y61 E65	V50-K54 PolarHBondContact O-N 2.93Å; K51-K54 WeakPolarHBondContact O-CB 3.46Å; K51-K54 PolarHBondContact O-N 2.83Å; Q52-K54 PolarHBondContact O-N 3Å; K54-I56 PolarHBondContact O-N 3.5Å; K54-Q58 HydrophobicContact CG-CB 4.26Å; K54-Q58 CarbonylContact O-C 3.39Å; K54-Q58 VanDerWaalsContact O-CA 3.32Å; K54-Q58 WeakPolarHBondContact O-CA 3.25Å; K54-Q58 WeakPolarHBondContact O-CB 3.36Å; K54-Q58 PolarHBondContact O-N 2.86Å; K54-G60 WeakPolarHBondContact CE-O 3.45Å; K54-G60 PolarHBondContact O-N 3.31Å; K54-Y61 HydrophobicContact CB-CE2 4.47Å; K54-Y61 HydrophobicContact CD-CD1 4.07Å; K54-Y61 HydrophobicContact CD-CE1 3.62Å; K54-Y61 HydrophobicContact CD-CE2 4.41Å; K54-Y61 HydrophobicContact CG-CE1 4.32Å; K54-Y61 HydrophobicContact CG-CE2 4.23Å; K54-E65 VanDerWaalsContact CE-OE2 3.23Å; K54-E65 WeakPolarHBondContact CE-OE2 3.4Å; K54-E65 IonicContact NZ-OE1 2.73Å; K54-E65 PolarHBondContact NZ-OE1 3.37Å; K54-E65 IonicContact NZ-OE2 3.27Å; K54-E65 PolarHBondContact NZ-OE2 3Å
55	I	95.1	Very high	95	Very high	25 Å²	25	40.3 Å²	40.3	13%	0.128	22%	0.215	C	C	.	.	H	α-helix	trans	-61.9	-44.9	177.5	-63.2	170	0	0	0	112.2	K51 Q52 Y61 E171 L175 T329	K51-I55 PolarHBondContact O-N 3.05Å; Q52-I55 PolarHBondContact O-N 2.79Å; Q52-I55 VanDerWaalsContact O-N 3.15Å; I55-Y61 HydrophobicContact CD1-CD2 4.34Å; I55-Y61 HydrophobicContact CD1-CE2 4.04Å; I55-Y61 HydrophobicContact CG1-CD2 3.87Å; I55-Y61 HydrophobicContact CG1-CE2 3.7Å; I55-E171 HydrophobicContact CD1-CB 4.05Å; I55-L175 HydrophobicContact CD1-CD1 3.72Å; I55-L175 HydrophobicContact CD1-CD2 3.81Å; I55-L175 HydrophobicContact CD1-CG 3.71Å; I55-T329 HydrophobicContact CG2-CG2 4.02Å
56	I	94.3	Very high	95.1	Very high	35 Å²	35	40.1 Å²	40.1	18%	0.179	21%	0.211	C	C	.	.	H	α-helix	trans	-82.3	-32.4	-171.4	-60.4	163.8	0	0	0	111.6	Q52 M53 K54 T329 V332 K333	Q52-I56 HydrophobicContact CB-CD1 4.14Å; Q52-I56 WeakPolarHBondContact O-CB 3.39Å; Q52-I56 WeakPolarHBondContact O-CD1 3.47Å; Q52-I56 WeakPolarHBondContact O-CG1 3.26Å; Q52-I56 PolarHBondContact O-N 2.83Å; M53-I56 HydrophobicContact CE-CD1 4.14Å; K54-I56 PolarHBondContact O-N 3.5Å; I56-T329 HydrophobicContact CD1-CG2 4.29Å; I56-T329 HydrophobicContact CG1-CG2 3.84Å; I56-V332 HydrophobicContact CD1-CB 4.31Å; I56-V332 HydrophobicContact CD1-CG1 4Å; I56-K333 HydrophobicContact CD1-CB 3.96Å; I56-K333 HydrophobicContact CG1-CB 4.46Å; I56-K333 HydrophobicContact CG2-CB 4.3Å; I56-K333 HydrophobicContact CG2-CD 4.2Å; I56-K333 HydrophobicContact CG2-CG 3.97Å
57	H	92.4	Very high	95.1	Very high	46 Å²	46	43.8 Å²	43.8	21%	0.213	23%	0.231	C	C	.	.	H	α-helix	trans	-127.3	1.5	-168	-56.1	-61.1	0	0	0	115.3	M53 F189 F336	M53-H57 WeakPolarHBondContact O-CA 3.4Å; M53-H57 WeakPolarHBondContact O-CB 3.2Å; M53-H57 PolarHBondContact O-N 3.28Å; H57-F189 HydrophobicContact CB-CB 4.14Å; H57-F189 HydrophobicContact CB-CD2 4.01Å; H57-F189 HydrophobicContact CB-CG 4.39Å; H57-F189 AromaticContact CD2-CD2 3.78Å; H57-F189 AromaticContact CD2-CE2 3.89Å; H57-F336 AromaticContact NE2-CD1 3.73Å
58	Q	91.5	Very high	95.1	Very high	67 Å²	67	49.3 Å²	49.3	31%	0.313	25%	0.253	S	S	.	.	S	Bend	trans	-139.3	39.6	-179	-54.6	-176.1	-38.3	0	0	113.2	K54 G60 K188 F189	K54-Q58 HydrophobicContact CG-CB 4.26Å; K54-Q58 CarbonylContact O-C 3.39Å; K54-Q58 VanDerWaalsContact O-CA 3.32Å; K54-Q58 WeakPolarHBondContact O-CA 3.25Å; K54-Q58 WeakPolarHBondContact O-CB 3.36Å; K54-Q58 PolarHBondContact O-N 2.86Å; Q58-G60 PolarHBondContact O-N 3.48Å; Q58-G60 VanDerWaalsContact O-N 3.08Å; Q58-K188 PolarHBondContact NE2-O 2.84Å; Q58-F189 HydrophobicContact CG-CB 4.11Å
59	D	92.4	Very high	95.1	Very high	174 Å²	174	49.5 Å²	49.5	93%	0.93	25%	0.252	S	S	*	.			trans	60.5	17.1	174.6	-55.8	-48.1	0	0	0	116.1
60	G	93.4	Very high	95.1	Very high	7 Å²	7	51.7 Å²	51.7	7%	0.072	26%	0.261	C	S	.	.			trans	82.8	-161.3	176.9	0	0	0	0	0	114.5	K54 Q58 E171	K54-G60 WeakPolarHBondContact CE-O 3.45Å; K54-G60 PolarHBondContact O-N 3.31Å; Q58-G60 PolarHBondContact O-N 3.48Å; Q58-G60 VanDerWaalsContact O-N 3.08Å; G60-E171 WeakPolarHBondContact CA-OE1 3.48Å
61	Y	95.8	Very high	95.1	Very high	35 Å²	35	53.2 Å²	53.2	14%	0.137	28%	0.276	C	S	.	.			trans	-102	131.2	173.1	-69.5	-88.5	0	0	0	110.1	K51 K54 I55 E65 C66 F69 E171 V174	K51-Y61 VanDerWaalsContact CA-OH 3.31Å; K51-Y61 WeakPolarHBondContact CA-OH 3.1Å; K51-Y61 VanDerWaalsContact CB-OH 3.29Å; K51-Y61 WeakPolarHBondContact CB-OH 3.31Å; K51-Y61 VanDerWaalsContact CG-OH 3.3Å; K51-Y61 WeakPolarHBondContact CG-OH 3.47Å; K54-Y61 HydrophobicContact CB-CE2 4.47Å; K54-Y61 HydrophobicContact CD-CD1 4.07Å; K54-Y61 HydrophobicContact CD-CE1 3.62Å; K54-Y61 HydrophobicContact CD-CE2 4.41Å; K54-Y61 HydrophobicContact CG-CE1 4.32Å; K54-Y61 HydrophobicContact CG-CE2 4.23Å; I55-Y61 HydrophobicContact CD1-CD2 4.34Å; I55-Y61 HydrophobicContact CD1-CE2 4.04Å; I55-Y61 HydrophobicContact CG1-CD2 3.87Å; I55-Y61 HydrophobicContact CG1-CE2 3.7Å; Y61-E65 WeakPolarHBondContact CA-OE2 3.34Å; Y61-E65 HydrophobicContact CD1-CB 4.25Å; Y61-C66 VanDerWaalsContact CB-SG 3.55Å; Y61-F69 HydrophobicContact CD1-CE2 4.23Å; Y61-F69 HydrophobicContact CE1-CE2 4.09Å; Y61-F69 HydrophobicContact CE1-CZ 4.35Å; Y61-E171 HydrophobicContact CD2-CG 4.4Å; Y61-E171 PolarHBondContact N-OE1 3.34Å; Y61-V174 HydrophobicContact CD1-CG1 4.29Å; Y61-V174 HydrophobicContact CD2-CG1 4.13Å; Y61-V174 HydrophobicContact CE1-CG1 3.99Å; Y61-V174 HydrophobicContact CE2-CG1 3.81Å; Y61-V174 HydrophobicContact CG-CG1 4.35Å
62	S	96.6	Very high	95.1	Very high	41 Å²	41	54.7 Å²	54.7	29%	0.287	28%	0.284	S	S	.	.			trans	-69.1	159.4	173.3	92.3	0	0	0	0	110.8	E64 E65 C66	S62-E64 WeakPolarHBondContact CB-OE2 3.25Å; S62-E64 PolarHBondContact O-N 3.21Å; S62-E64 PolarHBondContact OG-N 3.26Å; S62-E64 PolarHBondContact OG-OE2 3.37Å; S62-E65 PolarHBondContact N-OE2 2.95Å; S62-E65 VanDerWaalsContact N-OE2 3.09Å; S62-E65 PolarHBondContact O-N 3.04Å; S62-E65 VanDerWaalsContact O-N 3.12Å; S62-E65 PolarHBondContact OG-N 2.87Å; S62-C66 PolarHBondContact O-N 3.22Å
63	P	96.3	Very high	95.2	Very high	72 Å²	72	54.7 Å²	54.7	47%	0.468	28%	0.284	S	S	.	.	H	α-helix	trans	-54	-38.7	174.1	-27	36.2	0	0	0	113.1	C66 L67 L168	P63-C66 PolarHBondContact O-N 2.79Å; P63-L67 WeakPolarHBondContact O-CG 3.34Å; P63-L67 PolarHBondContact O-N 3.3Å; P63-L168 HydrophobicContact CB-CD1 4.46Å; P63-L168 HydrophobicContact CB-CD2 4.17Å; P63-L168 WeakPolarHBondContact O-CD1 3.22Å
64	E	96.4	Very high	95.3	Very high	125 Å²	125	55.8 Å²	55.8	58%	0.584	29%	0.289	S	S	*	.	H	α-helix	trans	-64.3	-45.2	177.2	-57.9	73.3	-158	0	0	111.2	S62 L67 E68	S62-E64 WeakPolarHBondContact CB-OE2 3.25Å; S62-E64 PolarHBondContact O-N 3.21Å; S62-E64 PolarHBondContact OG-N 3.26Å; S62-E64 PolarHBondContact OG-OE2 3.37Å; E64-L67 WeakPolarHBondContact O-CB 3.21Å; E64-L67 PolarHBondContact O-N 3.34Å; E64-E68 PolarHBondContact O-N 3.06Å
65	E	95.8	Very high	95.3	Very high	62 Å²	62	55 Å²	55	29%	0.29	29%	0.291	S	S	.	.	H	α-helix	trans	-65.6	-40	176.7	-64.5	-179.5	137.2	0	0	111.6	K54 Y61 S62 L67 E68 F69	K54-E65 VanDerWaalsContact CE-OE2 3.23Å; K54-E65 WeakPolarHBondContact CE-OE2 3.4Å; K54-E65 IonicContact NZ-OE1 2.73Å; K54-E65 PolarHBondContact NZ-OE1 3.37Å; K54-E65 IonicContact NZ-OE2 3.27Å; K54-E65 PolarHBondContact NZ-OE2 3Å; Y61-E65 WeakPolarHBondContact CA-OE2 3.34Å; Y61-E65 HydrophobicContact CD1-CB 4.25Å; S62-E65 PolarHBondContact N-OE2 2.95Å; S62-E65 VanDerWaalsContact N-OE2 3.09Å; S62-E65 PolarHBondContact O-N 3.04Å; S62-E65 VanDerWaalsContact O-N 3.12Å; S62-E65 PolarHBondContact OG-N 2.87Å; E65-L67 VanDerWaalsContact C-N 3.28Å; E65-L67 PolarHBondContact O-N 3.28Å; E65-E68 WeakPolarHBondContact O-CB 3.49Å; E65-E68 PolarHBondContact O-N 2.95Å; E65-F69 WeakPolarHBondContact O-CD2 3.42Å
66	C	96.8	Very high	95.4	Very high	6 Å²	6	54.1 Å²	54.1	4%	0.041	29%	0.287	C	S	.	.	H	α-helix	trans	-59.5	-39.2	174.5	-77.8	0	0	0	0	111.9	Y61 S62 P63 E68 F69 L168 P169	Y61-C66 VanDerWaalsContact CB-SG 3.55Å; S62-C66 PolarHBondContact O-N 3.22Å; P63-C66 PolarHBondContact O-N 2.79Å; C66-E68 VanDerWaalsContact C-N 3.27Å; C66-E68 PolarHBondContact O-N 2.93Å; C66-F69 WeakPolarHBondContact O-CB 3.33Å; C66-F69 PolarHBondContact O-N 2.72Å; C66-F69 VanDerWaalsContact O-N 3.09Å; C66-L168 HydrophobicContact CB-CD1 4.1Å; C66-P169 HydrophobicContact CB-CB 4.38Å; C66-P169 VanDerWaalsContact CB-O 3.31Å; C66-P169 WeakPolarHBondContact CB-O 3.45Å; C66-P169 VanDerWaalsContact O-CG 3.25Å; C66-P169 WeakPolarHBondContact O-CG 3.23Å; C66-P169 PolarHBondContact SG-O 2.83Å; C66-P169 VanDerWaalsContact SG-O 3.41Å
67	L	95.7	Very high	95.5	Very high	87 Å²	87	52.4 Å²	52.4	46%	0.455	28%	0.278	S	S	.	.	H	α-helix	trans	-62.4	-32.2	177	-75.7	170.6	0	0	0	112.8	P63 E64 E65 F69 K70 L168	P63-L67 WeakPolarHBondContact O-CG 3.34Å; P63-L67 PolarHBondContact O-N 3.3Å; E64-L67 WeakPolarHBondContact O-CB 3.21Å; E64-L67 PolarHBondContact O-N 3.34Å; E65-L67 VanDerWaalsContact C-N 3.28Å; E65-L67 PolarHBondContact O-N 3.28Å; L67-F69 PolarHBondContact O-N 2.97Å; L67-K70 VanDerWaalsContact O-CB 3.23Å; L67-K70 WeakPolarHBondContact O-CB 3.41Å; L67-K70 PolarHBondContact O-N 2.87Å; L67-L168 HydrophobicContact CD1-CD1 4.43Å; L67-L168 HydrophobicContact CD2-CD1 3.74Å; L67-L168 HydrophobicContact CG-CD1 3.61Å
68	E	95.3	Very high	95.7	Very high	146 Å²	146	51.2 Å²	51.2	68%	0.682	27%	0.273	S	S	*	.	H	α-helix	trans	-61.2	-26.1	175.6	-60.6	-179.6	177.1	0	0	112.2	E64 E65 C66	E64-E68 PolarHBondContact O-N 3.06Å; E65-E68 WeakPolarHBondContact O-CB 3.49Å; E65-E68 PolarHBondContact O-N 2.95Å; C66-E68 VanDerWaalsContact C-N 3.27Å; C66-E68 PolarHBondContact O-N 2.93Å
69	F	96.8	Very high	95.9	Very high	31 Å²	31	54 Å²	54	14%	0.136	29%	0.286	C	S	.	.	H	α-helix	trans	-81.6	-10.9	176.6	-69.2	-84.5	0	0	0	114.1	Y61 E65 C66 L67 A71 I72 I73 V174 S177	Y61-F69 HydrophobicContact CD1-CE2 4.23Å; Y61-F69 HydrophobicContact CE1-CE2 4.09Å; Y61-F69 HydrophobicContact CE1-CZ 4.35Å; E65-F69 WeakPolarHBondContact O-CD2 3.42Å; C66-F69 WeakPolarHBondContact O-CB 3.33Å; C66-F69 PolarHBondContact O-N 2.72Å; C66-F69 VanDerWaalsContact O-N 3.09Å; L67-F69 PolarHBondContact O-N 2.97Å; F69-A71 PolarHBondContact O-N 3.44Å; F69-I72 HydrophobicContact CD1-CD1 3.97Å; F69-I72 HydrophobicContact CE1-CD1 4.43Å; F69-I72 WeakPolarHBondContact O-CB 3.41Å; F69-I72 PolarHBondContact O-N 3.49Å; F69-I72 VanDerWaalsContact O-N 3.16Å; F69-I73 HydrophobicContact CB-CD1 4Å; F69-I73 WeakPolarHBondContact O-CD1 3.4Å; F69-I73 VanDerWaalsContact O-CG1 3.26Å; F69-I73 WeakPolarHBondContact O-CG1 3.3Å; F69-I73 PolarHBondContact O-N 2.89Å; F69-V174 HydrophobicContact CB-CG2 4.19Å; F69-V174 HydrophobicContact CD1-CG1 4.22Å; F69-V174 HydrophobicContact CD2-CB 4.37Å; F69-V174 HydrophobicContact CD2-CG1 3.87Å; F69-V174 HydrophobicContact CD2-CG2 3.66Å; F69-V174 HydrophobicContact CE1-CG1 4Å; F69-V174 HydrophobicContact CE2-CG1 3.64Å; F69-V174 HydrophobicContact CE2-CG2 4.23Å; F69-V174 HydrophobicContact CG-CB 4.48Å; F69-V174 HydrophobicContact CG-CG1 4.16Å; F69-V174 HydrophobicContact CG-CG2 3.93Å; F69-V174 HydrophobicContact CZ-CG1 3.71Å; F69-S177 WeakPolarHBondContact CD1-OG 3.35Å
70	K	96.1	Very high	96.1	Very high	47 Å²	47	45.9 Å²	45.9	20%	0.204	24%	0.243	C	C	.	.	H	α-helix	trans	-58.6	-49.7	-175	-172.4	166.9	-177.7	159.5	0	111.9	L67 I72 I73 Y74 Y167 P169	L67-K70 VanDerWaalsContact O-CB 3.23Å; L67-K70 WeakPolarHBondContact O-CB 3.41Å; L67-K70 PolarHBondContact O-N 2.87Å; K70-I72 VanDerWaalsContact C-N 3.32Å; K70-I72 PolarHBondContact O-N 3.3Å; K70-I73 PolarHBondContact O-N 2.85Å; K70-Y74 WeakPolarHBondContact CE-OH 3.46Å; K70-Y74 HydrophobicContact CG-CE1 4.18Å; K70-Y74 HydrophobicContact CG-CE2 4.15Å; K70-Y74 PolarHBondContact O-N 2.93Å; K70-Y167 HydrophobicContact CD-CD1 4.28Å; K70-Y167 HydrophobicContact CG-CD1 4.19Å; K70-Y167 HydrophobicContact CG-CE1 4.31Å; K70-Y167 PolarHBondContact NZ-O 2.94Å; K70-P169 HydrophobicContact CB-CG 4.1Å
71	A	95.2	Very high	96.3	Very high	47 Å²	47	45.5 Å²	45.5	39%	0.388	24%	0.24	S	C	.	.	H	α-helix	trans	-60.9	-40.4	176.9	0	0	0	0	0	112.3	F69 Y74 G75	F69-A71 PolarHBondContact O-N 3.44Å; A71-Y74 PolarHBondContact O-N 3.42Å; A71-G75 PolarHBondContact O-N 3.5Å
72	I	95.9	Very high	96.4	Very high	56 Å²	56	44.6 Å²	44.6	29%	0.287	24%	0.237	S	C	.	.	H	α-helix	trans	-63.3	-45	177.9	-64.1	166.7	0	0	0	110.5	F69 K70 G75 N76 V179	F69-I72 HydrophobicContact CD1-CD1 3.97Å; F69-I72 HydrophobicContact CE1-CD1 4.43Å; F69-I72 WeakPolarHBondContact O-CB 3.41Å; F69-I72 PolarHBondContact O-N 3.49Å; F69-I72 VanDerWaalsContact O-N 3.16Å; K70-I72 VanDerWaalsContact C-N 3.32Å; K70-I72 PolarHBondContact O-N 3.3Å; I72-G75 PolarHBondContact O-N 3.48Å; I72-N76 PolarHBondContact O-N 2.94Å; I72-N76 PolarHBondContact O-ND2 3.31Å; I72-V179 HydrophobicContact CD1-CG2 3.82Å; I72-V179 HydrophobicContact CG1-CG2 4.4Å; I72-V179 HydrophobicContact CG2-CG2 3.68Å
73	I	97.6	Very high	96.4	Very high	0 Å²	0	43.8 Å²	43.8	0%	0	23%	0.233	C	C	.	.	H	α-helix	trans	-64.7	-42.8	-179.6	-69.4	158.9	0	0	0	110.4	F69 K70 G75 N76 V77 Y155 I162 P169 D173	F69-I73 HydrophobicContact CB-CD1 4Å; F69-I73 WeakPolarHBondContact O-CD1 3.4Å; F69-I73 VanDerWaalsContact O-CG1 3.26Å; F69-I73 WeakPolarHBondContact O-CG1 3.3Å; F69-I73 PolarHBondContact O-N 2.89Å; K70-I73 PolarHBondContact O-N 2.85Å; I73-G75 PolarHBondContact O-N 3.26Å; I73-N76 WeakPolarHBondContact O-CB 3.3Å; I73-N76 PolarHBondContact O-N 2.97Å; I73-N76 VanDerWaalsContact O-N 3.15Å; I73-V77 WeakPolarHBondContact O-CG2 3.46Å; I73-V77 PolarHBondContact O-N 3.36Å; I73-Y155 HydrophobicContact CG1-CE1 4.26Å; I73-Y155 HydrophobicContact CG2-CD1 3.9Å; I73-Y155 HydrophobicContact CG2-CE1 3.63Å; I73-I162 HydrophobicContact CG2-CG2 4.04Å; I73-P169 HydrophobicContact CD1-CB 3.71Å; I73-P169 HydrophobicContact CD1-CG 3.85Å; I73-D173 HydrophobicContact CD1-CB 3.77Å
74	Y	97	Very high	96.5	Very high	24 Å²	24	40.4 Å²	40.4	9%	0.094	21%	0.211	C	C	.	.	H	α-helix	trans	-60	-45.9	174.3	-71.7	1.2	0	0	0	111.7	K70 A71 N76 V77 L78 G117 M119 I162 Y167	K70-Y74 WeakPolarHBondContact CE-OH 3.46Å; K70-Y74 HydrophobicContact CG-CE1 4.18Å; K70-Y74 HydrophobicContact CG-CE2 4.15Å; K70-Y74 PolarHBondContact O-N 2.93Å; A71-Y74 PolarHBondContact O-N 3.42Å; Y74-N76 VanDerWaalsContact C-N 3.3Å; Y74-N76 PolarHBondContact O-N 3.47Å; Y74-V77 PolarHBondContact O-N 2.69Å; Y74-L78 PolarHBondContact O-N 3.33Å; Y74-G117 VanDerWaalsContact CD2-O 3.31Å; Y74-G117 WeakPolarHBondContact CD2-O 3.44Å; Y74-M119 HydrophobicContact CD1-CG 3.77Å; Y74-M119 HydrophobicContact CD2-CB 3.82Å; Y74-M119 HydrophobicContact CD2-CG 3.45Å; Y74-M119 VanDerWaalsContact CD2-CG 3.45Å; Y74-M119 HydrophobicContact CE1-CG 4.25Å; Y74-M119 HydrophobicContact CE2-CB 3.84Å; Y74-M119 HydrophobicContact CE2-CG 3.95Å; Y74-M119 HydrophobicContact CG-CB 4.18Å; Y74-M119 HydrophobicContact CG-CG 3.34Å; Y74-I162 HydrophobicContact CD1-CG2 3.9Å; Y74-I162 HydrophobicContact CE1-CG2 3.64Å; Y74-I162 VanDerWaalsContact CE1-O 3.28Å; Y74-I162 WeakPolarHBondContact CE1-O 3.3Å; Y74-I162 PolarHBondContact OH-O 2.86Å; Y74-Y167 HydrophobicContact CE1-CD1 4.06Å; Y74-Y167 HydrophobicContact CE1-CE1 4.11Å
75	G	95.4	Very high	96.5	Very high	22 Å²	22	34.7 Å²	34.7	23%	0.227	18%	0.184	C	C	.	.	H	α-helix	trans	-58.1	-41.5	173	0	0	0	0	0	112.5	A71 I72 I73 L78 Q79	A71-G75 PolarHBondContact O-N 3.5Å; I72-G75 PolarHBondContact O-N 3.48Å; I73-G75 PolarHBondContact O-N 3.26Å; G75-L78 PolarHBondContact O-N 2.99Å; G75-Q79 VanDerWaalsContact O-CB 3.29Å; G75-Q79 WeakPolarHBondContact O-CB 3.4Å; G75-Q79 WeakPolarHBondContact O-CG 3.43Å; G75-Q79 PolarHBondContact O-N 2.87Å
76	N	96.4	Very high	96.5	Very high	6 Å²	6	38.7 Å²	38.7	3%	0.032	20%	0.197	C	C	.	.	H	α-helix	trans	-65.8	-38.8	177.1	-66.5	171	0	0	0	112.8	I72 I73 Y74 S80 Y155 R178	I72-N76 PolarHBondContact O-N 2.94Å; I72-N76 PolarHBondContact O-ND2 3.31Å; I73-N76 WeakPolarHBondContact O-CB 3.3Å; I73-N76 PolarHBondContact O-N 2.97Å; I73-N76 VanDerWaalsContact O-N 3.15Å; Y74-N76 VanDerWaalsContact C-N 3.3Å; Y74-N76 PolarHBondContact O-N 3.47Å; N76-S80 VanDerWaalsContact O-CB 3.3Å; N76-S80 WeakPolarHBondContact O-CB 3.23Å; N76-S80 PolarHBondContact O-N 3.34Å; N76-S80 PolarHBondContact O-OG 3.28Å; N76-Y155 HydrophobicContact CB-CE2 4.32Å; N76-R178 PolarHBondContact ND2-O 3.48Å; N76-R178 VanDerWaalsContact ND2-O 3.08Å; N76-R178 PolarHBondContact OD1-N 2.9Å
77	V	97.3	Very high	96.6	Very high	0 Å²	0	38.7 Å²	38.7	0%	0	20%	0.197	C	C	.	.	H	α-helix	trans	-61	-53.1	174.5	169.7	0	0	0	0	110.1	I73 Y74 Q79 S80 I81 M119 I127 Y155 L156 L159	I73-V77 WeakPolarHBondContact O-CG2 3.46Å; I73-V77 PolarHBondContact O-N 3.36Å; Y74-V77 PolarHBondContact O-N 2.69Å; V77-Q79 PolarHBondContact O-N 3.26Å; V77-S80 PolarHBondContact O-N 3Å; V77-I81 PolarHBondContact O-N 3.22Å; V77-M119 HydrophobicContact CB-CE 4.37Å; V77-M119 HydrophobicContact CG1-CE 3.73Å; V77-I127 HydrophobicContact CG1-CD1 4.32Å; V77-Y155 HydrophobicContact CG2-CG 4.22Å; V77-L156 HydrophobicContact CG1-CD2 4.13Å; V77-L159 HydrophobicContact CG1-CD1 3.92Å
78	L	96.1	Very high	96.6	Very high	21 Å²	21	34.7 Å²	34.7	11%	0.11	18%	0.176	C	C	.	.	H	α-helix	trans	-62.3	-45.8	-177.5	-179.7	60.2	0	0	0	112	Y74 G75 S80 I81 L82 L107 A111 I114 L123 I127	Y74-L78 PolarHBondContact O-N 3.33Å; G75-L78 PolarHBondContact O-N 2.99Å; L78-S80 VanDerWaalsContact C-N 3.28Å; L78-S80 PolarHBondContact O-N 3.25Å; L78-I81 HydrophobicContact CD1-CG2 4.42Å; L78-I81 VanDerWaalsContact O-CG2 3.27Å; L78-I81 WeakPolarHBondContact O-CG2 3.43Å; L78-I81 PolarHBondContact O-N 3.26Å; L78-L82 HydrophobicContact CD1-CD1 3.91Å; L78-L82 HydrophobicContact CD1-CG 4.11Å; L78-L82 HydrophobicContact CG-CD1 3.8Å; L78-L82 HydrophobicContact CG-CG 4.43Å; L78-L82 WeakPolarHBondContact O-CB 3.41Å; L78-L82 VanDerWaalsContact O-CG 3.25Å; L78-L82 WeakPolarHBondContact O-CG 3.41Å; L78-L82 PolarHBondContact O-N 3.26Å; L78-L107 HydrophobicContact CD1-CD1 4Å; L78-A111 HydrophobicContact CD1-CB 4.25Å; L78-A111 HydrophobicContact CD2-CB 4.4Å; L78-I114 HydrophobicContact CD2-CD1 3.35Å; L78-I114 HydrophobicContact CD2-CG1 4.34Å; L78-L123 HydrophobicContact CD1-CD1 4.21Å; L78-L123 HydrophobicContact CD1-CD2 4.34Å; L78-I127 HydrophobicContact CD1-CD1 4.5Å
79	Q	95.3	Very high	96.6	Very high	124 Å²	124	33.3 Å²	33.3	58%	0.579	18%	0.178	S	C	*	.	H	α-helix	trans	-61.5	-38.1	176.6	-73.6	172.7	6.1	0	0	111.9	G75 V77 A83	G75-Q79 VanDerWaalsContact O-CB 3.29Å; G75-Q79 WeakPolarHBondContact O-CB 3.4Å; G75-Q79 WeakPolarHBondContact O-CG 3.43Å; G75-Q79 PolarHBondContact O-N 2.87Å; V77-Q79 PolarHBondContact O-N 3.26Å; Q79-A83 VanDerWaalsContact O-CB 3.31Å; Q79-A83 WeakPolarHBondContact O-CB 3.41Å; Q79-A83 PolarHBondContact O-N 2.87Å
80	S	97.4	Very high	96.5	Very high	4 Å²	4	37.6 Å²	37.6	3%	0.028	21%	0.206	C	C	.	.	H	α-helix	trans	-65.9	-49.3	179.8	-60.3	0	0	0	0	111.6	N76 V77 L78 A83 I84	N76-S80 VanDerWaalsContact O-CB 3.3Å; N76-S80 WeakPolarHBondContact O-CB 3.23Å; N76-S80 PolarHBondContact O-N 3.34Å; N76-S80 PolarHBondContact O-OG 3.28Å; V77-S80 PolarHBondContact O-N 3Å; L78-S80 VanDerWaalsContact C-N 3.28Å; L78-S80 PolarHBondContact O-N 3.25Å; S80-A83 PolarHBondContact O-N 3.48Å; S80-I84 WeakPolarHBondContact O-CG1 3.36Å; S80-I84 PolarHBondContact O-N 2.84Å; S80-I84 VanDerWaalsContact O-N 3.14Å
81	I	97.7	Very high	96.5	Very high	0 Å²	0	37.1 Å²	37.1	0%	0	21%	0.206	C	C	.	.	H	α-helix	trans	-67	-40.3	179.6	-169.7	65.4	0	0	0	111.6	V77 L78 A83 I84 I85 L107 I127 L130 V136 L156	V77-I81 PolarHBondContact O-N 3.22Å; L78-I81 HydrophobicContact CD1-CG2 4.42Å; L78-I81 VanDerWaalsContact O-CG2 3.27Å; L78-I81 WeakPolarHBondContact O-CG2 3.43Å; L78-I81 PolarHBondContact O-N 3.26Å; I81-A83 VanDerWaalsContact C-N 3.31Å; I81-A83 PolarHBondContact O-N 3.19Å; I81-I84 PolarHBondContact O-N 3.2Å; I81-I85 HydrophobicContact CG1-CG1 4.41Å; I81-I85 WeakPolarHBondContact O-CG1 3.06Å; I81-I85 PolarHBondContact O-N 2.79Å; I81-L107 HydrophobicContact CG1-CD2 3.97Å; I81-L107 HydrophobicContact CG2-CD1 4.17Å; I81-L107 HydrophobicContact CG2-CD2 4.08Å; I81-I127 HydrophobicContact CB-CG2 4.35Å; I81-I127 HydrophobicContact CG1-CG2 4.23Å; I81-I127 HydrophobicContact CG2-CD1 4.05Å; I81-I127 HydrophobicContact CG2-CG1 4Å; I81-I127 HydrophobicContact CG2-CG2 4.32Å; I81-L130 HydrophobicContact CD1-CB 4.29Å; I81-V136 HydrophobicContact CD1-CG1 4.27Å; I81-L156 HydrophobicContact CB-CD2 4.2Å
82	L	96.5	Very high	96.6	Very high	16 Å²	16	37.9 Å²	37.9	8%	0.084	22%	0.218	C	C	.	.	H	α-helix	trans	-60.5	-40.3	174.8	-74.5	169.5	0	0	0	112.3	L78 I85 R86 L107 A111	L78-L82 HydrophobicContact CD1-CD1 3.91Å; L78-L82 HydrophobicContact CD1-CG 4.11Å; L78-L82 HydrophobicContact CG-CD1 3.8Å; L78-L82 HydrophobicContact CG-CG 4.43Å; L78-L82 WeakPolarHBondContact O-CB 3.41Å; L78-L82 VanDerWaalsContact O-CG 3.25Å; L78-L82 WeakPolarHBondContact O-CG 3.41Å; L78-L82 PolarHBondContact O-N 3.26Å; L82-I85 PolarHBondContact O-N 3.18Å; L82-R86 WeakPolarHBondContact O-CB 3.43Å; L82-R86 VanDerWaalsContact O-CG 3.24Å; L82-R86 WeakPolarHBondContact O-CG 3.4Å; L82-R86 PolarHBondContact O-N 3.24Å; L82-L107 HydrophobicContact CD2-CD2 3.9Å; L82-L107 HydrophobicContact CD2-CG 3.82Å; L82-L107 HydrophobicContact CG-CD2 4.41Å; L82-A111 HydrophobicContact CD1-CB 3.72Å; L82-A111 HydrophobicContact CD2-CB 4.02Å; L82-A111 HydrophobicContact CG-CB 4.41Å
83	A	97.3	Very high	96.6	Very high	24 Å²	24	36.5 Å²	36.5	20%	0.198	21%	0.211	C	C	.	.	H	α-helix	trans	-62.1	-43.9	176.8	0	0	0	0	0	111.6	Q79 S80 I81 R86 A87 L148	Q79-A83 VanDerWaalsContact O-CB 3.31Å; Q79-A83 WeakPolarHBondContact O-CB 3.41Å; Q79-A83 PolarHBondContact O-N 2.87Å; S80-A83 PolarHBondContact O-N 3.48Å; I81-A83 VanDerWaalsContact C-N 3.31Å; I81-A83 PolarHBondContact O-N 3.19Å; A83-R86 PolarHBondContact O-N 2.9Å; A83-A87 WeakPolarHBondContact O-CB 3.42Å; A83-A87 PolarHBondContact O-N 2.64Å; A83-L148 HydrophobicContact CB-CD1 3.99Å
84	I	98.3	Very high	96.6	Very high	0 Å²	0	43.2 Å²	43.2	0%	0	25%	0.247	C	C	.	.	H	α-helix	trans	-63.2	-47.1	177.8	-62.5	162.2	0	0	0	110.8	S80 I81 R86 A87 M88 W131 V136 C139 F140 Y146 L148 L156	S80-I84 WeakPolarHBondContact O-CG1 3.36Å; S80-I84 PolarHBondContact O-N 2.84Å; S80-I84 VanDerWaalsContact O-N 3.14Å; I81-I84 PolarHBondContact O-N 3.2Å; I84-R86 PolarHBondContact O-N 3.17Å; I84-A87 WeakPolarHBondContact O-CB 3.35Å; I84-A87 PolarHBondContact O-N 3.1Å; I84-M88 WeakPolarHBondContact O-CG 3.47Å; I84-M88 PolarHBondContact O-N 2.99Å; I84-W131 HydrophobicContact CD1-CE3 4.47Å; I84-W131 HydrophobicContact CD1-CZ3 3.87Å; I84-V136 HydrophobicContact CG2-CG1 3.82Å; I84-C139 HydrophobicContact CG2-CB 4.05Å; I84-C139 PolarHBondContact O-SG 3.49Å; I84-C139 VanDerWaalsContact O-SG 3.37Å; I84-F140 HydrophobicContact CD1-CD2 4.03Å; I84-Y146 HydrophobicContact CG1-CE2 4.38Å; I84-L148 HydrophobicContact CD1-CD1 4.34Å; I84-L148 HydrophobicContact CD1-CD2 4.26Å; I84-L148 HydrophobicContact CG1-CD1 3.93Å; I84-L148 HydrophobicContact CG1-CD2 4.01Å; I84-L156 HydrophobicContact CD1-CD1 3.97Å
85	I	97.2	Very high	96.6	Very high	5 Å²	5	44.8 Å²	44.8	3%	0.026	25%	0.253	C	S	.	.	H	α-helix	trans	-63.9	-39.9	-179.9	-64.5	-50	0	0	0	112	I81 L82 M88 Y95 L107 L130 V136	I81-I85 HydrophobicContact CG1-CG1 4.41Å; I81-I85 WeakPolarHBondContact O-CG1 3.06Å; I81-I85 PolarHBondContact O-N 2.79Å; L82-I85 PolarHBondContact O-N 3.18Å; I85-M88 HydrophobicContact CD1-SD 3.81Å; I85-M88 WeakPolarHBondContact O-CB 3.22Å; I85-M88 PolarHBondContact O-N 2.79Å; I85-Y95 HydrophobicContact CD1-CE1 3.98Å; I85-Y95 WeakPolarHBondContact CG2-OH 3.41Å; I85-L107 HydrophobicContact CG1-CD2 3.85Å; I85-L130 HydrophobicContact CD1-CD1 4.38Å; I85-L130 HydrophobicContact CD1-CD2 4.15Å; I85-L130 HydrophobicContact CG1-CD1 4.38Å; I85-V136 HydrophobicContact CD1-CG2 3.75Å
86	R	96.2	Very high	96.6	Very high	147 Å²	147	47.1 Å²	47.1	56%	0.555	27%	0.271	S	S	*	.	H	α-helix	trans	-64.4	-42.4	174.1	-71.9	170.4	-175.8	176.8	1.4	111.2	L82 A83 I84 M88 T89 T90	L82-R86 WeakPolarHBondContact O-CB 3.43Å; L82-R86 VanDerWaalsContact O-CG 3.24Å; L82-R86 WeakPolarHBondContact O-CG 3.4Å; L82-R86 PolarHBondContact O-N 3.24Å; A83-R86 PolarHBondContact O-N 2.9Å; I84-R86 PolarHBondContact O-N 3.17Å; R86-M88 VanDerWaalsContact C-N 3.31Å; R86-M88 PolarHBondContact O-N 3.29Å; R86-T89 PolarHBondContact O-N 3.39Å; R86-T90 PolarHBondContact O-N 3.25Å; R86-T90 PolarHBondContact O-OG1 3.18Å
87	A	97.4	Very high	96.5	Very high	6 Å²	6	52.4 Å²	52.4	5%	0.05	30%	0.295	C	S	.	.	H	α-helix	trans	-63.7	-33.5	178	0	0	0	0	0	112.7	A83 I84 T89 T90 L91 Y146	A83-A87 WeakPolarHBondContact O-CB 3.42Å; A83-A87 PolarHBondContact O-N 2.64Å; I84-A87 WeakPolarHBondContact O-CB 3.35Å; I84-A87 PolarHBondContact O-N 3.1Å; A87-T89 VanDerWaalsContact C-N 3.27Å; A87-T89 PolarHBondContact O-N 2.97Å; A87-T90 PolarHBondContact O-N 3.33Å; A87-T90 VanDerWaalsContact O-N 3.14Å; A87-L91 WeakPolarHBondContact O-CB 3.42Å; A87-L91 VanDerWaalsContact O-CG 3.28Å; A87-L91 WeakPolarHBondContact O-CG 3.38Å; A87-L91 PolarHBondContact O-N 3.2Å; A87-Y146 HydrophobicContact CB-CD1 3.46Å; A87-Y146 VanDerWaalsContact CB-CD1 3.46Å; A87-Y146 HydrophobicContact CB-CD2 3.65Å; A87-Y146 HydrophobicContact CB-CE1 3.55Å; A87-Y146 HydrophobicContact CB-CE2 3.74Å; A87-Y146 HydrophobicContact CB-CG 3.5Å
88	M	97.4	Very high	96.1	Very high	2 Å²	2	57.6 Å²	57.6	1%	0.01	33%	0.332	C	S	.	.	H	α-helix	trans	-55	-44.4	174.6	-73.3	178.2	73.8	0	0	111.9	I84 I85 R86 L91 G92 I93 Y95 V136 C139	I84-M88 WeakPolarHBondContact O-CG 3.47Å; I84-M88 PolarHBondContact O-N 2.99Å; I85-M88 HydrophobicContact CD1-SD 3.81Å; I85-M88 WeakPolarHBondContact O-CB 3.22Å; I85-M88 PolarHBondContact O-N 2.79Å; R86-M88 VanDerWaalsContact C-N 3.31Å; R86-M88 PolarHBondContact O-N 3.29Å; M88-L91 PolarHBondContact O-N 2.87Å; M88-G92 PolarHBondContact O-N 3.36Å; M88-I93 HydrophobicContact CB-CB 4.43Å; M88-I93 HydrophobicContact CE-CG2 4.26Å; M88-I93 WeakPolarHBondContact CE-O 3.47Å; M88-I93 HydrophobicContact CG-CB 4.45Å; M88-I93 PolarHBondContact O-N 2.83Å; M88-Y95 HydrophobicContact CE-CD1 3.69Å; M88-Y95 HydrophobicContact CE-CD2 4.41Å; M88-Y95 HydrophobicContact CE-CE1 3.84Å; M88-Y95 HydrophobicContact CE-CG 4.01Å; M88-Y95 HydrophobicContact SD-CD1 4.32Å; M88-Y95 HydrophobicContact SD-CE1 3.91Å; M88-V136 HydrophobicContact CE-CG2 4.19Å; M88-V136 HydrophobicContact SD-CB 4.3Å; M88-V136 HydrophobicContact SD-CG2 3.58Å; M88-V136 VanDerWaalsContact SD-CG2 3.58Å; M88-C139 HydrophobicContact CG-CB 3.48Å; M88-C139 VanDerWaalsContact CG-CB 3.48Å; M88-C139 VanDerWaalsContact CG-SG 3.57Å; M88-C139 PolarHBondContact N-SG 3.41Å; M88-C139 HydrophobicContact SD-CB 4.49Å
89	T	94.2	Very high	95.9	Very high	118 Å²	118	59.3 Å²	59.3	72%	0.724	35%	0.345	S	S	*	.	H	α-helix	trans	-64.4	-45.2	177.5	-56	0	0	0	0	111.2	R86 A87 L91 G92	R86-T89 PolarHBondContact O-N 3.39Å; A87-T89 VanDerWaalsContact C-N 3.27Å; A87-T89 PolarHBondContact O-N 2.97Å; T89-L91 VanDerWaalsContact C-N 3.34Å; T89-L91 PolarHBondContact O-N 3.22Å; T89-G92 PolarHBondContact O-N 2.84Å
90	T	94.6	Very high	95.8	Very high	120 Å²	120	53.5 Å²	53.5	74%	0.736	32%	0.318	S	S	*	.	H	α-helix	trans	-64.7	-37.9	179.3	-54.1	0	0	0	0	112.5	R86 A87	R86-T90 PolarHBondContact O-N 3.25Å; R86-T90 PolarHBondContact O-OG1 3.18Å; A87-T90 PolarHBondContact O-N 3.33Å; A87-T90 VanDerWaalsContact O-N 3.14Å
91	L	96.4	Very high	95.6	Very high	37 Å²	37	54.7 Å²	54.7	19%	0.194	33%	0.328	C	S	.	.	H	α-helix	trans	-88.9	-2.8	-177.3	-62.3	-178.2	0	0	0	113.4	A87 M88 T89 I93 R142 E145 Y146	A87-L91 WeakPolarHBondContact O-CB 3.42Å; A87-L91 VanDerWaalsContact O-CG 3.28Å; A87-L91 WeakPolarHBondContact O-CG 3.38Å; A87-L91 PolarHBondContact O-N 3.2Å; M88-L91 PolarHBondContact O-N 2.87Å; T89-L91 VanDerWaalsContact C-N 3.34Å; T89-L91 PolarHBondContact O-N 3.22Å; L91-I93 HydrophobicContact CB-CD1 3.88Å; L91-I93 HydrophobicContact CB-CG1 3.96Å; L91-I93 HydrophobicContact CD1-CD1 4.12Å; L91-R142 HydrophobicContact CD1-CB 4.11Å; L91-E145 HydrophobicContact CD2-CB 4.27Å; L91-E145 WeakPolarHBondContact CD2-OE2 3.3Å; L91-Y146 HydrophobicContact CD1-CD1 4.04Å; L91-Y146 HydrophobicContact CD1-CE1 4.05Å
92	G	96.5	Very high	95.4	Very high	63 Å²	63	59 Å²	59	65%	0.649	35%	0.351	S	S	*	.	T	Hydrogen-bonded Turn	trans	64.2	37.9	-178.3	0	0	0	0	0	113.4	M88 T89	M88-G92 PolarHBondContact O-N 3.36Å; T89-G92 PolarHBondContact O-N 2.84Å
93	I	97.3	Very high	95.4	Very high	27 Å²	27	58.5 Å²	58.5	14%	0.138	35%	0.349	C	S	.	.	P	Polyproline II helix	trans	-99.6	117.8	179.2	-57.4	172.9	0	0	0	108.7	M88 L91 G135 C139	M88-I93 HydrophobicContact CB-CB 4.43Å; M88-I93 HydrophobicContact CE-CG2 4.26Å; M88-I93 WeakPolarHBondContact CE-O 3.47Å; M88-I93 HydrophobicContact CG-CB 4.45Å; M88-I93 PolarHBondContact O-N 2.83Å; L91-I93 HydrophobicContact CB-CD1 3.88Å; L91-I93 HydrophobicContact CB-CG1 3.96Å; L91-I93 HydrophobicContact CD1-CD1 4.12Å; I93-G135 WeakPolarHBondContact CG2-O 3.46Å; I93-C139 HydrophobicContact CD1-CB 3.78Å
94	D	97	Very high	95.2	Very high	141 Å²	141	57.4 Å²	57.4	75%	0.754	34%	0.34	S	S	*	.	P	Polyproline II helix	trans	-78.1	153.6	175.3	-66.4	-42	0	0	0	111.6	G135	D94-G135 WeakPolarHBondContact O-CA 3.41Å
95	Y	97.1	Very high	95	Very high	57 Å²	57	64.4 Å²	64.4	22%	0.224	37%	0.367	C	S	.	.	P	Polyproline II helix	trans	-63.6	144	167.1	-63.3	-82.4	0	0	0	110.3	I85 M88 E97 C100 A101 L130 V136	I85-Y95 HydrophobicContact CD1-CE1 3.98Å; I85-Y95 WeakPolarHBondContact CG2-OH 3.41Å; M88-Y95 HydrophobicContact CE-CD1 3.69Å; M88-Y95 HydrophobicContact CE-CD2 4.41Å; M88-Y95 HydrophobicContact CE-CE1 3.84Å; M88-Y95 HydrophobicContact CE-CG 4.01Å; M88-Y95 HydrophobicContact SD-CD1 4.32Å; M88-Y95 HydrophobicContact SD-CE1 3.91Å; Y95-E97 WeakPolarHBondContact CB-O 3.49Å; Y95-C100 HydrophobicContact CD1-CB 3.59Å; Y95-C100 HydrophobicContact CE1-CB 4.3Å; Y95-C100 HydrophobicContact CG-CB 4.05Å; Y95-A101 HydrophobicContact CD2-CB 3.87Å; Y95-A101 HydrophobicContact CE2-CB 4.2Å; Y95-L130 HydrophobicContact CD1-CD2 4.46Å; Y95-L130 HydrophobicContact CE1-CD2 3.82Å; Y95-V136 HydrophobicContact CD1-CG2 4.18Å; Y95-V136 HydrophobicContact CE1-CG2 4.1Å
96	A	96	Very high	94.8	Very high	72 Å²	72	66.7 Å²	66.7	60%	0.595	38%	0.377	S	S	*	.	S	Bend	trans	-72.4	-38.1	174.4	0	0	0	0	0	111.2	D133	A96-D133 WeakPolarHBondContact CA-OD2 3.4Å; A96-D133 WeakPolarHBondContact CB-OD2 3.21Å; A96-D133 PolarHBondContact N-OD1 3.36Å; A96-D133 VanDerWaalsContact N-OD1 3.14Å; A96-D133 PolarHBondContact N-OD2 3.23Å
97	E	93.1	Very high	94.8	Very high	117 Å²	117	59.7 Å²	59.7	55%	0.547	35%	0.351	S	S	.	.	S	Bend	trans	-106.6	135.6	175.2	-62.8	-172.4	-178.2	0	0	112.2	Y95 S99 C100 D133	Y95-E97 WeakPolarHBondContact CB-O 3.49Å; E97-S99 VanDerWaalsContact C-N 3.26Å; E97-S99 PolarHBondContact O-N 2.78Å; E97-S99 PolarHBondContact OE2-OG 3.44Å; E97-C100 WeakPolarHBondContact O-CB 3.49Å; E97-C100 PolarHBondContact O-N 2.8Å; E97-D133 PolarHBondContact N-OD2 3.42Å
98	S	89.7	Confident	94.5	Very high	109 Å²	109	61.9 Å²	61.9	76%	0.762	36%	0.362	S	S	*	.	H	α-helix	trans	-63.4	-30.9	179.2	58.6	0	0	0	0	113.4	C100 A101	S98-C100 PolarHBondContact O-N 3.42Å; S98-A101 WeakPolarHBondContact O-CB 3.41Å; S98-A101 PolarHBondContact O-N 2.71Å
99	S	91.9	Very high	94.2	Very high	56 Å²	56	67.3 Å²	67.3	39%	0.392	39%	0.39	S	S	.	.	H	α-helix	trans	-61.1	-32.2	173.5	34.3	0	0	0	0	112.4	E97 A101 D102 D103	E97-S99 VanDerWaalsContact C-N 3.26Å; E97-S99 PolarHBondContact O-N 2.78Å; E97-S99 PolarHBondContact OE2-OG 3.44Å; S99-A101 PolarHBondContact O-N 3.43Å; S99-D102 WeakPolarHBondContact O-CB 3.46Å; S99-D102 PolarHBondContact O-N 2.99Å; S99-D102 VanDerWaalsContact O-N 3.15Å; S99-D103 PolarHBondContact O-N 3.24Å; S99-D103 VanDerWaalsContact O-N 3.16Å
100	C	93.6	Very high	94	Very high	2 Å²	2	62.9 Å²	62.9	1%	0.014	36%	0.362	C	S	.	.	H	α-helix	trans	-69.5	-21.1	178.9	-71.2	0	0	0	0	112.5	Y95 E97 S98 D103 G104 L130 D133	Y95-C100 HydrophobicContact CD1-CB 3.59Å; Y95-C100 HydrophobicContact CE1-CB 4.3Å; Y95-C100 HydrophobicContact CG-CB 4.05Å; E97-C100 WeakPolarHBondContact O-CB 3.49Å; E97-C100 PolarHBondContact O-N 2.8Å; S98-C100 PolarHBondContact O-N 3.42Å; C100-D103 PolarHBondContact O-N 2.91Å; C100-G104 PolarHBondContact O-N 3.3Å; C100-L130 HydrophobicContact CB-CD2 4.14Å; C100-L130 WeakPolarHBondContact O-CD2 3.35Å; C100-D133 HydrophobicContact CB-CB 4.31Å
101	A	92.6	Very high	93.7	Very high	29 Å²	29	58.1 Å²	58.1	24%	0.24	34%	0.335	C	S	.	.	H	α-helix	trans	-67.8	-35.6	172.1	0	0	0	0	0	112.3	Y95 S98 S99 R105	Y95-A101 HydrophobicContact CD2-CB 3.87Å; Y95-A101 HydrophobicContact CE2-CB 4.2Å; S98-A101 WeakPolarHBondContact O-CB 3.41Å; S98-A101 PolarHBondContact O-N 2.71Å; S99-A101 PolarHBondContact O-N 3.43Å; A101-R105 PolarHBondContact O-N 3.14Å
102	D	94.2	Very high	93.2	Very high	90 Å²	90	63.2 Å²	63.2	48%	0.481	36%	0.363	S	S	.	.	H	α-helix	trans	-68.9	-43.6	171.5	-73.3	-48.2	0	0	0	111	S99 G104 R105 Q106	S99-D102 WeakPolarHBondContact O-CB 3.46Å; S99-D102 PolarHBondContact O-N 2.99Å; S99-D102 VanDerWaalsContact O-N 3.15Å; D102-G104 VanDerWaalsContact C-N 3.29Å; D102-G104 PolarHBondContact O-N 3.36Å; D102-R105 WeakPolarHBondContact O-CB 3.3Å; D102-R105 PolarHBondContact O-N 3.07Å; D102-R105 VanDerWaalsContact O-N 3.12Å; D102-R105 IonicContact OD1-CZ 3.64Å; D102-R105 IonicContact OD1-NE 3.87Å; D102-R105 IonicContact OD1-NH2 3.95Å; D102-R105 PolarHBondContact OD1-NH2 2.85Å; D102-Q106 PolarHBondContact O-N 2.94Å
103	D	95.4	Very high	92.6	Very high	6 Å²	6	64.4 Å²	64.4	3%	0.032	36%	0.361	C	S	.	.	H	α-helix	trans	-58.9	-39.9	175.6	-74.3	-28.3	0	0	0	112	S99 C100 R105 Q106 L107 V126 R129 L130	S99-D103 PolarHBondContact O-N 3.24Å; S99-D103 VanDerWaalsContact O-N 3.16Å; C100-D103 PolarHBondContact O-N 2.91Å; D103-R105 VanDerWaalsContact C-N 3.34Å; D103-R105 PolarHBondContact O-N 2.89Å; D103-Q106 PolarHBondContact O-N 3.06Å; D103-L107 WeakPolarHBondContact O-CB 3.27Å; D103-L107 PolarHBondContact O-N 3.08Å; D103-V126 HydrophobicContact CB-CG1 4.12Å; D103-V126 WeakPolarHBondContact O-CG1 3.46Å; D103-R129 IonicContact OD1-CZ 2.63Å; D103-R129 VanDerWaalsContact OD1-CZ 3.28Å; D103-R129 IonicContact OD1-NE 2.78Å; D103-R129 PolarHBondContact OD1-NE 3.26Å; D103-R129 IonicContact OD1-NH2 3.61Å; D103-R129 PolarHBondContact OD1-NH2 3.33Å; D103-R129 VanDerWaalsContact OD2-CB 3.29Å; D103-R129 WeakPolarHBondContact OD2-CB 3.39Å; D103-R129 WeakPolarHBondContact OD2-CD 3.38Å; D103-R129 IonicContact OD2-CZ 2.66Å; D103-R129 IonicContact OD2-NE 3.64Å; D103-R129 PolarHBondContact OD2-NE 3Å; D103-R129 IonicContact OD2-NH2 3.5Å; D103-L130 HydrophobicContact CB-CD1 4.3Å; D103-L130 HydrophobicContact CB-CD2 3.72Å; D103-L130 HydrophobicContact CB-CG 3.82Å
104	G	93.5	Very high	92.2	Very high	2 Å²	2	64.9 Å²	64.9	2%	0.021	36%	0.364	C	S	.	.	H	α-helix	trans	-63.8	-37.2	176.2	0	0	0	0	0	112.8	C100 D102 N108	C100-G104 PolarHBondContact O-N 3.3Å; D102-G104 VanDerWaalsContact C-N 3.29Å; D102-G104 PolarHBondContact O-N 3.36Å; G104-N108 PolarHBondContact O-N 2.87Å; G104-N108 PolarHBondContact O-ND2 2.87Å
105	R	92.9	Very high	91.6	Very high	147 Å²	147	65.4 Å²	65.4	56%	0.555	36%	0.361	S	S	*	.	H	α-helix	trans	-68	-44.7	172.4	-72.7	-173	-78.9	-99.5	6.3	111.4	A101 D102 D103 L107 N108 N109	A101-R105 PolarHBondContact O-N 3.14Å; D102-R105 WeakPolarHBondContact O-CB 3.3Å; D102-R105 PolarHBondContact O-N 3.07Å; D102-R105 VanDerWaalsContact O-N 3.12Å; D102-R105 IonicContact OD1-CZ 3.64Å; D102-R105 IonicContact OD1-NE 3.87Å; D102-R105 IonicContact OD1-NH2 3.95Å; D102-R105 PolarHBondContact OD1-NH2 2.85Å; D103-R105 VanDerWaalsContact C-N 3.34Å; D103-R105 PolarHBondContact O-N 2.89Å; R105-L107 VanDerWaalsContact C-N 3.34Å; R105-L107 PolarHBondContact O-N 3.35Å; R105-N108 PolarHBondContact O-N 2.85Å; R105-N109 PolarHBondContact O-N 3.3Å; R105-N109 PolarHBondContact O-ND2 3.26Å
106	Q	93.8	Very high	90.9	Very high	53 Å²	53	71.8 Å²	71.8	25%	0.248	39%	0.393	C	S	.	.	H	α-helix	trans	-61.7	-42.3	178.6	-171.1	178.6	-7	0	0	111.4	D102 D103 N108 N109 L110 E122 V126	D102-Q106 PolarHBondContact O-N 2.94Å; D103-Q106 PolarHBondContact O-N 3.06Å; Q106-N108 VanDerWaalsContact C-N 3.35Å; Q106-N108 PolarHBondContact O-N 2.86Å; Q106-N109 PolarHBondContact O-N 3.31Å; Q106-L110 HydrophobicContact CG-CD1 3.89Å; Q106-L110 HydrophobicContact CG-CG 4.25Å; Q106-L110 WeakPolarHBondContact O-CB 3.36Å; Q106-L110 WeakPolarHBondContact O-CG 3.44Å; Q106-L110 PolarHBondContact O-N 2.93Å; Q106-E122 PolarHBondContact NE2-OE1 2.9Å; Q106-V126 HydrophobicContact CB-CG2 4.47Å; Q106-V126 VanDerWaalsContact CD-CG2 3.48Å; Q106-V126 HydrophobicContact CG-CG2 4.05Å
107	L	95.1	Very high	90.2	Very high	0 Å²	0	69.3 Å²	69.3	0%	0	38%	0.375	C	S	.	.	H	α-helix	trans	-55.8	-47.7	176.1	178.8	68.6	0	0	0	111.8	L78 I81 L82 I85 D103 R105 L110 A111 L123 V126 I127 L130	L78-L107 HydrophobicContact CD1-CD1 4Å; I81-L107 HydrophobicContact CG1-CD2 3.97Å; I81-L107 HydrophobicContact CG2-CD1 4.17Å; I81-L107 HydrophobicContact CG2-CD2 4.08Å; L82-L107 HydrophobicContact CD2-CD2 3.9Å; L82-L107 HydrophobicContact CD2-CG 3.82Å; L82-L107 HydrophobicContact CG-CD2 4.41Å; I85-L107 HydrophobicContact CG1-CD2 3.85Å; D103-L107 WeakPolarHBondContact O-CB 3.27Å; D103-L107 PolarHBondContact O-N 3.08Å; R105-L107 VanDerWaalsContact C-N 3.34Å; R105-L107 PolarHBondContact O-N 3.35Å; L107-L110 PolarHBondContact O-N 3.31Å; L107-A111 VanDerWaalsContact O-CB 3.28Å; L107-A111 WeakPolarHBondContact O-CB 3.3Å; L107-A111 PolarHBondContact O-N 2.81Å; L107-L123 HydrophobicContact CD1-CD1 3.65Å; L107-V126 HydrophobicContact CB-CG1 3.89Å; L107-V126 HydrophobicContact CD1-CG1 4.44Å; L107-I127 HydrophobicContact CD1-CD1 4.39Å; L107-I127 HydrophobicContact CD1-CG1 3.85Å; L107-L130 HydrophobicContact CB-CD1 4Å; L107-L130 HydrophobicContact CD2-CD1 3.72Å; L107-L130 HydrophobicContact CG-CD1 4.34Å
108	N	92	Very high	90.1	Very high	52 Å²	52	66.1 Å²	66.1	28%	0.278	36%	0.363	S	S	.	.	H	α-helix	trans	-63.3	-43.7	179.3	-75	-65.4	0	0	0	111.5	G104 R105 Q106 A111 D112	G104-N108 PolarHBondContact O-N 2.87Å; G104-N108 PolarHBondContact O-ND2 2.87Å; R105-N108 PolarHBondContact O-N 2.85Å; Q106-N108 VanDerWaalsContact C-N 3.35Å; Q106-N108 PolarHBondContact O-N 2.86Å; N108-A111 PolarHBondContact O-N 2.89Å; N108-D112 PolarHBondContact O-N 3.47Å
109	N	91.1	Very high	90.2	Very high	115 Å²	115	62 Å²	62	62%	0.615	33%	0.332	S	S	*	.	H	α-helix	trans	-65.2	-40.7	178.4	-65.5	-19.9	0	0	0	112.7	R105 Q106 S113	R105-N109 PolarHBondContact O-N 3.3Å; R105-N109 PolarHBondContact O-ND2 3.26Å; Q106-N109 PolarHBondContact O-N 3.31Å; N109-S113 PolarHBondContact O-OG 2.8Å
110	L	90.3	Very high	90.3	Very high	25 Å²	25	61.5 Å²	61.5	13%	0.131	33%	0.328	C	S	.	.	H	α-helix	trans	-66.8	-44.1	176.6	-71.3	174.3	0	0	0	110.6	Q106 L107 D112 S113 I114 E122 L123 V126	Q106-L110 HydrophobicContact CG-CD1 3.89Å; Q106-L110 HydrophobicContact CG-CG 4.25Å; Q106-L110 WeakPolarHBondContact O-CB 3.36Å; Q106-L110 WeakPolarHBondContact O-CG 3.44Å; Q106-L110 PolarHBondContact O-N 2.93Å; L107-L110 PolarHBondContact O-N 3.31Å; L110-D112 PolarHBondContact O-N 3.24Å; L110-D112 VanDerWaalsContact O-N 3.16Å; L110-S113 PolarHBondContact O-N 3.1Å; L110-S113 PolarHBondContact O-OG 2.97Å; L110-S113 VanDerWaalsContact O-OG 3.1Å; L110-I114 WeakPolarHBondContact O-CG2 3.47Å; L110-I114 PolarHBondContact O-N 3.3Å; L110-E122 HydrophobicContact CD1-CG 4.3Å; L110-L123 HydrophobicContact CB-CD1 4.14Å; L110-L123 HydrophobicContact CD1-CB 4.29Å; L110-L123 HydrophobicContact CD1-CD1 4.18Å; L110-V126 HydrophobicContact CD1-CG2 4.41Å
111	A	88	Confident	90.3	Very high	21 Å²	21	66.5 Å²	66.5	17%	0.174	36%	0.36	C	S	.	.	H	α-helix	trans	-56.9	-33.4	-179.5	0	0	0	0	0	113.6	L78 L82 L107 N108 S113	L78-A111 HydrophobicContact CD1-CB 4.25Å; L78-A111 HydrophobicContact CD2-CB 4.4Å; L82-A111 HydrophobicContact CD1-CB 3.72Å; L82-A111 HydrophobicContact CD2-CB 4.02Å; L82-A111 HydrophobicContact CG-CB 4.41Å; L107-A111 VanDerWaalsContact O-CB 3.28Å; L107-A111 WeakPolarHBondContact O-CB 3.3Å; L107-A111 PolarHBondContact O-N 2.81Å; N108-A111 PolarHBondContact O-N 2.89Å; A111-S113 VanDerWaalsContact C-N 3.34Å
112	D	85.8	Confident	90.4	Very high	144 Å²	144	70.4 Å²	70.4	77%	0.77	37%	0.374	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.1	-14.6	178.7	-69.5	-19.8	0	0	0	113.7	N108 L110	N108-D112 PolarHBondContact O-N 3.47Å; L110-D112 PolarHBondContact O-N 3.24Å; L110-D112 VanDerWaalsContact O-N 3.16Å
113	S	85.2	Confident	90.5	Very high	88 Å²	88	66.1 Å²	66.1	62%	0.615	35%	0.351	S	S	*	.	T	Hydrogen-bonded Turn	trans	-115.4	-19.3	-172.1	57	0	0	0	0	114.8	N109 L110 A111	N109-S113 PolarHBondContact O-OG 2.8Å; L110-S113 PolarHBondContact O-N 3.1Å; L110-S113 PolarHBondContact O-OG 2.97Å; L110-S113 VanDerWaalsContact O-OG 3.1Å; A111-S113 VanDerWaalsContact C-N 3.34Å
114	I	87	Confident	90.5	Very high	37 Å²	37	66.5 Å²	66.5	19%	0.19	35%	0.353	C	S	.	.	S	Bend	trans	-72.1	147.1	179.2	61.2	166.5	0	0	0	111.9	L78 L110 P120 L123	L78-I114 HydrophobicContact CD2-CD1 3.35Å; L78-I114 HydrophobicContact CD2-CG1 4.34Å; L110-I114 WeakPolarHBondContact O-CG2 3.47Å; L110-I114 PolarHBondContact O-N 3.3Å; I114-P120 HydrophobicContact CG2-CG 3.89Å; I114-L123 HydrophobicContact CD1-CD2 3.61Å; I114-L123 HydrophobicContact CG2-CD2 4.43Å
115	E	86.3	Confident	90.6	Very high	151 Å²	151	70.4 Å²	70.4	71%	0.706	37%	0.371	S	S	*	.	P	Polyproline II helix	trans	-66.9	135.5	169.6	-174.5	175.4	-172	0	0	110.1	G117 T118	E115-G117 PolarHBondContact O-N 2.99Å; E115-T118 HydrophobicContact CB-CG2 3.95Å; E115-T118 HydrophobicContact CG-CG2 4.28Å; E115-T118 PolarHBondContact O-N 3.46Å; E115-T118 VanDerWaalsContact O-N 3.16Å; E115-T118 PolarHBondContact O-OG1 2.84Å
116	E	81.8	Confident	90.8	Very high	191 Å²	191	63.5 Å²	63.5	89%	0.893	35%	0.345	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.8	132.5	179.6	-171.1	174	-171.5	0	0	110.7
117	G	81.8	Confident	91	Very high	20 Å²	20	61 Å²	61	21%	0.206	33%	0.333	C	S	.	.	T	Hydrogen-bonded Turn	trans	81.5	11.7	-179.7	0	0	0	0	0	115.3	Y74 E115	Y74-G117 VanDerWaalsContact CD2-O 3.31Å; Y74-G117 WeakPolarHBondContact CD2-O 3.44Å; E115-G117 PolarHBondContact O-N 2.99Å
118	T	89.9	Confident	91.2	Very high	51 Å²	51	63.9 Å²	63.9	31%	0.313	34%	0.344	S	S	.	.			trans	-110.4	155.7	173.8	70.1	0	0	0	0	112.4	E115	E115-T118 HydrophobicContact CB-CG2 3.95Å; E115-T118 HydrophobicContact CG-CG2 4.28Å; E115-T118 PolarHBondContact O-N 3.46Å; E115-T118 VanDerWaalsContact O-N 3.16Å; E115-T118 PolarHBondContact O-OG1 2.84Å
119	M	93	Very high	91.4	Very high	22 Å²	22	66.5 Å²	66.5	11%	0.108	35%	0.35	C	S	.	.			trans	-135.8	82.6	174.9	-79.1	-75.1	-89	0	0	109.1	Y74 V77 L123 V124 I127 L159 T163	Y74-M119 HydrophobicContact CD1-CG 3.77Å; Y74-M119 HydrophobicContact CD2-CB 3.82Å; Y74-M119 HydrophobicContact CD2-CG 3.45Å; Y74-M119 VanDerWaalsContact CD2-CG 3.45Å; Y74-M119 HydrophobicContact CE1-CG 4.25Å; Y74-M119 HydrophobicContact CE2-CB 3.84Å; Y74-M119 HydrophobicContact CE2-CG 3.95Å; Y74-M119 HydrophobicContact CG-CB 4.18Å; Y74-M119 HydrophobicContact CG-CG 3.34Å; V77-M119 HydrophobicContact CB-CE 4.37Å; V77-M119 HydrophobicContact CG1-CE 3.73Å; M119-L123 HydrophobicContact SD-CD2 3.75Å; M119-L123 HydrophobicContact SD-CG 4.35Å; M119-V124 HydrophobicContact CB-CG2 4.21Å; M119-V124 HydrophobicContact CE-CG2 4.29Å; M119-I127 HydrophobicContact CE-CD1 3.94Å; M119-I127 HydrophobicContact SD-CD1 4.34Å; M119-L159 HydrophobicContact CE-CD1 3.79Å; M119-T163 HydrophobicContact CB-CG2 4.44Å; M119-T163 HydrophobicContact CE-CG2 3.9Å
120	P	93.6	Very high	91.8	Very high	45 Å²	45	61 Å²	61	29%	0.292	32%	0.321	S	S	.	.			trans	-65.1	148	179.1	25.8	-32.7	0	0	0	110.9	I114 E122 L123 V124	I114-P120 HydrophobicContact CG2-CG 3.89Å; P120-E122 PolarHBondContact O-N 3.13Å; P120-E122 VanDerWaalsContact O-N 3.09Å; P120-L123 HydrophobicContact CG-CB 3.83Å; P120-L123 WeakPolarHBondContact O-CB 2.93Å; P120-L123 PolarHBondContact O-N 3.48Å; P120-V124 PolarHBondContact O-N 3.15Å; P120-V124 VanDerWaalsContact O-N 3.16Å
121	P	93.7	Very high	92.1	Very high	107 Å²	107	60.7 Å²	60.7	70%	0.695	32%	0.318	S	S	*	.	H	α-helix	trans	-53.8	-36.1	-175.6	-28.8	35.3	0	0	0	114.4	L123 V124 E125	P121-L123 PolarHBondContact O-N 2.84Å; P121-V124 WeakPolarHBondContact O-CB 3.42Å; P121-V124 PolarHBondContact O-N 3.18Å; P121-E125 WeakPolarHBondContact O-CG 3.39Å; P121-E125 PolarHBondContact O-N 2.91Å
122	E	94.2	Very high	92.6	Very high	112 Å²	112	66.4 Å²	66.4	52%	0.523	34%	0.338	S	S	.	.	H	α-helix	trans	-60.7	-43.6	176.3	-174.4	-178.1	172.3	0	0	112.4	Q106 L110 P120 E125 V126	Q106-E122 PolarHBondContact NE2-OE1 2.9Å; L110-E122 HydrophobicContact CD1-CG 4.3Å; P120-E122 PolarHBondContact O-N 3.13Å; P120-E122 VanDerWaalsContact O-N 3.09Å; E122-E125 PolarHBondContact O-N 3.34Å; E122-V126 WeakPolarHBondContact O-CG2 3.37Å; E122-V126 PolarHBondContact O-N 2.66Å; E122-V126 VanDerWaalsContact O-N 3.15Å
123	L	95.3	Very high	93.2	Very high	0 Å²	0	59.7 Å²	59.7	0%	0	30%	0.303	C	S	.	.	H	α-helix	trans	-64.8	-42.3	176.7	177.4	63.1	0	0	0	111.1	L78 L107 L110 I114 M119 P120 P121 E125 V126 I127	L78-L123 HydrophobicContact CD1-CD1 4.21Å; L78-L123 HydrophobicContact CD1-CD2 4.34Å; L107-L123 HydrophobicContact CD1-CD1 3.65Å; L110-L123 HydrophobicContact CB-CD1 4.14Å; L110-L123 HydrophobicContact CD1-CB 4.29Å; L110-L123 HydrophobicContact CD1-CD1 4.18Å; I114-L123 HydrophobicContact CD1-CD2 3.61Å; I114-L123 HydrophobicContact CG2-CD2 4.43Å; M119-L123 HydrophobicContact SD-CD2 3.75Å; M119-L123 HydrophobicContact SD-CG 4.35Å; P120-L123 HydrophobicContact CG-CB 3.83Å; P120-L123 WeakPolarHBondContact O-CB 2.93Å; P120-L123 PolarHBondContact O-N 3.48Å; P121-L123 PolarHBondContact O-N 2.84Å; L123-E125 VanDerWaalsContact C-N 3.3Å; L123-E125 PolarHBondContact O-N 3.25Å; L123-V126 PolarHBondContact O-N 2.86Å; L123-I127 HydrophobicContact CD1-CD1 3.92Å; L123-I127 HydrophobicContact CD1-CG1 4.14Å; L123-I127 HydrophobicContact CD2-CD1 4.44Å; L123-I127 HydrophobicContact CG-CD1 3.81Å; L123-I127 HydrophobicContact CG-CG1 4.39Å; L123-I127 VanDerWaalsContact O-CG1 3.27Å; L123-I127 WeakPolarHBondContact O-CG1 3.48Å; L123-I127 PolarHBondContact O-N 3.26Å
124	V	96.2	Very high	93.8	Very high	13 Å²	13	57.6 Å²	57.6	8%	0.079	30%	0.295	C	S	.	.	H	α-helix	trans	-58.1	-45.6	177.7	178.9	0	0	0	0	110.7	M119 P120 P121 V126 I127 R128 L159 T163	M119-V124 HydrophobicContact CB-CG2 4.21Å; M119-V124 HydrophobicContact CE-CG2 4.29Å; P120-V124 PolarHBondContact O-N 3.15Å; P120-V124 VanDerWaalsContact O-N 3.16Å; P121-V124 WeakPolarHBondContact O-CB 3.42Å; P121-V124 PolarHBondContact O-N 3.18Å; V124-V126 PolarHBondContact O-N 3.33Å; V124-I127 PolarHBondContact O-N 3.04Å; V124-R128 VanDerWaalsContact O-CB 3.26Å; V124-R128 WeakPolarHBondContact O-CB 3.49Å; V124-R128 PolarHBondContact O-N 2.86Å; V124-L159 HydrophobicContact CG1-CD2 4.22Å; V124-L159 HydrophobicContact CG1-CG 4.17Å; V124-T163 HydrophobicContact CB-CG2 4.28Å; V124-T163 HydrophobicContact CG1-CG2 3.82Å; V124-T163 HydrophobicContact CG2-CG2 3.45Å; V124-T163 VanDerWaalsContact CG2-CG2 3.45Å
125	E	96.5	Very high	94.3	Very high	85 Å²	85	56.1 Å²	56.1	40%	0.397	29%	0.289	S	S	.	.	H	α-helix	trans	-64.7	-39.6	-179.5	-71.3	-62.7	95.3	0	0	112.6	P121 E122 L123 R128 R129	P121-E125 WeakPolarHBondContact O-CG 3.39Å; P121-E125 PolarHBondContact O-N 2.91Å; E122-E125 PolarHBondContact O-N 3.34Å; L123-E125 VanDerWaalsContact C-N 3.3Å; L123-E125 PolarHBondContact O-N 3.25Å; E125-R128 VanDerWaalsContact CD-NH2 3.31Å; E125-R128 PolarHBondContact O-N 3.16Å; E125-R128 IonicContact OE1-CZ 2.7Å; E125-R128 IonicContact OE1-NE 2.78Å; E125-R128 PolarHBondContact OE1-NE 3.25Å; E125-R128 IonicContact OE1-NH2 3.4Å; E125-R128 IonicContact OE2-CZ 3.72Å; E125-R128 VanDerWaalsContact OE2-CZ 3.24Å; E125-R128 IonicContact OE2-NE 3.13Å; E125-R128 PolarHBondContact OE2-NE 3.08Å; E125-R128 IonicContact OE2-NH2 3.86Å; E125-R128 PolarHBondContact OE2-NH2 2.98Å; E125-R129 WeakPolarHBondContact O-CG 3.46Å; E125-R129 PolarHBondContact O-N 3.4Å
126	V	97.2	Very high	94.9	Very high	1 Å²	1	48.9 Å²	48.9	1%	0.006	26%	0.255	C	S	.	.	H	α-helix	trans	-62.7	-50.5	174.4	169.3	0	0	0	0	110.8	D103 Q106 L107 L110 E122 L123 V124 R128 R129 L130	D103-V126 HydrophobicContact CB-CG1 4.12Å; D103-V126 WeakPolarHBondContact O-CG1 3.46Å; Q106-V126 HydrophobicContact CB-CG2 4.47Å; Q106-V126 VanDerWaalsContact CD-CG2 3.48Å; Q106-V126 HydrophobicContact CG-CG2 4.05Å; L107-V126 HydrophobicContact CB-CG1 3.89Å; L107-V126 HydrophobicContact CD1-CG1 4.44Å; L110-V126 HydrophobicContact CD1-CG2 4.41Å; E122-V126 WeakPolarHBondContact O-CG2 3.37Å; E122-V126 PolarHBondContact O-N 2.66Å; E122-V126 VanDerWaalsContact O-N 3.15Å; L123-V126 PolarHBondContact O-N 2.86Å; V124-V126 PolarHBondContact O-N 3.33Å; V126-R128 VanDerWaalsContact C-N 3.28Å; V126-R128 PolarHBondContact O-N 3.46Å; V126-R129 PolarHBondContact O-N 2.94Å; V126-L130 HydrophobicContact CG1-CD1 3.83Å; V126-L130 HydrophobicContact CG1-CG 4.48Å; V126-L130 WeakPolarHBondContact O-CG 3.33Å; V126-L130 PolarHBondContact O-N 3.48Å
127	I	97.8	Very high	95.7	Very high	0 Å²	0	42.8 Å²	42.8	0%	0	23%	0.227	C	C	.	.	H	α-helix	trans	-60.6	-41.1	178.9	-64.6	173.3	0	0	0	110.5	V77 L78 I81 L107 M119 L123 V124 L130 W131 L156 L159	V77-I127 HydrophobicContact CG1-CD1 4.32Å; L78-I127 HydrophobicContact CD1-CD1 4.5Å; I81-I127 HydrophobicContact CB-CG2 4.35Å; I81-I127 HydrophobicContact CG1-CG2 4.23Å; I81-I127 HydrophobicContact CG2-CD1 4.05Å; I81-I127 HydrophobicContact CG2-CG1 4Å; I81-I127 HydrophobicContact CG2-CG2 4.32Å; L107-I127 HydrophobicContact CD1-CD1 4.39Å; L107-I127 HydrophobicContact CD1-CG1 3.85Å; M119-I127 HydrophobicContact CE-CD1 3.94Å; M119-I127 HydrophobicContact SD-CD1 4.34Å; L123-I127 HydrophobicContact CD1-CD1 3.92Å; L123-I127 HydrophobicContact CD1-CG1 4.14Å; L123-I127 HydrophobicContact CD2-CD1 4.44Å; L123-I127 HydrophobicContact CG-CD1 3.81Å; L123-I127 HydrophobicContact CG-CG1 4.39Å; L123-I127 VanDerWaalsContact O-CG1 3.27Å; L123-I127 WeakPolarHBondContact O-CG1 3.48Å; L123-I127 PolarHBondContact O-N 3.26Å; V124-I127 PolarHBondContact O-N 3.04Å; I127-L130 PolarHBondContact O-N 2.82Å; I127-W131 WeakPolarHBondContact O-CB 3.32Å; I127-W131 PolarHBondContact O-N 3.31Å; I127-L156 HydrophobicContact CG2-CD2 3.76Å; I127-L159 HydrophobicContact CB-CD2 4.06Å; I127-L159 HydrophobicContact CG2-CD1 4.34Å; I127-L159 HydrophobicContact CG2-CD2 3.74Å
128	R	97.8	Very high	96.4	Very high	61 Å²	61	44.1 Å²	44.1	23%	0.23	24%	0.236	C	C	.	.	H	α-helix	trans	-62.7	-41.3	178.7	-174.9	-177.9	57.6	70.1	27.4	112.4	V124 E125 V126 K132 L159	V124-R128 VanDerWaalsContact O-CB 3.26Å; V124-R128 WeakPolarHBondContact O-CB 3.49Å; V124-R128 PolarHBondContact O-N 2.86Å; E125-R128 VanDerWaalsContact CD-NH2 3.31Å; E125-R128 PolarHBondContact O-N 3.16Å; E125-R128 IonicContact OE1-CZ 2.7Å; E125-R128 IonicContact OE1-NE 2.78Å; E125-R128 PolarHBondContact OE1-NE 3.25Å; E125-R128 IonicContact OE1-NH2 3.4Å; E125-R128 IonicContact OE2-CZ 3.72Å; E125-R128 VanDerWaalsContact OE2-CZ 3.24Å; E125-R128 IonicContact OE2-NE 3.13Å; E125-R128 PolarHBondContact OE2-NE 3.08Å; E125-R128 IonicContact OE2-NH2 3.86Å; E125-R128 PolarHBondContact OE2-NH2 2.98Å; V126-R128 VanDerWaalsContact C-N 3.28Å; V126-R128 PolarHBondContact O-N 3.46Å; R128-K132 WeakPolarHBondContact O-CG 3.4Å; R128-K132 PolarHBondContact O-N 3.3Å; R128-L159 HydrophobicContact CB-CD2 3.9Å
129	R	97.7	Very high	96.8	Very high	107 Å²	107	41.7 Å²	41.7	40%	0.404	22%	0.221	S	C	.	.	H	α-helix	trans	-67.8	-48.9	176.2	-73.1	-166.1	-64.3	-129.9	-1.9	111	D103 E125 V126 W131 K132 D133	D103-R129 IonicContact OD1-CZ 2.63Å; D103-R129 VanDerWaalsContact OD1-CZ 3.28Å; D103-R129 IonicContact OD1-NE 2.78Å; D103-R129 PolarHBondContact OD1-NE 3.26Å; D103-R129 IonicContact OD1-NH2 3.61Å; D103-R129 PolarHBondContact OD1-NH2 3.33Å; D103-R129 VanDerWaalsContact OD2-CB 3.29Å; D103-R129 WeakPolarHBondContact OD2-CB 3.39Å; D103-R129 WeakPolarHBondContact OD2-CD 3.38Å; D103-R129 IonicContact OD2-CZ 2.66Å; D103-R129 IonicContact OD2-NE 3.64Å; D103-R129 PolarHBondContact OD2-NE 3Å; D103-R129 IonicContact OD2-NH2 3.5Å; E125-R129 WeakPolarHBondContact O-CG 3.46Å; E125-R129 PolarHBondContact O-N 3.4Å; V126-R129 PolarHBondContact O-N 2.94Å; R129-W131 PolarHBondContact O-N 2.92Å; R129-K132 PolarHBondContact O-N 3.02Å; R129-K132 VanDerWaalsContact O-N 3.13Å; R129-D133 PolarHBondContact O-N 3.21Å
130	L	98.1	Very high	97	Very high	0 Å²	0	42.7 Å²	42.7	0%	0	22%	0.224	C	C	.	.	H	α-helix	trans	-57.7	-46.8	177.5	-70.8	171.9	0	0	0	111.9	I81 I85 Y95 C100 D103 L107 V126 I127 K132 D133 V136	I81-L130 HydrophobicContact CD1-CB 4.29Å; I85-L130 HydrophobicContact CD1-CD1 4.38Å; I85-L130 HydrophobicContact CD1-CD2 4.15Å; I85-L130 HydrophobicContact CG1-CD1 4.38Å; Y95-L130 HydrophobicContact CD1-CD2 4.46Å; Y95-L130 HydrophobicContact CE1-CD2 3.82Å; C100-L130 HydrophobicContact CB-CD2 4.14Å; C100-L130 WeakPolarHBondContact O-CD2 3.35Å; D103-L130 HydrophobicContact CB-CD1 4.3Å; D103-L130 HydrophobicContact CB-CD2 3.72Å; D103-L130 HydrophobicContact CB-CG 3.82Å; L107-L130 HydrophobicContact CB-CD1 4Å; L107-L130 HydrophobicContact CD2-CD1 3.72Å; L107-L130 HydrophobicContact CG-CD1 4.34Å; V126-L130 HydrophobicContact CG1-CD1 3.83Å; V126-L130 HydrophobicContact CG1-CG 4.48Å; V126-L130 WeakPolarHBondContact O-CG 3.33Å; V126-L130 PolarHBondContact O-N 3.48Å; I127-L130 PolarHBondContact O-N 2.82Å; L130-K132 PolarHBondContact O-N 2.97Å; L130-D133 VanDerWaalsContact O-CB 3.28Å; L130-D133 WeakPolarHBondContact O-CB 3.49Å; L130-D133 PolarHBondContact O-N 3.04Å; L130-V136 WeakPolarHBondContact O-CB 3.38Å; L130-V136 WeakPolarHBondContact O-CG1 3.4Å; L130-V136 VanDerWaalsContact O-CG2 3.23Å; L130-V136 WeakPolarHBondContact O-CG2 3.32Å
131	W	98.1	Very high	97.1	Very high	18 Å²	18	46 Å²	46	7%	0.068	24%	0.236	C	C	.	.	H	α-helix	trans	-63.8	-24.9	-178.8	-173.3	-123.4	0	0	0	113.1	I84 I127 R129 V136 Q137 F140 L156 N157	I84-W131 HydrophobicContact CD1-CE3 4.47Å; I84-W131 HydrophobicContact CD1-CZ3 3.87Å; I127-W131 WeakPolarHBondContact O-CB 3.32Å; I127-W131 PolarHBondContact O-N 3.31Å; R129-W131 PolarHBondContact O-N 2.92Å; W131-V136 HydrophobicContact CE3-CG1 4.11Å; W131-Q137 VanDerWaalsContact CZ2-NE2 3.32Å; W131-Q137 VanDerWaalsContact CZ3-NE2 3.3Å; W131-Q137 PolarHBondContact O-NE2 3.44Å; W131-F140 HydrophobicContact CH2-CB 4.11Å; W131-F140 AromaticContact CH2-CD1 3.8Å; W131-F140 HydrophobicContact CH2-CD1 3.8Å; W131-F140 AromaticContact CH2-CD2 3.89Å; W131-F140 HydrophobicContact CH2-CD2 3.89Å; W131-F140 HydrophobicContact CH2-CE1 4.26Å; W131-F140 HydrophobicContact CH2-CE2 4.34Å; W131-F140 AromaticContact CH2-CG 3.62Å; W131-F140 HydrophobicContact CH2-CG 3.62Å; W131-F140 HydrophobicContact CZ3-CB 3.98Å; W131-F140 HydrophobicContact CZ3-CD2 4.17Å; W131-F140 AromaticContact CZ3-CG 3.95Å; W131-F140 HydrophobicContact CZ3-CG 3.95Å; W131-L156 HydrophobicContact CD2-CB 3.69Å; W131-L156 HydrophobicContact CD2-CD1 3.97Å; W131-L156 HydrophobicContact CD2-CG 4.33Å; W131-L156 HydrophobicContact CE3-CB 4.3Å; W131-L156 HydrophobicContact CE3-CD1 3.67Å; W131-L156 HydrophobicContact CE3-CG 4.5Å; W131-L156 HydrophobicContact CG-CB 3.94Å; W131-L156 HydrophobicContact CH2-CD1 4.11Å; W131-L156 HydrophobicContact CZ2-CB 4.01Å; W131-L156 HydrophobicContact CZ2-CD1 4.37Å; W131-L156 HydrophobicContact CZ3-CD1 3.76Å; W131-N157 PolarHBondContact NE1-OD1 3.24Å
132	K	97.6	Very high	97.2	Very high	141 Å²	141	45.3 Å²	45.3	61%	0.613	22%	0.22	S	C	*	.	H	α-helix	trans	-83	-12.8	175.6	-70.6	179.1	-178.2	-175.7	0	113.6	R128 R129 L130	R128-K132 WeakPolarHBondContact O-CG 3.4Å; R128-K132 PolarHBondContact O-N 3.3Å; R129-K132 PolarHBondContact O-N 3.02Å; R129-K132 VanDerWaalsContact O-N 3.13Å; L130-K132 PolarHBondContact O-N 2.97Å
133	D	98.4	Very high	97.3	Very high	3 Å²	3	40.8 Å²	40.8	2%	0.016	20%	0.202	C	C	.	.			trans	-68.2	136.1	-179.1	-178.9	-95.1	0	0	0	111.7	A96 E97 C100 R129 L130 G135 V136 Q137	A96-D133 WeakPolarHBondContact CA-OD2 3.4Å; A96-D133 WeakPolarHBondContact CB-OD2 3.21Å; A96-D133 PolarHBondContact N-OD1 3.36Å; A96-D133 VanDerWaalsContact N-OD1 3.14Å; A96-D133 PolarHBondContact N-OD2 3.23Å; E97-D133 PolarHBondContact N-OD2 3.42Å; C100-D133 HydrophobicContact CB-CB 4.31Å; R129-D133 PolarHBondContact O-N 3.21Å; L130-D133 VanDerWaalsContact O-CB 3.28Å; L130-D133 WeakPolarHBondContact O-CB 3.49Å; L130-D133 PolarHBondContact O-N 3.04Å; D133-G135 VanDerWaalsContact C-N 3.32Å; D133-G135 PolarHBondContact O-N 3.14Å; D133-G135 VanDerWaalsContact OD1-CA 3.24Å; D133-G135 WeakPolarHBondContact OD1-CA 3.33Å; D133-G135 PolarHBondContact OD1-N 3.03Å; D133-V136 HydrophobicContact CB-CB 4.11Å; D133-V136 HydrophobicContact CB-CG2 3.84Å; D133-V136 PolarHBondContact O-N 2.84Å; D133-V136 PolarHBondContact OD1-N 3.19Å; D133-Q137 WeakPolarHBondContact O-CG 3.33Å; D133-Q137 PolarHBondContact O-N 3.05Å
134	G	97.9	Very high	97.2	Very high	44 Å²	44	42.2 Å²	42.2	45%	0.454	21%	0.213	S	C	.	.	H	α-helix	trans	-64.9	-32.8	-178.8	0	0	0	0	0	113.8	A138	G134-A138 WeakPolarHBondContact O-CB 3.49Å; G134-A138 PolarHBondContact O-N 3.27Å
135	G	98	Very high	97.1	Very high	6 Å²	6	46.6 Å²	46.6	6%	0.062	23%	0.233	C	C	.	.	H	α-helix	trans	-70.6	-41.2	175.4	0	0	0	0	0	111.9	I93 D94 D133 A138 C139	I93-G135 WeakPolarHBondContact CG2-O 3.46Å; D94-G135 WeakPolarHBondContact O-CA 3.41Å; D133-G135 VanDerWaalsContact C-N 3.32Å; D133-G135 PolarHBondContact O-N 3.14Å; D133-G135 VanDerWaalsContact OD1-CA 3.24Å; D133-G135 WeakPolarHBondContact OD1-CA 3.33Å; D133-G135 PolarHBondContact OD1-N 3.03Å; G135-A138 PolarHBondContact O-N 3.38Å; G135-C139 WeakPolarHBondContact O-CB 3.47Å; G135-C139 PolarHBondContact O-N 3.06Å
136	V	98.3	Very high	97.1	Very high	0 Å²	0	44.1 Å²	44.1	0%	0	22%	0.22	C	C	.	.	H	α-helix	trans	-61.9	-44.7	173.6	177.1	0	0	0	0	111	I81 I84 I85 M88 Y95 L130 W131 D133 C139 F140	I81-V136 HydrophobicContact CD1-CG1 4.27Å; I84-V136 HydrophobicContact CG2-CG1 3.82Å; I85-V136 HydrophobicContact CD1-CG2 3.75Å; M88-V136 HydrophobicContact CE-CG2 4.19Å; M88-V136 HydrophobicContact SD-CB 4.3Å; M88-V136 HydrophobicContact SD-CG2 3.58Å; M88-V136 VanDerWaalsContact SD-CG2 3.58Å; Y95-V136 HydrophobicContact CD1-CG2 4.18Å; Y95-V136 HydrophobicContact CE1-CG2 4.1Å; L130-V136 WeakPolarHBondContact O-CB 3.38Å; L130-V136 WeakPolarHBondContact O-CG1 3.4Å; L130-V136 VanDerWaalsContact O-CG2 3.23Å; L130-V136 WeakPolarHBondContact O-CG2 3.32Å; W131-V136 HydrophobicContact CE3-CG1 4.11Å; D133-V136 HydrophobicContact CB-CB 4.11Å; D133-V136 HydrophobicContact CB-CG2 3.84Å; D133-V136 PolarHBondContact O-N 2.84Å; D133-V136 PolarHBondContact OD1-N 3.19Å; V136-C139 WeakPolarHBondContact O-CB 3.2Å; V136-C139 PolarHBondContact O-N 2.95Å; V136-F140 PolarHBondContact O-N 3.23Å
137	Q	98.3	Very high	96.9	Very high	63 Å²	63	47.5 Å²	47.5	29%	0.294	24%	0.236	S	C	.	.	H	α-helix	trans	-62.9	-41.9	174.5	-71.5	-61.1	-46.9	0	0	112.2	W131 D133 C139 F140 E141	W131-Q137 VanDerWaalsContact CZ2-NE2 3.32Å; W131-Q137 VanDerWaalsContact CZ3-NE2 3.3Å; W131-Q137 PolarHBondContact O-NE2 3.44Å; D133-Q137 WeakPolarHBondContact O-CG 3.33Å; D133-Q137 PolarHBondContact O-N 3.05Å; Q137-C139 VanDerWaalsContact C-N 3.3Å; Q137-C139 PolarHBondContact O-N 3.12Å; Q137-F140 WeakPolarHBondContact O-CB 3.39Å; Q137-F140 PolarHBondContact O-N 3.38Å; Q137-F140 VanDerWaalsContact O-N 3.16Å; Q137-E141 PolarHBondContact O-N 3.29Å
138	A	97.7	Very high	96.8	Very high	48 Å²	48	48.4 Å²	48.4	40%	0.397	24%	0.241	S	C	.	.	H	α-helix	trans	-62.9	-36.3	175.6	0	0	0	0	0	112.6	G134 G135	G134-A138 WeakPolarHBondContact O-CB 3.49Å; G134-A138 PolarHBondContact O-N 3.27Å; G135-A138 PolarHBondContact O-N 3.38Å
139	C	98.2	Very high	96.6	Very high	0 Å²	0	46.6 Å²	46.6	0%	0	24%	0.235	C	C	.	.	H	α-helix	trans	-67.8	-39.2	172.9	-172.3	0	0	0	0	112	I84 M88 I93 G135 V136 Q137 E141 R142 Y146	I84-C139 HydrophobicContact CG2-CB 4.05Å; I84-C139 PolarHBondContact O-SG 3.49Å; I84-C139 VanDerWaalsContact O-SG 3.37Å; M88-C139 HydrophobicContact CG-CB 3.48Å; M88-C139 VanDerWaalsContact CG-CB 3.48Å; M88-C139 VanDerWaalsContact CG-SG 3.57Å; M88-C139 PolarHBondContact N-SG 3.41Å; M88-C139 HydrophobicContact SD-CB 4.49Å; I93-C139 HydrophobicContact CD1-CB 3.78Å; G135-C139 WeakPolarHBondContact O-CB 3.47Å; G135-C139 PolarHBondContact O-N 3.06Å; V136-C139 WeakPolarHBondContact O-CB 3.2Å; V136-C139 PolarHBondContact O-N 2.95Å; Q137-C139 VanDerWaalsContact C-N 3.3Å; Q137-C139 PolarHBondContact O-N 3.12Å; C139-E141 VanDerWaalsContact C-N 3.35Å; C139-E141 PolarHBondContact O-N 3.22Å; C139-R142 CarbonylContact O-C 3.32Å; C139-R142 PolarHBondContact O-N 3.46Å; C139-R142 VanDerWaalsContact O-N 3.13Å; C139-Y146 WeakPolarHBondContact O-CE1 3.07Å; C139-Y146 PolarHBondContact O-OH 2.86Å
140	F	97.6	Very high	96.3	Very high	42 Å²	42	43.7 Å²	43.7	18%	0.184	23%	0.228	C	C	.	.	H	α-helix	trans	-63.6	-38	175.5	176.9	-102.4	0	0	0	112.5	I84 W131 V136 Q137 R142 A143 L148 A152	I84-F140 HydrophobicContact CD1-CD2 4.03Å; W131-F140 HydrophobicContact CH2-CB 4.11Å; W131-F140 AromaticContact CH2-CD1 3.8Å; W131-F140 HydrophobicContact CH2-CD1 3.8Å; W131-F140 AromaticContact CH2-CD2 3.89Å; W131-F140 HydrophobicContact CH2-CD2 3.89Å; W131-F140 HydrophobicContact CH2-CE1 4.26Å; W131-F140 HydrophobicContact CH2-CE2 4.34Å; W131-F140 AromaticContact CH2-CG 3.62Å; W131-F140 HydrophobicContact CH2-CG 3.62Å; W131-F140 HydrophobicContact CZ3-CB 3.98Å; W131-F140 HydrophobicContact CZ3-CD2 4.17Å; W131-F140 AromaticContact CZ3-CG 3.95Å; W131-F140 HydrophobicContact CZ3-CG 3.95Å; V136-F140 PolarHBondContact O-N 3.23Å; Q137-F140 WeakPolarHBondContact O-CB 3.39Å; Q137-F140 PolarHBondContact O-N 3.38Å; Q137-F140 VanDerWaalsContact O-N 3.16Å; F140-R142 PolarHBondContact O-N 3.11Å; F140-R142 VanDerWaalsContact O-N 3.14Å; F140-A143 WeakPolarHBondContact O-CB 3.48Å; F140-A143 PolarHBondContact O-N 3.12Å; F140-L148 HydrophobicContact CD2-CD2 3.56Å; F140-L148 HydrophobicContact CE2-CD2 3.58Å; F140-A152 HydrophobicContact CE2-CB 4.29Å
141	E	95.6	Very high	96.2	Very high	116 Å²	116	44.2 Å²	44.2	54%	0.542	23%	0.232	S	C	.	.	H	α-helix	trans	-61.7	-20.7	174.2	-74.3	-66.8	159.2	0	0	113.3	Q137 C139 K280	Q137-E141 PolarHBondContact O-N 3.29Å; C139-E141 VanDerWaalsContact C-N 3.35Å; C139-E141 PolarHBondContact O-N 3.22Å; E141-K280 IonicContact OE1-NZ 2.67Å; E141-K280 IonicContact OE2-NZ 3.83Å; E141-K280 PolarHBondContact OE2-NZ 2.88Å
142	R	95.7	Very high	96.2	Very high	91 Å²	91	43.3 Å²	43.3	34%	0.343	23%	0.228	S	C	.	.	T	Hydrogen-bonded Turn	trans	-98.8	19.8	174.7	-65.1	175.8	66.3	-169.5	-0.8	113	L91 C139 F140 A144 E145 Y146	L91-R142 HydrophobicContact CD1-CB 4.11Å; C139-R142 CarbonylContact O-C 3.32Å; C139-R142 PolarHBondContact O-N 3.46Å; C139-R142 VanDerWaalsContact O-N 3.13Å; F140-R142 PolarHBondContact O-N 3.11Å; F140-R142 VanDerWaalsContact O-N 3.14Å; R142-A144 PolarHBondContact O-N 3.04Å; R142-E145 IonicContact CZ-OE1 3.2Å; R142-E145 IonicContact CZ-OE2 3.67Å; R142-E145 IonicContact NE-OE1 3.49Å; R142-E145 PolarHBondContact NE-OE1 2.89Å; R142-E145 IonicContact NE-OE2 3.28Å; R142-E145 IonicContact NH2-OE1 3.24Å; R142-E145 PolarHBondContact NH2-OE1 3.09Å; R142-E145 IonicContact NH2-OE2 3.81Å; R142-E145 PolarHBondContact NH2-OE2 2.76Å; R142-E145 WeakPolarHBondContact O-CB 3.42Å; R142-E145 PolarHBondContact O-N 2.9Å; R142-Y146 WeakPolarHBondContact O-CE1 3.35Å
143	A	95.4	Very high	96.1	Very high	18 Å²	18	38.3 Å²	38.3	15%	0.149	21%	0.211	C	C	.	.	G	3₁₀ helix	trans	-59.4	-12.7	-176.7	0	0	0	0	0	115.7	F140 E145 Y146 L148	F140-A143 WeakPolarHBondContact O-CB 3.48Å; F140-A143 PolarHBondContact O-N 3.12Å; A143-E145 VanDerWaalsContact C-N 3.27Å; A143-Y146 HydrophobicContact CB-CE1 4.49Å; A143-L148 HydrophobicContact CB-CB 4.3Å; A143-L148 HydrophobicContact CB-CD2 3.63Å
144	A	93.5	Very high	96.1	Very high	29 Å²	29	40.1 Å²	40.1	24%	0.24	22%	0.218	C	C	.	.	G	3₁₀ helix	trans	-70.8	-22.6	171.8	0	0	0	0	0	113.2	R142 Y146 D231 M232	R142-A144 PolarHBondContact O-N 3.04Å; A144-Y146 VanDerWaalsContact C-N 3.3Å; A144-Y146 PolarHBondContact O-N 2.67Å; A144-D231 WeakPolarHBondContact CB-OD2 3.05Å; A144-M232 HydrophobicContact CB-CG 4.43Å
145	E	94.4	Very high	96.1	Very high	106 Å²	106	38 Å²	38	50%	0.495	20%	0.196	S	C	.	.	G	3₁₀ helix	trans	-82.8	-5.1	-176.9	-61.6	179.2	-131.5	0	0	113.3	L91 R142 A143	L91-E145 HydrophobicContact CD2-CB 4.27Å; L91-E145 WeakPolarHBondContact CD2-OE2 3.3Å; R142-E145 IonicContact CZ-OE1 3.2Å; R142-E145 IonicContact CZ-OE2 3.67Å; R142-E145 IonicContact NE-OE1 3.49Å; R142-E145 PolarHBondContact NE-OE1 2.89Å; R142-E145 IonicContact NE-OE2 3.28Å; R142-E145 IonicContact NH2-OE1 3.24Å; R142-E145 PolarHBondContact NH2-OE1 3.09Å; R142-E145 IonicContact NH2-OE2 3.81Å; R142-E145 PolarHBondContact NH2-OE2 2.76Å; R142-E145 WeakPolarHBondContact O-CB 3.42Å; R142-E145 PolarHBondContact O-N 2.9Å; A143-E145 VanDerWaalsContact C-N 3.27Å
146	Y	95.5	Very high	96.1	Very high	32 Å²	32	38 Å²	38	13%	0.125	20%	0.195	C	C	.	.	S	Bend	trans	-148.4	173	178.6	58.8	-87	0	0	0	111.7	I84 A87 L91 C139 R142 A143 A144 L148	I84-Y146 HydrophobicContact CG1-CE2 4.38Å; A87-Y146 HydrophobicContact CB-CD1 3.46Å; A87-Y146 VanDerWaalsContact CB-CD1 3.46Å; A87-Y146 HydrophobicContact CB-CD2 3.65Å; A87-Y146 HydrophobicContact CB-CE1 3.55Å; A87-Y146 HydrophobicContact CB-CE2 3.74Å; A87-Y146 HydrophobicContact CB-CG 3.5Å; L91-Y146 HydrophobicContact CD1-CD1 4.04Å; L91-Y146 HydrophobicContact CD1-CE1 4.05Å; C139-Y146 WeakPolarHBondContact O-CE1 3.07Å; C139-Y146 PolarHBondContact O-OH 2.86Å; R142-Y146 WeakPolarHBondContact O-CE1 3.35Å; A143-Y146 HydrophobicContact CB-CE1 4.49Å; A144-Y146 VanDerWaalsContact C-N 3.3Å; A144-Y146 PolarHBondContact O-N 2.67Å; Y146-L148 HydrophobicContact CD2-CB 4.15Å; Y146-L148 HydrophobicContact CE2-CB 3.85Å; Y146-L148 HydrophobicContact CE2-CD1 4.41Å; Y146-L148 HydrophobicContact CE2-CD2 4.15Å; Y146-L148 HydrophobicContact CE2-CG 4.36Å; Y146-L148 PolarHBondContact O-N 3.13Å
147	Q	94.4	Very high	96.1	Very high	73 Å²	73	43 Å²	43	34%	0.341	22%	0.221	S	C	.	.			trans	-84.7	99.7	-176.1	-56.1	-58.6	-30.3	0	0	110.5	V233 L234 V235	Q147-V233 PolarHBondContact NE2-O 3.15Å; Q147-V233 VanDerWaalsContact NE2-O 3.09Å; Q147-L234 PolarHBondContact NE2-O 2.87Å; Q147-V235 HydrophobicContact CG-CG2 4.13Å
148	L	95.7	Very high	96.1	Very high	18 Å²	18	42.6 Å²	42.6	9%	0.094	22%	0.22	C	C	.	.			trans	-123	146.5	175.9	-170.6	62.7	0	0	0	111.5	A83 I84 F140 A143 Y146 A152	A83-L148 HydrophobicContact CB-CD1 3.99Å; I84-L148 HydrophobicContact CD1-CD1 4.34Å; I84-L148 HydrophobicContact CD1-CD2 4.26Å; I84-L148 HydrophobicContact CG1-CD1 3.93Å; I84-L148 HydrophobicContact CG1-CD2 4.01Å; F140-L148 HydrophobicContact CD2-CD2 3.56Å; F140-L148 HydrophobicContact CE2-CD2 3.58Å; A143-L148 HydrophobicContact CB-CB 4.3Å; A143-L148 HydrophobicContact CB-CD2 3.63Å; Y146-L148 HydrophobicContact CD2-CB 4.15Å; Y146-L148 HydrophobicContact CE2-CB 3.85Å; Y146-L148 HydrophobicContact CE2-CD1 4.41Å; Y146-L148 HydrophobicContact CE2-CD2 4.15Å; Y146-L148 HydrophobicContact CE2-CG 4.36Å; Y146-L148 PolarHBondContact O-N 3.13Å; L148-A152 HydrophobicContact CD1-CB 3.99Å; L148-A152 HydrophobicContact CD2-CB 4.01Å; L148-A152 HydrophobicContact CG-CB 3.95Å
149	N	92.3	Very high	96	Very high	23 Å²	23	40.8 Å²	40.8	12%	0.123	20%	0.203	C	C	.	.			trans	-75.3	135.1	174.5	-172.5	16.9	0	0	0	111	S151 A152 R178	N149-S151 PolarHBondContact O-N 2.91Å; N149-S151 VanDerWaalsContact O-N 3.11Å; N149-A152 WeakPolarHBondContact O-CB 3.36Å; N149-A152 PolarHBondContact O-N 3.07Å; N149-R178 WeakPolarHBondContact ND2-CB 3.48Å
150	D	92.6	Very high	95.9	Very high	46 Å²	46	47.6 Å²	47.6	25%	0.246	24%	0.235	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57.5	-30.4	179.3	-60.5	-32.2	0	0	0	113.4	A152 K270 L273	D150-A152 PolarHBondContact O-N 3.2Å; D150-K270 WeakPolarHBondContact OD2-CD 3.3Å; D150-K270 WeakPolarHBondContact OD2-CE 3.42Å; D150-K270 IonicContact OD2-NZ 3.77Å; D150-K270 PolarHBondContact OD2-NZ 2.74Å; D150-L273 HydrophobicContact CB-CD1 3.75Å
151	S	95.4	Very high	95.9	Very high	11 Å²	11	49.7 Å²	49.7	8%	0.077	24%	0.242	C	C	.	.	T	Hydrogen-bonded Turn	trans	-78.5	-0.6	179.4	-56.9	0	0	0	0	113.8	N149 S153 Y154 Y155 R176	N149-S151 PolarHBondContact O-N 2.91Å; N149-S151 VanDerWaalsContact O-N 3.11Å; S151-S153 PolarHBondContact O-N 2.86Å; S151-Y154 PolarHBondContact O-N 3.09Å; S151-Y155 WeakPolarHBondContact O-CD2 3.48Å; S151-Y155 PolarHBondContact O-N 3.39Å; S151-Y155 VanDerWaalsContact O-N 3.15Å; S151-R176 WeakPolarHBondContact CB-O 3.23Å; S151-R176 WeakPolarHBondContact OG-CB 3.47Å; S151-R176 PolarHBondContact OG-O 3.09Å
152	A	97.2	Very high	96	Very high	0 Å²	0	44.2 Å²	44.2	0%	0	22%	0.216	C	C	.	.	H	α-helix	trans	-53.8	-53.6	-176.4	0	0	0	0	0	112.1	F140 L148 N149 D150 Y154 Y155 L156	F140-A152 HydrophobicContact CE2-CB 4.29Å; L148-A152 HydrophobicContact CD1-CB 3.99Å; L148-A152 HydrophobicContact CD2-CB 4.01Å; L148-A152 HydrophobicContact CG-CB 3.95Å; N149-A152 WeakPolarHBondContact O-CB 3.36Å; N149-A152 PolarHBondContact O-N 3.07Å; D150-A152 PolarHBondContact O-N 3.2Å; A152-Y154 VanDerWaalsContact C-N 3.35Å; A152-Y154 PolarHBondContact O-N 2.88Å; A152-Y155 PolarHBondContact O-N 3.31Å; A152-L156 HydrophobicContact CB-CD1 4.49Å; A152-L156 WeakPolarHBondContact O-CB 3.28Å; A152-L156 VanDerWaalsContact O-CG 3.28Å; A152-L156 WeakPolarHBondContact O-CG 3.39Å; A152-L156 PolarHBondContact O-N 3.41Å
153	S	96.8	Very high	96	Very high	36 Å²	36	41.5 Å²	41.5	25%	0.252	21%	0.21	S	C	.	.	H	α-helix	trans	-60.5	-42.8	179.2	-174.2	0	0	0	0	112.3	S151 Y155 L156 N157	S151-S153 PolarHBondContact O-N 2.86Å; S153-Y155 VanDerWaalsContact C-N 3.34Å; S153-Y155 PolarHBondContact O-N 2.76Å; S153-L156 PolarHBondContact O-N 3.46Å; S153-N157 WeakPolarHBondContact O-CB 3.22Å; S153-N157 PolarHBondContact O-N 3.47Å; S153-N157 PolarHBondContact O-ND2 2.99Å; S153-N157 PolarHBondContact OG-ND2 3.17Å; S153-N157 VanDerWaalsContact OG-ND2 3.13Å
154	Y	97.7	Very high	96	Very high	40 Å²	40	44.1 Å²	44.1	16%	0.157	22%	0.221	C	C	.	.	H	α-helix	trans	-57.7	-45.8	-179.6	169	-90.2	0	0	0	112.2	S151 A152 Q158 Q172 D173 R176	S151-Y154 PolarHBondContact O-N 3.09Å; A152-Y154 VanDerWaalsContact C-N 3.35Å; A152-Y154 PolarHBondContact O-N 2.88Å; Y154-Q158 PolarHBondContact O-NE2 3.29Å; Y154-Q158 VanDerWaalsContact O-NE2 3.09Å; Y154-Q172 HydrophobicContact CE2-CG 3.97Å; Y154-D173 WeakPolarHBondContact CE1-OD1 3.41Å; Y154-D173 VanDerWaalsContact CZ-OD1 3.31Å; Y154-D173 PolarHBondContact OH-OD1 3.22Å; Y154-R176 HydrophobicContact CD1-CB 4.32Å; Y154-R176 HydrophobicContact CD1-CG 4.46Å; Y154-R176 HydrophobicContact CE1-CB 4.43Å
155	Y	98.1	Very high	96	Very high	1 Å²	1	48.5 Å²	48.5	0%	0.004	25%	0.247	C	C	.	.	H	α-helix	trans	-78.7	-43.1	-178.9	-65.9	-57.8	0	0	0	112.4	I73 N76 V77 S151 A152 S153 N157 Q158 L159 I162 D173 R176 S177	I73-Y155 HydrophobicContact CG1-CE1 4.26Å; I73-Y155 HydrophobicContact CG2-CD1 3.9Å; I73-Y155 HydrophobicContact CG2-CE1 3.63Å; N76-Y155 HydrophobicContact CB-CE2 4.32Å; V77-Y155 HydrophobicContact CG2-CG 4.22Å; S151-Y155 WeakPolarHBondContact O-CD2 3.48Å; S151-Y155 PolarHBondContact O-N 3.39Å; S151-Y155 VanDerWaalsContact O-N 3.15Å; A152-Y155 PolarHBondContact O-N 3.31Å; S153-Y155 VanDerWaalsContact C-N 3.34Å; S153-Y155 PolarHBondContact O-N 2.76Å; Y155-N157 VanDerWaalsContact C-N 3.28Å; Y155-N157 PolarHBondContact O-N 3.05Å; Y155-Q158 CarbonylContact O-C 3.59Å; Y155-Q158 PolarHBondContact O-N 3.49Å; Y155-L159 PolarHBondContact O-N 2.81Å; Y155-L159 VanDerWaalsContact O-N 3.07Å; Y155-I162 HydrophobicContact CD1-CD1 3.58Å; Y155-I162 HydrophobicContact CG-CD1 4.19Å; Y155-I162 WeakPolarHBondContact O-CD1 3.29Å; Y155-D173 HydrophobicContact CE1-CB 4.33Å; Y155-D173 PolarHBondContact OH-O 2.81Å; Y155-R176 HydrophobicContact CE2-CB 4.4Å; Y155-R176 PolarHBondContact OH-O 3.02Å; Y155-S177 WeakPolarHBondContact OH-CA 3.09Å; Y155-S177 PolarHBondContact OH-N 3.18Å
156	L	98.1	Very high	96.1	Very high	4 Å²	4	51.9 Å²	51.9	2%	0.021	26%	0.263	C	S	.	.	H	α-helix	trans	-64	-34.9	-179.2	-68.7	167.5	0	0	0	112	V77 I81 I84 I127 W131 A152 S153 Q158 L159	V77-L156 HydrophobicContact CG1-CD2 4.13Å; I81-L156 HydrophobicContact CB-CD2 4.2Å; I84-L156 HydrophobicContact CD1-CD1 3.97Å; I127-L156 HydrophobicContact CG2-CD2 3.76Å; W131-L156 HydrophobicContact CD2-CB 3.69Å; W131-L156 HydrophobicContact CD2-CD1 3.97Å; W131-L156 HydrophobicContact CD2-CG 4.33Å; W131-L156 HydrophobicContact CE3-CB 4.3Å; W131-L156 HydrophobicContact CE3-CD1 3.67Å; W131-L156 HydrophobicContact CE3-CG 4.5Å; W131-L156 HydrophobicContact CG-CB 3.94Å; W131-L156 HydrophobicContact CH2-CD1 4.11Å; W131-L156 HydrophobicContact CZ2-CB 4.01Å; W131-L156 HydrophobicContact CZ2-CD1 4.37Å; W131-L156 HydrophobicContact CZ3-CD1 3.76Å; A152-L156 HydrophobicContact CB-CD1 4.49Å; A152-L156 WeakPolarHBondContact O-CB 3.28Å; A152-L156 VanDerWaalsContact O-CG 3.28Å; A152-L156 WeakPolarHBondContact O-CG 3.39Å; A152-L156 PolarHBondContact O-N 3.41Å; S153-L156 PolarHBondContact O-N 3.46Å; L156-Q158 PolarHBondContact O-N 3.11Å; L156-L159 WeakPolarHBondContact O-CB 3.27Å; L156-L159 PolarHBondContact O-N 2.94Å
157	N	98	Very high	96.1	Very high	105 Å²	105	50.9 Å²	50.9	56%	0.561	26%	0.259	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.6	-18.7	173.4	-70	-20.1	0	0	0	113.7	W131 S153 Y155	W131-N157 PolarHBondContact NE1-OD1 3.24Å; S153-N157 WeakPolarHBondContact O-CB 3.22Å; S153-N157 PolarHBondContact O-N 3.47Å; S153-N157 PolarHBondContact O-ND2 2.99Å; S153-N157 PolarHBondContact OG-ND2 3.17Å; S153-N157 VanDerWaalsContact OG-ND2 3.13Å; Y155-N157 VanDerWaalsContact C-N 3.28Å; Y155-N157 PolarHBondContact O-N 3.05Å
158	Q	97.4	Very high	96.2	Very high	56 Å²	56	51.3 Å²	51.3	26%	0.262	26%	0.263	S	S	.	.	T	Hydrogen-bonded Turn	trans	-112.8	21	-179.9	-70.1	-178.9	73.7	0	0	112.4	Y154 Y155 L156 E160 R161 I162	Y154-Q158 PolarHBondContact O-NE2 3.29Å; Y154-Q158 VanDerWaalsContact O-NE2 3.09Å; Y155-Q158 CarbonylContact O-C 3.59Å; Y155-Q158 PolarHBondContact O-N 3.49Å; L156-Q158 PolarHBondContact O-N 3.11Å; Q158-E160 PolarHBondContact O-N 2.86Å; Q158-R161 PolarHBondContact O-N 2.99Å; Q158-R161 VanDerWaalsContact OE1-CZ 3.27Å; Q158-I162 HydrophobicContact CB-CD1 3.99Å; Q158-I162 HydrophobicContact CB-CG1 4.42Å; Q158-I162 WeakPolarHBondContact O-CD1 3.44Å; Q158-I162 WeakPolarHBondContact O-CG1 3.42Å; Q158-I162 PolarHBondContact O-N 3.49Å
159	L	97.3	Very high	96.3	Very high	10 Å²	10	50.6 Å²	50.6	5%	0.052	26%	0.26	C	S	.	.	H	α-helix	trans	-52	-44.8	-174.8	-174.3	65.6	0	0	0	111.5	V77 M119 V124 I127 R128 Y155 L156 R161 I162 T163	V77-L159 HydrophobicContact CG1-CD1 3.92Å; M119-L159 HydrophobicContact CE-CD1 3.79Å; V124-L159 HydrophobicContact CG1-CD2 4.22Å; V124-L159 HydrophobicContact CG1-CG 4.17Å; I127-L159 HydrophobicContact CB-CD2 4.06Å; I127-L159 HydrophobicContact CG2-CD1 4.34Å; I127-L159 HydrophobicContact CG2-CD2 3.74Å; R128-L159 HydrophobicContact CB-CD2 3.9Å; Y155-L159 PolarHBondContact O-N 2.81Å; Y155-L159 VanDerWaalsContact O-N 3.07Å; L156-L159 WeakPolarHBondContact O-CB 3.27Å; L156-L159 PolarHBondContact O-N 2.94Å; L159-R161 PolarHBondContact O-N 3.35Å; L159-I162 PolarHBondContact O-N 3.35Å; L159-I162 VanDerWaalsContact O-N 3.17Å; L159-T163 HydrophobicContact CD1-CG2 3.89Å; L159-T163 HydrophobicContact CG-CG2 4.31Å; L159-T163 WeakPolarHBondContact O-CB 3.36Å; L159-T163 WeakPolarHBondContact O-CG2 3.4Å; L159-T163 PolarHBondContact O-N 2.82Å; L159-T163 PolarHBondContact O-OG1 3.46Å
160	E	96	Very high	96.6	Very high	143 Å²	143	51.7 Å²	51.7	67%	0.668	27%	0.269	S	S	*	.	H	α-helix	trans	-57.1	-46.7	179	-65.2	178.1	-175.3	0	0	112.5	Q158 T163 D164	Q158-E160 PolarHBondContact O-N 2.86Å; E160-T163 PolarHBondContact O-N 3.05Å; E160-T163 PolarHBondContact O-OG1 2.67Å; E160-D164 PolarHBondContact O-N 3.09Å
161	R	97.5	Very high	96.7	Very high	86 Å²	86	53 Å²	53	33%	0.325	27%	0.274	S	S	.	.	H	α-helix	trans	-65.9	-40.6	177.4	-177.3	-176.2	66.8	82.8	2.8	111.7	Q158 L159 T163 Y167 D173	Q158-R161 PolarHBondContact O-N 2.99Å; Q158-R161 VanDerWaalsContact OE1-CZ 3.27Å; L159-R161 PolarHBondContact O-N 3.35Å; R161-T163 VanDerWaalsContact C-N 3.31Å; R161-Y167 WeakPolarHBondContact O-CD2 3.24Å; R161-D173 IonicContact CZ-OD1 3.48Å; R161-D173 IonicContact CZ-OD2 2.73Å; R161-D173 IonicContact NH1-OD1 3.57Å; R161-D173 IonicContact NH1-OD2 3.13Å; R161-D173 PolarHBondContact NH1-OD2 2.88Å; R161-D173 VanDerWaalsContact NH2-CG 3.29Å; R161-D173 IonicContact NH2-OD1 3.28Å; R161-D173 PolarHBondContact NH2-OD1 2.86Å; R161-D173 IonicContact NH2-OD2 3.3Å; R161-D173 PolarHBondContact NH2-OD2 3.24Å; R161-D173 VanDerWaalsContact NH2-OD2 3.13Å
162	I	97.2	Very high	96.8	Very high	0 Å²	0	55.4 Å²	55.4	0%	0	28%	0.284	C	S	.	.	H	α-helix	trans	-70.7	-31.5	-176.2	-68.3	162	0	0	0	110.9	I73 Y74 Y155 Q158 L159 Y167	I73-I162 HydrophobicContact CG2-CG2 4.04Å; Y74-I162 HydrophobicContact CD1-CG2 3.9Å; Y74-I162 HydrophobicContact CE1-CG2 3.64Å; Y74-I162 VanDerWaalsContact CE1-O 3.28Å; Y74-I162 WeakPolarHBondContact CE1-O 3.3Å; Y74-I162 PolarHBondContact OH-O 2.86Å; Y155-I162 HydrophobicContact CD1-CD1 3.58Å; Y155-I162 HydrophobicContact CG-CD1 4.19Å; Y155-I162 WeakPolarHBondContact O-CD1 3.29Å; Q158-I162 HydrophobicContact CB-CD1 3.99Å; Q158-I162 HydrophobicContact CB-CG1 4.42Å; Q158-I162 WeakPolarHBondContact O-CD1 3.44Å; Q158-I162 WeakPolarHBondContact O-CG1 3.42Å; Q158-I162 PolarHBondContact O-N 3.49Å; L159-I162 PolarHBondContact O-N 3.35Å; L159-I162 VanDerWaalsContact O-N 3.17Å; I162-Y167 HydrophobicContact CB-CE1 4.38Å; I162-Y167 HydrophobicContact CG1-CE2 4.44Å; I162-Y167 HydrophobicContact CG2-CD1 4.39Å; I162-Y167 HydrophobicContact CG2-CE1 3.92Å; I162-Y167 WeakPolarHBondContact O-CB 3.33Å; I162-Y167 WeakPolarHBondContact O-CD1 3.38Å
163	T	95.6	Very high	96.9	Very high	35 Å²	35	55.4 Å²	55.4	22%	0.215	28%	0.284	C	S	.	.	T	Hydrogen-bonded Turn	trans	-95.7	4.1	-177.5	59	0	0	0	0	113.4	M119 V124 L159 E160 R161	M119-T163 HydrophobicContact CB-CG2 4.44Å; M119-T163 HydrophobicContact CE-CG2 3.9Å; V124-T163 HydrophobicContact CB-CG2 4.28Å; V124-T163 HydrophobicContact CG1-CG2 3.82Å; V124-T163 HydrophobicContact CG2-CG2 3.45Å; V124-T163 VanDerWaalsContact CG2-CG2 3.45Å; L159-T163 HydrophobicContact CD1-CG2 3.89Å; L159-T163 HydrophobicContact CG-CG2 4.31Å; L159-T163 WeakPolarHBondContact O-CB 3.36Å; L159-T163 WeakPolarHBondContact O-CG2 3.4Å; L159-T163 PolarHBondContact O-N 2.82Å; L159-T163 PolarHBondContact O-OG1 3.46Å; E160-T163 PolarHBondContact O-N 3.05Å; E160-T163 PolarHBondContact O-OG1 2.67Å; R161-T163 VanDerWaalsContact C-N 3.31Å
164	D	96.1	Very high	96.9	Very high	73 Å²	73	53.7 Å²	53.7	39%	0.39	27%	0.272	S	S	.	.	S	Bend	trans	-61	138.9	175	-170.5	-82.9	0	0	0	110.8	E160 E166 Y167	E160-D164 PolarHBondContact O-N 3.09Å; D164-E166 PolarHBondContact O-N 2.62Å; D164-E166 WeakPolarHBondContact OD1-CA 3.5Å; D164-E166 WeakPolarHBondContact OD1-CB 3.42Å; D164-E166 PolarHBondContact OD1-N 2.82Å; D164-Y167 WeakPolarHBondContact O-CB 3.35Å; D164-Y167 PolarHBondContact O-N 3.49Å
165	P	93.1	Very high	96.9	Very high	121 Å²	121	51.9 Å²	51.9	79%	0.786	27%	0.265	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56	-34.1	178.2	-26.9	35.8	0	0	0	113.8	Y167	P165-Y167 VanDerWaalsContact C-N 3.31Å
166	E	95.2	Very high	96.8	Very high	177 Å²	177	54.4 Å²	54.4	83%	0.827	27%	0.274	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.5	9.6	178.5	-57.6	-169.2	133.7	0	0	112.5	D164 L168	D164-E166 PolarHBondContact O-N 2.62Å; D164-E166 WeakPolarHBondContact OD1-CA 3.5Å; D164-E166 WeakPolarHBondContact OD1-CB 3.42Å; D164-E166 PolarHBondContact OD1-N 2.82Å; E166-L168 PolarHBondContact O-N 3.22Å
167	Y	96.5	Very high	96.7	Very high	10 Å²	10	54.5 Å²	54.5	4%	0.039	28%	0.276	C	S	.	.			trans	-56.7	115.6	-180	173	-125.5	0	0	0	112	K70 Y74 R161 I162 D164 P165 P169 D173	K70-Y167 HydrophobicContact CD-CD1 4.28Å; K70-Y167 HydrophobicContact CG-CD1 4.19Å; K70-Y167 HydrophobicContact CG-CE1 4.31Å; K70-Y167 PolarHBondContact NZ-O 2.94Å; Y74-Y167 HydrophobicContact CE1-CD1 4.06Å; Y74-Y167 HydrophobicContact CE1-CE1 4.11Å; R161-Y167 WeakPolarHBondContact O-CD2 3.24Å; I162-Y167 HydrophobicContact CB-CE1 4.38Å; I162-Y167 HydrophobicContact CG1-CE2 4.44Å; I162-Y167 HydrophobicContact CG2-CD1 4.39Å; I162-Y167 HydrophobicContact CG2-CE1 3.92Å; I162-Y167 WeakPolarHBondContact O-CB 3.33Å; I162-Y167 WeakPolarHBondContact O-CD1 3.38Å; D164-Y167 WeakPolarHBondContact O-CB 3.35Å; D164-Y167 PolarHBondContact O-N 3.49Å; P165-Y167 VanDerWaalsContact C-N 3.31Å; Y167-P169 HydrophobicContact CE1-CG 3.81Å; Y167-P169 HydrophobicContact CE2-CG 4.44Å; Y167-D173 PolarHBondContact OH-OD2 3.12Å
168	L	96.7	Very high	96.5	Very high	82 Å²	82	53.2 Å²	53.2	43%	0.429	26%	0.263	S	S	.	.			trans	-109.6	119.2	166.3	-179.8	64.8	0	0	0	108.2	P63 C66 L67 E166 S170	P63-L168 HydrophobicContact CB-CD1 4.46Å; P63-L168 HydrophobicContact CB-CD2 4.17Å; P63-L168 WeakPolarHBondContact O-CD1 3.22Å; C66-L168 HydrophobicContact CB-CD1 4.1Å; L67-L168 HydrophobicContact CD1-CD1 4.43Å; L67-L168 HydrophobicContact CD2-CD1 3.74Å; L67-L168 HydrophobicContact CG-CD1 3.61Å; E166-L168 PolarHBondContact O-N 3.22Å; L168-S170 PolarHBondContact O-N 3.17Å
169	P	98	Very high	96.2	Very high	3 Å²	3	54.2 Å²	54.2	2%	0.019	27%	0.273	C	S	.	.			trans	-54.4	132	175.9	-29.5	38.2	0	0	0	112	C66 K70 I73 Y167 D173	C66-P169 HydrophobicContact CB-CB 4.38Å; C66-P169 VanDerWaalsContact CB-O 3.31Å; C66-P169 WeakPolarHBondContact CB-O 3.45Å; C66-P169 VanDerWaalsContact O-CG 3.25Å; C66-P169 WeakPolarHBondContact O-CG 3.23Å; C66-P169 PolarHBondContact SG-O 2.83Å; C66-P169 VanDerWaalsContact SG-O 3.41Å; K70-P169 HydrophobicContact CB-CG 4.1Å; I73-P169 HydrophobicContact CD1-CB 3.71Å; I73-P169 HydrophobicContact CD1-CG 3.85Å; Y167-P169 HydrophobicContact CE1-CG 3.81Å; Y167-P169 HydrophobicContact CE2-CG 4.44Å; P169-D173 HydrophobicContact CB-CB 4.16Å
170	S	97.4	Very high	95.9	Very high	46 Å²	46	59.3 Å²	59.3	32%	0.322	30%	0.295	S	S	.	.			trans	-79.3	164.2	171	66.5	0	0	0	0	110.8	L168 Q172 D173 V174	L168-S170 PolarHBondContact O-N 3.17Å; S170-Q172 PolarHBondContact O-N 2.86Å; S170-Q172 PolarHBondContact OG-N 3.41Å; S170-D173 WeakPolarHBondContact CB-OD2 3.4Å; S170-D173 PolarHBondContact N-OD2 3.47Å; S170-D173 WeakPolarHBondContact O-CA 3.15Å; S170-D173 WeakPolarHBondContact O-CB 3.2Å; S170-D173 PolarHBondContact O-N 2.81Å; S170-D173 PolarHBondContact OG-N 3.09Å; S170-D173 PolarHBondContact OG-OD2 3.26Å; S170-V174 WeakPolarHBondContact O-CG2 3.44Å; S170-V174 PolarHBondContact O-N 3.27Å
171	E	96.6	Very high	95.6	Very high	74 Å²	74	53.7 Å²	53.7	35%	0.346	27%	0.27	S	S	.	.	H	α-helix	trans	-56.8	-32.4	171.8	-63.7	-170.6	137.5	0	0	112.1	I55 G60 Y61 D173 V174 L175	I55-E171 HydrophobicContact CD1-CB 4.05Å; G60-E171 WeakPolarHBondContact CA-OE1 3.48Å; Y61-E171 HydrophobicContact CD2-CG 4.4Å; Y61-E171 PolarHBondContact N-OE1 3.34Å; E171-D173 VanDerWaalsContact C-N 3.33Å; E171-D173 PolarHBondContact O-N 2.61Å; E171-V174 PolarHBondContact O-N 2.69Å; E171-L175 WeakPolarHBondContact O-CB 3.24Å; E171-L175 VanDerWaalsContact O-CG 3.3Å; E171-L175 WeakPolarHBondContact O-CG 2.99Å; E171-L175 PolarHBondContact O-N 2.67Å
172	Q	97.1	Very high	95.1	Very high	62 Å²	62	54.1 Å²	54.1	29%	0.29	28%	0.282	S	S	.	.	H	α-helix	trans	-66.1	-36.9	175	-166.8	63	42.3	0	0	112.2	Y154 S170 R176 T327	Y154-Q172 HydrophobicContact CE2-CG 3.97Å; S170-Q172 PolarHBondContact O-N 2.86Å; S170-Q172 PolarHBondContact OG-N 3.41Å; Q172-R176 WeakPolarHBondContact O-CB 3.29Å; Q172-R176 WeakPolarHBondContact O-CG 2.98Å; Q172-R176 PolarHBondContact O-N 3.33Å; Q172-R176 VanDerWaalsContact O-N 3.15Å; Q172-T327 PolarHBondContact NE2-O 3.19Å; Q172-T327 PolarHBondContact OE1-O 2.95Å
173	D	97.9	Very high	94.8	Very high	0 Å²	0	54.9 Å²	54.9	0%	0	29%	0.29	C	S	.	.	H	α-helix	trans	-67	-41.4	173.4	-58.4	-44.8	0	0	0	110.8	I73 Y154 Y155 R161 Y167 P169 S170 E171 R176 S177	I73-D173 HydrophobicContact CD1-CB 3.77Å; Y154-D173 WeakPolarHBondContact CE1-OD1 3.41Å; Y154-D173 VanDerWaalsContact CZ-OD1 3.31Å; Y154-D173 PolarHBondContact OH-OD1 3.22Å; Y155-D173 HydrophobicContact CE1-CB 4.33Å; Y155-D173 PolarHBondContact OH-O 2.81Å; R161-D173 IonicContact CZ-OD1 3.48Å; R161-D173 IonicContact CZ-OD2 2.73Å; R161-D173 IonicContact NH1-OD1 3.57Å; R161-D173 IonicContact NH1-OD2 3.13Å; R161-D173 PolarHBondContact NH1-OD2 2.88Å; R161-D173 VanDerWaalsContact NH2-CG 3.29Å; R161-D173 IonicContact NH2-OD1 3.28Å; R161-D173 PolarHBondContact NH2-OD1 2.86Å; R161-D173 IonicContact NH2-OD2 3.3Å; R161-D173 PolarHBondContact NH2-OD2 3.24Å; R161-D173 VanDerWaalsContact NH2-OD2 3.13Å; Y167-D173 PolarHBondContact OH-OD2 3.12Å; P169-D173 HydrophobicContact CB-CB 4.16Å; S170-D173 WeakPolarHBondContact CB-OD2 3.4Å; S170-D173 PolarHBondContact N-OD2 3.47Å; S170-D173 WeakPolarHBondContact O-CA 3.15Å; S170-D173 WeakPolarHBondContact O-CB 3.2Å; S170-D173 PolarHBondContact O-N 2.81Å; S170-D173 PolarHBondContact OG-N 3.09Å; S170-D173 PolarHBondContact OG-OD2 3.26Å; E171-D173 VanDerWaalsContact C-N 3.33Å; E171-D173 PolarHBondContact O-N 2.61Å; D173-R176 PolarHBondContact O-N 2.85Å; D173-S177 WeakPolarHBondContact O-CB 3.44Å; D173-S177 PolarHBondContact O-N 3.23Å
174	V	97.5	Very high	94.6	Very high	0 Å²	0	56.5 Å²	56.5	0%	0	30%	0.297	C	S	.	.	H	α-helix	trans	-63.6	-43.9	176	176	0	0	0	0	111.1	K51 Y61 F69 S170 E171 R176 S177	K51-V174 HydrophobicContact CD-CG1 4.4Å; K51-V174 WeakPolarHBondContact CD-O 3.23Å; K51-V174 PolarHBondContact NZ-O 2.98Å; Y61-V174 HydrophobicContact CD1-CG1 4.29Å; Y61-V174 HydrophobicContact CD2-CG1 4.13Å; Y61-V174 HydrophobicContact CE1-CG1 3.99Å; Y61-V174 HydrophobicContact CE2-CG1 3.81Å; Y61-V174 HydrophobicContact CG-CG1 4.35Å; F69-V174 HydrophobicContact CB-CG2 4.19Å; F69-V174 HydrophobicContact CD1-CG1 4.22Å; F69-V174 HydrophobicContact CD2-CB 4.37Å; F69-V174 HydrophobicContact CD2-CG1 3.87Å; F69-V174 HydrophobicContact CD2-CG2 3.66Å; F69-V174 HydrophobicContact CE1-CG1 4Å; F69-V174 HydrophobicContact CE2-CG1 3.64Å; F69-V174 HydrophobicContact CE2-CG2 4.23Å; F69-V174 HydrophobicContact CG-CB 4.48Å; F69-V174 HydrophobicContact CG-CG1 4.16Å; F69-V174 HydrophobicContact CG-CG2 3.93Å; F69-V174 HydrophobicContact CZ-CG1 3.71Å; S170-V174 WeakPolarHBondContact O-CG2 3.44Å; S170-V174 PolarHBondContact O-N 3.27Å; E171-V174 PolarHBondContact O-N 2.69Å; V174-R176 VanDerWaalsContact C-N 3.31Å; V174-R176 PolarHBondContact O-N 3.09Å; V174-S177 PolarHBondContact O-N 2.79Å; V174-S177 PolarHBondContact O-OG 3.11Å
175	L	97	Very high	94.4	Very high	2 Å²	2	56.8 Å²	56.8	1%	0.01	30%	0.298	C	S	.	.	H	α-helix	trans	-61.9	-39.1	178.1	-77.6	171.7	0	0	0	112.7	T48 K51 Q52 I55 E171 S177	T48-L175 HydrophobicContact CG2-CD2 4.06Å; K51-L175 HydrophobicContact CB-CD2 3.75Å; Q52-L175 HydrophobicContact CG-CD2 3.67Å; Q52-L175 VanDerWaalsContact NE2-CD1 3.33Å; I55-L175 HydrophobicContact CD1-CD1 3.72Å; I55-L175 HydrophobicContact CD1-CD2 3.81Å; I55-L175 HydrophobicContact CD1-CG 3.71Å; E171-L175 WeakPolarHBondContact O-CB 3.24Å; E171-L175 VanDerWaalsContact O-CG 3.3Å; E171-L175 WeakPolarHBondContact O-CG 2.99Å; E171-L175 PolarHBondContact O-N 2.67Å; L175-S177 VanDerWaalsContact C-N 3.34Å
176	R	96.9	Very high	94.5	Very high	53 Å²	53	54.5 Å²	54.5	20%	0.2	28%	0.276	C	S	.	.	H	α-helix	trans	-82.8	-11.8	-179.3	-72.6	-179.5	178.4	-84.7	-3.2	113.5	S151 Y154 Y155 Q172 D173 V174 T327	S151-R176 WeakPolarHBondContact CB-O 3.23Å; S151-R176 WeakPolarHBondContact OG-CB 3.47Å; S151-R176 PolarHBondContact OG-O 3.09Å; Y154-R176 HydrophobicContact CD1-CB 4.32Å; Y154-R176 HydrophobicContact CD1-CG 4.46Å; Y154-R176 HydrophobicContact CE1-CB 4.43Å; Y155-R176 HydrophobicContact CE2-CB 4.4Å; Y155-R176 PolarHBondContact OH-O 3.02Å; Q172-R176 WeakPolarHBondContact O-CB 3.29Å; Q172-R176 WeakPolarHBondContact O-CG 2.98Å; Q172-R176 PolarHBondContact O-N 3.33Å; Q172-R176 VanDerWaalsContact O-N 3.15Å; D173-R176 PolarHBondContact O-N 2.85Å; V174-R176 VanDerWaalsContact C-N 3.31Å; V174-R176 PolarHBondContact O-N 3.09Å; R176-T327 HydrophobicContact CG-CG2 4.15Å; R176-T327 PolarHBondContact NH2-OG1 3.45Å
177	S	96.3	Very high	94.3	Very high	7 Å²	7	47.2 Å²	47.2	5%	0.049	24%	0.244	C	C	.	.			trans	-70.5	136.4	-178.8	75.7	0	0	0	0	110.1	K51 F69 Y155 D173 V174 L175	K51-S177 PolarHBondContact NZ-O 3.27Å; K51-S177 PolarHBondContact NZ-OG 3.47Å; F69-S177 WeakPolarHBondContact CD1-OG 3.35Å; Y155-S177 WeakPolarHBondContact OH-CA 3.09Å; Y155-S177 PolarHBondContact OH-N 3.18Å; D173-S177 WeakPolarHBondContact O-CB 3.44Å; D173-S177 PolarHBondContact O-N 3.23Å; V174-S177 PolarHBondContact O-N 2.79Å; V174-S177 PolarHBondContact O-OG 3.11Å; L175-S177 VanDerWaalsContact C-N 3.34Å
178	R	93.3	Very high	94.2	Very high	77 Å²	77	53.1 Å²	53.1	29%	0.291	27%	0.27	S	S	.	.			trans	-105.9	115.2	-175.9	179.5	-179.5	173.7	123	1.2	109.7	E43 N76 N149	E43-R178 VanDerWaalsContact CG-NH1 3.3Å; E43-R178 IonicContact OE1-CZ 3.54Å; E43-R178 IonicContact OE1-NH1 2.8Å; E43-R178 PolarHBondContact OE1-NH1 3.34Å; E43-R178 IonicContact OE1-NH2 3.41Å; E43-R178 PolarHBondContact OE1-NH2 3.1Å; E43-R178 IonicContact OE2-NH1 2.62Å; E43-R178 PolarHBondContact OE2-NH1 3.07Å; N76-R178 PolarHBondContact ND2-O 3.48Å; N76-R178 VanDerWaalsContact ND2-O 3.08Å; N76-R178 PolarHBondContact OD1-N 2.9Å; N149-R178 WeakPolarHBondContact ND2-CB 3.48Å
179	V	91.8	Very high	94	Very high	78 Å²	78	49.6 Å²	49.6	47%	0.473	25%	0.251	S	S	.	.			trans	-122.1	130	167.7	-176.2	0	0	0	0	107.1	I72 T181	I72-V179 HydrophobicContact CD1-CG2 3.82Å; I72-V179 HydrophobicContact CG1-CG2 4.4Å; I72-V179 HydrophobicContact CG2-CG2 3.68Å; V179-T181 PolarHBondContact O-N 3.36Å
180	K	89.9	Confident	93.6	Very high	117 Å²	117	52.7 Å²	52.7	51%	0.509	27%	0.273	S	S	.	.			trans	-71.5	110	175.4	177.8	179.6	170.6	167.2	0	108.8	T182 Q204	K180-T182 PolarHBondContact O-N 3.42Å; K180-Q204 VanDerWaalsContact CE-CD 3.45Å
181	T	89.2	Confident	93	Very high	25 Å²	25	51.1 Å²	51.1	15%	0.153	26%	0.261	C	S	.	.			trans	-66.3	122.1	175.3	-50.7	0	0	0	0	110.7	S47 V179 I185	S47-T181 PolarHBondContact OG-OG1 3.25Å; V179-T181 PolarHBondContact O-N 3.36Å; T181-I185 HydrophobicContact CG2-CD1 3.84Å; T181-I185 HydrophobicContact CG2-CG1 4.27Å
182	T	88.9	Confident	92.1	Very high	94 Å²	94	53.4 Å²	53.4	58%	0.577	27%	0.27	S	S	*	.			trans	-115.7	134.7	172	57.3	0	0	0	0	109	K180	K180-T182 PolarHBondContact O-N 3.42Å
183	G	89.3	Confident	91.3	Very high	17 Å²	17	58.3 Å²	58.3	18%	0.175	30%	0.298	C	S	.	.	S	Bend	trans	75.6	-146.5	-176.9	0	0	0	0	0	114.1	G202 E207	G183-G202 PolarHBondContact O-N 3.26Å; G183-E207 PolarHBondContact N-OE2 2.71Å
184	I	92	Very high	90.6	Very high	68 Å²	68	60.4 Å²	60.4	35%	0.349	31%	0.309	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	124.1	-173.7	-60.1	156.1	0	0	0	107.2	F199 D200 V201 H213 C214	I184-F199 HydrophobicContact CG2-CD1 4.14Å; I184-D200 WeakPolarHBondContact CA-O 3.31Å; I184-V201 HydrophobicContact CB-CG1 4.41Å; I184-V201 HydrophobicContact CG1-CG1 3.89Å; I184-V201 HydrophobicContact CG2-CG1 4.25Å; I184-H213 HydrophobicContact CD1-CB 4.04Å; I184-C214 WeakPolarHBondContact CD1-SG 3.48Å; I184-C214 WeakPolarHBondContact CG2-SG 3.32Å
185	I	92.4	Very high	90.3	Very high	80 Å²	80	62.8 Å²	62.8	41%	0.41	32%	0.322	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	127.3	175.1	-58.5	178.7	0	0	0	107.8	T181 F199 D200	T181-I185 HydrophobicContact CG2-CD1 3.84Å; T181-I185 HydrophobicContact CG2-CG1 4.27Å; I185-F199 WeakPolarHBondContact O-CA 3.3Å; I185-D200 PolarHBondContact N-O 2.78Å; I185-D200 PolarHBondContact O-N 2.63Å
186	E	93.7	Very high	90.1	Very high	72 Å²	72	62.8 Å²	62.8	34%	0.336	32%	0.322	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	129.9	176.1	-172.9	-174.5	151.2	0	0	110.1	K188 R197 M198 F199	E186-K188 WeakPolarHBondContact OE1-CE 3.41Å; E186-K188 IonicContact OE1-NZ 3.43Å; E186-R197 VanDerWaalsContact CD-NH2 3.27Å; E186-R197 IonicContact OE1-CZ 2.71Å; E186-R197 VanDerWaalsContact OE1-CZ 3.25Å; E186-R197 IonicContact OE1-NE 3.25Å; E186-R197 PolarHBondContact OE1-NE 3.01Å; E186-R197 IonicContact OE1-NH2 3.52Å; E186-R197 PolarHBondContact OE1-NH2 2.84Å; E186-R197 IonicContact OE2-CZ 3.6Å; E186-R197 IonicContact OE2-NE 3.76Å; E186-R197 IonicContact OE2-NH2 2.89Å; E186-R197 PolarHBondContact OE2-NH2 3.02Å; E186-M198 WeakPolarHBondContact CA-O 3.39Å; E186-F199 HydrophobicContact CB-CD1 4.14Å; E186-F199 HydrophobicContact CB-CE1 4.09Å; E186-F199 HydrophobicContact CG-CD1 4.06Å; E186-F199 HydrophobicContact CG-CE1 3.69Å; E186-F199 HydrophobicContact CG-CZ 4.19Å; E186-F199 WeakPolarHBondContact OE2-CE1 3.29Å
187	T	92.9	Very high	90	Very high	24 Å²	24	62.9 Å²	62.9	15%	0.147	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	133.5	173.2	-59.6	0	0	0	0	109.9	V50 F189 M198	V50-T187 HydrophobicContact CG1-CG2 4.29Å; V50-T187 VanDerWaalsContact CG1-OG1 3.28Å; V50-T187 WeakPolarHBondContact CG1-OG1 3.34Å; T187-F189 HydrophobicContact CG2-CD1 4.46Å; T187-M198 PolarHBondContact N-O 3.12Å; T187-M198 PolarHBondContact O-N 2.91Å
188	K	93.6	Very high	89.9	Confident	134 Å²	134	62.5 Å²	62.5	58%	0.583	32%	0.32	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-115.8	125	-176	-60.7	-177.5	178.8	172.4	0	110.4	Q58 E186 F196 R197	Q58-K188 PolarHBondContact NE2-O 2.84Å; E186-K188 WeakPolarHBondContact OE1-CE 3.41Å; E186-K188 IonicContact OE1-NZ 3.43Å; K188-F196 WeakPolarHBondContact CA-O 3.28Å; K188-R197 HydrophobicContact CG-CG 4.24Å
189	F	92.8	Very high	90	Very high	9 Å²	9	60 Å²	60	4%	0.039	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.7	167.9	177.7	59.9	-85.2	0	0	0	110.4	M53 H57 Q58 T187 V191 F196 M198 F336	M53-F189 HydrophobicContact CB-CD1 4.05Å; M53-F189 HydrophobicContact CB-CE1 3.91Å; M53-F189 HydrophobicContact CB-CZ 4.24Å; M53-F189 HydrophobicContact CG-CD1 4.44Å; M53-F189 HydrophobicContact CG-CE1 3.79Å; M53-F189 HydrophobicContact CG-CZ 3.84Å; M53-F189 HydrophobicContact SD-CE1 4.23Å; M53-F189 HydrophobicContact SD-CE2 3.97Å; M53-F189 HydrophobicContact SD-CZ 3.64Å; H57-F189 HydrophobicContact CB-CB 4.14Å; H57-F189 HydrophobicContact CB-CD2 4.01Å; H57-F189 HydrophobicContact CB-CG 4.39Å; H57-F189 AromaticContact CD2-CD2 3.78Å; H57-F189 AromaticContact CD2-CE2 3.89Å; Q58-F189 HydrophobicContact CG-CB 4.11Å; T187-F189 HydrophobicContact CG2-CD1 4.46Å; F189-V191 HydrophobicContact CD2-CG2 3.67Å; F189-V191 HydrophobicContact CE2-CG2 3.72Å; F189-F196 HydrophobicContact CD1-CB 4.21Å; F189-F196 HydrophobicContact CD2-CB 4.03Å; F189-F196 HydrophobicContact CD2-CD2 4.39Å; F189-F196 HydrophobicContact CD2-CG 4.42Å; F189-F196 HydrophobicContact CE1-CB 3.87Å; F189-F196 HydrophobicContact CE2-CB 3.66Å; F189-F196 HydrophobicContact CE2-CD2 4.02Å; F189-F196 AromaticContact CE2-CG 3.82Å; F189-F196 HydrophobicContact CE2-CG 3.82Å; F189-F196 HydrophobicContact CG-CB 4.29Å; F189-F196 HydrophobicContact CZ-CB 3.57Å; F189-F196 HydrophobicContact CZ-CD1 4.45Å; F189-F196 HydrophobicContact CZ-CG 4Å; F189-F196 PolarHBondContact N-O 2.85Å; F189-F196 VanDerWaalsContact N-O 3.13Å; F189-F196 PolarHBondContact O-N 3.35Å; F189-M198 HydrophobicContact CE1-CB 3.93Å; F189-M198 HydrophobicContact CE1-CE 4.06Å; F189-M198 HydrophobicContact CE1-SD 4.47Å; F189-M198 HydrophobicContact CZ-CE 3.97Å; F189-F336 AromaticContact CE2-CE1 3.75Å; F189-F336 HydrophobicContact CE2-CE1 3.75Å; F189-F336 AromaticContact CE2-CZ 3.67Å; F189-F336 HydrophobicContact CE2-CZ 3.67Å; F189-F336 HydrophobicContact CZ-CE1 4.13Å; F189-F336 HydrophobicContact CZ-CE2 4.27Å; F189-F336 AromaticContact CZ-CZ 3.56Å; F189-F336 HydrophobicContact CZ-CZ 3.56Å
190	S	88.6	Confident	90.1	Very high	68 Å²	68	56.4 Å²	56.4	48%	0.476	29%	0.289	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	136.2	-177.9	-57.4	0	0	0	0	110.9	L194 N195	S190-L194 CarbonylContact C-O 3.48Å; S190-L194 WeakPolarHBondContact CA-O 3.48Å; S190-N195 PolarHBondContact OG-OD1 2.89Å
191	V	85.4	Confident	90.3	Very high	12 Å²	12	50.9 Å²	50.9	7%	0.073	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.8	126.1	178.7	-171.7	0	0	0	0	108.7	F189 D193 L194 F196 F336	F189-V191 HydrophobicContact CD2-CG2 3.67Å; F189-V191 HydrophobicContact CE2-CG2 3.72Å; V191-D193 VanDerWaalsContact C-N 3.29Å; V191-D193 PolarHBondContact O-N 2.81Å; V191-L194 PolarHBondContact N-O 3.33Å; V191-L194 WeakPolarHBondContact O-CB 3.35Å; V191-L194 PolarHBondContact O-N 3.26Å; V191-F196 HydrophobicContact CB-CD2 4.22Å; V191-F196 HydrophobicContact CB-CE2 3.78Å; V191-F196 HydrophobicContact CG2-CD2 4.08Å; V191-F196 HydrophobicContact CG2-CE2 4.06Å; V191-F336 HydrophobicContact CG2-CE1 4.24Å
192	K	77.4	Confident	90.5	Very high	123 Å²	123	49.8 Å²	49.8	54%	0.535	26%	0.259	S	S	.	.	T	Hydrogen-bonded Turn	trans	45.5	50.9	178.4	-59.3	175.8	-171.9	174.4	0	112.6	L194 D341	K192-L194 PolarHBondContact O-N 3.24Å; K192-L194 VanDerWaalsContact O-N 3.14Å; K192-D341 IonicContact NZ-OD1 2.67Å; K192-D341 PolarHBondContact NZ-OD1 3.33Å
193	D	79.8	Confident	90.5	Very high	165 Å²	165	45.6 Å²	45.6	88%	0.882	24%	0.235	S	C	*	.	T	Hydrogen-bonded Turn	trans	66.2	1.1	-177.6	-54.8	-45.3	0	0	0	117.2	V191	V191-D193 VanDerWaalsContact C-N 3.29Å; V191-D193 PolarHBondContact O-N 2.81Å
194	L	84.7	Confident	90.5	Very high	43 Å²	43	46.3 Å²	46.3	23%	0.225	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.6	139.7	172.6	-63.8	171.7	0	0	0	110.8	S190 V191 K192 F196 I344	S190-L194 CarbonylContact C-O 3.48Å; S190-L194 WeakPolarHBondContact CA-O 3.48Å; V191-L194 PolarHBondContact N-O 3.33Å; V191-L194 WeakPolarHBondContact O-CB 3.35Å; V191-L194 PolarHBondContact O-N 3.26Å; K192-L194 PolarHBondContact O-N 3.24Å; K192-L194 VanDerWaalsContact O-N 3.14Å; L194-F196 HydrophobicContact CB-CD2 4.33Å; L194-F196 HydrophobicContact CB-CE2 3.65Å; L194-F196 HydrophobicContact CB-CZ 4.27Å; L194-F196 HydrophobicContact CD1-CZ 4.44Å; L194-I344 HydrophobicContact CD1-CD1 3.66Å; L194-I344 HydrophobicContact CD1-CG1 3.48Å; L194-I344 VanDerWaalsContact CD1-CG1 3.48Å
195	N	90.3	Very high	90.5	Very high	50 Å²	50	47.4 Å²	47.4	27%	0.267	23%	0.233	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.4	127.1	173.8	-62.4	-56.5	0	0	0	109.2	T33 V34 S190	T33-N195 CarbonylContact C-O 3.43Å; T33-N195 WeakPolarHBondContact CA-O 3.37Å; V34-N195 PolarHBondContact N-O 3.42Å; S190-N195 PolarHBondContact OG-OD1 2.89Å
196	F	92.9	Very high	90.3	Very high	3 Å²	3	47.2 Å²	47.2	1%	0.013	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	138.8	177.8	-70.4	-96.2	0	0	0	110.4	V34 L36 K188 F189 V191 L194 F336 T340	V34-F196 HydrophobicContact CB-CD1 3.71Å; V34-F196 HydrophobicContact CB-CE1 3.78Å; V34-F196 HydrophobicContact CB-CG 4.34Å; V34-F196 HydrophobicContact CB-CZ 4.44Å; V34-F196 HydrophobicContact CG1-CD1 3.68Å; V34-F196 HydrophobicContact CG1-CE1 3.58Å; V34-F196 HydrophobicContact CG2-CE1 4.21Å; V34-F196 HydrophobicContact CG2-CZ 4.44Å; V34-F196 CarbonylContact O-C 3.56Å; V34-F196 WeakPolarHBondContact O-CA 3.39Å; L36-F196 HydrophobicContact CD1-CD1 3.64Å; L36-F196 HydrophobicContact CD1-CE1 4.18Å; L36-F196 HydrophobicContact CD2-CD1 4.49Å; L36-F196 HydrophobicContact CG-CD1 3.98Å; K188-F196 WeakPolarHBondContact CA-O 3.28Å; F189-F196 HydrophobicContact CD1-CB 4.21Å; F189-F196 HydrophobicContact CD2-CB 4.03Å; F189-F196 HydrophobicContact CD2-CD2 4.39Å; F189-F196 HydrophobicContact CD2-CG 4.42Å; F189-F196 HydrophobicContact CE1-CB 3.87Å; F189-F196 HydrophobicContact CE2-CB 3.66Å; F189-F196 HydrophobicContact CE2-CD2 4.02Å; F189-F196 AromaticContact CE2-CG 3.82Å; F189-F196 HydrophobicContact CE2-CG 3.82Å; F189-F196 HydrophobicContact CG-CB 4.29Å; F189-F196 HydrophobicContact CZ-CB 3.57Å; F189-F196 HydrophobicContact CZ-CD1 4.45Å; F189-F196 HydrophobicContact CZ-CG 4Å; F189-F196 PolarHBondContact N-O 2.85Å; F189-F196 VanDerWaalsContact N-O 3.13Å; F189-F196 PolarHBondContact O-N 3.35Å; V191-F196 HydrophobicContact CB-CD2 4.22Å; V191-F196 HydrophobicContact CB-CE2 3.78Å; V191-F196 HydrophobicContact CG2-CD2 4.08Å; V191-F196 HydrophobicContact CG2-CE2 4.06Å; L194-F196 HydrophobicContact CB-CD2 4.33Å; L194-F196 HydrophobicContact CB-CE2 3.65Å; L194-F196 HydrophobicContact CB-CZ 4.27Å; L194-F196 HydrophobicContact CD1-CZ 4.44Å; F196-F336 HydrophobicContact CD1-CZ 4.36Å; F196-F336 HydrophobicContact CE1-CZ 4.36Å; F196-T340 HydrophobicContact CZ-CG2 4.04Å
197	R	94.3	Very high	90.2	Very high	54 Å²	54	44.7 Å²	44.7	20%	0.204	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	110	165.8	-70	175.1	72.5	-177.4	1.5	107.5	E30 T33 V34 K35 L36 E186 K188 F199	E30-R197 IonicContact OE1-NH1 2.75Å; T33-R197 HydrophobicContact CG2-CB 4.16Å; T33-R197 VanDerWaalsContact CG2-CD 3.44Å; T33-R197 HydrophobicContact CG2-CG 3.5Å; T33-R197 VanDerWaalsContact CG2-CG 3.5Å; V34-R197 PolarHBondContact O-N 3.33Å; K35-R197 CarbonylContact C-O 3.46Å; K35-R197 WeakPolarHBondContact CA-O 3.48Å; K35-R197 HydrophobicContact CG-CB 4.46Å; L36-R197 PolarHBondContact N-O 3.41Å; E186-R197 VanDerWaalsContact CD-NH2 3.27Å; E186-R197 IonicContact OE1-CZ 2.71Å; E186-R197 VanDerWaalsContact OE1-CZ 3.25Å; E186-R197 IonicContact OE1-NE 3.25Å; E186-R197 PolarHBondContact OE1-NE 3.01Å; E186-R197 IonicContact OE1-NH2 3.52Å; E186-R197 PolarHBondContact OE1-NH2 2.84Å; E186-R197 IonicContact OE2-CZ 3.6Å; E186-R197 IonicContact OE2-NE 3.76Å; E186-R197 IonicContact OE2-NH2 2.89Å; E186-R197 PolarHBondContact OE2-NH2 3.02Å; K188-R197 HydrophobicContact CG-CG 4.24Å; R197-F199 HydrophobicContact CB-CE2 3.95Å; R197-F199 HydrophobicContact CB-CZ 4.2Å
198	M	94.7	Very high	90.2	Very high	0 Å²	0	45.9 Å²	45.9	0%	0	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	125.6	178.7	-176.3	177.2	-76.3	0	0	109.8	L36 L38 V50 M53 E186 T187 F189 I222 F336	L36-M198 HydrophobicContact CB-CB 4.43Å; L36-M198 HydrophobicContact CB-CG 4.43Å; L36-M198 HydrophobicContact CD1-CE 3.75Å; L36-M198 CarbonylContact O-C 3.56Å; L36-M198 WeakPolarHBondContact O-CA 3.45Å; L38-M198 HydrophobicContact CD1-CG 3.62Å; L38-M198 HydrophobicContact CD1-SD 3.49Å; L38-M198 WeakPolarHBondContact CD1-SD 3.3Å; L38-M198 HydrophobicContact CG-CG 4.12Å; L38-M198 HydrophobicContact CG-SD 4.23Å; V50-M198 HydrophobicContact CG2-SD 4.08Å; M53-M198 HydrophobicContact CG-CE 3.61Å; M53-M198 HydrophobicContact CG-SD 3.76Å; M53-M198 HydrophobicContact SD-CE 3.95Å; E186-M198 WeakPolarHBondContact CA-O 3.39Å; T187-M198 PolarHBondContact N-O 3.12Å; T187-M198 PolarHBondContact O-N 2.91Å; F189-M198 HydrophobicContact CE1-CB 3.93Å; F189-M198 HydrophobicContact CE1-CE 4.06Å; F189-M198 HydrophobicContact CE1-SD 4.47Å; F189-M198 HydrophobicContact CZ-CE 3.97Å; M198-I222 HydrophobicContact CE-CD1 4.36Å; M198-F336 HydrophobicContact CE-CE2 3.82Å; M198-F336 HydrophobicContact CE-CZ 4.44Å
199	F	95.2	Very high	90	Very high	23 Å²	23	48.4 Å²	48.4	10%	0.101	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	113.2	179.2	-60.9	-86.3	0	0	0	109.5	K35 L36 L37 L38 I184 I185 E186 R197	K35-F199 HydrophobicContact CB-CE2 4.25Å; K35-F199 HydrophobicContact CG-CE2 4.27Å; L36-F199 PolarHBondContact O-N 2.76Å; L37-F199 HydrophobicContact CD1-CB 3.87Å; L38-F199 WeakPolarHBondContact CB-O 3.28Å; L38-F199 PolarHBondContact N-O 3.06Å; I184-F199 HydrophobicContact CG2-CD1 4.14Å; I185-F199 WeakPolarHBondContact O-CA 3.3Å; E186-F199 HydrophobicContact CB-CD1 4.14Å; E186-F199 HydrophobicContact CB-CE1 4.09Å; E186-F199 HydrophobicContact CG-CD1 4.06Å; E186-F199 HydrophobicContact CG-CE1 3.69Å; E186-F199 HydrophobicContact CG-CZ 4.19Å; E186-F199 WeakPolarHBondContact OE2-CE1 3.29Å; R197-F199 HydrophobicContact CB-CE2 3.95Å; R197-F199 HydrophobicContact CB-CZ 4.2Å
200	D	95	Very high	89.9	Confident	4 Å²	4	51.7 Å²	51.7	2%	0.021	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.6	124.2	170.9	-178.4	31.8	0	0	0	110.1	L38 K46 S47 V50 I184 I185	L38-D200 HydrophobicContact CD1-CB 4.19Å; K46-D200 VanDerWaalsContact CB-OD1 3.28Å; K46-D200 WeakPolarHBondContact CB-OD1 3.5Å; S47-D200 WeakPolarHBondContact CA-OD2 3.28Å; S47-D200 WeakPolarHBondContact CB-OD2 3.43Å; S47-D200 PolarHBondContact OG-OD2 3.34Å; V50-D200 HydrophobicContact CG2-CB 3.55Å; I184-D200 WeakPolarHBondContact CA-O 3.31Å; I185-D200 PolarHBondContact N-O 2.78Å; I185-D200 PolarHBondContact O-N 2.63Å
201	V	94.4	Very high	90	Very high	1 Å²	1	48.9 Å²	48.9	1%	0.006	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	145.3	-177.1	-60.1	0	0	0	0	110.3	L37 L38 L39 K46 I184 G203 W211	L37-V201 HydrophobicContact CD1-CG1 4.26Å; L38-V201 WeakPolarHBondContact O-CG2 3.46Å; L39-V201 HydrophobicContact CD2-CG2 3.68Å; K46-V201 WeakPolarHBondContact CE-O 3.42Å; I184-V201 HydrophobicContact CB-CG1 4.41Å; I184-V201 HydrophobicContact CG1-CG1 3.89Å; I184-V201 HydrophobicContact CG2-CG1 4.25Å; V201-G203 PolarHBondContact O-N 2.88Å; V201-W211 HydrophobicContact CB-CG 4.48Å; V201-W211 VanDerWaalsContact CG2-CD1 3.45Å; V201-W211 HydrophobicContact CG2-CD2 4.13Å; V201-W211 HydrophobicContact CG2-CG 3.99Å; V201-W211 HydrophobicContact CG2-CZ2 4.35Å; V201-W211 VanDerWaalsContact CG2-NE1 3.26Å
202	G	92.5	Very high	90	Very high	2 Å²	2	52.2 Å²	52.2	2%	0.021	25%	0.25	C	C	.	.			trans	-53.8	127	176.1	0	0	0	0	0	112	G183 E207 W211	G183-G202 PolarHBondContact O-N 3.26Å; G202-E207 WeakPolarHBondContact O-CB 3.3Å; G202-W211 PolarHBondContact O-NE1 3.21Å
203	G	89.6	Confident	90.5	Very high	6 Å²	6	53.5 Å²	53.5	6%	0.062	26%	0.257	C	S	.	.			trans	-82.2	-17.1	-176.1	0	0	0	0	0	115.5	G40 G42 V201 R208	G40-G203 VanDerWaalsContact O-CA 3.32Å; G40-G203 WeakPolarHBondContact O-CA 3.18Å; G42-G203 PolarHBondContact N-O 2.88Å; V201-G203 PolarHBondContact O-N 2.88Å; G203-R208 PolarHBondContact O-NE 3.22Å
204	Q	88.6	Confident	90.9	Very high	32 Å²	32	46.2 Å²	46.2	15%	0.15	22%	0.219	C	C	.	.	S	Bend	trans	-70.2	152.4	-176.2	-67.8	-174.9	4.3	0	0	111.4	K180 S206 E207 R208 E236	K180-Q204 VanDerWaalsContact CE-CD 3.45Å; Q204-S206 PolarHBondContact O-N 3.12Å; Q204-S206 VanDerWaalsContact O-N 3.13Å; Q204-E207 PolarHBondContact O-N 3.23Å; Q204-R208 VanDerWaalsContact O-CG 3.31Å; Q204-R208 WeakPolarHBondContact O-CG 2.77Å; Q204-R208 PolarHBondContact O-N 3.34Å; Q204-E236 WeakPolarHBondContact CA-OE1 3.49Å; Q204-E236 WeakPolarHBondContact CB-OE1 3.2Å
205	R	91.5	Very high	91	Very high	90 Å²	90	45.3 Å²	45.3	34%	0.34	21%	0.213	S	C	.	.	T	Hydrogen-bonded Turn	trans	-53.4	-38.9	-176	-74.9	-178.5	172.2	172.4	-1.4	112.6	E207 R208 E236 D237 E245	R205-E207 VanDerWaalsContact C-N 3.28Å; R205-E207 PolarHBondContact O-N 2.65Å; R205-R208 PolarHBondContact O-N 2.63Å; R205-E236 PolarHBondContact N-OE1 2.88Å; R205-E236 VanDerWaalsContact N-OE1 3.14Å; R205-D237 IonicContact CZ-OD2 2.81Å; R205-D237 IonicContact NH1-OD2 3.21Å; R205-D237 PolarHBondContact NH1-OD2 2.75Å; R205-E245 IonicContact CZ-OE2 2.61Å; R205-E245 IonicContact NE-OE1 3.51Å; R205-E245 PolarHBondContact NE-OE1 3.03Å; R205-E245 IonicContact NE-OE2 2.72Å; R205-E245 IonicContact NH2-OE1 2.61Å; R205-E245 IonicContact NH2-OE2 2.84Å; R205-E245 PolarHBondContact NH2-OE2 3.38Å
206	S	89.1	Confident	90.7	Very high	76 Å²	76	51.6 Å²	51.6	53%	0.531	24%	0.241	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.4	-28.3	178.7	63	0	0	0	0	114.1	Q204	Q204-S206 PolarHBondContact O-N 3.12Å; Q204-S206 VanDerWaalsContact O-N 3.13Å
207	E	92.4	Very high	90.3	Very high	19 Å²	19	54 Å²	54	9%	0.089	27%	0.267	C	S	.	.	T	Hydrogen-bonded Turn	trans	-88.6	-19.5	-174.9	-64	-59.3	111	0	0	112.6	G183 G202 Q204 R205 K209 K210	G183-E207 PolarHBondContact N-OE2 2.71Å; G202-E207 WeakPolarHBondContact O-CB 3.3Å; Q204-E207 PolarHBondContact O-N 3.23Å; R205-E207 VanDerWaalsContact C-N 3.28Å; R205-E207 PolarHBondContact O-N 2.65Å; E207-K209 PolarHBondContact O-N 3Å; E207-K209 VanDerWaalsContact O-N 3.15Å; E207-K210 VanDerWaalsContact CD-NZ 3.33Å; E207-K210 WeakPolarHBondContact O-CB 3.43Å; E207-K210 PolarHBondContact O-N 3.4Å; E207-K210 IonicContact OE1-NZ 2.6Å; E207-K210 PolarHBondContact OE1-NZ 3.26Å; E207-K210 IonicContact OE2-NZ 2.81Å; E207-K210 PolarHBondContact OE2-NZ 2.6Å
208	R	91.6	Very high	90.1	Very high	50 Å²	50	52.2 Å²	52.2	19%	0.189	26%	0.262	C	S	.	.	G	3₁₀ helix	trans	-63.7	-25.5	-171.7	-52.8	-166.3	-171.3	151.3	2.2	114.6	G203 Q204 R205 K210 W211 E245	G203-R208 PolarHBondContact O-NE 3.22Å; Q204-R208 VanDerWaalsContact O-CG 3.31Å; Q204-R208 WeakPolarHBondContact O-CG 2.77Å; Q204-R208 PolarHBondContact O-N 3.34Å; R205-R208 PolarHBondContact O-N 2.63Å; R208-K210 PolarHBondContact O-N 2.85Å; R208-K210 VanDerWaalsContact O-N 3.16Å; R208-W211 HydrophobicContact CB-CD2 4.11Å; R208-W211 HydrophobicContact CB-CE3 4.45Å; R208-W211 HydrophobicContact CB-CZ2 4.27Å; R208-W211 HydrophobicContact CG-CD2 4.38Å; R208-W211 HydrophobicContact CG-CH2 3.99Å; R208-W211 HydrophobicContact CG-CZ2 3.63Å; R208-W211 WeakPolarHBondContact O-CB 3.46Å; R208-W211 VanDerWaalsContact O-CG 3.3Å; R208-W211 PolarHBondContact O-N 3.25Å; R208-W211 VanDerWaalsContact O-N 3.12Å; R208-E245 IonicContact CZ-OE1 2.69Å; R208-E245 IonicContact NH1-OE1 2.96Å; R208-E245 PolarHBondContact NH1-OE1 3.24Å; R208-E245 IonicContact NH2-OE1 3.56Å; R208-E245 PolarHBondContact NH2-OE1 3.41Å
209	K	88.8	Confident	89.9	Confident	187 Å²	187	54 Å²	54	81%	0.813	27%	0.273	S	S	*	.	G	3₁₀ helix	trans	-60.4	-24.1	174.9	-67.9	-176.8	-178.2	178.4	0	112.6	E207	E207-K209 PolarHBondContact O-N 3Å; E207-K209 VanDerWaalsContact O-N 3.15Å
210	K	91	Very high	89.7	Confident	78 Å²	78	53 Å²	53	34%	0.339	27%	0.269	S	S	.	.	G	3₁₀ helix	trans	-81.2	-16.2	-179.6	-56.9	174.2	-172.6	167.3	0	112.7	E207 R208 I212 H213	E207-K210 VanDerWaalsContact CD-NZ 3.33Å; E207-K210 WeakPolarHBondContact O-CB 3.43Å; E207-K210 PolarHBondContact O-N 3.4Å; E207-K210 IonicContact OE1-NZ 2.6Å; E207-K210 PolarHBondContact OE1-NZ 3.26Å; E207-K210 IonicContact OE2-NZ 2.81Å; E207-K210 PolarHBondContact OE2-NZ 2.6Å; R208-K210 PolarHBondContact O-N 2.85Å; R208-K210 VanDerWaalsContact O-N 3.16Å; K210-I212 VanDerWaalsContact C-N 3.27Å; K210-I212 PolarHBondContact O-N 3.11Å; K210-H213 WeakPolarHBondContact O-CB 3.36Å; K210-H213 PolarHBondContact O-CD2 2.85Å; K210-H213 PolarHBondContact O-N 2.9Å
211	W	91.2	Very high	89.6	Confident	9 Å²	9	52.9 Å²	52.9	3%	0.034	27%	0.268	C	S	.	.	G	3₁₀ helix	trans	-63	-33.1	-172.3	-65.9	3	0	0	0	113.3	L39 V201 G202 R208 H213 C214 F215 L249 I253	L39-W211 HydrophobicContact CD2-CD2 3.82Å; L39-W211 HydrophobicContact CD2-CE3 3.66Å; L39-W211 HydrophobicContact CD2-CG 4.35Å; L39-W211 HydrophobicContact CD2-CH2 4.34Å; L39-W211 HydrophobicContact CD2-CZ2 4.49Å; L39-W211 HydrophobicContact CD2-CZ3 3.92Å; V201-W211 HydrophobicContact CB-CG 4.48Å; V201-W211 VanDerWaalsContact CG2-CD1 3.45Å; V201-W211 HydrophobicContact CG2-CD2 4.13Å; V201-W211 HydrophobicContact CG2-CG 3.99Å; V201-W211 HydrophobicContact CG2-CZ2 4.35Å; V201-W211 VanDerWaalsContact CG2-NE1 3.26Å; G202-W211 PolarHBondContact O-NE1 3.21Å; R208-W211 HydrophobicContact CB-CD2 4.11Å; R208-W211 HydrophobicContact CB-CE3 4.45Å; R208-W211 HydrophobicContact CB-CZ2 4.27Å; R208-W211 HydrophobicContact CG-CD2 4.38Å; R208-W211 HydrophobicContact CG-CH2 3.99Å; R208-W211 HydrophobicContact CG-CZ2 3.63Å; R208-W211 WeakPolarHBondContact O-CB 3.46Å; R208-W211 VanDerWaalsContact O-CG 3.3Å; R208-W211 PolarHBondContact O-N 3.25Å; R208-W211 VanDerWaalsContact O-N 3.12Å; W211-H213 PolarHBondContact O-N 2.91Å; W211-C214 PolarHBondContact O-N 3.06Å; W211-F215 HydrophobicContact CB-CE1 3.72Å; W211-F215 HydrophobicContact CB-CZ 4.06Å; W211-F215 WeakPolarHBondContact O-CD1 3.44Å; W211-F215 VanDerWaalsContact O-CE1 3.24Å; W211-F215 WeakPolarHBondContact O-CE1 3.48Å; W211-L249 HydrophobicContact CH2-CD1 3.82Å; W211-L249 HydrophobicContact CH2-CD2 3.83Å; W211-L249 HydrophobicContact CH2-CG 4.29Å; W211-L249 HydrophobicContact CZ3-CD1 3.7Å; W211-L249 HydrophobicContact CZ3-CD2 4.42Å; W211-L249 HydrophobicContact CZ3-CG 4.42Å; W211-I253 HydrophobicContact CE3-CD1 4.23Å; W211-I253 HydrophobicContact CZ3-CD1 4.1Å; W211-I253 HydrophobicContact CZ3-CG1 4.45Å
212	I	85.9	Confident	89.7	Confident	82 Å²	82	52.8 Å²	52.8	42%	0.421	27%	0.268	S	S	.	.	G	3₁₀ helix	trans	-56.3	-26.8	-179.9	-168.7	59.5	0	0	0	112.7	K210 C214 F215 F258	K210-I212 VanDerWaalsContact C-N 3.27Å; K210-I212 PolarHBondContact O-N 3.11Å; I212-C214 PolarHBondContact O-N 3.35Å; I212-F215 HydrophobicContact CD1-CB 4.37Å; I212-F215 HydrophobicContact CD1-CD2 3.56Å; I212-F215 HydrophobicContact CD1-CE2 4.13Å; I212-F215 HydrophobicContact CD1-CG 4.13Å; I212-F215 PolarHBondContact O-N 2.6Å; I212-F258 HydrophobicContact CD1-CD2 3.95Å; I212-F258 HydrophobicContact CD1-CE2 3.72Å
213	H	86.3	Confident	89.9	Confident	149 Å²	149	52.7 Å²	52.7	69%	0.69	27%	0.267	S	S	*	.	G	3₁₀ helix	trans	-70.1	-10.9	177.4	-58.1	-58.5	0	0	0	113.8	I184 K210 W211	I184-H213 HydrophobicContact CD1-CB 4.04Å; K210-H213 WeakPolarHBondContact O-CB 3.36Å; K210-H213 PolarHBondContact O-CD2 2.85Å; K210-H213 PolarHBondContact O-N 2.9Å; W211-H213 PolarHBondContact O-N 2.91Å
214	C	88.9	Confident	90.3	Very high	13 Å²	13	52.4 Å²	52.4	9%	0.088	26%	0.264	C	S	.	.	G	3₁₀ helix	trans	-111.2	2.3	179.1	-55.3	0	0	0	0	113.1	L37 I184 W211 I212 V218	L37-C214 HydrophobicContact CD1-CB 3.63Å; L37-C214 HydrophobicContact CD2-CB 4.47Å; I184-C214 WeakPolarHBondContact CD1-SG 3.48Å; I184-C214 WeakPolarHBondContact CG2-SG 3.32Å; W211-C214 PolarHBondContact O-N 3.06Å; I212-C214 PolarHBondContact O-N 3.35Å; C214-V218 WeakPolarHBondContact O-CG2 3.45Å
215	F	87.3	Confident	90.8	Very high	24 Å²	24	51 Å²	51	11%	0.105	26%	0.257	C	S	.	.			trans	-80.9	-22.3	-170.9	-76.2	13.2	0	0	0	113.3	L37 W211 I212 G217 I253 F258 F259	L37-F215 HydrophobicContact CD2-CD1 3.65Å; L37-F215 HydrophobicContact CD2-CE1 3.77Å; W211-F215 HydrophobicContact CB-CE1 3.72Å; W211-F215 HydrophobicContact CB-CZ 4.06Å; W211-F215 WeakPolarHBondContact O-CD1 3.44Å; W211-F215 VanDerWaalsContact O-CE1 3.24Å; W211-F215 WeakPolarHBondContact O-CE1 3.48Å; I212-F215 HydrophobicContact CD1-CB 4.37Å; I212-F215 HydrophobicContact CD1-CD2 3.56Å; I212-F215 HydrophobicContact CD1-CE2 4.13Å; I212-F215 HydrophobicContact CD1-CG 4.13Å; I212-F215 PolarHBondContact O-N 2.6Å; F215-G217 PolarHBondContact O-N 2.85Å; F215-I253 HydrophobicContact CZ-CD1 4.35Å; F215-F258 HydrophobicContact CD2-CB 4.32Å; F215-F258 HydrophobicContact CD2-CD2 4.08Å; F215-F259 HydrophobicContact CB-CE1 4.14Å; F215-F259 HydrophobicContact CB-CZ 4.05Å; F215-F259 HydrophobicContact CD1-CE1 4.24Å; F215-F259 HydrophobicContact CD1-CE2 4.2Å; F215-F259 AromaticContact CD1-CZ 3.39Å; F215-F259 HydrophobicContact CD1-CZ 3.39Å; F215-F259 HydrophobicContact CD2-CE1 4.18Å; F215-F259 AromaticContact CD2-CE2 3.81Å; F215-F259 HydrophobicContact CD2-CE2 3.81Å; F215-F259 AromaticContact CD2-CZ 3.45Å; F215-F259 HydrophobicContact CD2-CZ 3.45Å; F215-F259 VanDerWaalsContact CD2-CZ 3.45Å; F215-F259 AromaticContact CE1-CE2 3.89Å; F215-F259 HydrophobicContact CE1-CE2 3.89Å; F215-F259 AromaticContact CE1-CZ 3.51Å; F215-F259 HydrophobicContact CE1-CZ 3.51Å; F215-F259 AromaticContact CE2-CE2 3.5Å; F215-F259 HydrophobicContact CE2-CE2 3.5Å; F215-F259 VanDerWaalsContact CE2-CE2 3.5Å; F215-F259 AromaticContact CE2-CZ 3.6Å; F215-F259 HydrophobicContact CE2-CZ 3.6Å; F215-F259 AromaticContact CG-CE1 3.95Å; F215-F259 HydrophobicContact CG-CE1 3.95Å; F215-F259 HydrophobicContact CG-CE2 4.16Å; F215-F259 AromaticContact CG-CZ 3.36Å; F215-F259 HydrophobicContact CG-CZ 3.36Å; F215-F259 AromaticContact CZ-CE2 3.53Å; F215-F259 HydrophobicContact CZ-CE2 3.53Å; F215-F259 AromaticContact CZ-CZ 3.62Å; F215-F259 HydrophobicContact CZ-CZ 3.62Å
216	E	84.2	Confident	91.1	Very high	181 Å²	181	47.2 Å²	47.2	85%	0.846	25%	0.246	S	C	*	.	T	Hydrogen-bonded Turn	trans	-73.2	127.3	-177	-171	174.1	-172.6	0	0	111.7	V218	E216-V218 VanDerWaalsContact C-N 3.25Å; E216-V218 PolarHBondContact O-N 2.85Å
217	G	83.9	Confident	91.6	Very high	55 Å²	55	43.6 Å²	43.6	57%	0.567	22%	0.221	S	C	*	.	T	Hydrogen-bonded Turn	trans	67.3	20.6	175.9	0	0	0	0	0	114.7	K35 F215 T219	K35-G217 WeakPolarHBondContact CD-O 3.23Å; F215-G217 PolarHBondContact O-N 2.85Å; G217-T219 PolarHBondContact O-N 3.18Å
218	V	90.4	Very high	91.8	Very high	15 Å²	15	42.8 Å²	42.8	9%	0.091	22%	0.217	C	C	.	.			trans	-66.8	122.5	173.8	176	0	0	0	0	109.6	L37 C214 E216 C220 I221 T262	L37-V218 HydrophobicContact CB-CG1 3.79Å; L37-V218 HydrophobicContact CB-CG2 4.01Å; L37-V218 HydrophobicContact CD2-CG2 4.11Å; C214-V218 WeakPolarHBondContact O-CG2 3.45Å; E216-V218 VanDerWaalsContact C-N 3.25Å; E216-V218 PolarHBondContact O-N 2.85Å; V218-C220 VanDerWaalsContact CG1-O 3.3Å; V218-C220 WeakPolarHBondContact CG1-O 3.39Å; V218-I221 HydrophobicContact CG1-CG1 4.06Å; V218-T262 HydrophobicContact CG1-CG2 4.22Å
219	T	89.3	Confident	92	Very high	39 Å²	39	40.7 Å²	40.7	24%	0.239	21%	0.21	C	C	.	.	S	Bend	trans	-75.4	-45.3	176.3	-45.2	0	0	0	0	110.6	V34 K35 G217 I343	V34-T219 HydrophobicContact CG1-CG2 4.09Å; K35-T219 PolarHBondContact N-OG1 3.41Å; K35-T219 PolarHBondContact O-N 3.13Å; G217-T219 PolarHBondContact O-N 3.18Å; T219-I343 HydrophobicContact CG2-CG2 4.05Å
220	C	91	Very high	92.4	Very high	2 Å²	2	31.8 Å²	31.8	1%	0.014	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.5	143.6	-177.8	-176.8	0	0	0	0	111.1	K35 L36 L37 V218 I343	K35-C220 PolarHBondContact O-N 3.22Å; L36-C220 WeakPolarHBondContact CA-O 3.29Å; L36-C220 HydrophobicContact CD2-CB 3.84Å; L37-C220 PolarHBondContact N-O 2.83Å; L37-C220 VanDerWaalsContact N-O 3.07Å; V218-C220 VanDerWaalsContact CG1-O 3.3Å; V218-C220 WeakPolarHBondContact CG1-O 3.39Å; C220-I343 HydrophobicContact CB-CD1 3.75Å; C220-I343 HydrophobicContact CB-CG1 3.98Å
221	I	94.3	Very high	92.7	Very high	0 Å²	0	29.4 Å²	29.4	0%	0	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.7	133.1	171.7	-63.8	168	0	0	0	108.8	L37 L39 V218 I253 F259 T262 S263 I264 V265	L37-I221 WeakPolarHBondContact O-CA 3.45Å; L39-I221 HydrophobicContact CB-CG2 4.4Å; L39-I221 HydrophobicContact CD1-CG2 3.91Å; L39-I221 HydrophobicContact CG-CG2 4.23Å; V218-I221 HydrophobicContact CG1-CG1 4.06Å; I221-I253 HydrophobicContact CD1-CG2 4.07Å; I221-I253 HydrophobicContact CG2-CG2 4.48Å; I221-F259 HydrophobicContact CD1-CB 4.02Å; I221-F259 HydrophobicContact CD1-CD1 3.6Å; I221-F259 HydrophobicContact CD1-CD2 3.61Å; I221-F259 HydrophobicContact CD1-CE1 3.79Å; I221-F259 HydrophobicContact CD1-CE2 3.81Å; I221-F259 HydrophobicContact CD1-CG 3.48Å; I221-F259 VanDerWaalsContact CD1-CG 3.48Å; I221-F259 HydrophobicContact CD1-CZ 3.85Å; I221-F259 HydrophobicContact CG1-CE1 4.47Å; I221-T262 HydrophobicContact CD1-CG2 4.16Å; I221-T262 HydrophobicContact CG1-CG2 4.03Å; I221-S263 PolarHBondContact N-O 3.3Å; I221-I264 HydrophobicContact CB-CG1 4.17Å; I221-I264 HydrophobicContact CD1-CG1 4.34Å; I221-I264 WeakPolarHBondContact O-CA 3.45Å; I221-V265 PolarHBondContact O-N 2.61Å
222	I	96	Very high	92.9	Very high	0 Å²	0	30 Å²	30	0%	0	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	108.5	166.4	-60.1	175.6	0	0	0	106.9	L36 L37 L38 L39 M198 V265 F267 F336	L36-I222 HydrophobicContact CD1-CD1 4.2Å; L37-I222 PolarHBondContact O-N 3.5Å; L38-I222 CarbonylContact C-O 3.54Å; L38-I222 WeakPolarHBondContact CA-O 3.32Å; L38-I222 HydrophobicContact CD2-CB 3.82Å; L38-I222 HydrophobicContact CD2-CG2 3.71Å; L39-I222 PolarHBondContact N-O 2.97Å; M198-I222 HydrophobicContact CE-CD1 4.36Å; I222-V265 CarbonylContact C-O 3.59Å; I222-V265 WeakPolarHBondContact CA-O 3.47Å; I222-V265 HydrophobicContact CG1-CB 4.38Å; I222-F267 HydrophobicContact CG2-CD1 4.45Å; I222-F267 HydrophobicContact CG2-CD2 3.56Å; I222-F267 HydrophobicContact CG2-CE1 4.45Å; I222-F267 HydrophobicContact CG2-CE2 3.56Å; I222-F267 HydrophobicContact CG2-CG 4.03Å; I222-F267 HydrophobicContact CG2-CZ 4.03Å; I222-F336 HydrophobicContact CD1-CE2 4.42Å
223	F	97.8	Very high	93.3	Very high	0 Å²	0	28.4 Å²	28.4	0%	0	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.8	117.8	176.6	-168.5	-82.8	0	0	0	110.2	L39 A225 L249 F250 I264 V265 L266 F267 F307	L39-F223 HydrophobicContact CB-CD2 3.97Å; L39-F223 CarbonylContact O-C 3.56Å; L39-F223 WeakPolarHBondContact O-CA 3.5Å; F223-A225 HydrophobicContact CD1-CB 4.49Å; F223-A225 HydrophobicContact CE1-CB 4.24Å; F223-L249 HydrophobicContact CE2-CD2 4.13Å; F223-L249 HydrophobicContact CE2-CG 3.98Å; F223-L249 HydrophobicContact CZ-CB 4.34Å; F223-L249 HydrophobicContact CZ-CD2 4.06Å; F223-L249 HydrophobicContact CZ-CG 4.09Å; F223-F250 HydrophobicContact CB-CD2 4.1Å; F223-F250 HydrophobicContact CB-CE2 4.1Å; F223-F250 AromaticContact CD1-CD2 3.56Å; F223-F250 HydrophobicContact CD1-CD2 3.56Å; F223-F250 HydrophobicContact CD1-CE2 4.23Å; F223-F250 HydrophobicContact CD1-CG 4.48Å; F223-F250 AromaticContact CD2-CD2 3.8Å; F223-F250 HydrophobicContact CD2-CD2 3.8Å; F223-F250 HydrophobicContact CE1-CB 3.92Å; F223-F250 AromaticContact CE1-CD2 3.82Å; F223-F250 HydrophobicContact CE1-CD2 3.82Å; F223-F250 HydrophobicContact CE1-CG 4.34Å; F223-F250 HydrophobicContact CE2-CB 4.09Å; F223-F250 HydrophobicContact CE2-CD2 4.04Å; F223-F250 AromaticContact CG-CD2 3.54Å; F223-F250 HydrophobicContact CG-CD2 3.54Å; F223-F250 HydrophobicContact CG-CE2 4.05Å; F223-F250 HydrophobicContact CZ-CB 3.67Å; F223-F250 HydrophobicContact CZ-CD2 4.05Å; F223-F250 HydrophobicContact CZ-CG 4.39Å; F223-I264 HydrophobicContact CB-CG2 4.33Å; F223-V265 PolarHBondContact N-O 2.84Å; F223-L266 HydrophobicContact CB-CD1 4.42Å; F223-L266 HydrophobicContact CD1-CD1 3.77Å; F223-F267 PolarHBondContact O-N 2.72Å; F223-F307 HydrophobicContact CE1-CE1 4.08Å
224	C	98	Very high	93.6	Very high	0 Å²	0	21.8 Å²	21.8	0%	0	13%	0.129	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.3	122.7	176.1	-61.7	0	0	0	0	110.8	L39 G40 S44 K46	L39-C224 PolarHBondContact O-N 3.37Å; G40-C224 WeakPolarHBondContact CA-O 3.47Å; S44-C224 WeakPolarHBondContact CB-O 3.47Å; S44-C224 PolarHBondContact OG-O 3.42Å; K46-C224 HydrophobicContact CG-CB 4.04Å
225	A	98.4	Very high	93.6	Very high	1 Å²	1	25 Å²	25	1%	0.008	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	138.9	169.8	0	0	0	0	0	109.4	F223 L266 F267 L268 N269 F307	F223-A225 HydrophobicContact CD1-CB 4.49Å; F223-A225 HydrophobicContact CE1-CB 4.24Å; A225-L266 HydrophobicContact CB-CD1 4.42Å; A225-F267 PolarHBondContact N-O 2.83Å; A225-L268 HydrophobicContact CB-CD2 4.23Å; A225-N269 PolarHBondContact O-N 2.78Å; A225-F307 HydrophobicContact CB-CE1 4.07Å; A225-F307 HydrophobicContact CB-CE2 4.04Å; A225-F307 HydrophobicContact CB-CZ 3.57Å
226	A	97.9	Very high	93.7	Very high	12 Å²	12	27.6 Å²	27.6	10%	0.099	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.6	112.9	176.7	0	0	0	0	0	110.2	S228 A229 M243 K270	A226-S228 VanDerWaalsContact C-N 3.28Å; A226-S228 PolarHBondContact O-N 3Å; A226-A229 HydrophobicContact CB-CB 3.92Å; A226-A229 WeakPolarHBondContact O-CB 3.25Å; A226-A229 PolarHBondContact O-N 2.91Å; A226-M243 VanDerWaalsContact O-CE 3.24Å; A226-M243 WeakPolarHBondContact O-CE 3.19Å; A226-K270 HydrophobicContact CB-CD 3.89Å; A226-K270 HydrophobicContact CB-CG 4.48Å
227	L	98.1	Very high	94.1	Very high	0 Å²	0	21.2 Å²	21.2	0%	0	13%	0.133	C	C	.	.	G	3₁₀ helix	trans	-60.3	-39.8	175.9	-74.4	173.2	0	0	0	111.7	A229 Y230 L268 N269 K271 F274 I303	L227-A229 PolarHBondContact O-N 3.26Å; L227-A229 VanDerWaalsContact O-N 3.09Å; L227-Y230 WeakPolarHBondContact O-CD1 3.34Å; L227-L268 HydrophobicContact CD1-CB 3.94Å; L227-L268 WeakPolarHBondContact CD1-O 3.16Å; L227-L268 HydrophobicContact CD2-CB 3.96Å; L227-L268 HydrophobicContact CD2-CD1 4.48Å; L227-L268 HydrophobicContact CD2-CD2 4.2Å; L227-L268 HydrophobicContact CD2-CG 4.44Å; L227-L268 HydrophobicContact CG-CB 3.86Å; L227-N269 WeakPolarHBondContact CB-O 3.3Å; L227-N269 PolarHBondContact N-O 3.15Å; L227-K271 HydrophobicContact CD1-CB 4.07Å; L227-F274 HydrophobicContact CB-CB 3.67Å; L227-F274 HydrophobicContact CB-CD1 4.36Å; L227-F274 HydrophobicContact CB-CD2 4.03Å; L227-F274 HydrophobicContact CB-CG 3.77Å; L227-F274 HydrophobicContact CD1-CD1 4.34Å; L227-F274 WeakPolarHBondContact O-CD2 3.39Å; L227-I303 HydrophobicContact CD2-CB 4.13Å; L227-I303 HydrophobicContact CD2-CD1 3.99Å; L227-I303 HydrophobicContact CD2-CG2 3.78Å
228	S	97.1	Very high	94.4	Very high	2 Å²	2	24.8 Å²	24.8	1%	0.014	14%	0.139	C	C	.	.	G	3₁₀ helix	trans	-71	0.1	-177.7	65.5	0	0	0	0	115	A226 K270 K277	A226-S228 VanDerWaalsContact C-N 3.28Å; A226-S228 PolarHBondContact O-N 3Å; S228-K270 VanDerWaalsContact OG-CD 3.29Å; S228-K270 WeakPolarHBondContact OG-CD 3.32Å; S228-K277 PolarHBondContact O-NZ 3.26Å
229	A	96.8	Very high	94.5	Very high	6 Å²	6	32.4 Å²	32.4	5%	0.05	17%	0.174	C	C	.	.	G	3₁₀ helix	trans	-95.1	5.3	-174.4	0	0	0	0	0	114.2	A226 L227 D231 M232 R242	A226-A229 HydrophobicContact CB-CB 3.92Å; A226-A229 WeakPolarHBondContact O-CB 3.25Å; A226-A229 PolarHBondContact O-N 2.91Å; L227-A229 PolarHBondContact O-N 3.26Å; L227-A229 VanDerWaalsContact O-N 3.09Å; A229-D231 PolarHBondContact O-N 3.42Å; A229-M232 PolarHBondContact O-N 3.41Å; A229-R242 HydrophobicContact CB-CB 3.82Å
230	Y	97.3	Very high	94.7	Very high	0 Å²	0	32.2 Å²	32.2	0%	0	17%	0.172	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.4	-23.2	-175.4	73.4	-86.9	0	0	0	114.2	L227 N241 F274 K277 I278 V281 L283 I285 C286	L227-Y230 WeakPolarHBondContact O-CD1 3.34Å; Y230-N241 PolarHBondContact O-ND2 2.7Å; Y230-F274 AromaticContact CD1-CD2 3.98Å; Y230-F274 HydrophobicContact CD1-CD2 3.98Å; Y230-F274 AromaticContact CD1-CE2 3.96Å; Y230-F274 HydrophobicContact CD1-CE2 3.96Å; Y230-F274 AromaticContact CE1-CD2 3.84Å; Y230-F274 HydrophobicContact CE1-CD2 3.84Å; Y230-F274 AromaticContact CE1-CE2 3.86Å; Y230-F274 HydrophobicContact CE1-CE2 3.86Å; Y230-K277 HydrophobicContact CD1-CD 4.31Å; Y230-K277 HydrophobicContact CE1-CB 4.46Å; Y230-K277 HydrophobicContact CE1-CD 3.55Å; Y230-K277 HydrophobicContact CE1-CG 3.88Å; Y230-K277 PolarHBondContact OH-O 3.49Å; Y230-I278 HydrophobicContact CE1-CD1 4.5Å; Y230-I278 WeakPolarHBondContact OH-CA 3.38Å; Y230-V281 HydrophobicContact CE2-CB 4.34Å; Y230-V281 HydrophobicContact CE2-CG1 4.08Å; Y230-V281 PolarHBondContact OH-O 3.42Å; Y230-L283 HydrophobicContact CD2-CD1 4Å; Y230-L283 HydrophobicContact CG-CD1 4.12Å; Y230-I285 HydrophobicContact CD2-CD1 4.26Å; Y230-I285 HydrophobicContact CD2-CG1 4.12Å; Y230-I285 HydrophobicContact CE2-CD1 4.2Å; Y230-I285 HydrophobicContact CE2-CG1 4.24Å; Y230-C286 HydrophobicContact CD2-CB 4.3Å; Y230-C286 VanDerWaalsContact O-CB 3.27Å; Y230-C286 WeakPolarHBondContact O-CB 3.39Å
231	D	96.4	Very high	95	Very high	27 Å²	27	33.5 Å²	33.5	14%	0.144	18%	0.179	C	C	.	.	T	Hydrogen-bonded Turn	trans	-106.4	12.2	-179.1	68.4	-27.6	0	0	0	112.9	A144 A229 K277 V281 I285	A144-D231 WeakPolarHBondContact CB-OD2 3.05Å; A229-D231 PolarHBondContact O-N 3.42Å; D231-K277 VanDerWaalsContact CG-NZ 3.28Å; D231-K277 WeakPolarHBondContact OD1-CD 3.31Å; D231-K277 IonicContact OD1-NZ 3.05Å; D231-K277 PolarHBondContact OD1-NZ 2.88Å; D231-K277 VanDerWaalsContact OD2-CD 3.23Å; D231-K277 WeakPolarHBondContact OD2-CD 3.07Å; D231-K277 VanDerWaalsContact OD2-CE 3.3Å; D231-K277 WeakPolarHBondContact OD2-CE 3.41Å; D231-K277 IonicContact OD2-NZ 2.82Å; D231-K277 PolarHBondContact OD2-NZ 2.86Å; D231-K277 VanDerWaalsContact OD2-NZ 3.12Å; D231-V281 HydrophobicContact CB-CG1 4.29Å; D231-I285 HydrophobicContact CB-CD1 3.37Å
232	M	95.4	Very high	95.2	Very high	22 Å²	22	34.6 Å²	34.6	11%	0.108	18%	0.183	C	C	.	.			trans	-118.9	152.5	-172.6	-70.9	168.2	165	0	0	111.8	A144 A229 N241 R242	A144-M232 HydrophobicContact CB-CG 4.43Å; A229-M232 PolarHBondContact O-N 3.41Å; M232-N241 CarbonylContact O-C 3.58Å; M232-N241 WeakPolarHBondContact O-CA 3.46Å; M232-R242 HydrophobicContact CB-CG 4.08Å; M232-R242 WeakPolarHBondContact O-CG 3.48Å; M232-R242 PolarHBondContact O-N 2.85Å
233	V	95.1	Very high	95.2	Very high	49 Å²	49	34.6 Å²	34.6	30%	0.297	18%	0.183	S	C	.	.	B	Isolated β-bridge	trans	-104.7	157.4	173.5	-59.3	0	0	0	0	111.9	Q147 D238 V240 R242	Q147-V233 PolarHBondContact NE2-O 3.15Å; Q147-V233 VanDerWaalsContact NE2-O 3.09Å; V233-D238 WeakPolarHBondContact CB-O 3.45Å; V233-D238 WeakPolarHBondContact CG1-O 3.33Å; V233-D238 HydrophobicContact CG2-CB 4.31Å; V233-V240 CarbonylContact C-O 3.59Å; V233-V240 VanDerWaalsContact CA-O 3.3Å; V233-V240 WeakPolarHBondContact CA-O 3.43Å; V233-R242 VanDerWaalsContact C-CG 3.46Å; V233-R242 WeakPolarHBondContact O-CG 3.42Å; V233-R242 PolarHBondContact O-NE 3.4Å
234	L	92.8	Very high	95.3	Very high	9 Å²	9	37.9 Å²	37.9	5%	0.047	20%	0.198	C	C	.	.			trans	-64.3	153.4	-179.2	-67.4	171.8	0	0	0	111.5	Q147 E236 D237 V240 R242 E245	Q147-L234 PolarHBondContact NE2-O 2.87Å; L234-E236 VanDerWaalsContact C-N 3.28Å; L234-D237 HydrophobicContact CB-CB 4.34Å; L234-D237 WeakPolarHBondContact CB-O 3.4Å; L234-D237 HydrophobicContact CD1-CB 4.42Å; L234-D237 PolarHBondContact N-O 3.41Å; L234-D237 CarbonylContact O-C 3.59Å; L234-V240 HydrophobicContact CD1-CB 3.89Å; L234-V240 HydrophobicContact CD1-CG1 3.62Å; L234-V240 HydrophobicContact CG-CB 4.41Å; L234-V240 HydrophobicContact CG-CG1 4.25Å; L234-V240 PolarHBondContact N-O 2.7Å; L234-R242 HydrophobicContact CD2-CB 4.47Å; L234-R242 HydrophobicContact CD2-CG 3.98Å; L234-R242 HydrophobicContact CG-CG 4.39Å; L234-E245 HydrophobicContact CD1-CB 3.93Å; L234-E245 HydrophobicContact CD1-CG 3.76Å; L234-E245 HydrophobicContact CD2-CB 4.15Å; L234-E245 HydrophobicContact CD2-CG 3.97Å; L234-E245 HydrophobicContact CG-CB 4.33Å; L234-E245 HydrophobicContact CG-CG 4.4Å
235	V	88.3	Confident	95.2	Very high	81 Å²	81	38.6 Å²	38.6	49%	0.491	20%	0.202	S	C	.	.	S	Bend	trans	-68.6	-36.4	170.5	179	0	0	0	0	109.8	Q147 D237	Q147-V235 HydrophobicContact CG-CG2 4.13Å; V235-D237 VanDerWaalsContact C-N 3.33Å
236	E	89.8	Confident	95.2	Very high	79 Å²	79	38.8 Å²	38.8	37%	0.369	20%	0.203	S	C	.	.	S	Bend	trans	-78.4	-15.1	-177.2	-56.6	102	125.9	0	0	114.1	Q204 R205 L234	Q204-E236 WeakPolarHBondContact CA-OE1 3.49Å; Q204-E236 WeakPolarHBondContact CB-OE1 3.2Å; R205-E236 PolarHBondContact N-OE1 2.88Å; R205-E236 VanDerWaalsContact N-OE1 3.14Å; L234-E236 VanDerWaalsContact C-N 3.28Å
237	D	91.3	Very high	95.2	Very high	47 Å²	47	39 Å²	39	25%	0.251	20%	0.202	S	C	.	.			trans	-164.5	103.6	-167.9	-166.9	-20.1	0	0	0	110.1	R205 L234 V235 E239 V240	R205-D237 IonicContact CZ-OD2 2.81Å; R205-D237 IonicContact NH1-OD2 3.21Å; R205-D237 PolarHBondContact NH1-OD2 2.75Å; L234-D237 HydrophobicContact CB-CB 4.34Å; L234-D237 WeakPolarHBondContact CB-O 3.4Å; L234-D237 HydrophobicContact CD1-CB 4.42Å; L234-D237 PolarHBondContact N-O 3.41Å; L234-D237 CarbonylContact O-C 3.59Å; V235-D237 VanDerWaalsContact C-N 3.33Å; D237-E239 PolarHBondContact O-N 2.99Å; D237-E239 PolarHBondContact OD1-N 3.38Å; D237-V240 HydrophobicContact CB-CB 4.27Å; D237-V240 HydrophobicContact CB-CG2 4.22Å; D237-V240 VanDerWaalsContact CG-CG2 3.45Å; D237-V240 PolarHBondContact O-N 3.36Å; D237-V240 VanDerWaalsContact OD2-CG2 3.24Å; D237-V240 WeakPolarHBondContact OD2-CG2 3.33Å
238	D	90.8	Very high	95.2	Very high	129 Å²	129	44.8 Å²	44.8	69%	0.69	23%	0.229	S	C	*	.	T	Hydrogen-bonded Turn	trans	-76.8	-7.4	-173.5	61.3	-15.4	0	0	0	113.9	V233	V233-D238 WeakPolarHBondContact CB-O 3.45Å; V233-D238 WeakPolarHBondContact CG1-O 3.33Å; V233-D238 HydrophobicContact CG2-CB 4.31Å
239	E	92.4	Very high	95.2	Very high	176 Å²	176	45.3 Å²	45.3	82%	0.822	23%	0.231	S	C	*	.	T	Hydrogen-bonded Turn	trans	-90	-14.5	173.4	-60.8	-170.2	157	0	0	112.6	D237	D237-E239 PolarHBondContact O-N 2.99Å; D237-E239 PolarHBondContact OD1-N 3.38Å
240	V	94.7	Very high	95.3	Very high	34 Å²	34	45 Å²	45	21%	0.206	23%	0.229	C	C	.	.	S	Bend	trans	-103.6	117	-173.7	178.6	0	0	0	0	111.2	V233 L234 D237 E245	V233-V240 CarbonylContact C-O 3.59Å; V233-V240 VanDerWaalsContact CA-O 3.3Å; V233-V240 WeakPolarHBondContact CA-O 3.43Å; L234-V240 HydrophobicContact CD1-CB 3.89Å; L234-V240 HydrophobicContact CD1-CG1 3.62Å; L234-V240 HydrophobicContact CG-CB 4.41Å; L234-V240 HydrophobicContact CG-CG1 4.25Å; L234-V240 PolarHBondContact N-O 2.7Å; D237-V240 HydrophobicContact CB-CB 4.27Å; D237-V240 HydrophobicContact CB-CG2 4.22Å; D237-V240 VanDerWaalsContact CG-CG2 3.45Å; D237-V240 PolarHBondContact O-N 3.36Å; D237-V240 VanDerWaalsContact OD2-CG2 3.24Å; D237-V240 WeakPolarHBondContact OD2-CG2 3.33Å; V240-E245 HydrophobicContact CG1-CB 4.08Å
241	N	96.9	Very high	95.3	Very high	30 Å²	30	47.8 Å²	47.8	16%	0.16	24%	0.244	C	C	.	.	B	Isolated β-bridge	trans	-63.3	134.9	172.3	-177.5	-77.3	0	0	0	111.6	Y230 M232 M243 H244 E245	Y230-N241 PolarHBondContact O-ND2 2.7Å; M232-N241 CarbonylContact O-C 3.58Å; M232-N241 WeakPolarHBondContact O-CA 3.46Å; N241-M243 PolarHBondContact O-N 3.39Å; N241-M243 WeakPolarHBondContact OD1-CA 3.14Å; N241-M243 VanDerWaalsContact OD1-CB 3.3Å; N241-M243 WeakPolarHBondContact OD1-CB 3.42Å; N241-M243 PolarHBondContact OD1-N 3.13Å; N241-H244 HydrophobicContact CB-CB 4.32Å; N241-H244 PolarHBondContact O-N 3.09Å; N241-H244 PolarHBondContact OD1-N 3.36Å; N241-E245 PolarHBondContact O-N 2.95Å
242	R	97	Very high	95.3	Very high	22 Å²	22	50 Å²	50	8%	0.083	26%	0.261	C	S	.	.	H	α-helix	trans	-64.3	-35.6	-176.3	-66.1	-171.4	174.7	-159	-9.3	113.4	E43 A229 M232 V233 L234 S246	E43-R242 IonicContact OE1-NH2 2.65Å; E43-R242 IonicContact OE2-CZ 3.12Å; E43-R242 IonicContact OE2-NH1 3.77Å; E43-R242 PolarHBondContact OE2-NH1 3.01Å; E43-R242 IonicContact OE2-NH2 2.63Å; E43-R242 PolarHBondContact OE2-NH2 3.18Å; A229-R242 HydrophobicContact CB-CB 3.82Å; M232-R242 HydrophobicContact CB-CG 4.08Å; M232-R242 WeakPolarHBondContact O-CG 3.48Å; M232-R242 PolarHBondContact O-N 2.85Å; V233-R242 VanDerWaalsContact C-CG 3.46Å; V233-R242 WeakPolarHBondContact O-CG 3.42Å; V233-R242 PolarHBondContact O-NE 3.4Å; L234-R242 HydrophobicContact CD2-CB 4.47Å; L234-R242 HydrophobicContact CD2-CG 3.98Å; L234-R242 HydrophobicContact CG-CG 4.39Å; R242-S246 WeakPolarHBondContact O-CB 3.43Å; R242-S246 PolarHBondContact O-N 3.05Å
243	M	97.9	Very high	95.2	Very high	1 Å²	1	49.4 Å²	49.4	1%	0.005	26%	0.259	C	S	.	.	H	α-helix	trans	-69.2	-43.6	178	-178.2	61.7	71.2	0	0	111.1	A226 N241 S246 L247 F287 I303 F307	A226-M243 VanDerWaalsContact O-CE 3.24Å; A226-M243 WeakPolarHBondContact O-CE 3.19Å; N241-M243 PolarHBondContact O-N 3.39Å; N241-M243 WeakPolarHBondContact OD1-CA 3.14Å; N241-M243 VanDerWaalsContact OD1-CB 3.3Å; N241-M243 WeakPolarHBondContact OD1-CB 3.42Å; N241-M243 PolarHBondContact OD1-N 3.13Å; M243-S246 WeakPolarHBondContact O-CA 3.45Å; M243-S246 WeakPolarHBondContact O-CB 3.34Å; M243-S246 PolarHBondContact O-N 2.78Å; M243-S246 VanDerWaalsContact O-N 3.09Å; M243-L247 HydrophobicContact CG-CD1 4.49Å; M243-L247 PolarHBondContact O-N 3.37Å; M243-F287 HydrophobicContact CG-CE2 4.01Å; M243-F287 HydrophobicContact CG-CZ 3.71Å; M243-I303 HydrophobicContact CE-CD1 4.24Å; M243-I303 HydrophobicContact CE-CG2 3.95Å; M243-I303 HydrophobicContact SD-CG2 3.98Å; M243-F307 HydrophobicContact SD-CE2 3.78Å; M243-F307 HydrophobicContact SD-CZ 4.05Å
244	H	97.9	Very high	95.2	Very high	69 Å²	69	47.1 Å²	47.1	32%	0.319	25%	0.245	S	C	.	.	H	α-helix	trans	-62.5	-43.1	175.1	-73.4	-45.3	0	0	0	112.1	N241 S246 L247 H248 C286 F287	N241-H244 HydrophobicContact CB-CB 4.32Å; N241-H244 PolarHBondContact O-N 3.09Å; N241-H244 PolarHBondContact OD1-N 3.36Å; H244-S246 VanDerWaalsContact C-N 3.28Å; H244-S246 PolarHBondContact O-N 3.17Å; H244-L247 PolarHBondContact O-N 3.39Å; H244-H248 PolarHBondContact O-CD2 2.73Å; H244-H248 PolarHBondContact O-N 3.29Å; H244-C286 PolarHBondContact CE1-O 3.31Å; H244-C286 VanDerWaalsContact CE1-O 3.27Å; H244-C286 PolarHBondContact NE2-O 3.43Å; H244-F287 AromaticContact CE1-CE1 3.87Å
245	E	97.2	Very high	95.3	Very high	15 Å²	15	48.4 Å²	48.4	7%	0.07	25%	0.252	C	S	.	.	H	α-helix	trans	-57.4	-42.1	171.1	176.4	69.2	-175.7	0	0	112	R205 R208 L234 V240 N241 H248 L249	R205-E245 IonicContact CZ-OE2 2.61Å; R205-E245 IonicContact NE-OE1 3.51Å; R205-E245 PolarHBondContact NE-OE1 3.03Å; R205-E245 IonicContact NE-OE2 2.72Å; R205-E245 IonicContact NH2-OE1 2.61Å; R205-E245 IonicContact NH2-OE2 2.84Å; R205-E245 PolarHBondContact NH2-OE2 3.38Å; R208-E245 IonicContact CZ-OE1 2.69Å; R208-E245 IonicContact NH1-OE1 2.96Å; R208-E245 PolarHBondContact NH1-OE1 3.24Å; R208-E245 IonicContact NH2-OE1 3.56Å; R208-E245 PolarHBondContact NH2-OE1 3.41Å; L234-E245 HydrophobicContact CD1-CB 3.93Å; L234-E245 HydrophobicContact CD1-CG 3.76Å; L234-E245 HydrophobicContact CD2-CB 4.15Å; L234-E245 HydrophobicContact CD2-CG 3.97Å; L234-E245 HydrophobicContact CG-CB 4.33Å; L234-E245 HydrophobicContact CG-CG 4.4Å; V240-E245 HydrophobicContact CG1-CB 4.08Å; N241-E245 PolarHBondContact O-N 2.95Å; E245-H248 PolarHBondContact O-N 2.75Å; E245-L249 VanDerWaalsContact O-CB 3.25Å; E245-L249 WeakPolarHBondContact O-CB 3.46Å; E245-L249 PolarHBondContact O-N 3.04Å
246	S	98.2	Very high	95.5	Very high	5 Å²	5	47.8 Å²	47.8	4%	0.035	24%	0.243	C	C	.	.	H	α-helix	trans	-65.4	-40.1	179	-168.9	0	0	0	0	111.9	R242 M243 H244 F250	R242-S246 WeakPolarHBondContact O-CB 3.43Å; R242-S246 PolarHBondContact O-N 3.05Å; M243-S246 WeakPolarHBondContact O-CA 3.45Å; M243-S246 WeakPolarHBondContact O-CB 3.34Å; M243-S246 PolarHBondContact O-N 2.78Å; M243-S246 VanDerWaalsContact O-N 3.09Å; H244-S246 VanDerWaalsContact C-N 3.28Å; H244-S246 PolarHBondContact O-N 3.17Å; S246-F250 WeakPolarHBondContact O-CB 3.37Å; S246-F250 PolarHBondContact O-N 2.91Å
247	L	98.5	Very high	95.5	Very high	17 Å²	17	52.7 Å²	52.7	9%	0.089	26%	0.264	C	S	.	.	H	α-helix	trans	-64.3	-46.4	173.8	-73.8	167	0	0	0	111.6	M243 H244 L249 F250 N251 F287 Q306 F307 L310	M243-L247 HydrophobicContact CG-CD1 4.49Å; M243-L247 PolarHBondContact O-N 3.37Å; H244-L247 PolarHBondContact O-N 3.39Å; L247-L249 VanDerWaalsContact C-N 3.32Å; L247-L249 PolarHBondContact O-N 2.78Å; L247-F250 PolarHBondContact O-N 2.67Å; L247-N251 WeakPolarHBondContact O-CB 3.31Å; L247-N251 PolarHBondContact O-N 2.86Å; L247-F287 HydrophobicContact CD1-CE1 3.76Å; L247-F287 HydrophobicContact CD1-CZ 3.87Å; L247-Q306 HydrophobicContact CD1-CB 4.44Å; L247-Q306 HydrophobicContact CD2-CB 3.97Å; L247-F307 HydrophobicContact CD2-CB 4.49Å; L247-F307 HydrophobicContact CD2-CD1 3.8Å; L247-F307 HydrophobicContact CD2-CD2 3.74Å; L247-F307 HydrophobicContact CD2-CE1 3.81Å; L247-F307 HydrophobicContact CD2-CE2 3.74Å; L247-F307 HydrophobicContact CD2-CG 3.75Å; L247-F307 HydrophobicContact CD2-CZ 3.76Å; L247-F307 HydrophobicContact CG-CE1 4.3Å; L247-F307 HydrophobicContact CG-CE2 4.25Å; L247-F307 HydrophobicContact CG-CZ 4.02Å; L247-L310 HydrophobicContact CB-CD1 4.18Å; L247-L310 HydrophobicContact CD2-CD1 3.78Å; L247-L310 WeakPolarHBondContact O-CD1 3.32Å
248	H	97.7	Very high	95.5	Very high	121 Å²	121	56.9 Å²	56.9	56%	0.56	28%	0.28	S	S	*	.	H	α-helix	trans	-60.1	-43.1	176.5	-77.6	-57.1	0	0	0	112.4	H244 E245 S252	H244-H248 PolarHBondContact O-CD2 2.73Å; H244-H248 PolarHBondContact O-N 3.29Å; E245-H248 PolarHBondContact O-N 2.75Å; H248-S252 PolarHBondContact O-N 3.23Å; H248-S252 VanDerWaalsContact O-N 3.12Å; H248-S252 PolarHBondContact O-OG 3.27Å
249	L	97.3	Very high	95.4	Very high	12 Å²	12	50.8 Å²	50.8	6%	0.063	25%	0.247	C	C	.	.	H	α-helix	trans	-63.5	-46.4	175.8	-179.3	63.3	0	0	0	111.1	A41 W211 F223 E245 L247 N251 S252 I253	A41-L249 HydrophobicContact CB-CD2 4.49Å; W211-L249 HydrophobicContact CH2-CD1 3.82Å; W211-L249 HydrophobicContact CH2-CD2 3.83Å; W211-L249 HydrophobicContact CH2-CG 4.29Å; W211-L249 HydrophobicContact CZ3-CD1 3.7Å; W211-L249 HydrophobicContact CZ3-CD2 4.42Å; W211-L249 HydrophobicContact CZ3-CG 4.42Å; F223-L249 HydrophobicContact CE2-CD2 4.13Å; F223-L249 HydrophobicContact CE2-CG 3.98Å; F223-L249 HydrophobicContact CZ-CB 4.34Å; F223-L249 HydrophobicContact CZ-CD2 4.06Å; F223-L249 HydrophobicContact CZ-CG 4.09Å; E245-L249 VanDerWaalsContact O-CB 3.25Å; E245-L249 WeakPolarHBondContact O-CB 3.46Å; E245-L249 PolarHBondContact O-N 3.04Å; L247-L249 VanDerWaalsContact C-N 3.32Å; L247-L249 PolarHBondContact O-N 2.78Å; L249-N251 PolarHBondContact O-N 3.09Å; L249-S252 WeakPolarHBondContact O-CB 3.4Å; L249-S252 PolarHBondContact O-N 3.13Å; L249-I253 WeakPolarHBondContact O-CG1 3.25Å; L249-I253 PolarHBondContact O-N 2.95Å
250	F	98	Very high	95.2	Very high	0 Å²	0	43.8 Å²	43.8	0%	0	22%	0.219	C	C	.	.	H	α-helix	trans	-60	-46.7	177.7	-175.5	-100	0	0	0	111.8	F223 S246 L247 S252 I253 C254 I264 L266 F307 L310 I319	F223-F250 HydrophobicContact CB-CD2 4.1Å; F223-F250 HydrophobicContact CB-CE2 4.1Å; F223-F250 AromaticContact CD1-CD2 3.56Å; F223-F250 HydrophobicContact CD1-CD2 3.56Å; F223-F250 HydrophobicContact CD1-CE2 4.23Å; F223-F250 HydrophobicContact CD1-CG 4.48Å; F223-F250 AromaticContact CD2-CD2 3.8Å; F223-F250 HydrophobicContact CD2-CD2 3.8Å; F223-F250 HydrophobicContact CE1-CB 3.92Å; F223-F250 AromaticContact CE1-CD2 3.82Å; F223-F250 HydrophobicContact CE1-CD2 3.82Å; F223-F250 HydrophobicContact CE1-CG 4.34Å; F223-F250 HydrophobicContact CE2-CB 4.09Å; F223-F250 HydrophobicContact CE2-CD2 4.04Å; F223-F250 AromaticContact CG-CD2 3.54Å; F223-F250 HydrophobicContact CG-CD2 3.54Å; F223-F250 HydrophobicContact CG-CE2 4.05Å; F223-F250 HydrophobicContact CZ-CB 3.67Å; F223-F250 HydrophobicContact CZ-CD2 4.05Å; F223-F250 HydrophobicContact CZ-CG 4.39Å; S246-F250 WeakPolarHBondContact O-CB 3.37Å; S246-F250 PolarHBondContact O-N 2.91Å; L247-F250 PolarHBondContact O-N 2.67Å; F250-S252 VanDerWaalsContact C-N 3.25Å; F250-S252 PolarHBondContact O-N 2.93Å; F250-I253 PolarHBondContact O-N 3.47Å; F250-I253 VanDerWaalsContact O-N 3.13Å; F250-C254 HydrophobicContact CD1-CB 4.21Å; F250-C254 HydrophobicContact CE1-CB 3.93Å; F250-C254 HydrophobicContact CZ-CB 4.26Å; F250-C254 WeakPolarHBondContact O-CB 3.38Å; F250-C254 PolarHBondContact O-N 2.96Å; F250-I264 HydrophobicContact CE2-CG2 3.92Å; F250-I264 HydrophobicContact CZ-CG2 4.33Å; F250-L266 HydrophobicContact CD2-CD1 4.34Å; F250-L266 HydrophobicContact CE2-CD1 4.08Å; F250-F307 HydrophobicContact CB-CD1 3.71Å; F250-F307 HydrophobicContact CB-CE1 3.72Å; F250-F307 HydrophobicContact CD1-CB 4.48Å; F250-F307 AromaticContact CD1-CD1 3.77Å; F250-F307 HydrophobicContact CD1-CD1 3.77Å; F250-F307 HydrophobicContact CD2-CD1 4.05Å; F250-F307 HydrophobicContact CE1-CB 4.42Å; F250-F307 HydrophobicContact CE1-CD1 4.39Å; F250-F307 VanDerWaalsContact CE1-O 3.23Å; F250-F307 WeakPolarHBondContact CE1-O 3.19Å; F250-F307 AromaticContact CG-CD1 3.56Å; F250-F307 HydrophobicContact CG-CD1 3.56Å; F250-F307 HydrophobicContact CG-CE1 4.07Å; F250-L310 HydrophobicContact CD1-CB 4.14Å; F250-L310 HydrophobicContact CD1-CD1 3.93Å; F250-L310 HydrophobicContact CE1-CB 4.44Å; F250-I319 HydrophobicContact CE1-CD1 4.21Å; F250-I319 HydrophobicContact CZ-CD1 3.91Å; F250-I319 HydrophobicContact CZ-CG2 4.31Å
251	N	97.8	Very high	94.7	Very high	58 Å²	58	46.2 Å²	46.2	31%	0.31	24%	0.243	S	C	.	.	H	α-helix	trans	-54.1	-44.7	176.1	-175.6	37.3	0	0	0	111.5	L247 L249 I253 N255 L310	L247-N251 WeakPolarHBondContact O-CB 3.31Å; L247-N251 PolarHBondContact O-N 2.86Å; L249-N251 PolarHBondContact O-N 3.09Å; N251-I253 PolarHBondContact O-N 3.14Å; N251-N255 WeakPolarHBondContact O-CB 3.39Å; N251-N255 PolarHBondContact O-N 3.46Å; N251-N255 PolarHBondContact O-ND2 3.16Å; N251-N255 PolarHBondContact OD1-ND2 3.01Å; N251-L310 HydrophobicContact CB-CB 4.41Å; N251-L310 HydrophobicContact CB-CD1 4.1Å; N251-L310 HydrophobicContact CB-CD2 4.1Å; N251-L310 HydrophobicContact CB-CG 4.43Å
252	S	95.8	Very high	94.3	Very high	73 Å²	73	45.8 Å²	45.8	51%	0.51	24%	0.242	S	C	.	.	H	α-helix	trans	-64.9	-37	179.9	-57.9	0	0	0	0	112.8	H248 L249 F250 H256	H248-S252 PolarHBondContact O-N 3.23Å; H248-S252 VanDerWaalsContact O-N 3.12Å; H248-S252 PolarHBondContact O-OG 3.27Å; L249-S252 WeakPolarHBondContact O-CB 3.4Å; L249-S252 PolarHBondContact O-N 3.13Å; F250-S252 VanDerWaalsContact C-N 3.25Å; F250-S252 PolarHBondContact O-N 2.93Å; S252-H256 WeakPolarHBondContact O-CB 3.22Å; S252-H256 PolarHBondContact O-N 3.42Å
253	I	94.8	Very high	93.9	Very high	10 Å²	10	45.5 Å²	45.5	5%	0.051	24%	0.243	C	C	.	.	H	α-helix	trans	-78.6	-49	178.4	-65.3	-57.1	0	0	0	111.4	L39 W211 F215 I221 L249 F250 N251 N255 H256 F259 I264	L39-I253 HydrophobicContact CD1-CD1 3.85Å; L39-I253 HydrophobicContact CD1-CG1 4.05Å; L39-I253 HydrophobicContact CD1-CG2 3.72Å; W211-I253 HydrophobicContact CE3-CD1 4.23Å; W211-I253 HydrophobicContact CZ3-CD1 4.1Å; W211-I253 HydrophobicContact CZ3-CG1 4.45Å; F215-I253 HydrophobicContact CZ-CD1 4.35Å; I221-I253 HydrophobicContact CD1-CG2 4.07Å; I221-I253 HydrophobicContact CG2-CG2 4.48Å; L249-I253 WeakPolarHBondContact O-CG1 3.25Å; L249-I253 PolarHBondContact O-N 2.95Å; F250-I253 PolarHBondContact O-N 3.47Å; F250-I253 VanDerWaalsContact O-N 3.13Å; N251-I253 PolarHBondContact O-N 3.14Å; I253-N255 PolarHBondContact O-N 3.34Å; I253-H256 WeakPolarHBondContact O-CB 3.5Å; I253-H256 PolarHBondContact O-N 3.14Å; I253-H256 VanDerWaalsContact O-N 3.11Å; I253-F259 HydrophobicContact CD1-CE2 4.32Å; I253-F259 HydrophobicContact CG2-CD2 4.03Å; I253-F259 HydrophobicContact CG2-CE2 4.21Å; I253-I264 HydrophobicContact CG2-CD1 4.49Å
254	C	95.1	Very high	93.7	Very high	2 Å²	2	45.4 Å²	45.4	1%	0.014	24%	0.243	C	C	.	.	H	α-helix	trans	-56.7	-40	-177	-176.2	0	0	0	0	111.6	F250 I264 K317	F250-C254 HydrophobicContact CD1-CB 4.21Å; F250-C254 HydrophobicContact CE1-CB 3.93Å; F250-C254 HydrophobicContact CZ-CB 4.26Å; F250-C254 WeakPolarHBondContact O-CB 3.38Å; F250-C254 PolarHBondContact O-N 2.96Å; C254-I264 HydrophobicContact CB-CD1 4.14Å; C254-K317 PolarHBondContact O-NZ 3.15Å
255	N	94.5	Very high	93.6	Very high	36 Å²	36	42.1 Å²	42.1	19%	0.193	23%	0.227	C	C	.	.	T	Hydrogen-bonded Turn	trans	-100	10.3	-177.2	-58.9	-52.1	0	0	0	113.3	N251 I253 L310 M312	N251-N255 WeakPolarHBondContact O-CB 3.39Å; N251-N255 PolarHBondContact O-N 3.46Å; N251-N255 PolarHBondContact O-ND2 3.16Å; N251-N255 PolarHBondContact OD1-ND2 3.01Å; I253-N255 PolarHBondContact O-N 3.34Å; N255-L310 PolarHBondContact ND2-O 2.96Å; N255-M312 WeakPolarHBondContact OD1-CB 3.29Å; N255-M312 PolarHBondContact OD1-N 3.16Å
256	H	92.4	Very high	93.6	Very high	67 Å²	67	41.4 Å²	41.4	31%	0.31	22%	0.224	S	C	.	.			trans	-68.8	140.7	178.7	-158.8	-86.6	0	0	0	111.9	S252 I253 F258 F259 A260	S252-H256 WeakPolarHBondContact O-CB 3.22Å; S252-H256 PolarHBondContact O-N 3.42Å; I253-H256 WeakPolarHBondContact O-CB 3.5Å; I253-H256 PolarHBondContact O-N 3.14Å; I253-H256 VanDerWaalsContact O-N 3.11Å; H256-F258 VanDerWaalsContact C-N 3.35Å; H256-F258 AromaticContact CE1-CD2 3.22Å; H256-F258 WeakPolarHBondContact CE1-CD2 3.46Å; H256-F258 AromaticContact CE1-CE2 3.89Å; H256-F258 AromaticContact ND1-CD2 3.55Å; H256-F258 AromaticContact ND1-CG 3.98Å; H256-F258 PolarHBondContact ND1-N 3.5Å; H256-F258 PolarHBondContact O-N 3.13Å; H256-F259 HydrophobicContact CB-CB 4.49Å; H256-F259 HydrophobicContact CB-CD2 3.8Å; H256-F259 HydrophobicContact CB-CG 4.48Å; H256-F259 CarbonylContact O-C 3.6Å; H256-F259 PolarHBondContact O-N 2.99Å; H256-A260 PolarHBondContact O-N 2.95Å
257	K	90.3	Very high	93.6	Very high	182 Å²	182	41.4 Å²	41.4	79%	0.791	22%	0.223	S	C	*	.	G	3₁₀ helix	trans	-59.5	-40.4	-178.8	-66	-176.3	-179.5	-179.4	0	113.4	F259 A260	K257-F259 PolarHBondContact O-N 2.98Å; K257-A260 WeakPolarHBondContact O-CB 3.38Å; K257-A260 PolarHBondContact O-N 3.16Å
258	F	89.5	Confident	93.6	Very high	136 Å²	136	40.6 Å²	40.6	60%	0.596	22%	0.219	S	C	*	.	G	3₁₀ helix	trans	-63.7	-19.9	175.6	-70	-61.7	0	0	0	113.7	I212 F215 H256	I212-F258 HydrophobicContact CD1-CD2 3.95Å; I212-F258 HydrophobicContact CD1-CE2 3.72Å; F215-F258 HydrophobicContact CD2-CB 4.32Å; F215-F258 HydrophobicContact CD2-CD2 4.08Å; H256-F258 VanDerWaalsContact C-N 3.35Å; H256-F258 AromaticContact CE1-CD2 3.22Å; H256-F258 WeakPolarHBondContact CE1-CD2 3.46Å; H256-F258 AromaticContact CE1-CE2 3.89Å; H256-F258 AromaticContact ND1-CD2 3.55Å; H256-F258 AromaticContact ND1-CG 3.98Å; H256-F258 PolarHBondContact ND1-N 3.5Å; H256-F258 PolarHBondContact O-N 3.13Å
259	F	90.4	Very high	93.6	Very high	0 Å²	0	35 Å²	35	0%	0	19%	0.194	C	C	.	.	G	3₁₀ helix	trans	-115.2	22.8	-176.7	-54.7	-44.4	0	0	0	112.7	L37 L39 F215 I221 I253 H256 K257 A261 T262 K317	L37-F259 HydrophobicContact CD2-CZ 4.13Å; L39-F259 HydrophobicContact CD1-CE2 4.48Å; F215-F259 HydrophobicContact CB-CE1 4.14Å; F215-F259 HydrophobicContact CB-CZ 4.05Å; F215-F259 HydrophobicContact CD1-CE1 4.24Å; F215-F259 HydrophobicContact CD1-CE2 4.2Å; F215-F259 AromaticContact CD1-CZ 3.39Å; F215-F259 HydrophobicContact CD1-CZ 3.39Å; F215-F259 HydrophobicContact CD2-CE1 4.18Å; F215-F259 AromaticContact CD2-CE2 3.81Å; F215-F259 HydrophobicContact CD2-CE2 3.81Å; F215-F259 AromaticContact CD2-CZ 3.45Å; F215-F259 HydrophobicContact CD2-CZ 3.45Å; F215-F259 VanDerWaalsContact CD2-CZ 3.45Å; F215-F259 AromaticContact CE1-CE2 3.89Å; F215-F259 HydrophobicContact CE1-CE2 3.89Å; F215-F259 AromaticContact CE1-CZ 3.51Å; F215-F259 HydrophobicContact CE1-CZ 3.51Å; F215-F259 AromaticContact CE2-CE2 3.5Å; F215-F259 HydrophobicContact CE2-CE2 3.5Å; F215-F259 VanDerWaalsContact CE2-CE2 3.5Å; F215-F259 AromaticContact CE2-CZ 3.6Å; F215-F259 HydrophobicContact CE2-CZ 3.6Å; F215-F259 AromaticContact CG-CE1 3.95Å; F215-F259 HydrophobicContact CG-CE1 3.95Å; F215-F259 HydrophobicContact CG-CE2 4.16Å; F215-F259 AromaticContact CG-CZ 3.36Å; F215-F259 HydrophobicContact CG-CZ 3.36Å; F215-F259 AromaticContact CZ-CE2 3.53Å; F215-F259 HydrophobicContact CZ-CE2 3.53Å; F215-F259 AromaticContact CZ-CZ 3.62Å; F215-F259 HydrophobicContact CZ-CZ 3.62Å; I221-F259 HydrophobicContact CD1-CB 4.02Å; I221-F259 HydrophobicContact CD1-CD1 3.6Å; I221-F259 HydrophobicContact CD1-CD2 3.61Å; I221-F259 HydrophobicContact CD1-CE1 3.79Å; I221-F259 HydrophobicContact CD1-CE2 3.81Å; I221-F259 HydrophobicContact CD1-CG 3.48Å; I221-F259 VanDerWaalsContact CD1-CG 3.48Å; I221-F259 HydrophobicContact CD1-CZ 3.85Å; I221-F259 HydrophobicContact CG1-CE1 4.47Å; I253-F259 HydrophobicContact CD1-CE2 4.32Å; I253-F259 HydrophobicContact CG2-CD2 4.03Å; I253-F259 HydrophobicContact CG2-CE2 4.21Å; H256-F259 HydrophobicContact CB-CB 4.49Å; H256-F259 HydrophobicContact CB-CD2 3.8Å; H256-F259 HydrophobicContact CB-CG 4.48Å; H256-F259 CarbonylContact O-C 3.6Å; H256-F259 PolarHBondContact O-N 2.99Å; K257-F259 PolarHBondContact O-N 2.98Å; F259-A261 PolarHBondContact O-N 2.83Å; F259-T262 HydrophobicContact CD1-CG2 4.42Å; F259-T262 PolarHBondContact O-N 3.28Å; F259-K317 PolarHBondContact O-NZ 3.4Å
260	A	87.8	Confident	93.6	Very high	29 Å²	29	35.2 Å²	35.2	24%	0.24	19%	0.194	C	C	.	.	S	Bend	trans	-53.7	-40.5	-177.8	0	0	0	0	0	113.4	H256 K257	H256-A260 PolarHBondContact O-N 2.95Å; K257-A260 WeakPolarHBondContact O-CB 3.38Å; K257-A260 PolarHBondContact O-N 3.16Å
261	A	83.4	Confident	93.6	Very high	85 Å²	85	37.9 Å²	37.9	70%	0.702	21%	0.205	S	C	*	.	S	Bend	trans	-115.5	-0.2	179.6	0	0	0	0	0	112.9	F259 S263	F259-A261 PolarHBondContact O-N 2.83Å; A261-S263 PolarHBondContact O-N 3.23Å
262	T	88.9	Confident	93.5	Very high	22 Å²	22	37.5 Å²	37.5	14%	0.135	20%	0.203	C	C	.	.			trans	-77.2	124.3	-179.6	-50.4	0	0	0	0	109.9	V218 I221 F259 K317	V218-T262 HydrophobicContact CG1-CG2 4.22Å; I221-T262 HydrophobicContact CD1-CG2 4.16Å; I221-T262 HydrophobicContact CG1-CG2 4.03Å; F259-T262 HydrophobicContact CD1-CG2 4.42Å; F259-T262 PolarHBondContact O-N 3.28Å; T262-K317 WeakPolarHBondContact O-CE 3.26Å; T262-K317 PolarHBondContact O-NZ 2.73Å
263	S	87.8	Confident	93.5	Very high	15 Å²	15	36.7 Å²	36.7	11%	0.105	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-62.7	144.5	176.8	-57.1	0	0	0	0	112	I221 A261 E346	I221-S263 PolarHBondContact N-O 3.3Å; A261-S263 PolarHBondContact O-N 3.23Å; S263-E346 WeakPolarHBondContact CB-OE2 3.32Å; S263-E346 PolarHBondContact OG-OE1 2.88Å; S263-E346 PolarHBondContact OG-OE2 3.44Å
264	I	93.7	Very high	93.7	Very high	0 Å²	0	36.2 Å²	36.2	0%	0	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123	126.5	179.5	-61.2	-175.4	0	0	0	109.3	I221 F223 F250 I253 C254 K317 I319 Y320	I221-I264 HydrophobicContact CB-CG1 4.17Å; I221-I264 HydrophobicContact CD1-CG1 4.34Å; I221-I264 WeakPolarHBondContact O-CA 3.45Å; F223-I264 HydrophobicContact CB-CG2 4.33Å; F250-I264 HydrophobicContact CE2-CG2 3.92Å; F250-I264 HydrophobicContact CZ-CG2 4.33Å; I253-I264 HydrophobicContact CG2-CD1 4.49Å; C254-I264 HydrophobicContact CB-CD1 4.14Å; I264-K317 VanDerWaalsContact CG1-CE 3.48Å; I264-I319 HydrophobicContact CB-CG1 4.31Å; I264-I319 HydrophobicContact CG2-CG2 4.41Å; I264-I319 WeakPolarHBondContact O-CA 3.5Å; I264-Y320 PolarHBondContact O-N 3.47Å
265	V	95.6	Very high	93.8	Very high	0 Å²	0	40.3 Å²	40.3	0%	0	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.3	123.5	164.6	179.7	0	0	0	0	107.9	I221 I222 F223 F267 Y320 V339	I221-V265 PolarHBondContact O-N 2.61Å; I222-V265 CarbonylContact C-O 3.59Å; I222-V265 WeakPolarHBondContact CA-O 3.47Å; I222-V265 HydrophobicContact CG1-CB 4.38Å; F223-V265 PolarHBondContact N-O 2.84Å; V265-F267 HydrophobicContact CG1-CD1 3.71Å; V265-F267 HydrophobicContact CG1-CE1 3.34Å; V265-F267 HydrophobicContact CG1-CZ 4.21Å; V265-Y320 CarbonylContact C-O 3.53Å; V265-Y320 VanDerWaalsContact CA-O 3.29Å; V265-Y320 WeakPolarHBondContact CA-O 3.31Å; V265-V339 HydrophobicContact CB-CG2 4.29Å; V265-V339 HydrophobicContact CG1-CG2 3.54Å; V265-V339 HydrophobicContact CG2-CB 4.47Å; V265-V339 HydrophobicContact CG2-CG1 3.9Å; V265-V339 HydrophobicContact CG2-CG2 3.88Å
266	L	97.6	Very high	93.8	Very high	0 Å²	0	43.6 Å²	43.6	0%	0	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.4	113.5	177.1	174.9	64.8	0	0	0	109.9	F223 A225 F250 L268 F307 I319 Y320 S321 H322	F223-L266 HydrophobicContact CB-CD1 4.42Å; F223-L266 HydrophobicContact CD1-CD1 3.77Å; A225-L266 HydrophobicContact CB-CD1 4.42Å; F250-L266 HydrophobicContact CD2-CD1 4.34Å; F250-L266 HydrophobicContact CE2-CD1 4.08Å; L266-L268 HydrophobicContact CD1-CD2 4.33Å; L266-L268 HydrophobicContact CD2-CD2 4.09Å; L266-L268 HydrophobicContact CD2-CG 4.32Å; L266-L268 HydrophobicContact CG-CD2 4.14Å; L266-L268 HydrophobicContact CG-CG 4.24Å; L266-F307 HydrophobicContact CD1-CD1 4.14Å; L266-F307 HydrophobicContact CD1-CG 4.35Å; L266-F307 HydrophobicContact CD2-CB 3.43Å; L266-F307 VanDerWaalsContact CD2-CB 3.43Å; L266-F307 HydrophobicContact CD2-CD1 4.37Å; L266-F307 HydrophobicContact CD2-CD2 4.47Å; L266-F307 HydrophobicContact CD2-CG 3.86Å; L266-I319 HydrophobicContact CB-CG2 3.98Å; L266-Y320 PolarHBondContact N-O 3.45Å; L266-S321 CarbonylContact O-C 3.59Å; L266-S321 VanDerWaalsContact O-CA 3.31Å; L266-S321 WeakPolarHBondContact O-CA 3.32Å; L266-H322 PolarHBondContact O-N 2.81Å
267	F	98.1	Very high	94	Very high	4 Å²	4	42.2 Å²	42.2	2%	0.018	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.4	109.7	169.9	-73.3	-3.6	0	0	0	110.1	I49 I222 F223 A225 V265 N269 H322 T324 V335 V339	I49-F267 HydrophobicContact CD1-CD2 4.11Å; I49-F267 HydrophobicContact CD1-CE2 4.1Å; I49-F267 HydrophobicContact CG1-CD2 4.23Å; I49-F267 HydrophobicContact CG1-CE2 4.37Å; I49-F267 HydrophobicContact CG2-CE2 4.36Å; I222-F267 HydrophobicContact CG2-CD1 4.45Å; I222-F267 HydrophobicContact CG2-CD2 3.56Å; I222-F267 HydrophobicContact CG2-CE1 4.45Å; I222-F267 HydrophobicContact CG2-CE2 3.56Å; I222-F267 HydrophobicContact CG2-CG 4.03Å; I222-F267 HydrophobicContact CG2-CZ 4.03Å; F223-F267 PolarHBondContact O-N 2.72Å; A225-F267 PolarHBondContact N-O 2.83Å; V265-F267 HydrophobicContact CG1-CD1 3.71Å; V265-F267 HydrophobicContact CG1-CE1 3.34Å; V265-F267 HydrophobicContact CG1-CZ 4.21Å; F267-N269 PolarHBondContact O-N 3.17Å; F267-H322 HydrophobicContact CD1-CB 4.23Å; F267-H322 HydrophobicContact CE1-CB 4.43Å; F267-T324 HydrophobicContact CB-CG2 4.26Å; F267-T324 HydrophobicContact CD1-CG2 3.95Å; F267-T324 HydrophobicContact CD2-CG2 4.41Å; F267-T324 HydrophobicContact CE1-CG2 4.41Å; F267-T324 HydrophobicContact CG-CG2 3.96Å; F267-V335 HydrophobicContact CD1-CG1 4.08Å; F267-V335 HydrophobicContact CE1-CG1 3.24Å; F267-V335 HydrophobicContact CZ-CG1 3.55Å; F267-V339 HydrophobicContact CE1-CG2 4.14Å; F267-V339 HydrophobicContact CZ-CG2 4.31Å
268	L	98.4	Very high	94.3	Very high	1 Å²	1	33.6 Å²	33.6	1%	0.005	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.6	82.9	168.1	-63.6	176.3	0	0	0	107.9	A225 L227 L266 K304 F307 H322 M323 T324	A225-L268 HydrophobicContact CB-CD2 4.23Å; L227-L268 HydrophobicContact CD1-CB 3.94Å; L227-L268 WeakPolarHBondContact CD1-O 3.16Å; L227-L268 HydrophobicContact CD2-CB 3.96Å; L227-L268 HydrophobicContact CD2-CD1 4.48Å; L227-L268 HydrophobicContact CD2-CD2 4.2Å; L227-L268 HydrophobicContact CD2-CG 4.44Å; L227-L268 HydrophobicContact CG-CB 3.86Å; L266-L268 HydrophobicContact CD1-CD2 4.33Å; L266-L268 HydrophobicContact CD2-CD2 4.09Å; L266-L268 HydrophobicContact CD2-CG 4.32Å; L266-L268 HydrophobicContact CG-CD2 4.14Å; L266-L268 HydrophobicContact CG-CG 4.24Å; L268-K304 HydrophobicContact CD1-CB 3.53Å; L268-K304 HydrophobicContact CD1-CD 4.44Å; L268-K304 HydrophobicContact CD1-CG 3.97Å; L268-F307 HydrophobicContact CD2-CD2 3.96Å; L268-F307 HydrophobicContact CD2-CE2 4.15Å; L268-H322 PolarHBondContact N-O 3.29Å; L268-M323 HydrophobicContact CB-CG 4.3Å; L268-M323 HydrophobicContact CD1-CG 4.45Å; L268-M323 CarbonylContact O-C 3.33Å; L268-M323 WeakPolarHBondContact O-CA 3.46Å; L268-T324 PolarHBondContact O-N 2.89Å
269	N	98.2	Very high	94.6	Very high	4 Å²	4	33.4 Å²	33.4	2%	0.021	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.9	168.9	-169.3	-168.2	27.9	0	0	0	112.7	S44 A225 L227 F267 K271 T324 A326	S44-N269 PolarHBondContact O-ND2 2.93Å; A225-N269 PolarHBondContact O-N 2.78Å; L227-N269 WeakPolarHBondContact CB-O 3.3Å; L227-N269 PolarHBondContact N-O 3.15Å; F267-N269 PolarHBondContact O-N 3.17Å; N269-K271 VanDerWaalsContact C-N 3.29Å; N269-T324 CarbonylContact C-O 3.57Å; N269-T324 VanDerWaalsContact CA-O 3.3Å; N269-T324 WeakPolarHBondContact CA-O 3.47Å; N269-T324 VanDerWaalsContact CA-OG1 3.27Å; N269-T324 WeakPolarHBondContact CA-OG1 3.24Å; N269-T324 WeakPolarHBondContact CB-OG1 3.35Å; N269-T324 PolarHBondContact OD1-O 3.14Å; N269-T324 PolarHBondContact OD1-OG1 3.31Å; N269-A326 WeakPolarHBondContact ND2-CB 3.47Å; N269-A326 WeakPolarHBondContact OD1-CB 3.48Å; N269-A326 PolarHBondContact OD1-N 3.41Å
270	K	97.6	Very high	94.8	Very high	16 Å²	16	40.1 Å²	40.1	7%	0.07	21%	0.208	C	C	.	.			trans	61.2	37.5	-177.9	-49.9	-176.9	-172.2	177.4	0	112.4	E43 D150 A226 S228 D272 L273 F274 T324	E43-K270 WeakPolarHBondContact O-CE 3.42Å; E43-K270 PolarHBondContact O-NZ 3.32Å; D150-K270 WeakPolarHBondContact OD2-CD 3.3Å; D150-K270 WeakPolarHBondContact OD2-CE 3.42Å; D150-K270 IonicContact OD2-NZ 3.77Å; D150-K270 PolarHBondContact OD2-NZ 2.74Å; A226-K270 HydrophobicContact CB-CD 3.89Å; A226-K270 HydrophobicContact CB-CG 4.48Å; S228-K270 VanDerWaalsContact OG-CD 3.29Å; S228-K270 WeakPolarHBondContact OG-CD 3.32Å; K270-D272 VanDerWaalsContact C-OD1 3.25Å; K270-D272 WeakPolarHBondContact CA-OD1 3.41Å; K270-D272 PolarHBondContact O-N 2.66Å; K270-L273 HydrophobicContact CB-CB 4.37Å; K270-L273 HydrophobicContact CB-CD1 4.29Å; K270-L273 HydrophobicContact CD-CD1 4.19Å; K270-L273 PolarHBondContact O-N 2.97Å; K270-F274 PolarHBondContact O-N 3.17Å; K270-T324 PolarHBondContact N-O 3.33Å; K270-T324 VanDerWaalsContact N-O 3.08Å
271	K	97.3	Very high	95.1	Very high	56 Å²	56	41 Å²	41	24%	0.243	21%	0.209	C	C	.	.	H	α-helix	trans	-60.1	-31.7	179.6	75.9	178.4	-174	168.9	0	112.6	L227 N269 F274 E275 Y296 M323 T324 C325	L227-K271 HydrophobicContact CD1-CB 4.07Å; N269-K271 VanDerWaalsContact C-N 3.29Å; K271-F274 PolarHBondContact O-N 3.36Å; K271-E275 WeakPolarHBondContact O-CB 3.37Å; K271-E275 PolarHBondContact O-N 3.46Å; K271-Y296 HydrophobicContact CB-CE2 4.18Å; K271-M323 HydrophobicContact CD-CB 4.25Å; K271-T324 WeakPolarHBondContact CG-O 3.45Å; K271-T324 PolarHBondContact N-O 2.95Å; K271-T324 VanDerWaalsContact N-O 3.14Å; K271-C325 HydrophobicContact CG-CB 4.21Å
272	D	96.4	Very high	95.8	Very high	50 Å²	50	40.3 Å²	40.3	27%	0.267	19%	0.192	S	C	.	.	H	α-helix	trans	-63.3	-48.2	175.8	57.6	-42.6	0	0	0	111.6	K270 F274 E275 E276	K270-D272 VanDerWaalsContact C-OD1 3.25Å; K270-D272 WeakPolarHBondContact CA-OD1 3.41Å; K270-D272 PolarHBondContact O-N 2.66Å; D272-F274 VanDerWaalsContact C-N 3.33Å; D272-E275 PolarHBondContact O-N 3.07Å; D272-E276 PolarHBondContact O-N 2.92Å
273	L	96.4	Very high	96.2	Very high	56 Å²	56	39.3 Å²	39.3	29%	0.293	19%	0.185	S	C	.	.	H	α-helix	trans	-69.6	-34.5	177	-59.5	-178.9	0	0	0	111.7	D150 K270 K277	D150-L273 HydrophobicContact CB-CD1 3.75Å; K270-L273 HydrophobicContact CB-CB 4.37Å; K270-L273 HydrophobicContact CB-CD1 4.29Å; K270-L273 HydrophobicContact CD-CD1 4.19Å; K270-L273 PolarHBondContact O-N 2.97Å; L273-K277 WeakPolarHBondContact O-CB 3.36Å; L273-K277 PolarHBondContact O-N 3.15Å; L273-K277 VanDerWaalsContact O-N 3.09Å
274	F	97.9	Very high	96.6	Very high	0 Å²	0	40.6 Å²	40.6	0%	0	19%	0.194	C	C	.	.	H	α-helix	trans	-64.8	-42.8	175.5	177.5	-108.3	0	0	0	112	L227 Y230 K270 K271 D272 E276 K277 I278 Y296 A299 I303	L227-F274 HydrophobicContact CB-CB 3.67Å; L227-F274 HydrophobicContact CB-CD1 4.36Å; L227-F274 HydrophobicContact CB-CD2 4.03Å; L227-F274 HydrophobicContact CB-CG 3.77Å; L227-F274 HydrophobicContact CD1-CD1 4.34Å; L227-F274 WeakPolarHBondContact O-CD2 3.39Å; Y230-F274 AromaticContact CD1-CD2 3.98Å; Y230-F274 HydrophobicContact CD1-CD2 3.98Å; Y230-F274 AromaticContact CD1-CE2 3.96Å; Y230-F274 HydrophobicContact CD1-CE2 3.96Å; Y230-F274 AromaticContact CE1-CD2 3.84Å; Y230-F274 HydrophobicContact CE1-CD2 3.84Å; Y230-F274 AromaticContact CE1-CE2 3.86Å; Y230-F274 HydrophobicContact CE1-CE2 3.86Å; K270-F274 PolarHBondContact O-N 3.17Å; K271-F274 PolarHBondContact O-N 3.36Å; D272-F274 VanDerWaalsContact C-N 3.33Å; F274-E276 VanDerWaalsContact C-N 3.31Å; F274-E276 PolarHBondContact O-N 2.77Å; F274-K277 PolarHBondContact O-N 3.37Å; F274-I278 HydrophobicContact CE2-CB 4.29Å; F274-I278 HydrophobicContact CE2-CD1 3.91Å; F274-I278 HydrophobicContact CE2-CG1 4.34Å; F274-I278 HydrophobicContact CZ-CB 4.25Å; F274-I278 HydrophobicContact CZ-CD1 3.95Å; F274-I278 HydrophobicContact CZ-CG1 4.08Å; F274-I278 WeakPolarHBondContact O-CB 3.39Å; F274-I278 WeakPolarHBondContact O-CG2 3.47Å; F274-I278 PolarHBondContact O-N 3.08Å; F274-Y296 AromaticContact CD1-CD2 3.7Å; F274-Y296 HydrophobicContact CD1-CD2 3.7Å; F274-Y296 AromaticContact CD1-CE2 3.9Å; F274-Y296 HydrophobicContact CD1-CE2 3.9Å; F274-Y296 HydrophobicContact CE1-CD2 4.06Å; F274-Y296 HydrophobicContact CE1-CE2 4.5Å; F274-A299 HydrophobicContact CE1-CB 4.43Å; F274-A299 HydrophobicContact CZ-CB 3.74Å; F274-I303 HydrophobicContact CE2-CD1 3.77Å; F274-I303 HydrophobicContact CZ-CD1 3.94Å
275	E	97.1	Very high	96.7	Very high	88 Å²	88	45.2 Å²	45.2	41%	0.411	22%	0.218	S	C	.	.	H	α-helix	trans	-58.8	-39.6	178.9	-174.5	174.8	-175.1	0	0	112.8	K271 D272 K279 Y296	K271-E275 WeakPolarHBondContact O-CB 3.37Å; K271-E275 PolarHBondContact O-N 3.46Å; D272-E275 PolarHBondContact O-N 3.07Å; E275-K279 WeakPolarHBondContact O-CD 3.16Å; E275-K279 WeakPolarHBondContact O-CE 3.28Å; E275-K279 WeakPolarHBondContact O-CG 3.47Å; E275-Y296 HydrophobicContact CB-CD2 3.73Å; E275-Y296 HydrophobicContact CB-CE2 4.17Å; E275-Y296 HydrophobicContact CG-CD2 4.09Å; E275-Y296 HydrophobicContact CG-CG 4.4Å
276	E	95	Very high	96.8	Very high	105 Å²	105	45.3 Å²	45.3	49%	0.491	22%	0.219	S	C	.	.	H	α-helix	trans	-75.1	-39.6	176	-68.2	-52.7	120.8	0	0	112.7	D272 F274 K279	D272-E276 PolarHBondContact O-N 2.92Å; F274-E276 VanDerWaalsContact C-N 3.31Å; F274-E276 PolarHBondContact O-N 2.77Å; E276-K279 IonicContact OE1-NZ 2.73Å; E276-K279 PolarHBondContact OE1-NZ 3.5Å; E276-K279 IonicContact OE2-NZ 2.98Å
277	K	95.6	Very high	96.8	Very high	37 Å²	37	45.5 Å²	45.5	16%	0.161	22%	0.22	C	C	.	.	H	α-helix	trans	-72.6	-39.6	-175.2	-175.1	-179.3	-84.1	-160.2	0	113	S228 Y230 D231 L273 F274 K279 K280 V281	S228-K277 PolarHBondContact O-NZ 3.26Å; Y230-K277 HydrophobicContact CD1-CD 4.31Å; Y230-K277 HydrophobicContact CE1-CB 4.46Å; Y230-K277 HydrophobicContact CE1-CD 3.55Å; Y230-K277 HydrophobicContact CE1-CG 3.88Å; Y230-K277 PolarHBondContact OH-O 3.49Å; D231-K277 VanDerWaalsContact CG-NZ 3.28Å; D231-K277 WeakPolarHBondContact OD1-CD 3.31Å; D231-K277 IonicContact OD1-NZ 3.05Å; D231-K277 PolarHBondContact OD1-NZ 2.88Å; D231-K277 VanDerWaalsContact OD2-CD 3.23Å; D231-K277 WeakPolarHBondContact OD2-CD 3.07Å; D231-K277 VanDerWaalsContact OD2-CE 3.3Å; D231-K277 WeakPolarHBondContact OD2-CE 3.41Å; D231-K277 IonicContact OD2-NZ 2.82Å; D231-K277 PolarHBondContact OD2-NZ 2.86Å; D231-K277 VanDerWaalsContact OD2-NZ 3.12Å; L273-K277 WeakPolarHBondContact O-CB 3.36Å; L273-K277 PolarHBondContact O-N 3.15Å; L273-K277 VanDerWaalsContact O-N 3.09Å; F274-K277 PolarHBondContact O-N 3.37Å; K277-K279 PolarHBondContact O-N 2.91Å; K277-K280 PolarHBondContact O-N 3.17Å; K277-V281 PolarHBondContact O-N 3.15Å
278	I	97.1	Very high	96.7	Very high	2 Å²	2	50.3 Å²	50.3	1%	0.01	25%	0.251	C	S	.	.	H	α-helix	trans	-61.9	-28.2	-178.5	-160.4	64.9	0	0	0	111.5	Y230 F274 K280 L283 N294 A299	Y230-I278 HydrophobicContact CE1-CD1 4.5Å; Y230-I278 WeakPolarHBondContact OH-CA 3.38Å; F274-I278 HydrophobicContact CE2-CB 4.29Å; F274-I278 HydrophobicContact CE2-CD1 3.91Å; F274-I278 HydrophobicContact CE2-CG1 4.34Å; F274-I278 HydrophobicContact CZ-CB 4.25Å; F274-I278 HydrophobicContact CZ-CD1 3.95Å; F274-I278 HydrophobicContact CZ-CG1 4.08Å; F274-I278 WeakPolarHBondContact O-CB 3.39Å; F274-I278 WeakPolarHBondContact O-CG2 3.47Å; F274-I278 PolarHBondContact O-N 3.08Å; I278-K280 PolarHBondContact O-N 3.29Å; I278-L283 HydrophobicContact CD1-CB 4.09Å; I278-N294 WeakPolarHBondContact CD1-OD1 3.5Å; I278-N294 WeakPolarHBondContact CG1-OD1 2.87Å; I278-N294 PolarHBondContact O-ND2 3.28Å; I278-A299 HydrophobicContact CD1-CB 3.78Å; I278-A299 HydrophobicContact CG1-CB 3.91Å
279	K	95.7	Very high	96.6	Very high	132 Å²	132	55.7 Å²	55.7	57%	0.574	28%	0.276	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.1	-23.6	174	-61.9	166.1	-172.1	167	0	113.3	E275 E276 K277	E275-K279 WeakPolarHBondContact O-CD 3.16Å; E275-K279 WeakPolarHBondContact O-CE 3.28Å; E275-K279 WeakPolarHBondContact O-CG 3.47Å; E276-K279 IonicContact OE1-NZ 2.73Å; E276-K279 PolarHBondContact OE1-NZ 3.5Å; E276-K279 IonicContact OE2-NZ 2.98Å; K277-K279 PolarHBondContact O-N 2.91Å
280	K	94.4	Very high	96.5	Very high	141 Å²	141	56.2 Å²	56.2	61%	0.613	28%	0.278	S	S	*	.	T	Hydrogen-bonded Turn	trans	-105.5	-40.7	-173.5	-60.9	179.6	179.8	178.4	0	112.8	E141 K277 I278	E141-K280 IonicContact OE1-NZ 2.67Å; E141-K280 IonicContact OE2-NZ 3.83Å; E141-K280 PolarHBondContact OE2-NZ 2.88Å; K277-K280 PolarHBondContact O-N 3.17Å; I278-K280 PolarHBondContact O-N 3.29Å
281	V	95.6	Very high	96.3	Very high	46 Å²	46	63 Å²	63	28%	0.279	32%	0.315	S	S	.	.	S	Bend	trans	-122.3	121.8	-171.8	-175.6	0	0	0	0	110	Y230 D231 K277 I285	Y230-V281 HydrophobicContact CE2-CB 4.34Å; Y230-V281 HydrophobicContact CE2-CG1 4.08Å; Y230-V281 PolarHBondContact OH-O 3.42Å; D231-V281 HydrophobicContact CB-CG1 4.29Å; K277-V281 PolarHBondContact O-N 3.15Å; V281-I285 HydrophobicContact CG1-CD1 3.27Å; V281-I285 HydrophobicContact CG1-CG1 4.09Å; V281-I285 HydrophobicContact CG1-CG2 4.36Å
282	H	96.9	Very high	96.1	Very high	72 Å²	72	61.5 Å²	61.5	33%	0.333	32%	0.316	S	S	.	.			trans	-67	138.4	-177.2	-160.5	-91.1	0	0	0	112.5	S284 I285 Y290 N294	H282-S284 VanDerWaalsContact ND1-CB 3.28Å; H282-S284 WeakPolarHBondContact ND1-CB 3.48Å; H282-S284 PolarHBondContact ND1-N 3.02Å; H282-S284 VanDerWaalsContact ND1-N 3.19Å; H282-S284 PolarHBondContact ND1-OG 3.2Å; H282-S284 PolarHBondContact O-N 2.95Å; H282-I285 WeakPolarHBondContact O-CG1 3.37Å; H282-I285 PolarHBondContact O-N 2.89Å; H282-Y290 AromaticContact CE1-CD1 3.95Å; H282-N294 WeakPolarHBondContact CA-ND2 3.28Å; H282-N294 WeakPolarHBondContact CA-OD1 3.23Å; H282-N294 VanDerWaalsContact CD2-CB 3.46Å; H282-N294 WeakPolarHBondContact CD2-CB 3.48Å; H282-N294 VanDerWaalsContact CD2-CG 3.41Å
283	L	97.8	Very high	95.9	Very high	0 Å²	0	64.7 Å²	64.7	0%	0	33%	0.333	C	S	.	.	G	3₁₀ helix	trans	-57.7	-25.9	179.8	-176	61.2	0	0	0	113.2	Y230 I278 I285 C286 F287 Y290 N294 A299 Y302 I303	Y230-L283 HydrophobicContact CD2-CD1 4Å; Y230-L283 HydrophobicContact CG-CD1 4.12Å; I278-L283 HydrophobicContact CD1-CB 4.09Å; L283-I285 PolarHBondContact O-N 2.81Å; L283-C286 PolarHBondContact O-N 3.3Å; L283-F287 HydrophobicContact CD1-CD2 3.66Å; L283-F287 HydrophobicContact CD1-CE2 4Å; L283-F287 HydrophobicContact CD2-CD2 4.24Å; L283-F287 HydrophobicContact CG-CD2 3.83Å; L283-F287 PolarHBondContact O-N 3.48Å; L283-F287 VanDerWaalsContact O-N 3.12Å; L283-Y290 HydrophobicContact CB-CD1 3.76Å; L283-Y290 HydrophobicContact CB-CE1 3.97Å; L283-Y290 HydrophobicContact CB-CG 4.45Å; L283-Y290 HydrophobicContact CD2-CD1 3.93Å; L283-Y290 HydrophobicContact CD2-CD2 4.08Å; L283-Y290 HydrophobicContact CD2-CE1 4.02Å; L283-Y290 HydrophobicContact CD2-CE2 4.18Å; L283-Y290 HydrophobicContact CD2-CG 3.93Å; L283-Y290 HydrophobicContact CG-CD1 4.15Å; L283-Y290 HydrophobicContact CG-CG 4.36Å; L283-N294 PolarHBondContact N-OD1 2.9Å; L283-N294 VanDerWaalsContact N-OD1 3.1Å; L283-A299 HydrophobicContact CB-CB 4.36Å; L283-A299 HydrophobicContact CD2-CB 3.82Å; L283-Y302 HydrophobicContact CD2-CD1 3.84Å; L283-Y302 HydrophobicContact CD2-CG 4.38Å; L283-I303 HydrophobicContact CD1-CD1 3.88Å; L283-I303 HydrophobicContact CD1-CG1 4.09Å; L283-I303 HydrophobicContact CD2-CG1 4.23Å
284	S	96.8	Very high	95.7	Very high	42 Å²	42	64.1 Å²	64.1	29%	0.294	33%	0.33	S	S	.	.	G	3₁₀ helix	trans	-61.3	-15.6	-178.4	64.3	0	0	0	0	115	H282 C286 F287 P288	H282-S284 VanDerWaalsContact ND1-CB 3.28Å; H282-S284 WeakPolarHBondContact ND1-CB 3.48Å; H282-S284 PolarHBondContact ND1-N 3.02Å; H282-S284 VanDerWaalsContact ND1-N 3.19Å; H282-S284 PolarHBondContact ND1-OG 3.2Å; H282-S284 PolarHBondContact O-N 2.95Å; S284-C286 PolarHBondContact O-N 3.22Å; S284-F287 VanDerWaalsContact CA-O 3.29Å; S284-F287 WeakPolarHBondContact CA-O 3.48Å; S284-F287 CarbonylContact O-C 3.54Å; S284-P288 WeakPolarHBondContact O-CA 3.5Å
285	I	95.8	Very high	95.6	Very high	98 Å²	98	66.1 Å²	66.1	50%	0.503	35%	0.345	S	S	.	.	G	3₁₀ helix	trans	-65.3	-28.6	172	69.8	166.4	0	0	0	112.1	Y230 D231 V281 H282 L283	Y230-I285 HydrophobicContact CD2-CD1 4.26Å; Y230-I285 HydrophobicContact CD2-CG1 4.12Å; Y230-I285 HydrophobicContact CE2-CD1 4.2Å; Y230-I285 HydrophobicContact CE2-CG1 4.24Å; D231-I285 HydrophobicContact CB-CD1 3.37Å; V281-I285 HydrophobicContact CG1-CD1 3.27Å; V281-I285 HydrophobicContact CG1-CG1 4.09Å; V281-I285 HydrophobicContact CG1-CG2 4.36Å; H282-I285 WeakPolarHBondContact O-CG1 3.37Å; H282-I285 PolarHBondContact O-N 2.89Å; L283-I285 PolarHBondContact O-N 2.81Å
286	C	96.8	Very high	95.6	Very high	2 Å²	2	64.2 Å²	64.2	1%	0.014	33%	0.334	C	S	.	.	T	Hydrogen-bonded Turn	trans	-95.9	-39.1	178.2	-172.1	0	0	0	0	110.6	Y230 H244 L283 S284	Y230-C286 HydrophobicContact CD2-CB 4.3Å; Y230-C286 VanDerWaalsContact O-CB 3.27Å; Y230-C286 WeakPolarHBondContact O-CB 3.39Å; H244-C286 PolarHBondContact CE1-O 3.31Å; H244-C286 VanDerWaalsContact CE1-O 3.27Å; H244-C286 PolarHBondContact NE2-O 3.43Å; L283-C286 PolarHBondContact O-N 3.3Å; S284-C286 PolarHBondContact O-N 3.22Å
287	F	97.4	Very high	95.6	Very high	3 Å²	3	64 Å²	64	1%	0.013	34%	0.336	C	S	.	.			trans	-125.3	83.1	-176	-61.1	-76.1	0	0	0	109.8	M243 H244 L247 L283 S284 E289 Y290 Y302 I303 Q306	M243-F287 HydrophobicContact CG-CE2 4.01Å; M243-F287 HydrophobicContact CG-CZ 3.71Å; H244-F287 AromaticContact CE1-CE1 3.87Å; L247-F287 HydrophobicContact CD1-CE1 3.76Å; L247-F287 HydrophobicContact CD1-CZ 3.87Å; L283-F287 HydrophobicContact CD1-CD2 3.66Å; L283-F287 HydrophobicContact CD1-CE2 4Å; L283-F287 HydrophobicContact CD2-CD2 4.24Å; L283-F287 HydrophobicContact CG-CD2 3.83Å; L283-F287 PolarHBondContact O-N 3.48Å; L283-F287 VanDerWaalsContact O-N 3.12Å; S284-F287 VanDerWaalsContact CA-O 3.29Å; S284-F287 WeakPolarHBondContact CA-O 3.48Å; S284-F287 CarbonylContact O-C 3.54Å; F287-E289 WeakPolarHBondContact CB-OE1 3.45Å; F287-E289 PolarHBondContact O-N 3.36Å; F287-Y290 VanDerWaalsContact O-CB 3.22Å; F287-Y290 WeakPolarHBondContact O-CB 3.33Å; F287-Y290 PolarHBondContact O-N 2.96Å; F287-Y302 HydrophobicContact CB-CE1 3.77Å; F287-Y302 AromaticContact CD1-CE1 3.98Å; F287-Y302 HydrophobicContact CD1-CE1 3.98Å; F287-Y302 HydrophobicContact CD2-CD1 4.43Å; F287-Y302 HydrophobicContact CD2-CE1 4.14Å; F287-Y302 HydrophobicContact CG-CD1 4.42Å; F287-Y302 AromaticContact CG-CE1 3.7Å; F287-Y302 HydrophobicContact CG-CE1 3.7Å; F287-I303 HydrophobicContact CE2-CG1 4.05Å; F287-Q306 HydrophobicContact CD1-CG 4.37Å; F287-Q306 HydrophobicContact CE1-CG 3.95Å; F287-Q306 HydrophobicContact CZ-CG 4.3Å
288	P	96.9	Very high	95.7	Very high	105 Å²	105	65.5 Å²	65.5	68%	0.682	35%	0.346	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.4	-25.9	-175.2	-27.6	36.2	0	0	0	114.6	S284 Y290	S284-P288 WeakPolarHBondContact O-CA 3.5Å; P288-Y290 VanDerWaalsContact C-N 3.31Å
289	E	95.6	Very high	95.8	Very high	114 Å²	114	65.4 Å²	65.4	53%	0.533	35%	0.346	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.7	-7.8	176.5	71.6	-71.3	165.1	0	0	114.7	F287 D291 Y302	F287-E289 WeakPolarHBondContact CB-OE1 3.45Å; F287-E289 PolarHBondContact O-N 3.36Å; E289-D291 PolarHBondContact O-N 3.48Å; E289-Y302 VanDerWaalsContact CG-OH 3.3Å; E289-Y302 WeakPolarHBondContact CG-OH 3.47Å; E289-Y302 PolarHBondContact OE1-OH 3.13Å
290	Y	96.9	Very high	95.9	Very high	15 Å²	15	59.1 Å²	59.1	6%	0.059	32%	0.318	C	S	.	.			trans	-74.1	113.9	176.6	-178.2	-106.3	0	0	0	111.5	H282 L283 F287 P288 G292 N293 D298 A299 Y302	H282-Y290 AromaticContact CE1-CD1 3.95Å; L283-Y290 HydrophobicContact CB-CD1 3.76Å; L283-Y290 HydrophobicContact CB-CE1 3.97Å; L283-Y290 HydrophobicContact CB-CG 4.45Å; L283-Y290 HydrophobicContact CD2-CD1 3.93Å; L283-Y290 HydrophobicContact CD2-CD2 4.08Å; L283-Y290 HydrophobicContact CD2-CE1 4.02Å; L283-Y290 HydrophobicContact CD2-CE2 4.18Å; L283-Y290 HydrophobicContact CD2-CG 3.93Å; L283-Y290 HydrophobicContact CG-CD1 4.15Å; L283-Y290 HydrophobicContact CG-CG 4.36Å; F287-Y290 VanDerWaalsContact O-CB 3.22Å; F287-Y290 WeakPolarHBondContact O-CB 3.33Å; F287-Y290 PolarHBondContact O-N 2.96Å; P288-Y290 VanDerWaalsContact C-N 3.31Å; Y290-G292 VanDerWaalsContact CE1-O 3.3Å; Y290-G292 WeakPolarHBondContact CE1-O 3.38Å; Y290-N293 PolarHBondContact OH-O 2.69Å; Y290-D298 VanDerWaalsContact OH-C 3.28Å; Y290-D298 WeakPolarHBondContact OH-CB 3.26Å; Y290-A299 WeakPolarHBondContact OH-CA 3.46Å; Y290-A299 PolarHBondContact OH-N 3.29Å; Y290-Y302 AromaticContact CD2-CD1 3.75Å; Y290-Y302 HydrophobicContact CD2-CD1 3.75Å; Y290-Y302 AromaticContact CD2-CD2 3.44Å; Y290-Y302 HydrophobicContact CD2-CD2 3.44Å; Y290-Y302 VanDerWaalsContact CD2-CD2 3.44Å; Y290-Y302 HydrophobicContact CD2-CE1 4.09Å; Y290-Y302 AromaticContact CD2-CE2 3.8Å; Y290-Y302 HydrophobicContact CD2-CE2 3.8Å; Y290-Y302 AromaticContact CD2-CG 3.39Å; Y290-Y302 HydrophobicContact CD2-CG 3.39Å; Y290-Y302 HydrophobicContact CE2-CD1 4.3Å; Y290-Y302 AromaticContact CE2-CD2 3.8Å; Y290-Y302 HydrophobicContact CE2-CD2 3.8Å; Y290-Y302 AromaticContact CE2-CG 3.62Å; Y290-Y302 HydrophobicContact CE2-CG 3.62Å; Y290-Y302 HydrophobicContact CG-CD1 4.42Å; Y290-Y302 HydrophobicContact CG-CG 4.45Å
291	D	93.2	Very high	96	Very high	158 Å²	158	56.3 Å²	56.3	85%	0.845	31%	0.31	S	S	*	.			trans	-109	2.6	179.5	66.5	-12	0	0	0	113.7	E289	E289-D291 PolarHBondContact O-N 3.48Å
292	G	92.5	Very high	96.1	Very high	26 Å²	26	56.3 Å²	56.3	27%	0.268	31%	0.305	S	S	.	.	S	Bend	trans	-73.7	172.9	179.5	0	0	0	0	0	113.9	Y290	Y290-G292 VanDerWaalsContact CE1-O 3.3Å; Y290-G292 WeakPolarHBondContact CE1-O 3.38Å
293	N	92.9	Very high	96.2	Very high	116 Å²	116	52.9 Å²	52.9	62%	0.62	29%	0.289	S	S	*	.			trans	-69.1	146.6	176.3	-57.9	-47.6	0	0	0	110.8	Y290 S295 D298	Y290-N293 PolarHBondContact OH-O 2.69Å; N293-S295 PolarHBondContact O-N 3.41Å; N293-D298 WeakPolarHBondContact CB-OD2 3.49Å; N293-D298 PolarHBondContact ND2-OD2 3.37Å; N293-D298 WeakPolarHBondContact O-CB 3.02Å
294	N	92.1	Very high	96.2	Very high	44 Å²	44	56 Å²	56	24%	0.235	30%	0.303	C	S	.	.	S	Bend	trans	-77.9	38.3	176.7	-151	36.3	0	0	0	113.8	I278 H282 L283	I278-N294 WeakPolarHBondContact CD1-OD1 3.5Å; I278-N294 WeakPolarHBondContact CG1-OD1 2.87Å; I278-N294 PolarHBondContact O-ND2 3.28Å; H282-N294 WeakPolarHBondContact CA-ND2 3.28Å; H282-N294 WeakPolarHBondContact CA-OD1 3.23Å; H282-N294 VanDerWaalsContact CD2-CB 3.46Å; H282-N294 WeakPolarHBondContact CD2-CB 3.48Å; H282-N294 VanDerWaalsContact CD2-CG 3.41Å; L283-N294 PolarHBondContact N-OD1 2.9Å; L283-N294 VanDerWaalsContact N-OD1 3.1Å
295	S	95.8	Very high	96.3	Very high	43 Å²	43	55.9 Å²	55.9	30%	0.301	30%	0.302	S	S	.	.			trans	-86.3	154.6	177.5	79.8	0	0	0	0	110.3	N293 D297 D298 A299	N293-S295 PolarHBondContact O-N 3.41Å; S295-D297 VanDerWaalsContact C-N 3.28Å; S295-D297 PolarHBondContact O-N 3.2Å; S295-D298 PolarHBondContact O-N 2.98Å; S295-D298 VanDerWaalsContact OG-CB 3.28Å; S295-D298 WeakPolarHBondContact OG-CB 3.46Å; S295-D298 PolarHBondContact OG-N 3.06Å; S295-D298 VanDerWaalsContact OG-N 3.08Å; S295-D298 PolarHBondContact OG-OD2 3.3Å; S295-A299 WeakPolarHBondContact O-CB 3.07Å; S295-A299 PolarHBondContact O-N 2.81Å
296	Y	96.5	Very high	96.4	Very high	48 Å²	48	53.7 Å²	53.7	19%	0.188	29%	0.29	C	S	.	.	H	α-helix	trans	-53.2	-46.4	175.9	169.5	-96.6	0	0	0	112	K271 F274 E275 G300 M323	K271-Y296 HydrophobicContact CB-CE2 4.18Å; F274-Y296 AromaticContact CD1-CD2 3.7Å; F274-Y296 HydrophobicContact CD1-CD2 3.7Å; F274-Y296 AromaticContact CD1-CE2 3.9Å; F274-Y296 HydrophobicContact CD1-CE2 3.9Å; F274-Y296 HydrophobicContact CE1-CD2 4.06Å; F274-Y296 HydrophobicContact CE1-CE2 4.5Å; E275-Y296 HydrophobicContact CB-CD2 3.73Å; E275-Y296 HydrophobicContact CB-CE2 4.17Å; E275-Y296 HydrophobicContact CG-CD2 4.09Å; E275-Y296 HydrophobicContact CG-CG 4.4Å; Y296-G300 WeakPolarHBondContact O-CA 3.4Å; Y296-G300 PolarHBondContact O-N 3.14Å; Y296-M323 HydrophobicContact CE1-SD 4.31Å; Y296-M323 PolarHBondContact OH-SD 3.41Å
297	D	96.3	Very high	96.5	Very high	100 Å²	100	53.6 Å²	53.6	54%	0.535	29%	0.289	S	S	.	.	H	α-helix	trans	-70.2	-48.3	-176.7	-66.9	-47.2	0	0	0	112	S295 N301	S295-D297 VanDerWaalsContact C-N 3.28Å; S295-D297 PolarHBondContact O-N 3.2Å; D297-N301 WeakPolarHBondContact O-CB 3.28Å; D297-N301 PolarHBondContact O-N 3.32Å; D297-N301 PolarHBondContact O-ND2 2.95Å
298	D	96.9	Very high	96.5	Very high	69 Å²	69	55.7 Å²	55.7	37%	0.369	30%	0.3	S	S	.	.	H	α-helix	trans	-67.5	-47	-176.2	-64.5	-41.6	0	0	0	111.1	Y290 N293 S295 Y302	Y290-D298 VanDerWaalsContact OH-C 3.28Å; Y290-D298 WeakPolarHBondContact OH-CB 3.26Å; N293-D298 WeakPolarHBondContact CB-OD2 3.49Å; N293-D298 PolarHBondContact ND2-OD2 3.37Å; N293-D298 WeakPolarHBondContact O-CB 3.02Å; S295-D298 PolarHBondContact O-N 2.98Å; S295-D298 VanDerWaalsContact OG-CB 3.28Å; S295-D298 WeakPolarHBondContact OG-CB 3.46Å; S295-D298 PolarHBondContact OG-N 3.06Å; S295-D298 VanDerWaalsContact OG-N 3.08Å; S295-D298 PolarHBondContact OG-OD2 3.3Å; D298-Y302 WeakPolarHBondContact O-CB 3.33Å; D298-Y302 PolarHBondContact O-N 3.02Å
299	A	98	Very high	96.5	Very high	0 Å²	0	55.3 Å²	55.3	0%	0	29%	0.292	C	S	.	.	H	α-helix	trans	-69.6	-41.2	-179.8	0	0	0	0	0	111.4	F274 I278 L283 Y290 S295 Y302 I303	F274-A299 HydrophobicContact CE1-CB 4.43Å; F274-A299 HydrophobicContact CZ-CB 3.74Å; I278-A299 HydrophobicContact CD1-CB 3.78Å; I278-A299 HydrophobicContact CG1-CB 3.91Å; L283-A299 HydrophobicContact CB-CB 4.36Å; L283-A299 HydrophobicContact CD2-CB 3.82Å; Y290-A299 WeakPolarHBondContact OH-CA 3.46Å; Y290-A299 PolarHBondContact OH-N 3.29Å; S295-A299 WeakPolarHBondContact O-CB 3.07Å; S295-A299 PolarHBondContact O-N 2.81Å; A299-Y302 PolarHBondContact O-N 3.35Å; A299-I303 WeakPolarHBondContact O-CG1 3.48Å; A299-I303 PolarHBondContact O-N 3.4Å
300	G	97.8	Very high	96.5	Very high	0 Å²	0	52 Å²	52	0%	0	28%	0.278	C	S	.	.	H	α-helix	trans	-64.5	-41.3	176.9	0	0	0	0	0	112.6	Y296 I303 K304 M323	Y296-G300 WeakPolarHBondContact O-CA 3.4Å; Y296-G300 PolarHBondContact O-N 3.14Å; G300-I303 PolarHBondContact O-N 3.14Å; G300-K304 WeakPolarHBondContact O-CB 3.32Å; G300-K304 PolarHBondContact O-N 3.23Å; G300-M323 VanDerWaalsContact C-CE 3.47Å
301	N	97.7	Very high	96.5	Very high	82 Å²	82	51.9 Å²	51.9	44%	0.439	28%	0.278	S	S	.	.	H	α-helix	trans	-68.9	-33.9	175.6	-75.3	-42.6	0	0	0	112.4	D297 K304 S305	D297-N301 WeakPolarHBondContact O-CB 3.28Å; D297-N301 PolarHBondContact O-N 3.32Å; D297-N301 PolarHBondContact O-ND2 2.95Å; N301-K304 WeakPolarHBondContact O-CB 3.49Å; N301-K304 PolarHBondContact O-N 2.98Å; N301-S305 PolarHBondContact O-N 3.4Å
302	Y	98.4	Very high	96.5	Very high	46 Å²	46	51.5 Å²	51.5	18%	0.18	27%	0.273	C	S	.	.	H	α-helix	trans	-64.4	-49.3	172.5	-175.7	-91.9	0	0	0	111.7	L283 F287 E289 Y290 D298 A299 K304 S305 Q306	L283-Y302 HydrophobicContact CD2-CD1 3.84Å; L283-Y302 HydrophobicContact CD2-CG 4.38Å; F287-Y302 HydrophobicContact CB-CE1 3.77Å; F287-Y302 AromaticContact CD1-CE1 3.98Å; F287-Y302 HydrophobicContact CD1-CE1 3.98Å; F287-Y302 HydrophobicContact CD2-CD1 4.43Å; F287-Y302 HydrophobicContact CD2-CE1 4.14Å; F287-Y302 HydrophobicContact CG-CD1 4.42Å; F287-Y302 AromaticContact CG-CE1 3.7Å; F287-Y302 HydrophobicContact CG-CE1 3.7Å; E289-Y302 VanDerWaalsContact CG-OH 3.3Å; E289-Y302 WeakPolarHBondContact CG-OH 3.47Å; E289-Y302 PolarHBondContact OE1-OH 3.13Å; Y290-Y302 AromaticContact CD2-CD1 3.75Å; Y290-Y302 HydrophobicContact CD2-CD1 3.75Å; Y290-Y302 AromaticContact CD2-CD2 3.44Å; Y290-Y302 HydrophobicContact CD2-CD2 3.44Å; Y290-Y302 VanDerWaalsContact CD2-CD2 3.44Å; Y290-Y302 HydrophobicContact CD2-CE1 4.09Å; Y290-Y302 AromaticContact CD2-CE2 3.8Å; Y290-Y302 HydrophobicContact CD2-CE2 3.8Å; Y290-Y302 AromaticContact CD2-CG 3.39Å; Y290-Y302 HydrophobicContact CD2-CG 3.39Å; Y290-Y302 HydrophobicContact CE2-CD1 4.3Å; Y290-Y302 AromaticContact CE2-CD2 3.8Å; Y290-Y302 HydrophobicContact CE2-CD2 3.8Å; Y290-Y302 AromaticContact CE2-CG 3.62Å; Y290-Y302 HydrophobicContact CE2-CG 3.62Å; Y290-Y302 HydrophobicContact CG-CD1 4.42Å; Y290-Y302 HydrophobicContact CG-CG 4.45Å; D298-Y302 WeakPolarHBondContact O-CB 3.33Å; D298-Y302 PolarHBondContact O-N 3.02Å; A299-Y302 PolarHBondContact O-N 3.35Å; Y302-K304 PolarHBondContact O-N 3.18Å; Y302-S305 PolarHBondContact O-N 3.47Å; Y302-S305 PolarHBondContact O-OG 3.03Å; Y302-Q306 HydrophobicContact CD1-CG 3.98Å; Y302-Q306 HydrophobicContact CE1-CG 3.67Å; Y302-Q306 WeakPolarHBondContact O-CG 3.39Å; Y302-Q306 PolarHBondContact O-N 3.38Å; Y302-Q306 PolarHBondContact OH-NE2 3.44Å
303	I	98.4	Very high	96.3	Very high	0 Å²	0	55.1 Å²	55.1	0%	0	28%	0.279	C	S	.	.	H	α-helix	trans	-57.4	-43.2	175.9	-65.6	166.6	0	0	0	110	L227 M243 F274 L283 F287 A299 G300 S305 Q306 F307	L227-I303 HydrophobicContact CD2-CB 4.13Å; L227-I303 HydrophobicContact CD2-CD1 3.99Å; L227-I303 HydrophobicContact CD2-CG2 3.78Å; M243-I303 HydrophobicContact CE-CD1 4.24Å; M243-I303 HydrophobicContact CE-CG2 3.95Å; M243-I303 HydrophobicContact SD-CG2 3.98Å; F274-I303 HydrophobicContact CE2-CD1 3.77Å; F274-I303 HydrophobicContact CZ-CD1 3.94Å; L283-I303 HydrophobicContact CD1-CD1 3.88Å; L283-I303 HydrophobicContact CD1-CG1 4.09Å; L283-I303 HydrophobicContact CD2-CG1 4.23Å; F287-I303 HydrophobicContact CE2-CG1 4.05Å; A299-I303 WeakPolarHBondContact O-CG1 3.48Å; A299-I303 PolarHBondContact O-N 3.4Å; G300-I303 PolarHBondContact O-N 3.14Å; I303-S305 PolarHBondContact O-N 3.06Å; I303-Q306 WeakPolarHBondContact O-CB 3.24Å; I303-Q306 PolarHBondContact O-N 3.48Å; I303-F307 HydrophobicContact CG2-CD2 4.1Å; I303-F307 HydrophobicContact CG2-CE2 3.91Å; I303-F307 WeakPolarHBondContact O-CD2 3.48Å; I303-F307 PolarHBondContact O-N 3.47Å
304	K	98.4	Very high	95.9	Very high	64 Å²	64	55.6 Å²	55.6	28%	0.278	28%	0.276	S	S	.	.	H	α-helix	trans	-55.8	-47.1	174.8	175.6	176.7	157.2	169	0	112.1	L268 G300 N301 Y302 Q306 F307 L308 S321	L268-K304 HydrophobicContact CD1-CB 3.53Å; L268-K304 HydrophobicContact CD1-CD 4.44Å; L268-K304 HydrophobicContact CD1-CG 3.97Å; G300-K304 WeakPolarHBondContact O-CB 3.32Å; G300-K304 PolarHBondContact O-N 3.23Å; N301-K304 WeakPolarHBondContact O-CB 3.49Å; N301-K304 PolarHBondContact O-N 2.98Å; Y302-K304 PolarHBondContact O-N 3.18Å; K304-Q306 VanDerWaalsContact C-N 3.34Å; K304-Q306 PolarHBondContact O-N 2.91Å; K304-F307 PolarHBondContact O-N 2.98Å; K304-L308 HydrophobicContact CG-CD1 3.91Å; K304-L308 HydrophobicContact CG-CG 4.36Å; K304-L308 WeakPolarHBondContact O-CG 3.31Å; K304-L308 PolarHBondContact O-N 3.24Å; K304-L308 VanDerWaalsContact O-N 3.07Å; K304-S321 WeakPolarHBondContact CD-OG 3.4Å; K304-S321 WeakPolarHBondContact CE-OG 3.23Å; K304-S321 PolarHBondContact NZ-OG 2.84Å; K304-S321 VanDerWaalsContact NZ-OG 3.1Å
305	S	97.6	Very high	95.5	Very high	41 Å²	41	60.2 Å²	60.2	29%	0.287	30%	0.3	S	S	.	.	H	α-helix	trans	-64.1	-39.3	179.5	68.8	0	0	0	0	111.8	N301 Y302 I303 F307 L308 D309	N301-S305 PolarHBondContact O-N 3.4Å; Y302-S305 PolarHBondContact O-N 3.47Å; Y302-S305 PolarHBondContact O-OG 3.03Å; I303-S305 PolarHBondContact O-N 3.06Å; S305-F307 VanDerWaalsContact C-N 3.25Å; S305-F307 PolarHBondContact O-N 3.18Å; S305-L308 PolarHBondContact O-N 3.06Å; S305-L308 VanDerWaalsContact O-N 3.1Å; S305-D309 WeakPolarHBondContact O-CB 3.28Å; S305-D309 PolarHBondContact O-N 2.88Å
306	Q	98.3	Very high	94.9	Very high	52 Å²	52	63 Å²	63	24%	0.243	32%	0.315	C	S	.	.	H	α-helix	trans	-54.6	-40.9	175.1	-64.6	-56.8	-57.8	0	0	112.3	L247 F287 Y302 I303 K304 L310	L247-Q306 HydrophobicContact CD1-CB 4.44Å; L247-Q306 HydrophobicContact CD2-CB 3.97Å; F287-Q306 HydrophobicContact CD1-CG 4.37Å; F287-Q306 HydrophobicContact CE1-CG 3.95Å; F287-Q306 HydrophobicContact CZ-CG 4.3Å; Y302-Q306 HydrophobicContact CD1-CG 3.98Å; Y302-Q306 HydrophobicContact CE1-CG 3.67Å; Y302-Q306 WeakPolarHBondContact O-CG 3.39Å; Y302-Q306 PolarHBondContact O-N 3.38Å; Y302-Q306 PolarHBondContact OH-NE2 3.44Å; I303-Q306 WeakPolarHBondContact O-CB 3.24Å; I303-Q306 PolarHBondContact O-N 3.48Å; K304-Q306 VanDerWaalsContact C-N 3.34Å; K304-Q306 PolarHBondContact O-N 2.91Å; Q306-L310 WeakPolarHBondContact O-CG 3.45Å
307	F	98.4	Very high	94.4	Very high	0 Å²	0	61 Å²	61	0%	0	31%	0.308	C	S	.	.	H	α-helix	trans	-71	-46.5	174.4	-80.1	-84.9	0	0	0	112.8	F223 A225 M243 L247 F250 L266 L268 I303 K304 S305 D309 L310	F223-F307 HydrophobicContact CE1-CE1 4.08Å; A225-F307 HydrophobicContact CB-CE1 4.07Å; A225-F307 HydrophobicContact CB-CE2 4.04Å; A225-F307 HydrophobicContact CB-CZ 3.57Å; M243-F307 HydrophobicContact SD-CE2 3.78Å; M243-F307 HydrophobicContact SD-CZ 4.05Å; L247-F307 HydrophobicContact CD2-CB 4.49Å; L247-F307 HydrophobicContact CD2-CD1 3.8Å; L247-F307 HydrophobicContact CD2-CD2 3.74Å; L247-F307 HydrophobicContact CD2-CE1 3.81Å; L247-F307 HydrophobicContact CD2-CE2 3.74Å; L247-F307 HydrophobicContact CD2-CG 3.75Å; L247-F307 HydrophobicContact CD2-CZ 3.76Å; L247-F307 HydrophobicContact CG-CE1 4.3Å; L247-F307 HydrophobicContact CG-CE2 4.25Å; L247-F307 HydrophobicContact CG-CZ 4.02Å; F250-F307 HydrophobicContact CB-CD1 3.71Å; F250-F307 HydrophobicContact CB-CE1 3.72Å; F250-F307 HydrophobicContact CD1-CB 4.48Å; F250-F307 AromaticContact CD1-CD1 3.77Å; F250-F307 HydrophobicContact CD1-CD1 3.77Å; F250-F307 HydrophobicContact CD2-CD1 4.05Å; F250-F307 HydrophobicContact CE1-CB 4.42Å; F250-F307 HydrophobicContact CE1-CD1 4.39Å; F250-F307 VanDerWaalsContact CE1-O 3.23Å; F250-F307 WeakPolarHBondContact CE1-O 3.19Å; F250-F307 AromaticContact CG-CD1 3.56Å; F250-F307 HydrophobicContact CG-CD1 3.56Å; F250-F307 HydrophobicContact CG-CE1 4.07Å; L266-F307 HydrophobicContact CD1-CD1 4.14Å; L266-F307 HydrophobicContact CD1-CG 4.35Å; L266-F307 HydrophobicContact CD2-CB 3.43Å; L266-F307 VanDerWaalsContact CD2-CB 3.43Å; L266-F307 HydrophobicContact CD2-CD1 4.37Å; L266-F307 HydrophobicContact CD2-CD2 4.47Å; L266-F307 HydrophobicContact CD2-CG 3.86Å; L268-F307 HydrophobicContact CD2-CD2 3.96Å; L268-F307 HydrophobicContact CD2-CE2 4.15Å; I303-F307 HydrophobicContact CG2-CD2 4.1Å; I303-F307 HydrophobicContact CG2-CE2 3.91Å; I303-F307 WeakPolarHBondContact O-CD2 3.48Å; I303-F307 PolarHBondContact O-N 3.47Å; K304-F307 PolarHBondContact O-N 2.98Å; S305-F307 VanDerWaalsContact C-N 3.25Å; S305-F307 PolarHBondContact O-N 3.18Å; F307-D309 VanDerWaalsContact C-N 3.26Å; F307-D309 PolarHBondContact O-N 3.01Å; F307-L310 WeakPolarHBondContact O-CB 3.33Å; F307-L310 PolarHBondContact O-N 3.44Å
308	L	97.2	Very high	93.8	Very high	46 Å²	46	61.8 Å²	61.8	24%	0.241	31%	0.308	C	S	.	.	H	α-helix	trans	-65.7	-29.8	-175.9	-66.8	179.4	0	0	0	112.8	K304 S305 L310 N311 K314 I319	K304-L308 HydrophobicContact CG-CD1 3.91Å; K304-L308 HydrophobicContact CG-CG 4.36Å; K304-L308 WeakPolarHBondContact O-CG 3.31Å; K304-L308 PolarHBondContact O-N 3.24Å; K304-L308 VanDerWaalsContact O-N 3.07Å; S305-L308 PolarHBondContact O-N 3.06Å; S305-L308 VanDerWaalsContact O-N 3.1Å; L308-L310 VanDerWaalsContact C-N 3.27Å; L308-L310 PolarHBondContact O-N 3.35Å; L308-N311 WeakPolarHBondContact O-CB 3.27Å; L308-N311 PolarHBondContact O-N 3.46Å; L308-K314 WeakPolarHBondContact O-CE 3.18Å; L308-I319 HydrophobicContact CD2-CB 3.81Å; L308-I319 HydrophobicContact CD2-CG2 3.61Å
309	D	96.7	Very high	93.6	Very high	97 Å²	97	59.5 Å²	59.5	52%	0.519	30%	0.296	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.6	-15.4	178.6	-72.3	-29.1	0	0	0	113.9	S305 F307 N311 K314	S305-D309 WeakPolarHBondContact O-CB 3.28Å; S305-D309 PolarHBondContact O-N 2.88Å; F307-D309 VanDerWaalsContact C-N 3.26Å; F307-D309 PolarHBondContact O-N 3.01Å; D309-N311 PolarHBondContact O-N 3.23Å; D309-K314 IonicContact OD1-NZ 3.29Å; D309-K314 PolarHBondContact OD1-NZ 3.38Å
310	L	97.1	Very high	93.4	Very high	45 Å²	45	61.6 Å²	61.6	24%	0.236	30%	0.304	C	S	.	.	T	Hydrogen-bonded Turn	trans	-72.9	-11.6	171.9	-64	169.8	0	0	0	113.1	L247 F250 N251 N255 Q306 F307 L308 M312	L247-L310 HydrophobicContact CB-CD1 4.18Å; L247-L310 HydrophobicContact CD2-CD1 3.78Å; L247-L310 WeakPolarHBondContact O-CD1 3.32Å; F250-L310 HydrophobicContact CD1-CB 4.14Å; F250-L310 HydrophobicContact CD1-CD1 3.93Å; F250-L310 HydrophobicContact CE1-CB 4.44Å; N251-L310 HydrophobicContact CB-CB 4.41Å; N251-L310 HydrophobicContact CB-CD1 4.1Å; N251-L310 HydrophobicContact CB-CD2 4.1Å; N251-L310 HydrophobicContact CB-CG 4.43Å; N255-L310 PolarHBondContact ND2-O 2.96Å; Q306-L310 WeakPolarHBondContact O-CG 3.45Å; F307-L310 WeakPolarHBondContact O-CB 3.33Å; F307-L310 PolarHBondContact O-N 3.44Å; L308-L310 VanDerWaalsContact C-N 3.27Å; L308-L310 PolarHBondContact O-N 3.35Å; L310-M312 PolarHBondContact O-N 3.43Å
311	N	95.6	Very high	93.3	Very high	12 Å²	12	62.7 Å²	62.7	6%	0.064	31%	0.311	C	S	.	.			trans	-73.2	108.4	176.2	-172.8	5.1	0	0	0	111.1	L308 D309 R313 K314 K317 I319	L308-N311 WeakPolarHBondContact O-CB 3.27Å; L308-N311 PolarHBondContact O-N 3.46Å; D309-N311 PolarHBondContact O-N 3.23Å; N311-R313 VanDerWaalsContact C-N 3.26Å; N311-R313 PolarHBondContact O-N 3.01Å; N311-R313 PolarHBondContact OD1-N 2.62Å; N311-K314 HydrophobicContact CB-CG 4.12Å; N311-K314 VanDerWaalsContact O-CG 3.31Å; N311-K314 WeakPolarHBondContact O-CG 3.3Å; N311-K317 PolarHBondContact ND2-O 3.4Å; N311-I319 HydrophobicContact CB-CD1 3.51Å
312	M	93.1	Very high	93.2	Very high	150 Å²	150	60.8 Å²	60.8	74%	0.739	30%	0.3	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.1	-4.7	178.5	-60.7	-178.4	70.6	0	0	113.5	N255 L310	N255-M312 WeakPolarHBondContact OD1-CB 3.29Å; N255-M312 PolarHBondContact OD1-N 3.16Å; L310-M312 PolarHBondContact O-N 3.43Å
313	R	88.4	Confident	93.1	Very high	102 Å²	102	60.6 Å²	60.6	39%	0.385	30%	0.301	S	S	.	.	T	Hydrogen-bonded Turn	trans	-127.7	47.4	-174.9	-58.2	-175.7	-174.4	-160.6	0.2	111.5	N311 D315 V316 K317	N311-R313 VanDerWaalsContact C-N 3.26Å; N311-R313 PolarHBondContact O-N 3.01Å; N311-R313 PolarHBondContact OD1-N 2.62Å; R313-D315 VanDerWaalsContact C-OD1 3.28Å; R313-D315 WeakPolarHBondContact CA-OD1 3.27Å; R313-D315 PolarHBondContact O-N 3.41Å; R313-D315 VanDerWaalsContact O-N 3.07Å; R313-V316 PolarHBondContact O-N 2.8Å; R313-K317 HydrophobicContact CB-CB 4.36Å; R313-K317 PolarHBondContact O-N 3.47Å
314	K	85.7	Confident	93	Very high	126 Å²	126	60.7 Å²	60.7	55%	0.548	30%	0.302	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.6	-20.9	-176.9	-62	-172.7	176.1	-176.5	0	113.5	L308 D309 N311	L308-K314 WeakPolarHBondContact O-CE 3.18Å; D309-K314 IonicContact OD1-NZ 3.29Å; D309-K314 PolarHBondContact OD1-NZ 3.38Å; N311-K314 HydrophobicContact CB-CG 4.12Å; N311-K314 VanDerWaalsContact O-CG 3.31Å; N311-K314 WeakPolarHBondContact O-CG 3.3Å
315	D	84.1	Confident	92.9	Very high	141 Å²	141	58 Å²	58	75%	0.754	29%	0.291	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.4	-25.9	177.9	59.3	-43.1	0	0	0	114	R313	R313-D315 VanDerWaalsContact C-OD1 3.28Å; R313-D315 WeakPolarHBondContact CA-OD1 3.27Å; R313-D315 PolarHBondContact O-N 3.41Å; R313-D315 VanDerWaalsContact O-N 3.07Å
316	V	82.8	Confident	92.9	Very high	102 Å²	102	56.2 Å²	56.2	62%	0.618	28%	0.279	S	S	*	.	T	Hydrogen-bonded Turn	trans	-114.1	-31.7	-176.1	-174.5	0	0	0	0	112.2	R313	R313-V316 PolarHBondContact O-N 2.8Å
317	K	85.9	Confident	92.7	Very high	6 Å²	6	55.1 Å²	55.1	3%	0.026	28%	0.276	C	S	.	.			trans	-120.6	114.2	-169.7	-178.7	173.1	180	162.4	0	110.3	C254 F259 T262 I264 N311 R313	C254-K317 PolarHBondContact O-NZ 3.15Å; F259-K317 PolarHBondContact O-NZ 3.4Å; T262-K317 WeakPolarHBondContact O-CE 3.26Å; T262-K317 PolarHBondContact O-NZ 2.73Å; I264-K317 VanDerWaalsContact CG1-CE 3.48Å; N311-K317 PolarHBondContact ND2-O 3.4Å; R313-K317 HydrophobicContact CB-CB 4.36Å; R313-K317 PolarHBondContact O-N 3.47Å
318	E	83.9	Confident	92.7	Very high	116 Å²	116	58.4 Å²	58.4	54%	0.542	29%	0.293	S	S	.	.			trans	-87.2	142.1	174.1	-163.8	163.9	-175.7	0	0	110.4	Y320	E318-Y320 HydrophobicContact CB-CE2 4.14Å; E318-Y320 HydrophobicContact CG-CD1 4.45Å; E318-Y320 HydrophobicContact CG-CE1 3.93Å; E318-Y320 HydrophobicContact CG-CE2 4.15Å; E318-Y320 PolarHBondContact OE2-OH 2.99Å
319	I	92.7	Very high	92.6	Very high	21 Å²	21	57.9 Å²	57.9	11%	0.108	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	117.9	174.7	-62.2	163.6	0	0	0	108.3	F250 I264 L266 L308 N311	F250-I319 HydrophobicContact CE1-CD1 4.21Å; F250-I319 HydrophobicContact CZ-CD1 3.91Å; F250-I319 HydrophobicContact CZ-CG2 4.31Å; I264-I319 HydrophobicContact CB-CG1 4.31Å; I264-I319 HydrophobicContact CG2-CG2 4.41Å; I264-I319 WeakPolarHBondContact O-CA 3.5Å; L266-I319 HydrophobicContact CB-CG2 3.98Å; L308-I319 HydrophobicContact CD2-CB 3.81Å; L308-I319 HydrophobicContact CD2-CG2 3.61Å; N311-I319 HydrophobicContact CB-CD1 3.51Å
320	Y	92.7	Very high	92.5	Very high	44 Å²	44	59.6 Å²	59.6	17%	0.173	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95	109.8	-179.9	-55.9	-85.4	0	0	0	109.5	I264 V265 L266 E318 I342 E346	I264-Y320 PolarHBondContact O-N 3.47Å; V265-Y320 CarbonylContact C-O 3.53Å; V265-Y320 VanDerWaalsContact CA-O 3.29Å; V265-Y320 WeakPolarHBondContact CA-O 3.31Å; L266-Y320 PolarHBondContact N-O 3.45Å; E318-Y320 HydrophobicContact CB-CE2 4.14Å; E318-Y320 HydrophobicContact CG-CD1 4.45Å; E318-Y320 HydrophobicContact CG-CE1 3.93Å; E318-Y320 HydrophobicContact CG-CE2 4.15Å; E318-Y320 PolarHBondContact OE2-OH 2.99Å; Y320-I342 HydrophobicContact CD1-CD1 3.53Å; Y320-I342 HydrophobicContact CD1-CG1 4.25Å; Y320-I342 HydrophobicContact CD1-CG2 4.48Å; Y320-I342 HydrophobicContact CD2-CD1 4.21Å; Y320-I342 HydrophobicContact CD2-CG2 3.79Å; Y320-I342 HydrophobicContact CE1-CD1 3.93Å; Y320-I342 HydrophobicContact CE1-CG1 4.13Å; Y320-I342 HydrophobicContact CE1-CG2 4.09Å; Y320-I342 HydrophobicContact CE2-CG2 3.32Å; Y320-I342 HydrophobicContact CG-CD1 3.66Å; Y320-I342 HydrophobicContact CG-CG2 4.33Å; Y320-I342 VanDerWaalsContact CZ-CG2 3.46Å; Y320-E346 PolarHBondContact OH-OE1 2.79Å
321	S	95.6	Very high	92.4	Very high	23 Å²	23	58.5 Å²	58.5	16%	0.161	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.7	134.6	-177.8	66.8	0	0	0	0	112.1	L266 K304	L266-S321 CarbonylContact O-C 3.59Å; L266-S321 VanDerWaalsContact O-CA 3.31Å; L266-S321 WeakPolarHBondContact O-CA 3.32Å; K304-S321 WeakPolarHBondContact CD-OG 3.4Å; K304-S321 WeakPolarHBondContact CE-OG 3.23Å; K304-S321 PolarHBondContact NZ-OG 2.84Å; K304-S321 VanDerWaalsContact NZ-OG 3.1Å
322	H	95.9	Very high	92.3	Very high	42 Å²	42	58.1 Å²	58.1	19%	0.194	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.1	135.2	172.9	-63.5	-89.1	0	0	0	110.6	L266 F267 L268 T324 V335	L266-H322 PolarHBondContact O-N 2.81Å; F267-H322 HydrophobicContact CD1-CB 4.23Å; F267-H322 HydrophobicContact CE1-CB 4.43Å; L268-H322 PolarHBondContact N-O 3.29Å; H322-T324 HydrophobicContact CB-CG2 4.06Å; H322-V335 HydrophobicContact CB-CG1 3.7Å; H322-V335 HydrophobicContact CB-CG2 4.18Å
323	M	96.1	Very high	92.4	Very high	43 Å²	43	55.4 Å²	55.4	21%	0.212	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.7	122.3	166.6	-67.7	-177.4	179.4	0	0	109.1	L268 K271 Y296 G300	L268-M323 HydrophobicContact CB-CG 4.3Å; L268-M323 HydrophobicContact CD1-CG 4.45Å; L268-M323 CarbonylContact O-C 3.33Å; L268-M323 WeakPolarHBondContact O-CA 3.46Å; K271-M323 HydrophobicContact CD-CB 4.25Å; Y296-M323 HydrophobicContact CE1-SD 4.31Å; Y296-M323 PolarHBondContact OH-SD 3.41Å; G300-M323 VanDerWaalsContact C-CE 3.47Å
324	T	97.1	Very high	92.4	Very high	1 Å²	1	57.4 Å²	57.4	1%	0.006	29%	0.285	C	S	.	.			trans	-124.9	152.2	-171.1	61.3	0	0	0	0	112.9	F267 L268 N269 K270 K271 H322 N331 V335	F267-T324 HydrophobicContact CB-CG2 4.26Å; F267-T324 HydrophobicContact CD1-CG2 3.95Å; F267-T324 HydrophobicContact CD2-CG2 4.41Å; F267-T324 HydrophobicContact CE1-CG2 4.41Å; F267-T324 HydrophobicContact CG-CG2 3.96Å; L268-T324 PolarHBondContact O-N 2.89Å; N269-T324 CarbonylContact C-O 3.57Å; N269-T324 VanDerWaalsContact CA-O 3.3Å; N269-T324 WeakPolarHBondContact CA-O 3.47Å; N269-T324 VanDerWaalsContact CA-OG1 3.27Å; N269-T324 WeakPolarHBondContact CA-OG1 3.24Å; N269-T324 WeakPolarHBondContact CB-OG1 3.35Å; N269-T324 PolarHBondContact OD1-O 3.14Å; N269-T324 PolarHBondContact OD1-OG1 3.31Å; K270-T324 PolarHBondContact N-O 3.33Å; K270-T324 VanDerWaalsContact N-O 3.08Å; K271-T324 WeakPolarHBondContact CG-O 3.45Å; K271-T324 PolarHBondContact N-O 2.95Å; K271-T324 VanDerWaalsContact N-O 3.14Å; H322-T324 HydrophobicContact CB-CG2 4.06Å; T324-N331 VanDerWaalsContact CA-OD1 3.23Å; T324-N331 WeakPolarHBondContact CA-OD1 3.48Å; T324-V335 HydrophobicContact CG2-CB 4.42Å; T324-V335 HydrophobicContact CG2-CG1 3.99Å; T324-V335 HydrophobicContact CG2-CG2 4.1Å
325	C	96.9	Very high	92.6	Very high	9 Å²	9	51.6 Å²	51.6	6%	0.061	26%	0.26	C	S	.	.			trans	-119.9	101	160.3	176.7	0	0	0	0	106.7	K271 T327 D328 N331	K271-C325 HydrophobicContact CG-CB 4.21Å; C325-T327 PolarHBondContact O-N 3.25Å; C325-T327 PolarHBondContact SG-OG1 2.96Å; C325-D328 HydrophobicContact CB-CB 3.98Å; C325-D328 PolarHBondContact O-N 3.4Å; C325-N331 PolarHBondContact N-OD1 3Å
326	A	96.3	Very high	92.9	Very high	3 Å²	3	45 Å²	45	3%	0.025	23%	0.225	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.3	-17.3	-177.6	0	0	0	0	0	113.2	T48 I49 Q52 N269	T48-A326 HydrophobicContact CG2-CB 3.7Å; T48-A326 WeakPolarHBondContact CG2-O 3.47Å; I49-A326 HydrophobicContact CD1-CB 3.7Å; I49-A326 HydrophobicContact CG1-CB 4.23Å; Q52-A326 WeakPolarHBondContact CG-O 3.37Å; Q52-A326 PolarHBondContact NE2-O 2.95Å; N269-A326 WeakPolarHBondContact ND2-CB 3.47Å; N269-A326 WeakPolarHBondContact OD1-CB 3.48Å; N269-A326 PolarHBondContact OD1-N 3.41Å
327	T	95.7	Very high	93.2	Very high	29 Å²	29	42.4 Å²	42.4	18%	0.178	21%	0.207	C	C	.	.	T	Hydrogen-bonded Turn	trans	-88.1	-4.9	175.2	69.7	0	0	0	0	113.9	T48 Q172 R176 C325	T48-T327 HydrophobicContact CG2-CG2 4.3Å; Q172-T327 PolarHBondContact NE2-O 3.19Å; Q172-T327 PolarHBondContact OE1-O 2.95Å; R176-T327 HydrophobicContact CG-CG2 4.15Å; R176-T327 PolarHBondContact NH2-OG1 3.45Å; C325-T327 PolarHBondContact O-N 3.25Å; C325-T327 PolarHBondContact SG-OG1 2.96Å
328	D	96.9	Very high	93.2	Very high	68 Å²	68	43.5 Å²	43.5	36%	0.364	22%	0.218	S	C	.	.			trans	-101.4	106.6	173.7	175	-8.7	0	0	0	109.7	C325 Q330 N331 V332	C325-D328 HydrophobicContact CB-CB 3.98Å; C325-D328 PolarHBondContact O-N 3.4Å; D328-Q330 VanDerWaalsContact C-N 3.31Å; D328-Q330 PolarHBondContact O-N 2.97Å; D328-Q330 PolarHBondContact OD1-N 3.46Å; D328-N331 HydrophobicContact CB-CB 3.89Å; D328-N331 PolarHBondContact O-N 3.28Å; D328-N331 PolarHBondContact OD1-N 3.03Å; D328-N331 WeakPolarHBondContact OD2-CB 3.45Å; D328-V332 WeakPolarHBondContact O-CG2 3.42Å; D328-V332 PolarHBondContact O-N 3.45Å
329	T	96.2	Very high	93.3	Very high	36 Å²	36	38 Å²	38	22%	0.221	19%	0.192	C	C	.	.	H	α-helix	trans	-61.8	-35.3	-177.6	-58.4	0	0	0	0	113	Q52 I55 I56 K333	Q52-T329 PolarHBondContact NE2-OG1 3.25Å; Q52-T329 PolarHBondContact OE1-OG1 3.44Å; I55-T329 HydrophobicContact CG2-CG2 4.02Å; I56-T329 HydrophobicContact CD1-CG2 4.29Å; I56-T329 HydrophobicContact CG1-CG2 3.84Å; T329-K333 VanDerWaalsContact O-CB 3.26Å; T329-K333 WeakPolarHBondContact O-CB 3.39Å; T329-K333 PolarHBondContact O-N 2.81Å
330	Q	95.1	Very high	93.1	Very high	133 Å²	133	37 Å²	37	62%	0.621	19%	0.187	S	C	*	.	H	α-helix	trans	-71.5	-41	178.8	-66.1	-58.7	-38.4	0	0	110.8	D328 K333 F334	D328-Q330 VanDerWaalsContact C-N 3.31Å; D328-Q330 PolarHBondContact O-N 2.97Å; D328-Q330 PolarHBondContact OD1-N 3.46Å; Q330-K333 PolarHBondContact O-N 2.98Å; Q330-F334 WeakPolarHBondContact O-CB 3.43Å; Q330-F334 PolarHBondContact O-N 3.39Å
331	N	94.1	Very high	92.7	Very high	22 Å²	22	38.9 Å²	38.9	12%	0.118	20%	0.2	C	C	.	.	H	α-helix	trans	-62.1	-45.3	175.5	179.7	-117.2	0	0	0	111.9	T324 C325 D328 F334 V335	T324-N331 VanDerWaalsContact CA-OD1 3.23Å; T324-N331 WeakPolarHBondContact CA-OD1 3.48Å; C325-N331 PolarHBondContact N-OD1 3Å; D328-N331 HydrophobicContact CB-CB 3.89Å; D328-N331 PolarHBondContact O-N 3.28Å; D328-N331 PolarHBondContact OD1-N 3.03Å; D328-N331 WeakPolarHBondContact OD2-CB 3.45Å; N331-F334 PolarHBondContact O-N 3.4Å; N331-V335 WeakPolarHBondContact O-CB 3.35Å; N331-V335 VanDerWaalsContact O-CG2 3.25Å; N331-V335 WeakPolarHBondContact O-CG2 3.34Å; N331-V335 PolarHBondContact O-N 3.36Å
332	V	94.3	Very high	92	Very high	4 Å²	4	39.2 Å²	39.2	2%	0.024	20%	0.2	C	C	.	.	H	α-helix	trans	-65.9	-41.9	178.3	175.9	0	0	0	0	111.5	I49 Q52 M53 I56 D328 V335 F336	I49-V332 HydrophobicContact CD1-CG1 4.17Å; I49-V332 HydrophobicContact CD1-CG2 3.92Å; Q52-V332 HydrophobicContact CB-CB 4.35Å; Q52-V332 HydrophobicContact CB-CG1 3.75Å; Q52-V332 HydrophobicContact CG-CB 4.26Å; Q52-V332 HydrophobicContact CG-CG1 4.12Å; Q52-V332 HydrophobicContact CG-CG2 4.11Å; M53-V332 HydrophobicContact CE-CG1 3.81Å; I56-V332 HydrophobicContact CD1-CB 4.31Å; I56-V332 HydrophobicContact CD1-CG1 4Å; D328-V332 WeakPolarHBondContact O-CG2 3.42Å; D328-V332 PolarHBondContact O-N 3.45Å; V332-V335 PolarHBondContact O-N 2.95Å; V332-F336 VanDerWaalsContact O-CB 3.25Å; V332-F336 WeakPolarHBondContact O-CB 3.24Å; V332-F336 PolarHBondContact O-N 3.44Å
333	K	93.4	Very high	91.3	Very high	92 Å²	92	37.3 Å²	37.3	40%	0.4	19%	0.191	S	C	.	.	H	α-helix	trans	-57.4	-51.8	176	-177	176.8	-180	177.8	0	111.8	I56 T329 Q330 V335 F336 D337	I56-K333 HydrophobicContact CD1-CB 3.96Å; I56-K333 HydrophobicContact CG1-CB 4.46Å; I56-K333 HydrophobicContact CG2-CB 4.3Å; I56-K333 HydrophobicContact CG2-CD 4.2Å; I56-K333 HydrophobicContact CG2-CG 3.97Å; T329-K333 VanDerWaalsContact O-CB 3.26Å; T329-K333 WeakPolarHBondContact O-CB 3.39Å; T329-K333 PolarHBondContact O-N 2.81Å; Q330-K333 PolarHBondContact O-N 2.98Å; K333-V335 VanDerWaalsContact C-N 3.34Å; K333-V335 PolarHBondContact O-N 3.15Å; K333-F336 PolarHBondContact O-N 3.29Å; K333-D337 PolarHBondContact O-N 3.41Å
334	F	90.1	Very high	90.7	Very high	145 Å²	145	37.6 Å²	37.6	64%	0.636	19%	0.193	S	C	*	.	H	α-helix	trans	-59.2	-44.7	179.4	176.3	-96.8	0	0	0	112.4	Q330 N331 A338	Q330-F334 WeakPolarHBondContact O-CB 3.43Å; Q330-F334 PolarHBondContact O-N 3.39Å; N331-F334 PolarHBondContact O-N 3.4Å; F334-A338 PolarHBondContact O-N 3.21Å
335	V	89.8	Confident	89.8	Confident	4 Å²	4	43.7 Å²	43.7	2%	0.024	22%	0.219	C	C	.	.	H	α-helix	trans	-68.4	-40.1	-179.8	172.1	0	0	0	0	111	F267 H322 T324 N331 V332 K333 A338 V339	F267-V335 HydrophobicContact CD1-CG1 4.08Å; F267-V335 HydrophobicContact CE1-CG1 3.24Å; F267-V335 HydrophobicContact CZ-CG1 3.55Å; H322-V335 HydrophobicContact CB-CG1 3.7Å; H322-V335 HydrophobicContact CB-CG2 4.18Å; T324-V335 HydrophobicContact CG2-CB 4.42Å; T324-V335 HydrophobicContact CG2-CG1 3.99Å; T324-V335 HydrophobicContact CG2-CG2 4.1Å; N331-V335 WeakPolarHBondContact O-CB 3.35Å; N331-V335 VanDerWaalsContact O-CG2 3.25Å; N331-V335 WeakPolarHBondContact O-CG2 3.34Å; N331-V335 PolarHBondContact O-N 3.36Å; V332-V335 PolarHBondContact O-N 2.95Å; K333-V335 VanDerWaalsContact C-N 3.34Å; K333-V335 PolarHBondContact O-N 3.15Å; V335-A338 PolarHBondContact O-N 2.95Å; V335-V339 VanDerWaalsContact O-CG2 3.28Å; V335-V339 WeakPolarHBondContact O-CG2 3.35Å; V335-V339 PolarHBondContact O-N 2.72Å
336	F	89.9	Confident	88.8	Confident	1 Å²	1	45.1 Å²	45.1	0%	0.004	23%	0.225	C	C	.	.	H	α-helix	trans	-69.3	-35.6	179.1	-165.4	-93	0	0	0	112.6	L36 M53 H57 F189 V191 F196 M198 I222 V332 K333 A338 V339 T340	L36-F336 HydrophobicContact CD1-CE2 3.79Å; L36-F336 HydrophobicContact CD1-CZ 3.79Å; M53-F336 HydrophobicContact CE-CB 4.28Å; M53-F336 HydrophobicContact CE-CD2 3.92Å; M53-F336 HydrophobicContact CE-CE2 4.46Å; M53-F336 HydrophobicContact CE-CG 3.97Å; M53-F336 HydrophobicContact SD-CD1 4.09Å; M53-F336 HydrophobicContact SD-CD2 3.67Å; M53-F336 HydrophobicContact SD-CE1 4.05Å; M53-F336 HydrophobicContact SD-CE2 3.61Å; M53-F336 HydrophobicContact SD-CG 3.92Å; M53-F336 HydrophobicContact SD-CZ 3.82Å; H57-F336 AromaticContact NE2-CD1 3.73Å; F189-F336 AromaticContact CE2-CE1 3.75Å; F189-F336 HydrophobicContact CE2-CE1 3.75Å; F189-F336 AromaticContact CE2-CZ 3.67Å; F189-F336 HydrophobicContact CE2-CZ 3.67Å; F189-F336 HydrophobicContact CZ-CE1 4.13Å; F189-F336 HydrophobicContact CZ-CE2 4.27Å; F189-F336 AromaticContact CZ-CZ 3.56Å; F189-F336 HydrophobicContact CZ-CZ 3.56Å; V191-F336 HydrophobicContact CG2-CE1 4.24Å; F196-F336 HydrophobicContact CD1-CZ 4.36Å; F196-F336 HydrophobicContact CE1-CZ 4.36Å; M198-F336 HydrophobicContact CE-CE2 3.82Å; M198-F336 HydrophobicContact CE-CZ 4.44Å; I222-F336 HydrophobicContact CD1-CE2 4.42Å; V332-F336 VanDerWaalsContact O-CB 3.25Å; V332-F336 WeakPolarHBondContact O-CB 3.24Å; V332-F336 PolarHBondContact O-N 3.44Å; K333-F336 PolarHBondContact O-N 3.29Å; F336-A338 VanDerWaalsContact C-N 3.35Å; F336-V339 PolarHBondContact O-N 3.16Å; F336-T340 WeakPolarHBondContact CE1-OG1 3.46Å; F336-T340 WeakPolarHBondContact O-CB 3.36Å; F336-T340 PolarHBondContact O-N 3.39Å; F336-T340 PolarHBondContact O-OG1 3.02Å
337	D	89.1	Confident	87.6	Confident	48 Å²	48	47.7 Å²	47.7	26%	0.257	24%	0.238	S	C	.	.	H	α-helix	trans	-60.9	-44.5	172.2	-74.9	-26.9	0	0	0	111	K333 V339 T340 D341	K333-D337 PolarHBondContact O-N 3.41Å; D337-V339 PolarHBondContact O-N 3.37Å; D337-T340 WeakPolarHBondContact O-CB 3.25Å; D337-T340 PolarHBondContact O-N 3.16Å; D337-D341 PolarHBondContact O-N 3.29Å
338	A	85.6	Confident	86.4	Confident	29 Å²	29	49.2 Å²	49.2	24%	0.24	25%	0.245	C	C	.	.	H	α-helix	trans	-62.8	-41.5	175.8	0	0	0	0	0	112.5	F334 V335 F336 T340 D341 I342	F334-A338 PolarHBondContact O-N 3.21Å; V335-A338 PolarHBondContact O-N 2.95Å; F336-A338 VanDerWaalsContact C-N 3.35Å; A338-T340 VanDerWaalsContact C-N 3.33Å; A338-D341 PolarHBondContact O-N 3.47Å; A338-I342 WeakPolarHBondContact O-CD1 3.29Å; A338-I342 WeakPolarHBondContact O-CG1 3.46Å; A338-I342 PolarHBondContact O-N 3.09Å; A338-I342 VanDerWaalsContact O-N 3.12Å
339	V	86.1	Confident	85.2	Confident	0 Å²	0	51.5 Å²	51.5	0%	0	25%	0.252	C	S	.	.	H	α-helix	trans	-62.7	-41.6	174.6	168.6	0	0	0	0	111.3	V265 F267 V335 F336 D337 D341 I342 I343	V265-V339 HydrophobicContact CB-CG2 4.29Å; V265-V339 HydrophobicContact CG1-CG2 3.54Å; V265-V339 HydrophobicContact CG2-CB 4.47Å; V265-V339 HydrophobicContact CG2-CG1 3.9Å; V265-V339 HydrophobicContact CG2-CG2 3.88Å; F267-V339 HydrophobicContact CE1-CG2 4.14Å; F267-V339 HydrophobicContact CZ-CG2 4.31Å; V335-V339 VanDerWaalsContact O-CG2 3.28Å; V335-V339 WeakPolarHBondContact O-CG2 3.35Å; V335-V339 PolarHBondContact O-N 2.72Å; F336-V339 PolarHBondContact O-N 3.16Å; D337-V339 PolarHBondContact O-N 3.37Å; V339-D341 VanDerWaalsContact C-N 3.35Å; V339-D341 PolarHBondContact O-N 3.2Å; V339-I342 PolarHBondContact O-N 3.31Å; V339-I343 HydrophobicContact CG1-CD1 3.63Å; V339-I343 HydrophobicContact CG1-CG1 4.35Å; V339-I343 VanDerWaalsContact O-CG1 3.27Å; V339-I343 WeakPolarHBondContact O-CG1 3.36Å; V339-I343 PolarHBondContact O-N 3.45Å
340	T	87.8	Confident	83.9	Confident	0 Å²	0	56.5 Å²	56.5	0%	0	28%	0.277	C	S	.	.	H	α-helix	trans	-61.3	-45.1	177.7	-62.3	0	0	0	0	110.9	F196 F336 D337 A338 I342 I343 I344	F196-T340 HydrophobicContact CZ-CG2 4.04Å; F336-T340 WeakPolarHBondContact CE1-OG1 3.46Å; F336-T340 WeakPolarHBondContact O-CB 3.36Å; F336-T340 PolarHBondContact O-N 3.39Å; F336-T340 PolarHBondContact O-OG1 3.02Å; D337-T340 WeakPolarHBondContact O-CB 3.25Å; D337-T340 PolarHBondContact O-N 3.16Å; A338-T340 VanDerWaalsContact C-N 3.33Å; T340-I342 VanDerWaalsContact C-N 3.32Å; T340-I342 PolarHBondContact O-N 3.37Å; T340-I343 PolarHBondContact O-N 3.12Å; T340-I344 HydrophobicContact CG2-CD1 3.72Å; T340-I344 HydrophobicContact CG2-CG1 4.38Å; T340-I344 WeakPolarHBondContact O-CB 3.4Å; T340-I344 WeakPolarHBondContact O-CG1 3.28Å; T340-I344 PolarHBondContact O-N 2.85Å
341	D	85.1	Confident	82.4	Confident	84 Å²	84	54.7 Å²	54.7	45%	0.449	28%	0.278	S	S	.	.	H	α-helix	trans	-64.8	-36.3	179.4	-68.1	-12.5	0	0	0	112	K192 D337 A338 V339 K345	K192-D341 IonicContact NZ-OD1 2.67Å; K192-D341 PolarHBondContact NZ-OD1 3.33Å; D337-D341 PolarHBondContact O-N 3.29Å; A338-D341 PolarHBondContact O-N 3.47Å; V339-D341 VanDerWaalsContact C-N 3.35Å; V339-D341 PolarHBondContact O-N 3.2Å; D341-K345 WeakPolarHBondContact O-CB 3.48Å; D341-K345 PolarHBondContact O-N 3.15Å
342	I	81.3	Confident	80.4	Confident	31 Å²	31	56.7 Å²	56.7	16%	0.159	30%	0.304	C	S	.	.	H	α-helix	trans	-63.3	-50.4	173.2	-70.6	160.1	0	0	0	111	Y320 A338 V339 T340 I344 K345 E346	Y320-I342 HydrophobicContact CD1-CD1 3.53Å; Y320-I342 HydrophobicContact CD1-CG1 4.25Å; Y320-I342 HydrophobicContact CD1-CG2 4.48Å; Y320-I342 HydrophobicContact CD2-CD1 4.21Å; Y320-I342 HydrophobicContact CD2-CG2 3.79Å; Y320-I342 HydrophobicContact CE1-CD1 3.93Å; Y320-I342 HydrophobicContact CE1-CG1 4.13Å; Y320-I342 HydrophobicContact CE1-CG2 4.09Å; Y320-I342 HydrophobicContact CE2-CG2 3.32Å; Y320-I342 HydrophobicContact CG-CD1 3.66Å; Y320-I342 HydrophobicContact CG-CG2 4.33Å; Y320-I342 VanDerWaalsContact CZ-CG2 3.46Å; A338-I342 WeakPolarHBondContact O-CD1 3.29Å; A338-I342 WeakPolarHBondContact O-CG1 3.46Å; A338-I342 PolarHBondContact O-N 3.09Å; A338-I342 VanDerWaalsContact O-N 3.12Å; V339-I342 PolarHBondContact O-N 3.31Å; T340-I342 VanDerWaalsContact C-N 3.32Å; T340-I342 PolarHBondContact O-N 3.37Å; I342-I344 VanDerWaalsContact C-N 3.3Å; I342-I344 PolarHBondContact O-N 2.86Å; I342-K345 WeakPolarHBondContact O-CB 3.44Å; I342-K345 PolarHBondContact O-N 3.33Å; I342-K345 VanDerWaalsContact O-N 3.13Å; I342-E346 PolarHBondContact O-N 3.35Å
343	I	81.4	Confident	78.6	Confident	2 Å²	2	62.4 Å²	62.4	1%	0.01	33%	0.334	C	S	.	.	H	α-helix	trans	-62.5	-40	-178.8	-68.3	168.4	0	0	0	110.9	V34 L36 T219 C220 V339 T340 K345 E346 N347	V34-I343 HydrophobicContact CG1-CG2 3.87Å; V34-I343 HydrophobicContact CG2-CG2 4.36Å; L36-I343 HydrophobicContact CD2-CD1 3.63Å; T219-I343 HydrophobicContact CG2-CG2 4.05Å; C220-I343 HydrophobicContact CB-CD1 3.75Å; C220-I343 HydrophobicContact CB-CG1 3.98Å; V339-I343 HydrophobicContact CG1-CD1 3.63Å; V339-I343 HydrophobicContact CG1-CG1 4.35Å; V339-I343 VanDerWaalsContact O-CG1 3.27Å; V339-I343 WeakPolarHBondContact O-CG1 3.36Å; V339-I343 PolarHBondContact O-N 3.45Å; T340-I343 PolarHBondContact O-N 3.12Å; I343-K345 VanDerWaalsContact C-N 3.35Å; I343-E346 PolarHBondContact O-N 3.38Å; I343-N347 WeakPolarHBondContact O-CB 3.36Å; I343-N347 PolarHBondContact O-N 2.87Å; I343-N347 PolarHBondContact O-ND2 2.96Å
344	I	81.7	Confident	76.2	Confident	49 Å²	49	68 Å²	68	25%	0.251	36%	0.358	S	S	.	.	H	α-helix	trans	-61	-46.8	175.1	-71.4	169	0	0	0	110.4	L194 T340 I342 E346 N347 L348	L194-I344 HydrophobicContact CD1-CD1 3.66Å; L194-I344 HydrophobicContact CD1-CG1 3.48Å; L194-I344 VanDerWaalsContact CD1-CG1 3.48Å; T340-I344 HydrophobicContact CG2-CD1 3.72Å; T340-I344 HydrophobicContact CG2-CG1 4.38Å; T340-I344 WeakPolarHBondContact O-CB 3.4Å; T340-I344 WeakPolarHBondContact O-CG1 3.28Å; T340-I344 PolarHBondContact O-N 2.85Å; I342-I344 VanDerWaalsContact C-N 3.3Å; I342-I344 PolarHBondContact O-N 2.86Å; I344-E346 VanDerWaalsContact C-N 3.3Å; I344-E346 PolarHBondContact O-N 2.66Å; I344-N347 PolarHBondContact O-N 3.39Å; I344-L348 HydrophobicContact CG2-CD1 3.83Å; I344-L348 HydrophobicContact CG2-CG 4.33Å; I344-L348 WeakPolarHBondContact O-CB 3.37Å; I344-L348 VanDerWaalsContact O-CG 3.27Å; I344-L348 WeakPolarHBondContact O-CG 3.35Å; I344-L348 PolarHBondContact O-N 3.36Å
345	K	79.3	Confident	75.5	Confident	129 Å²	129	64.1 Å²	64.1	56%	0.561	35%	0.345	S	S	*	.	H	α-helix	trans	-61.3	-39.2	-179.7	-172.4	-179.6	-178.9	-175	0	112.1	D341 I342 I343 K349	D341-K345 WeakPolarHBondContact O-CB 3.48Å; D341-K345 PolarHBondContact O-N 3.15Å; I342-K345 WeakPolarHBondContact O-CB 3.44Å; I342-K345 PolarHBondContact O-N 3.33Å; I342-K345 VanDerWaalsContact O-N 3.13Å; I343-K345 VanDerWaalsContact C-N 3.35Å; K345-K349 WeakPolarHBondContact O-CG 3.46Å; K345-K349 PolarHBondContact O-N 3.41Å
346	E	75.6	Confident	74.8	Confident	38 Å²	38	67.3 Å²	67.3	18%	0.178	36%	0.361	C	S	.	.	H	α-helix	trans	-69.9	-46	176.9	-72	177.8	173.8	0	0	112.1	S263 Y320 I342 I343 I344 L348 K349 D350	S263-E346 WeakPolarHBondContact CB-OE2 3.32Å; S263-E346 PolarHBondContact OG-OE1 2.88Å; S263-E346 PolarHBondContact OG-OE2 3.44Å; Y320-E346 PolarHBondContact OH-OE1 2.79Å; I342-E346 PolarHBondContact O-N 3.35Å; I343-E346 PolarHBondContact O-N 3.38Å; I344-E346 VanDerWaalsContact C-N 3.3Å; I344-E346 PolarHBondContact O-N 2.66Å; E346-L348 VanDerWaalsContact C-N 3.26Å; E346-L348 PolarHBondContact O-N 3.16Å; E346-K349 WeakPolarHBondContact O-CB 3.33Å; E346-K349 PolarHBondContact O-N 3.27Å; E346-K349 VanDerWaalsContact O-N 3.08Å; E346-D350 PolarHBondContact O-N 2.74Å
347	N	71.5	Confident	74	Confident	57 Å²	57	70.9 Å²	70.9	31%	0.305	38%	0.381	S	S	.	.	H	α-helix	trans	-59.5	-36	175.1	-77.9	-38.6	0	0	0	112.6	I343 I344 D350 C351	I343-N347 WeakPolarHBondContact O-CB 3.36Å; I343-N347 PolarHBondContact O-N 2.87Å; I343-N347 PolarHBondContact O-ND2 2.96Å; I344-N347 PolarHBondContact O-N 3.39Å; N347-D350 PolarHBondContact O-N 2.63Å; N347-C351 PolarHBondContact O-N 3.24Å; N347-C351 VanDerWaalsContact O-N 3.15Å; N347-C351 PolarHBondContact O-SG 2.89Å
348	L	71.2	Confident	73.1	Confident	62 Å²	62	72.3 Å²	72.3	33%	0.325	39%	0.389	S	S	.	.	H	α-helix	trans	-67.5	-37	175.8	-73.9	171.9	0	0	0	112.7	I344 E346 C351 G352 L353 F354	I344-L348 HydrophobicContact CG2-CD1 3.83Å; I344-L348 HydrophobicContact CG2-CG 4.33Å; I344-L348 WeakPolarHBondContact O-CB 3.37Å; I344-L348 VanDerWaalsContact O-CG 3.27Å; I344-L348 WeakPolarHBondContact O-CG 3.35Å; I344-L348 PolarHBondContact O-N 3.36Å; E346-L348 VanDerWaalsContact C-N 3.26Å; E346-L348 PolarHBondContact O-N 3.16Å; L348-C351 PolarHBondContact O-N 3.16Å; L348-G352 PolarHBondContact O-N 3.46Å; L348-L353 HydrophobicContact CD2-CB 4.49Å; L348-L353 HydrophobicContact CD2-CD1 3.85Å; L348-L353 PolarHBondContact O-N 3.48Å; L348-L353 VanDerWaalsContact O-N 3.13Å; L348-F354 HydrophobicContact CB-CD2 4.49Å
349	K	70.6	Confident	72.3	Confident	115 Å²	115	75 Å²	75	50%	0.5	40%	0.398	S	S	.	.	H	α-helix	trans	-64.1	-44.1	173.1	-74	176.2	178	-179.5	0	111.3	K345 E346 C351 G352 F354	K345-K349 WeakPolarHBondContact O-CG 3.46Å; K345-K349 PolarHBondContact O-N 3.41Å; E346-K349 WeakPolarHBondContact O-CB 3.33Å; E346-K349 PolarHBondContact O-N 3.27Å; E346-K349 VanDerWaalsContact O-N 3.08Å; K349-C351 PolarHBondContact O-N 3.1Å; K349-G352 PolarHBondContact O-N 2.95Å; K349-F354 HydrophobicContact CG-CB 4.21Å
350	D	68.2	Low	71.4	Confident	141 Å²	141	80 Å²	80	75%	0.754	42%	0.424	S	S	*	.	H	α-helix	trans	-63.8	-28.1	179.1	-74.4	-9.6	0	0	0	112.3	E346 N347 G352	E346-D350 PolarHBondContact O-N 2.74Å; N347-D350 PolarHBondContact O-N 2.63Å; D350-G352 VanDerWaalsContact C-N 3.29Å; D350-G352 PolarHBondContact O-N 3.17Å
351	C	64	Low	70.2	Confident	95 Å²	95	85.7 Å²	85.7	64%	0.642	46%	0.455	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.3	1.2	173.4	-68.2	0	0	0	0	114	N347 L348 K349 L353	N347-C351 PolarHBondContact O-N 3.24Å; N347-C351 VanDerWaalsContact O-N 3.15Å; N347-C351 PolarHBondContact O-SG 2.89Å; L348-C351 PolarHBondContact O-N 3.16Å; K349-C351 PolarHBondContact O-N 3.1Å; C351-L353 VanDerWaalsContact C-N 3.29Å; C351-L353 HydrophobicContact CB-CD1 4.07Å; C351-L353 HydrophobicContact CB-CG 4.44Å; C351-L353 PolarHBondContact O-N 2.98Å
352	G	53	Low	69.1	Low	65 Å²	65	85.8 Å²	85.8	67%	0.67	46%	0.455	S	S	*	.	T	Hydrogen-bonded Turn	trans	69.2	22	179.1	0	0	0	0	0	114.7	L348 K349 D350	L348-G352 PolarHBondContact O-N 3.46Å; K349-G352 PolarHBondContact O-N 2.95Å; D350-G352 VanDerWaalsContact C-N 3.29Å; D350-G352 PolarHBondContact O-N 3.17Å
353	L	56.6	Low	68	Low	124 Å²	124	90.4 Å²	90.4	65%	0.649	48%	0.48	S	S	*	.			trans	-90.4	-0.7	179.9	-72.1	162	0	0	0	113.2	L348 C351	L348-L353 HydrophobicContact CD2-CB 4.49Å; L348-L353 HydrophobicContact CD2-CD1 3.85Å; L348-L353 PolarHBondContact O-N 3.48Å; L348-L353 VanDerWaalsContact O-N 3.13Å; C351-L353 VanDerWaalsContact C-N 3.29Å; C351-L353 HydrophobicContact CB-CD1 4.07Å; C351-L353 HydrophobicContact CB-CG 4.44Å; C351-L353 PolarHBondContact O-N 2.98Å
354	F	43.3	Very low	66.8	Low	208 Å²	208	98.5 Å²	98.5	91%	0.912	52%	0.522	S	S	*	.			trans	-143.4	0	-179.9	-103	-82.1	0	0	0	113.3	L348 K349	L348-F354 HydrophobicContact CB-CD2 4.49Å; K349-F354 HydrophobicContact CG-CB 4.21Å

Retrieved 354 of 354 residues in 74.7 ms (Link to these results)

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